NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
491779 |
2jv1   |
15464 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2jv1
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 618
_Distance_constraint_stats_list.Viol_count 1
_Distance_constraint_stats_list.Viol_total 2.909
_Distance_constraint_stats_list.Viol_max 0.058
_Distance_constraint_stats_list.Viol_rms 0.0003
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0000
_Distance_constraint_stats_list.Viol_average_violations_only 0.0582
_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 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
1 2 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
1 3 VAL 0.058 0.058 2 0 "[ . 1 . 2 . 3 . 4 . 5]"
1 4 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
1 5 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
1 6 CYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
1 7 CYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
1 8 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
1 9 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
1 10 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
1 11 CYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
1 12 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
1 13 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
1 14 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
1 15 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
1 16 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
1 17 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
1 18 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
1 19 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
1 20 CYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
1 21 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 1 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 2 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 3 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 4 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 5 HIS 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 6 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 7 CYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 8 GLY 0.058 0.058 2 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 9 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 10 HIS 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 11 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 12 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 13 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 14 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 15 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 16 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 17 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 18 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 19 CYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 20 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 21 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 22 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 23 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 24 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 25 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 26 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 27 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 28 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
2 29 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . 5]"
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 1 GLY QA 1 3 VAL H 7.720 . 8.220 3.727 3.318 4.675 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
2 1 1 GLY QA 1 5 GLN H 6.630 . 7.130 4.596 2.867 5.925 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
3 1 2 ILE H 1 2 ILE HB 3.750 . 4.250 3.178 2.268 3.798 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
4 1 2 ILE H 1 3 VAL CB 5.650 . 6.150 5.324 4.615 5.688 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
5 1 2 ILE H 1 3 VAL H 3.440 . 3.940 2.747 2.093 3.101 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
6 1 2 ILE H 1 3 VAL HA 6.000 . 6.500 5.304 4.673 5.650 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
7 1 2 ILE H 1 4 GLU H 5.280 . 5.780 4.529 3.088 5.313 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
8 1 2 ILE H 1 19 TYR QE 9.130 . 9.630 4.234 2.453 6.390 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
9 1 2 ILE HA 1 5 GLN H 4.090 . 4.590 3.364 2.776 4.090 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
10 1 2 ILE HA 1 5 GLN QB 4.820 . 5.320 2.540 2.133 3.525 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
11 1 2 ILE HB 1 3 VAL H 4.740 . 5.240 4.069 3.592 4.396 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
12 1 2 ILE HB 1 11 CYS QB 6.520 . 7.020 5.231 3.732 5.907 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
13 1 2 ILE MD 1 3 VAL H 8.380 . 8.880 4.436 2.651 5.565 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
14 1 2 ILE MD 1 5 GLN QB 9.100 . 9.600 4.641 2.301 6.168 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
15 1 2 ILE MD 1 15 GLN HB2 8.430 . 8.930 4.949 2.805 7.030 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
16 1 2 ILE MD 1 15 GLN HB3 8.430 . 8.930 4.426 2.255 6.899 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
17 1 2 ILE MD 1 16 LEU HA 8.430 . 8.930 3.356 2.160 5.322 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
18 1 2 ILE MD 1 16 LEU HG 8.430 . 8.930 4.303 2.265 6.229 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
19 1 2 ILE MD 2 11 LEU HG 7.610 . 8.110 4.360 2.548 6.098 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
20 1 2 ILE QG 1 3 VAL H 6.520 . 7.020 3.269 2.168 4.495 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
21 1 2 ILE QG 1 19 TYR QD 9.790 . 10.290 3.964 2.817 5.373 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
22 1 2 ILE QG 1 19 TYR QE 9.800 . 10.300 3.891 2.572 5.103 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
23 1 2 ILE MG 1 3 VAL H 5.010 . 5.510 3.355 2.107 4.279 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
24 1 2 ILE MG 2 26 TYR HA 8.430 . 8.930 4.152 2.188 7.025 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
25 1 3 VAL CB 1 4 GLU H 4.660 . 5.160 3.254 2.926 3.538 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
26 1 3 VAL CB 1 4 GLU QB 6.360 . 6.860 5.023 4.533 5.485 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
27 1 3 VAL CB 1 4 GLU QG 7.430 . 7.930 5.172 3.904 6.533 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
28 1 3 VAL CB 1 7 CYS H 6.900 . 7.400 5.720 4.711 6.412 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
29 1 3 VAL CB 2 27 THR HA 6.900 . 7.400 6.030 4.484 6.929 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
30 1 3 VAL H 1 3 VAL HB 2.980 . 3.480 2.566 2.380 2.843 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
31 1 3 VAL H 2 28 PRO HA 3.980 . 4.480 3.414 2.602 4.140 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
32 1 3 VAL HA 1 6 CYS H 4.310 . 4.810 3.894 3.329 4.391 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
33 1 3 VAL HA 1 6 CYS QB 5.230 . 5.730 3.345 2.495 4.418 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
34 1 3 VAL HA 1 7 CYS H 4.810 . 5.310 4.255 3.292 4.875 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
35 1 3 VAL HA 2 11 LEU CG 5.860 . 6.360 4.267 3.593 4.933 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
36 1 3 VAL HA 2 26 TYR QE 9.130 . 9.630 5.473 3.029 8.146 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
37 1 3 VAL HB 1 4 GLU H 3.260 . 3.760 2.851 2.470 3.286 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
38 1 3 VAL MG1 1 4 GLU H 6.400 . 6.900 3.590 2.938 3.988 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
39 1 3 VAL MG1 2 8 GLY H 8.430 . 8.930 3.129 1.742 4.602 0.058 2 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
40 1 3 VAL MG2 1 4 GLU H 6.400 . 6.900 4.020 3.629 4.287 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
41 1 3 VAL MG2 2 8 GLY H 8.430 . 8.930 4.344 2.690 5.563 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
42 1 4 GLU H 1 4 GLU HG2 5.350 . 5.850 3.564 2.186 4.610 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
43 1 4 GLU H 1 4 GLU HG3 5.350 . 5.850 3.616 2.170 4.652 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
44 1 4 GLU H 1 8 THR MG 8.430 . 8.930 6.162 5.065 7.099 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
45 1 4 GLU HA 1 5 GLN H 3.680 . 4.180 3.554 3.252 3.641 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
46 1 4 GLU HA 1 7 CYS H 4.130 . 4.630 3.805 3.257 4.222 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
47 1 4 GLU HA 1 8 THR H 4.160 . 4.660 3.698 2.629 4.217 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
48 1 4 GLU HA 1 8 THR MG 8.250 . 8.750 3.949 2.583 5.357 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
49 1 4 GLU QB 2 29 LYS QG 8.350 . 8.850 4.740 2.233 6.645 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
50 1 4 GLU HB2 1 8 THR MG 8.430 . 8.930 4.999 3.435 6.440 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
51 1 4 GLU HB3 1 8 THR MG 8.430 . 8.930 4.632 3.234 6.464 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
52 1 4 GLU QG 1 5 GLN H 6.520 . 7.020 3.738 2.359 4.597 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
53 1 4 GLU QG 2 29 LYS QG 8.350 . 8.850 4.771 2.322 6.670 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
54 1 4 GLU HG2 1 8 THR MG 8.430 . 8.930 4.839 2.552 7.015 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
55 1 4 GLU HG3 1 8 THR MG 8.430 . 8.930 5.012 2.499 7.040 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
56 1 5 GLN H 1 5 GLN HB2 3.010 . 3.510 2.513 2.214 3.049 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
57 1 5 GLN H 1 5 GLN QB 2.930 . 3.430 2.238 2.125 2.505 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
58 1 5 GLN H 1 5 GLN HB3 3.010 . 3.510 2.557 2.407 2.919 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
59 1 5 GLN H 1 5 GLN HG2 4.780 . 5.280 4.529 4.251 4.793 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
60 1 5 GLN H 1 5 GLN HG3 4.780 . 5.280 4.469 4.310 4.860 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
61 1 5 GLN H 1 8 THR MG 8.430 . 8.930 5.646 4.204 6.687 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
62 1 5 GLN HA 1 6 CYS H 3.840 . 4.340 3.620 3.584 3.653 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
63 1 5 GLN HA 1 7 CYS H 4.460 . 4.960 4.289 3.897 4.531 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
64 1 5 GLN QB 1 6 CYS H 4.200 . 4.700 2.523 2.150 2.886 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
65 1 5 GLN QB 1 6 CYS HA 5.280 . 5.780 4.250 3.887 4.523 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
66 1 5 GLN HB2 1 6 CYS HA 5.800 . 6.400 5.698 5.389 5.848 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
67 1 5 GLN HB3 1 6 CYS HA 5.500 . 6.000 4.387 3.974 4.714 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
68 1 5 GLN QG 1 11 CYS QB 6.530 . 7.030 3.275 2.193 5.198 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
69 1 5 GLN HG2 1 6 CYS H 6.000 . 6.500 4.233 3.438 5.024 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
70 1 5 GLN HG3 1 6 CYS H 6.000 . 6.500 4.415 3.058 5.182 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
71 1 6 CYS CB 1 11 CYS SG 3.100 . 3.600 3.021 2.983 3.061 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
72 1 6 CYS H 1 6 CYS HB2 3.520 . 4.020 2.327 2.200 2.580 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
73 1 6 CYS H 1 6 CYS QB 3.200 . 3.700 2.265 2.126 2.521 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
74 1 6 CYS H 1 6 CYS HB3 3.520 . 4.020 3.275 2.502 3.577 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
75 1 6 CYS H 1 7 CYS QB 5.230 . 5.730 4.346 3.974 4.682 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
76 1 6 CYS H 1 11 CYS QB 5.500 . 6.000 3.894 3.224 4.941 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
77 1 6 CYS H 2 11 LEU CG 6.900 . 7.400 6.223 5.877 6.566 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
78 1 6 CYS HA 1 7 CYS H 3.440 . 3.940 3.467 3.347 3.548 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
79 1 6 CYS HA 1 11 CYS H 3.910 . 4.410 3.428 2.801 3.922 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
80 1 6 CYS HA 1 11 CYS QB 6.520 . 7.020 2.618 2.220 3.326 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
81 1 6 CYS QB 1 7 CYS H 3.700 . 4.200 2.963 2.679 3.216 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
82 1 6 CYS QB 1 7 CYS QB 7.070 . 7.570 3.740 3.366 4.763 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
83 1 6 CYS QB 1 11 CYS H 6.520 . 7.020 4.515 3.799 4.929 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
84 1 6 CYS QB 2 6 LEU CG 7.430 . 7.930 4.475 3.949 5.352 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
85 1 6 CYS QB 2 6 LEU H 5.040 . 5.540 3.088 2.438 3.875 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
86 1 6 CYS QB 2 6 LEU QB 7.070 . 7.570 2.463 2.033 3.357 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
87 1 6 CYS QB 2 11 LEU CG 6.760 . 7.260 3.874 3.551 4.287 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
88 1 6 CYS HB2 1 7 CYS H 4.000 . 4.500 3.325 2.762 4.090 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
89 1 6 CYS HB3 1 7 CYS H 3.800 . 4.300 3.606 3.123 3.938 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
90 1 6 CYS SG 1 11 CYS CB 3.100 . 3.600 3.027 2.970 3.097 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
91 1 6 CYS SG 1 11 CYS SG 2.100 . 2.600 2.032 2.023 2.043 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
92 1 7 CYS CB 2 7 CYS SG 3.100 . 3.600 3.047 3.012 3.104 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
93 1 7 CYS H 1 7 CYS HB2 3.370 . 3.870 2.610 2.245 2.810 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
94 1 7 CYS H 1 7 CYS QB 3.230 . 3.730 2.294 2.220 2.402 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
95 1 7 CYS H 1 7 CYS HB3 3.370 . 3.870 2.599 2.431 3.514 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
96 1 7 CYS H 1 8 THR H 2.690 . 3.190 2.428 2.273 2.680 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
97 1 7 CYS H 1 8 THR MG 8.130 . 8.630 4.757 3.947 5.897 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
98 1 7 CYS H 1 9 SER H 4.090 . 4.590 3.769 3.492 4.111 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
99 1 7 CYS H 2 6 LEU H 5.460 . 5.960 4.526 4.350 4.686 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
100 1 7 CYS HA 1 8 THR MG 8.430 . 8.930 5.381 4.527 6.238 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
101 1 7 CYS HA 2 5 HIS QB 5.610 . 6.110 3.681 3.224 4.204 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
102 1 7 CYS HA 2 6 LEU H 3.120 . 3.620 3.033 2.681 3.239 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
103 1 7 CYS QB 1 8 THR H 3.460 . 3.960 2.580 2.272 2.963 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
104 1 7 CYS QB 1 8 THR MG 8.340 . 8.840 3.849 2.667 5.269 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
105 1 7 CYS QB 2 6 LEU H 6.520 . 7.020 4.496 4.187 5.217 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
106 1 7 CYS QB 2 7 CYS HA 5.100 . 5.600 2.782 2.260 4.367 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
107 1 7 CYS QB 2 7 CYS QB 6.530 . 7.030 3.238 2.813 3.580 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
108 1 7 CYS HB2 1 8 THR MG 8.430 . 8.930 5.320 2.850 6.777 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
109 1 7 CYS HB2 2 8 GLY H 6.000 . 6.500 4.270 3.703 5.999 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
110 1 7 CYS HB3 1 8 THR MG 8.430 . 8.930 3.989 2.743 5.493 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
111 1 7 CYS HB3 2 8 GLY H 6.000 . 6.500 5.518 5.042 6.018 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
112 1 7 CYS SG 2 7 CYS CB 3.100 . 3.600 3.045 2.989 3.101 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
113 1 7 CYS SG 2 7 CYS SG 2.100 . 2.600 2.041 2.034 2.048 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
114 1 8 THR H 1 9 SER H 3.080 . 3.580 2.427 2.135 2.712 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
115 1 8 THR HA 2 5 HIS HE1 6.000 . 6.500 5.318 3.750 6.055 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
116 1 8 THR MG 1 9 SER HA 8.430 . 8.930 5.060 3.873 5.783 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
117 1 8 THR MG 1 9 SER QB 8.260 . 8.760 4.553 2.579 5.592 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
118 1 8 THR MG 2 5 HIS HE1 8.430 . 8.930 6.356 4.812 7.069 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
119 1 9 SER H 1 10 ILE H 4.340 . 4.840 4.193 3.717 4.420 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
120 1 9 SER HA 1 10 ILE H 3.120 . 3.620 2.884 2.495 3.225 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
121 1 9 SER HA 1 10 ILE HB 5.890 . 6.390 5.408 4.157 6.024 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
122 1 9 SER HA 1 10 ILE QG 6.520 . 7.020 4.479 3.505 5.809 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
123 1 9 SER HA 1 10 ILE MG 8.430 . 8.930 4.175 3.417 5.827 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
124 1 9 SER HA 2 5 HIS HE1 4.600 . 5.100 3.085 2.403 4.051 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
125 1 9 SER QB 1 10 ILE H 3.890 . 4.390 2.378 1.867 3.165 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
126 1 10 ILE H 1 10 ILE HB 3.840 . 4.340 3.339 2.356 3.874 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
127 1 10 ILE H 1 11 CYS H 4.880 . 5.380 4.545 4.448 4.697 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
128 1 10 ILE H 2 5 HIS HE1 6.000 . 6.500 4.587 3.529 5.425 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
129 1 10 ILE HA 1 11 CYS H 3.010 . 3.510 2.269 2.133 2.391 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
130 1 10 ILE HB 1 11 CYS H 4.350 . 4.850 3.251 2.336 4.308 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
131 1 10 ILE HB 2 4 GLN HA 6.000 . 6.500 4.785 3.629 6.080 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
132 1 10 ILE MD 1 11 CYS H 8.430 . 8.930 4.390 3.292 5.097 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
133 1 10 ILE MD 1 12 SER HA 8.430 . 8.930 6.099 4.736 7.049 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
134 1 10 ILE MD 2 3 ASN H 8.430 . 8.930 5.309 4.200 7.017 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
135 1 10 ILE MD 2 4 GLN H 7.910 . 8.410 4.319 3.375 5.147 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
136 1 10 ILE MD 2 5 HIS H 7.730 . 8.230 5.148 2.934 6.449 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
137 1 10 ILE MD 2 5 HIS QB 9.100 . 9.600 5.781 3.614 6.769 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
138 1 10 ILE MD 2 5 HIS HE1 8.430 . 8.930 4.997 3.211 6.755 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
139 1 10 ILE QG 2 5 HIS HE1 6.520 . 7.020 4.629 2.549 5.835 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
140 1 10 ILE MG 1 11 CYS H 6.140 . 6.640 3.438 2.399 3.883 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
141 1 10 ILE MG 1 12 SER HA 8.430 . 8.930 6.125 3.923 6.922 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
142 1 10 ILE MG 2 3 ASN H 8.430 . 8.930 6.086 4.602 6.872 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
143 1 10 ILE MG 2 3 ASN HA 8.080 . 8.580 5.133 3.524 5.829 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
144 1 10 ILE MG 2 3 ASN HB2 8.430 . 8.930 3.956 2.153 6.288 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
145 1 10 ILE MG 2 3 ASN HB3 8.430 . 8.930 4.506 2.163 6.032 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
146 1 10 ILE MG 2 4 GLN H 7.130 . 7.630 4.027 2.506 5.003 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
147 1 10 ILE MG 2 4 GLN QB 9.100 . 9.600 4.940 4.231 6.402 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
148 1 10 ILE MG 2 5 HIS H 8.430 . 8.930 4.209 3.075 6.318 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
149 1 10 ILE MG 2 5 HIS HE1 8.430 . 8.930 3.817 2.554 6.903 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
150 1 11 CYS H 1 11 CYS HB2 4.060 . 4.560 3.893 2.589 4.081 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
151 1 11 CYS H 1 11 CYS HB3 3.660 . 4.160 3.286 3.085 3.751 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
152 1 11 CYS H 1 12 SER H 4.600 . 5.100 4.440 4.386 4.495 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
153 1 11 CYS H 2 4 GLN H 4.880 . 5.380 2.858 2.645 3.174 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
154 1 11 CYS H 2 5 HIS HA 3.980 . 4.480 3.798 3.564 3.993 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
155 1 11 CYS HA 1 12 SER H 2.760 . 3.260 2.377 2.219 2.761 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
156 1 11 CYS HA 1 15 GLN QB 6.380 . 6.880 4.002 3.481 4.385 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
157 1 11 CYS QB 1 12 SER H 3.540 . 4.040 2.450 2.216 2.665 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
158 1 11 CYS QB 1 15 GLN QB 6.360 . 6.860 2.736 2.357 3.221 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
159 1 11 CYS QB 1 15 GLN QG 6.770 . 7.270 4.016 2.501 4.724 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
160 1 11 CYS HB2 1 12 SER H 3.660 . 4.160 2.556 2.233 3.774 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
161 1 11 CYS HB3 1 12 SER H 3.810 . 4.310 3.765 2.457 3.933 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
162 1 12 SER H 1 12 SER QB 3.300 . 3.800 2.593 2.347 2.975 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
163 1 12 SER H 1 15 GLN H 3.800 . 4.300 3.611 3.237 3.816 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
164 1 12 SER H 1 15 GLN HB2 3.950 . 4.450 2.404 1.966 2.604 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
165 1 12 SER H 1 15 GLN QB 3.560 . 4.060 2.380 1.956 2.573 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
166 1 12 SER H 1 15 GLN HB3 3.950 . 4.450 3.851 3.474 4.017 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
167 1 12 SER H 1 15 GLN QE 6.520 . 7.020 4.057 2.091 5.236 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
168 1 12 SER H 1 15 GLN QG 4.730 . 5.230 3.138 2.276 3.790 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
169 1 12 SER H 1 16 LEU H 4.460 . 4.960 4.419 3.906 4.522 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
170 1 12 SER H 1 16 LEU MD1 8.430 . 8.930 5.313 3.780 5.912 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
171 1 12 SER H 1 16 LEU MD2 8.430 . 8.930 5.295 4.211 6.338 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
172 1 12 SER HA 1 13 LEU CG 6.900 . 7.400 4.741 4.553 4.942 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
173 1 12 SER HA 1 13 LEU H 2.760 . 3.260 2.342 2.231 2.443 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
174 1 12 SER HA 1 14 TYR H 4.960 . 5.460 4.197 3.933 4.604 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
175 1 12 SER HA 1 15 GLN H 4.540 . 5.040 4.466 4.283 4.607 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
176 1 12 SER QB 1 13 LEU H 3.540 . 4.040 2.800 2.366 3.295 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
177 1 12 SER QB 1 13 LEU QB 7.070 . 7.570 4.305 3.921 4.803 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
178 1 12 SER QB 1 14 TYR H 3.820 . 4.320 2.805 2.508 3.210 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
179 1 12 SER QB 1 15 GLN H 4.890 . 5.390 2.941 2.099 3.622 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
180 1 13 LEU CG 2 3 ASN H 6.900 . 7.400 6.400 3.345 6.975 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
181 1 13 LEU CG 2 4 GLN QB 7.050 . 7.550 6.128 5.563 6.322 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
182 1 13 LEU H 1 13 LEU HB2 3.340 . 3.840 2.506 2.405 2.600 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
183 1 13 LEU H 1 13 LEU QB 3.120 . 3.620 2.459 2.369 2.540 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
184 1 13 LEU H 1 13 LEU HB3 3.540 . 4.040 3.570 3.493 3.591 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
185 1 13 LEU H 1 13 LEU HG 3.410 . 3.910 2.274 2.084 3.594 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
186 1 13 LEU H 1 14 TYR H 3.160 . 3.660 2.668 2.478 2.823 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
187 1 13 LEU H 1 14 TYR HA 5.350 . 5.850 5.331 5.185 5.427 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
188 1 13 LEU H 1 14 TYR QB 5.880 . 6.380 4.461 4.121 4.903 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
189 1 13 LEU H 1 14 TYR QD 9.130 . 9.630 5.478 3.409 6.409 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
190 1 13 LEU H 1 15 GLN H 4.110 . 4.610 4.099 3.952 4.142 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
191 1 13 LEU H 1 16 LEU H 4.740 . 5.240 4.736 4.669 4.818 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
192 1 13 LEU HA 1 16 LEU H 3.700 . 4.200 3.121 2.989 3.247 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
193 1 13 LEU HA 1 16 LEU HB2 4.090 . 4.590 2.472 2.231 2.614 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
194 1 13 LEU HA 1 16 LEU QB 3.880 . 4.380 2.451 2.218 2.587 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
195 1 13 LEU HA 1 16 LEU HB3 4.090 . 4.590 4.063 3.851 4.155 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
196 1 13 LEU HA 1 16 LEU HG 6.000 . 6.500 3.205 2.442 4.842 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
197 1 13 LEU QB 1 14 TYR H 3.570 . 4.070 2.680 2.596 2.773 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
198 1 13 LEU QB 1 14 TYR HA 4.540 . 5.040 4.071 4.039 4.096 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
199 1 13 LEU QB 1 14 TYR QD 9.790 . 10.290 4.875 2.784 5.543 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
200 1 13 LEU QB 1 15 GLN H 6.440 . 6.940 4.658 4.569 4.762 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
201 1 13 LEU QB 1 17 GLU H 5.350 . 5.850 4.578 4.439 4.729 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
202 1 13 LEU QB 2 18 VAL CB 7.430 . 7.930 4.259 3.844 4.765 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
203 1 13 LEU HB2 1 14 TYR H 3.730 . 4.230 2.742 2.645 2.860 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
204 1 13 LEU HB2 1 14 TYR HA 4.670 . 5.170 4.468 4.403 4.610 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
205 1 13 LEU HB3 1 14 TYR H 3.730 . 4.230 3.778 3.731 3.814 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
206 1 13 LEU HB3 1 14 TYR HA 5.270 . 5.770 4.692 4.568 4.792 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
207 1 14 TYR H 1 14 TYR HA 2.870 . 3.370 2.853 2.822 2.885 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
208 1 14 TYR H 1 14 TYR HB2 3.540 . 4.040 2.548 2.290 3.605 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
209 1 14 TYR H 1 14 TYR HB3 3.540 . 4.040 2.818 2.355 3.578 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
210 1 14 TYR HA 1 15 GLN H 3.480 . 3.980 3.517 3.483 3.555 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
211 1 14 TYR HA 1 17 GLU HB2 3.480 . 3.980 3.142 2.746 3.507 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
212 1 14 TYR HA 1 17 GLU QB 3.170 . 3.670 2.596 2.300 2.849 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
213 1 14 TYR HA 1 17 GLU HB3 3.480 . 3.980 2.794 2.409 3.313 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
214 1 14 TYR HA 2 18 VAL CB 6.850 . 7.550 6.764 6.423 6.902 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
215 1 14 TYR QB 1 15 GLN HA 5.130 . 5.630 4.374 4.014 4.647 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
216 1 14 TYR QB 1 15 GLN QG 6.530 . 7.030 3.461 3.057 4.608 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
217 1 14 TYR HB2 1 15 GLN H 4.100 . 4.600 3.686 2.736 4.146 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
218 1 14 TYR HB3 1 15 GLN H 3.800 . 4.300 3.313 2.804 3.980 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
219 1 14 TYR QD 1 15 GLN H 9.130 . 9.630 4.066 3.314 4.647 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
220 1 14 TYR QD 1 17 GLU QB 9.790 . 10.290 3.996 3.432 5.034 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
221 1 15 GLN H 1 15 GLN HB2 3.550 . 4.050 2.443 2.320 2.596 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
222 1 15 GLN H 1 15 GLN QB 3.290 . 3.790 2.408 2.293 2.547 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
223 1 15 GLN H 1 15 GLN HB3 3.750 . 4.250 3.646 3.590 3.690 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
224 1 15 GLN H 1 15 GLN QE 6.330 . 6.830 4.976 3.489 5.371 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
225 1 15 GLN H 1 15 GLN QG 3.820 . 4.320 2.624 2.419 2.869 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
226 1 15 GLN H 1 16 LEU H 2.980 . 3.480 2.449 2.226 2.689 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
227 1 15 GLN H 1 16 LEU QB 5.280 . 5.780 4.409 3.928 4.627 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
228 1 15 GLN H 1 16 LEU HG 6.000 . 6.500 4.662 4.044 6.134 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
229 1 15 GLN HA 1 17 GLU H 4.360 . 4.860 4.326 4.095 4.425 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
230 1 15 GLN HA 1 18 ASN QB 4.510 . 5.010 2.805 2.182 3.494 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
231 1 15 GLN HA 1 18 ASN QD 5.990 . 6.490 4.693 2.480 5.358 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
232 1 15 GLN HA 1 19 TYR QE 8.770 . 9.270 5.072 4.346 7.664 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
233 1 15 GLN QB 1 16 LEU CG 6.760 . 7.260 4.672 4.412 5.101 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
234 1 15 GLN QB 1 16 LEU QB 7.070 . 7.570 4.668 4.496 4.814 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
235 1 15 GLN QB 1 16 LEU HG 6.520 . 7.020 4.102 3.591 5.413 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
236 1 15 GLN QG 1 16 LEU H 5.540 . 6.040 4.292 4.074 4.463 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
237 1 16 LEU H 1 16 LEU HB2 3.300 . 3.800 2.486 2.247 2.641 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
238 1 16 LEU H 1 16 LEU QB 3.240 . 3.740 2.443 2.222 2.583 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
239 1 16 LEU H 1 16 LEU HB3 3.700 . 4.200 3.610 3.519 3.650 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
240 1 16 LEU H 1 16 LEU HG 4.270 . 4.770 2.604 2.199 3.897 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
241 1 16 LEU HA 1 19 TYR QB 4.970 . 5.470 3.289 2.598 4.415 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
242 1 16 LEU HA 1 19 TYR QD 6.300 . 6.800 3.234 2.203 5.018 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
243 1 16 LEU HA 1 19 TYR QE 9.130 . 9.630 4.910 3.526 6.628 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
244 1 16 LEU HA 2 15 LEU MD1 8.430 . 8.930 3.596 2.345 5.132 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
245 1 16 LEU HA 2 15 LEU MD2 8.430 . 8.930 3.645 2.346 5.023 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
246 1 16 LEU QB 1 17 GLU H 3.470 . 3.970 2.602 2.437 2.793 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
247 1 16 LEU QB 2 15 LEU CG 5.750 . 6.250 3.928 3.474 4.393 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
248 1 16 LEU QB 2 18 VAL CB 7.020 . 7.520 3.467 3.188 4.018 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
249 1 16 LEU HG 1 19 TYR QD 9.130 . 9.630 5.859 3.383 7.586 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
250 1 17 GLU H 1 17 GLU HB2 3.120 . 3.620 2.352 2.076 2.487 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
251 1 17 GLU H 1 17 GLU QB 3.040 . 3.540 2.203 2.033 2.284 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
252 1 17 GLU H 1 17 GLU HB3 3.120 . 3.620 2.678 2.557 2.988 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
253 1 17 GLU H 1 17 GLU QG 4.500 . 5.000 3.943 3.694 3.990 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
254 1 17 GLU H 1 18 ASN H 2.980 . 3.480 2.875 2.751 2.969 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
255 1 17 GLU H 2 18 VAL CB 6.900 . 7.400 4.830 4.687 5.209 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
256 1 17 GLU HA 1 20 CYS H 3.480 . 3.980 3.413 3.031 3.581 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
257 1 17 GLU HA 1 20 CYS QB 5.350 . 5.850 3.408 2.468 3.928 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
258 1 17 GLU QB 1 18 ASN H 3.980 . 4.480 2.923 2.641 3.083 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
259 1 17 GLU QB 2 18 VAL CB 5.530 . 6.030 4.423 4.207 4.704 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
260 1 17 GLU HB2 1 18 ASN H 4.130 . 4.630 4.059 3.577 4.177 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
261 1 17 GLU HB3 1 18 ASN H 4.130 . 4.630 2.998 2.684 3.179 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
262 1 17 GLU QG 1 18 ASN H 5.990 . 6.490 4.089 3.815 4.657 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
263 1 17 GLU QG 2 18 VAL CB 5.900 . 6.400 5.084 4.225 5.287 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
264 1 17 GLU HG2 2 18 VAL MG1 8.430 . 8.930 4.051 2.191 4.379 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
265 1 17 GLU HG2 2 18 VAL MG2 8.430 . 8.930 6.454 4.761 6.840 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
266 1 17 GLU HG3 2 18 VAL MG1 8.430 . 8.930 2.997 2.575 3.656 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
267 1 17 GLU HG3 2 18 VAL MG2 8.430 . 8.930 5.503 5.001 5.827 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
268 1 18 ASN H 1 18 ASN HB2 3.300 . 3.800 2.439 2.088 2.694 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
269 1 18 ASN H 1 18 ASN HB3 3.300 . 3.800 2.561 2.387 3.489 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
270 1 18 ASN QB 1 19 TYR H 4.110 . 4.610 2.978 2.778 3.221 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
271 1 18 ASN HB2 1 19 TYR H 4.160 . 4.660 4.082 3.172 4.189 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
272 1 18 ASN HB2 1 19 TYR QD 9.130 . 9.630 4.637 3.101 5.596 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
273 1 18 ASN HB2 1 19 TYR QE 9.130 . 9.630 5.244 3.684 7.249 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
274 1 18 ASN HB3 1 19 TYR H 4.160 . 4.660 3.099 2.827 4.022 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
275 1 18 ASN HB3 1 19 TYR QD 9.130 . 9.630 3.171 2.569 4.773 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
276 1 18 ASN HB3 1 19 TYR QE 9.130 . 9.630 3.869 2.928 5.761 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
277 1 19 TYR H 1 19 TYR HB2 3.520 . 4.020 2.335 2.133 2.521 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
278 1 19 TYR H 1 19 TYR QB 3.170 . 3.670 2.305 2.113 2.473 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
279 1 19 TYR H 1 19 TYR HB3 3.520 . 4.020 3.546 3.214 3.603 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
280 1 19 TYR H 1 20 CYS QB 5.280 . 5.780 4.613 4.058 4.755 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
281 1 19 TYR QB 1 20 CYS H 4.220 . 4.720 3.460 2.636 3.633 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
282 1 19 TYR QB 2 15 LEU CG 6.490 . 6.990 4.306 3.738 5.241 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
283 1 19 TYR QB 2 25 PHE H 4.510 . 5.010 3.206 2.365 4.032 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
284 1 19 TYR HB2 1 20 CYS H 4.270 . 4.770 3.690 2.693 4.099 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
285 1 19 TYR HB3 1 20 CYS H 4.270 . 4.770 4.212 3.661 4.337 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
286 1 20 CYS CB 2 19 CYS SG 3.100 . 3.600 3.044 2.968 3.100 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
287 1 20 CYS H 1 20 CYS HB2 3.950 . 4.450 2.501 2.321 2.597 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
288 1 20 CYS H 1 20 CYS QB 3.560 . 4.060 2.449 2.177 2.545 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
289 1 20 CYS H 1 20 CYS HB3 3.950 . 4.450 3.573 2.548 3.712 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
290 1 20 CYS HA 1 21 ASN H 3.010 . 3.510 2.310 2.210 2.569 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
291 1 20 CYS HA 2 24 PHE QB 6.520 . 7.020 2.885 2.252 4.038 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
292 1 20 CYS HA 2 24 PHE QD 9.130 . 9.630 4.846 4.237 5.693 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
293 1 20 CYS QB 1 21 ASN H 4.280 . 4.780 2.592 2.201 3.899 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
294 1 20 CYS QB 1 21 ASN HA 5.040 . 5.540 4.349 4.078 4.572 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
295 1 20 CYS QB 2 19 CYS H 6.520 . 7.020 5.254 4.315 5.555 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
296 1 20 CYS QB 2 22 ARG QB 6.530 . 7.030 2.982 2.204 4.399 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
297 1 20 CYS QB 2 22 ARG HE 6.520 . 7.020 4.063 2.709 5.811 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
298 1 20 CYS QB 2 22 ARG QG 8.350 . 8.850 4.373 2.484 5.939 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
299 1 20 CYS QB 2 23 GLY H 6.520 . 7.020 4.874 3.926 5.834 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
300 1 20 CYS SG 2 19 CYS CB 3.100 . 3.600 3.045 2.973 3.085 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
301 1 20 CYS SG 2 19 CYS SG 2.100 . 2.600 2.029 2.013 2.037 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
302 1 21 ASN H 1 21 ASN HB2 3.730 . 4.230 2.892 2.318 3.852 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
303 1 21 ASN H 1 21 ASN QB 3.570 . 4.070 2.421 2.127 3.048 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
304 1 21 ASN H 1 21 ASN HB3 3.730 . 4.230 2.743 2.210 3.785 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
305 1 21 ASN H 1 21 ASN QD 5.400 . 5.900 4.112 2.486 4.763 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
306 1 21 ASN H 2 24 PHE HA 3.840 . 4.340 2.964 2.364 3.881 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
307 1 21 ASN QB 2 22 ARG QB 7.070 . 7.570 3.706 2.189 5.621 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
308 2 1 PHE HA 2 2 VAL CB 8.100 . 8.600 4.695 3.233 5.324 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
309 2 1 PHE HA 2 2 VAL H 3.690 . 4.190 2.615 2.286 3.589 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
310 2 1 PHE HB2 2 2 VAL H 4.700 . 5.200 3.494 2.231 4.574 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
311 2 1 PHE HB3 2 2 VAL H 4.700 . 5.200 3.031 2.017 4.867 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
312 2 1 PHE QD 2 2 VAL H 9.130 . 9.630 3.711 2.696 5.280 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
313 2 2 VAL CB 2 3 ASN H 7.270 . 7.770 3.319 2.840 3.982 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
314 2 2 VAL H 2 2 VAL HB 3.950 . 4.450 3.363 2.412 4.000 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
315 2 2 VAL H 2 4 GLN QG 6.920 . 7.520 5.662 3.078 6.249 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
316 2 2 VAL HA 2 3 ASN H 2.650 . 3.150 2.272 2.062 2.774 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
317 2 2 VAL HA 2 3 ASN QB 5.610 . 6.110 4.454 3.914 4.951 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
318 2 2 VAL HB 2 3 ASN H 4.130 . 4.530 3.663 2.223 4.331 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
319 2 3 ASN H 2 3 ASN HB2 3.970 . 4.470 3.431 2.391 3.997 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
320 2 3 ASN H 2 3 ASN HB3 3.770 . 4.170 3.358 2.511 4.006 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
321 2 3 ASN H 2 3 ASN HD22 6.000 . 6.500 4.385 3.190 6.041 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
322 2 3 ASN H 2 4 GLN HA 5.530 . 6.030 5.232 4.744 5.654 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
323 2 3 ASN H 2 4 GLN HG2 6.000 . 6.500 4.675 3.190 6.020 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
324 2 3 ASN H 2 4 GLN HG3 6.000 . 6.500 4.568 3.081 6.080 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
325 2 3 ASN HA 2 4 GLN H 2.650 . 3.150 2.219 2.040 2.322 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
326 2 3 ASN HA 2 4 GLN HB2 5.640 . 6.140 4.154 3.815 4.416 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
327 2 3 ASN HA 2 4 GLN QB 5.480 . 5.980 4.032 3.730 4.267 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
328 2 3 ASN HA 2 4 GLN HB3 5.640 . 6.140 5.460 5.260 5.653 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
329 2 3 ASN HA 2 4 GLN HG2 6.000 . 6.500 4.599 3.359 5.532 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
330 2 3 ASN HA 2 4 GLN HG3 6.000 . 6.500 4.133 3.250 5.700 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
331 2 3 ASN HA 2 6 LEU CG 6.900 . 7.400 6.909 6.629 7.000 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
332 2 3 ASN HB2 2 4 GLN H 4.060 . 4.560 3.333 2.673 4.194 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
333 2 3 ASN HB2 2 4 GLN HA 6.000 . 6.500 4.873 4.580 6.040 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
334 2 3 ASN HB3 2 4 GLN H 4.060 . 4.560 3.618 2.722 4.155 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
335 2 3 ASN HB3 2 4 GLN HA 6.000 . 6.500 5.445 4.247 6.040 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
336 2 3 ASN QD 2 4 GLN H 6.520 . 7.020 4.674 3.411 5.664 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
337 2 4 GLN H 2 4 GLN QB 3.640 . 4.140 2.688 2.494 2.803 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
338 2 4 GLN H 2 4 GLN QE 6.520 . 7.020 4.988 4.150 5.813 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
339 2 4 GLN H 2 4 GLN HG2 4.670 . 5.170 4.010 3.099 4.631 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
340 2 4 GLN H 2 4 GLN HG3 4.670 . 5.170 3.753 3.208 4.668 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
341 2 4 GLN HA 2 5 HIS H 2.830 . 3.330 2.377 2.310 2.499 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
342 2 4 GLN HA 2 5 HIS QB 6.520 . 7.020 4.588 4.481 4.719 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
343 2 4 GLN QB 2 5 HIS H 3.340 . 3.840 2.471 2.309 2.649 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
344 2 4 GLN QB 2 6 LEU CG 7.430 . 7.930 3.122 2.907 3.463 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
345 2 4 GLN QB 2 6 LEU HG 6.520 . 7.020 2.340 2.182 2.659 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
346 2 4 GLN HB2 2 5 HIS H 3.840 . 4.340 3.741 3.599 3.868 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
347 2 4 GLN HB3 2 5 HIS H 3.440 . 3.940 2.507 2.337 2.699 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
348 2 4 GLN HG2 2 5 HIS H 6.000 . 6.500 4.301 3.485 5.027 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
349 2 4 GLN HG3 2 5 HIS H 6.000 . 6.500 4.872 4.469 5.084 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
350 2 5 HIS H 2 5 HIS HB2 3.340 . 3.840 2.450 2.336 2.532 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
351 2 5 HIS H 2 5 HIS QB 3.100 . 3.600 2.414 2.307 2.490 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
352 2 5 HIS H 2 5 HIS HB3 3.740 . 4.240 3.643 3.562 3.689 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
353 2 5 HIS H 2 5 HIS HD2 4.700 . 5.200 3.383 2.986 4.728 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
354 2 5 HIS H 2 6 LEU H 4.630 . 5.130 4.465 4.339 4.562 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
355 2 5 HIS H 2 6 LEU QB 6.140 . 6.640 5.505 5.458 5.562 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
356 2 5 HIS H 2 6 LEU HG 6.000 . 6.500 4.114 3.931 4.304 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
357 2 5 HIS HA 2 6 LEU H 3.370 . 3.870 2.190 2.134 2.275 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
358 2 5 HIS HB2 2 6 LEU H 4.490 . 4.990 4.206 4.040 4.409 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
359 2 5 HIS HB3 2 6 LEU H 4.490 . 4.990 3.234 3.032 3.571 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
360 2 5 HIS HD2 2 6 LEU H 6.300 . 6.800 6.222 3.647 6.357 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
361 2 6 LEU CG 2 7 CYS H 4.990 . 5.490 4.617 4.477 4.724 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
362 2 6 LEU CG 2 10 HIS QB 6.760 . 7.260 4.828 4.268 5.342 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
363 2 6 LEU CG 2 14 ALA MB 7.220 . 7.720 3.700 3.460 4.265 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
364 2 6 LEU H 2 6 LEU HB2 3.800 . 4.300 2.707 2.594 2.847 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
365 2 6 LEU H 2 6 LEU QB 3.510 . 4.010 2.653 2.550 2.778 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
366 2 6 LEU H 2 6 LEU HB3 3.800 . 4.300 3.815 3.752 3.869 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
367 2 6 LEU H 2 6 LEU HG 4.240 . 4.740 3.433 3.176 3.734 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
368 2 6 LEU H 2 7 CYS H 4.280 . 4.780 4.262 4.181 4.341 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
369 2 6 LEU H 2 7 CYS HA 4.990 . 5.490 4.826 4.719 4.915 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
370 2 6 LEU H 2 11 LEU CG 6.900 . 7.400 6.280 6.055 6.510 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
371 2 6 LEU HA 2 7 CYS H 2.690 . 3.190 2.195 2.120 2.263 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
372 2 6 LEU QB 2 7 CYS H 3.780 . 4.280 3.189 2.903 3.373 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
373 2 6 LEU QB 2 11 LEU CG 5.500 . 6.000 3.535 3.230 3.846 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
374 2 6 LEU QB 2 11 LEU HA 6.520 . 7.020 2.405 2.214 2.667 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
375 2 6 LEU QB 2 11 LEU QB 6.000 . 6.500 2.481 2.270 2.814 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
376 2 6 LEU MD1 2 14 ALA MB 10.140 . 10.640 2.219 2.068 2.743 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
377 2 6 LEU MD2 2 14 ALA MB 10.140 . 10.640 2.532 2.281 3.091 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
378 2 7 CYS H 2 7 CYS QB 3.510 . 4.010 2.664 2.516 2.839 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
379 2 7 CYS H 2 8 GLY H 4.310 . 4.810 4.376 4.349 4.407 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
380 2 7 CYS H 2 10 HIS QB 3.690 . 4.190 2.638 2.267 3.107 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
381 2 7 CYS HA 2 8 GLY H 2.800 . 3.300 2.207 2.123 2.283 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
382 2 7 CYS HA 2 8 GLY QA 5.400 . 5.900 3.984 3.913 4.037 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
383 2 7 CYS HA 2 11 LEU CG 5.860 . 6.360 4.544 3.972 5.244 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
384 2 7 CYS HA 2 11 LEU HB2 4.630 . 5.130 2.954 2.427 3.507 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
385 2 7 CYS HA 2 11 LEU QB 4.310 . 4.810 2.823 2.345 3.313 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
386 2 7 CYS HA 2 11 LEU HB3 4.630 . 5.130 3.594 3.061 4.168 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
387 2 7 CYS HA 2 11 LEU HG 6.000 . 6.500 5.393 4.807 6.035 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
388 2 7 CYS QB 2 8 GLY H 3.710 . 4.210 3.114 2.759 3.357 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
389 2 7 CYS HB2 2 8 GLY H 3.990 . 4.490 4.017 3.854 4.099 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
390 2 7 CYS HB3 2 8 GLY H 3.590 . 4.090 3.257 2.827 3.590 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
391 2 8 GLY H 2 11 LEU H 5.100 . 5.600 4.124 3.973 4.280 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
392 2 8 GLY H 2 11 LEU HB2 4.850 . 5.350 3.843 3.493 4.280 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
393 2 8 GLY H 2 11 LEU QB 4.650 . 5.150 3.184 2.949 3.456 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
394 2 8 GLY H 2 11 LEU HB3 4.850 . 5.350 3.401 3.142 3.767 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
395 2 8 GLY H 2 11 LEU MD1 8.430 . 8.930 5.131 3.617 5.866 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
396 2 8 GLY H 2 11 LEU MD2 8.430 . 8.930 3.669 3.190 4.945 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
397 2 8 GLY QA 2 9 SER H 3.040 . 3.540 2.107 2.085 2.134 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
398 2 8 GLY HA2 2 9 SER H 3.440 . 3.940 3.200 3.076 3.298 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
399 2 8 GLY HA3 2 9 SER H 3.440 . 3.940 2.138 2.116 2.176 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
400 2 9 SER H 2 10 HIS H 3.260 . 3.760 2.801 2.641 2.886 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
401 2 9 SER H 2 10 HIS QB 5.420 . 5.920 4.866 4.835 4.903 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
402 2 9 SER H 2 10 HIS HD2 6.000 . 6.500 5.224 4.169 6.045 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
403 2 9 SER H 2 11 LEU H 4.700 . 5.200 4.325 4.197 4.464 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
404 2 9 SER H 2 11 LEU MD2 8.430 . 8.930 6.455 6.163 6.836 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
405 2 9 SER H 2 12 VAL CB 6.900 . 7.400 5.848 5.701 6.208 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
406 2 9 SER H 2 12 VAL H 5.890 . 6.390 4.767 4.676 4.995 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
407 2 9 SER H 2 12 VAL HB 5.780 . 6.280 4.962 4.735 5.417 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
408 2 9 SER HA 2 12 VAL H 4.340 . 4.840 3.416 3.274 3.576 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
409 2 9 SER QB 2 10 HIS H 5.220 . 5.720 3.026 2.679 3.550 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
410 2 9 SER QB 2 10 HIS HD2 7.720 . 8.220 4.556 3.772 6.254 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
411 2 10 HIS H 2 10 HIS HB2 3.700 . 4.200 2.467 2.334 2.734 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
412 2 10 HIS H 2 10 HIS QB 3.320 . 3.820 2.425 2.306 2.649 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
413 2 10 HIS H 2 10 HIS HB3 3.700 . 4.200 3.589 3.537 3.625 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
414 2 10 HIS H 2 11 LEU H 2.940 . 3.440 2.613 2.482 2.841 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
415 2 10 HIS HA 2 13 GLU HB2 4.160 . 4.660 3.132 2.255 3.711 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
416 2 10 HIS HA 2 13 GLU QB 3.910 . 4.410 2.428 2.081 2.811 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
417 2 10 HIS HA 2 13 GLU HB3 4.160 . 4.660 2.783 2.127 4.180 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
418 2 10 HIS HA 2 14 ALA MB 8.430 . 8.930 4.590 4.495 4.781 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
419 2 10 HIS QB 2 11 LEU HA 5.540 . 6.040 4.161 4.007 4.286 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
420 2 10 HIS QB 2 14 ALA MB 9.100 . 9.600 4.290 4.163 4.441 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
421 2 10 HIS HB2 2 11 LEU H 4.200 . 4.700 2.826 2.551 3.111 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
422 2 10 HIS HB3 2 11 LEU H 4.200 . 4.700 3.827 3.728 3.935 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
423 2 11 LEU H 2 11 LEU HB2 3.440 . 3.940 2.608 2.511 2.700 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
424 2 11 LEU H 2 11 LEU QB 3.300 . 3.800 2.238 2.189 2.326 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
425 2 11 LEU H 2 11 LEU HB3 3.440 . 3.940 2.438 2.368 2.622 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
426 2 11 LEU H 2 11 LEU HG 4.450 . 4.950 4.455 4.407 4.500 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
427 2 11 LEU HA 2 11 LEU HG 3.770 . 4.270 3.077 2.262 3.324 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
428 2 11 LEU HA 2 14 ALA H 3.620 . 4.120 3.379 3.226 3.555 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
429 2 11 LEU HA 2 14 ALA MB 6.440 . 6.940 2.538 2.347 2.734 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
430 2 11 LEU QB 2 12 VAL H 3.650 . 4.150 2.565 2.463 2.663 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
431 2 11 LEU QB 2 12 VAL HA 5.860 . 6.360 4.384 4.285 4.462 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
432 2 11 LEU HB2 2 12 VAL H 3.920 . 4.430 3.915 3.847 3.962 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
433 2 11 LEU HB2 2 12 VAL HA 6.000 . 6.500 5.791 5.708 5.874 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
434 2 11 LEU HB3 2 12 VAL H 3.770 . 4.270 2.600 2.492 2.706 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
435 2 11 LEU HB3 2 12 VAL HA 6.000 . 6.500 4.540 4.427 4.624 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
436 2 11 LEU MD1 2 12 VAL HA 8.430 . 8.930 4.882 4.448 5.687 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
437 2 11 LEU MD2 2 12 VAL HA 8.430 . 8.930 4.639 2.709 5.345 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
438 2 11 LEU HG 2 12 VAL H 4.380 . 4.880 3.813 3.424 4.442 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
439 2 11 LEU HG 2 12 VAL HA 5.460 . 5.960 4.062 3.602 4.944 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
440 2 11 LEU HG 2 15 LEU CG 5.690 . 6.190 4.732 3.647 5.724 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
441 2 11 LEU HG 2 15 LEU H 4.780 . 5.280 4.463 3.909 4.768 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
442 2 12 VAL CB 2 26 TYR QB 7.430 . 7.930 5.515 4.123 6.656 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
443 2 12 VAL H 2 12 VAL HB 3.160 . 3.660 2.449 2.312 2.623 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
444 2 12 VAL H 2 13 GLU H 3.160 . 3.660 2.848 2.719 2.937 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
445 2 12 VAL HA 2 13 GLU H 3.550 . 4.050 3.585 3.560 3.603 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
446 2 12 VAL HA 2 13 GLU HA 5.460 . 5.960 4.858 4.811 4.937 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
447 2 12 VAL HA 2 14 ALA H 4.630 . 5.130 4.661 4.634 4.696 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
448 2 12 VAL HA 2 14 ALA MB 8.430 . 8.930 5.098 4.965 5.223 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
449 2 12 VAL HA 2 15 LEU CG 5.690 . 6.190 4.211 3.798 4.771 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
450 2 12 VAL HA 2 15 LEU H 4.020 . 4.520 3.633 3.441 3.803 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
451 2 12 VAL HA 2 15 LEU QB 5.050 . 5.550 2.569 2.325 2.817 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
452 2 12 VAL HA 2 15 LEU MD1 8.430 . 8.930 3.929 2.200 5.493 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
453 2 12 VAL HA 2 15 LEU MD2 8.430 . 8.930 3.890 2.780 5.186 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
454 2 12 VAL HA 2 16 TYR H 4.310 . 4.810 3.928 3.736 4.258 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
455 2 12 VAL HA 2 24 PHE QE 9.130 . 9.630 3.870 3.020 6.357 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
456 2 12 VAL HA 2 26 TYR QE 9.130 . 9.630 4.569 3.232 7.731 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
457 2 12 VAL HB 2 13 GLU H 3.120 . 3.620 2.776 2.641 2.947 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
458 2 13 GLU H 2 13 GLU HB2 3.480 . 3.980 2.412 2.280 2.498 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
459 2 13 GLU H 2 13 GLU QB 3.240 . 3.740 2.208 2.132 2.343 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
460 2 13 GLU H 2 13 GLU HB3 3.480 . 3.980 2.684 2.359 3.563 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
461 2 13 GLU H 2 14 ALA H 2.830 . 3.330 2.820 2.741 2.863 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
462 2 13 GLU H 2 14 ALA MB 6.830 . 7.330 4.434 4.372 4.490 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
463 2 13 GLU HA 2 16 TYR QB 4.740 . 5.240 2.660 2.468 2.933 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
464 2 13 GLU HB2 2 14 ALA H 3.780 . 4.280 3.613 2.541 3.856 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
465 2 13 GLU HB3 2 14 ALA H 3.480 . 3.980 2.644 2.390 3.445 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
466 2 13 GLU QG 2 14 ALA H 7.720 . 8.220 3.696 3.357 4.357 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
467 2 14 ALA H 2 15 LEU H 2.940 . 3.440 2.827 2.750 2.912 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
468 2 14 ALA MB 2 15 LEU H 5.220 . 5.720 2.499 2.421 2.631 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
469 2 14 ALA MB 2 15 LEU MD1 11.600 . 12.100 4.717 4.381 5.039 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
470 2 14 ALA MB 2 15 LEU MD2 11.600 . 12.100 4.942 3.245 5.473 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
471 2 14 ALA MB 2 16 TYR H 8.210 . 8.710 4.732 4.636 4.825 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
472 2 14 ALA MB 2 17 LEU MD1 11.080 . 11.580 3.997 3.684 4.311 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
473 2 14 ALA MB 2 17 LEU MD2 11.080 . 11.580 5.939 5.724 6.132 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
474 2 14 ALA MB 2 18 VAL H 8.350 . 8.850 4.555 4.430 4.776 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
475 2 14 ALA MB 2 18 VAL HB 8.430 . 8.930 4.886 4.661 5.288 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
476 2 15 LEU CG 2 18 VAL CB 7.680 . 8.180 6.290 5.881 6.632 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
477 2 15 LEU CG 2 18 VAL HB 6.900 . 7.400 5.223 4.802 5.574 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
478 2 15 LEU CG 2 24 PHE QB 7.430 . 7.930 3.446 2.788 4.787 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
479 2 15 LEU CG 2 24 PHE QE 10.000 . 10.500 4.871 4.192 6.270 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
480 2 15 LEU CG 2 26 TYR QB 6.640 . 7.140 4.536 3.536 5.846 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
481 2 15 LEU H 2 15 LEU HA 2.940 . 3.440 2.842 2.813 2.867 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
482 2 15 LEU H 2 15 LEU QB 2.960 . 3.460 2.199 2.080 2.310 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
483 2 15 LEU H 2 18 VAL CB 6.900 . 7.400 5.962 5.784 6.180 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
484 2 15 LEU HA 2 18 VAL CB 5.380 . 5.880 3.788 3.525 4.022 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
485 2 15 LEU HA 2 18 VAL H 4.160 . 4.660 3.539 3.349 3.729 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
486 2 15 LEU HA 2 18 VAL HB 3.880 . 4.380 2.737 2.498 2.962 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
487 2 15 LEU HA 2 19 CYS H 4.020 . 4.520 3.919 3.676 4.065 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
488 2 15 LEU QB 2 16 TYR H 3.380 . 3.880 2.437 2.343 2.526 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
489 2 15 LEU QB 2 16 TYR QB 8.340 . 8.840 3.926 3.720 4.456 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
490 2 15 LEU HB2 2 16 TYR H 3.820 . 4.320 3.237 2.419 3.864 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
491 2 15 LEU HB2 2 24 PHE QD 9.130 . 9.630 4.529 3.107 5.924 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
492 2 15 LEU HB3 2 16 TYR H 3.520 . 4.020 2.815 2.398 3.384 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
493 2 15 LEU HB3 2 24 PHE QD 9.130 . 9.630 3.742 2.463 5.122 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
494 2 15 LEU MD1 2 16 TYR H 8.430 . 8.930 4.409 4.259 4.595 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
495 2 15 LEU MD1 2 19 CYS H 8.430 . 8.930 5.192 3.849 6.770 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
496 2 15 LEU MD1 2 24 PHE QD 12.330 . 12.830 3.265 2.240 4.488 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
497 2 15 LEU MD2 2 16 TYR H 8.430 . 8.930 4.424 3.961 4.795 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
498 2 15 LEU MD2 2 19 CYS H 8.430 . 8.930 5.545 4.738 6.322 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
499 2 15 LEU MD2 2 24 PHE QD 12.330 . 12.830 2.853 2.169 3.995 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
500 2 15 LEU HG 2 16 TYR H 4.780 . 5.280 4.079 3.412 4.816 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
501 2 16 TYR H 2 17 LEU H 2.940 . 3.440 2.866 2.770 2.956 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
502 2 16 TYR H 2 18 VAL H 4.380 . 4.880 4.355 4.258 4.417 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
503 2 16 TYR H 2 24 PHE QD 9.130 . 9.630 4.455 3.881 5.702 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
504 2 16 TYR H 2 24 PHE QE 9.130 . 9.630 4.109 3.177 6.776 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
505 2 16 TYR HA 2 17 LEU CG 6.900 . 7.400 6.170 6.100 6.247 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
506 2 16 TYR HA 2 17 LEU H 3.520 . 4.020 3.576 3.555 3.592 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
507 2 16 TYR HA 2 18 VAL H 4.700 . 5.200 4.577 4.340 4.698 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
508 2 16 TYR HA 2 19 CYS H 3.950 . 4.450 3.665 3.295 3.916 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
509 2 16 TYR HA 2 20 GLY H 4.020 . 4.520 3.754 2.675 4.086 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
510 2 16 TYR HA 2 24 PHE H 5.820 . 6.320 5.806 4.954 5.923 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
511 2 16 TYR HA 2 24 PHE QD 9.080 . 9.580 2.894 2.650 4.321 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
512 2 16 TYR HA 2 24 PHE QE 7.880 . 8.380 3.129 2.266 5.895 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
513 2 16 TYR QB 2 17 LEU CG 8.680 . 9.180 4.428 4.258 4.746 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
514 2 16 TYR QB 2 17 LEU H 5.170 . 5.670 2.674 2.573 2.944 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
515 2 16 TYR QB 2 17 LEU QB 8.340 . 8.840 4.473 4.343 4.732 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
516 2 16 TYR QB 2 17 LEU HG 7.160 . 7.660 3.472 3.313 3.801 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
517 2 16 TYR QB 2 18 VAL H 6.790 . 7.290 4.886 4.790 4.994 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
518 2 16 TYR QB 2 24 PHE QE 11.350 . 11.850 2.537 2.258 5.869 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
519 2 16 TYR QD 2 18 VAL H 9.130 . 9.630 5.704 5.580 5.957 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
520 2 16 TYR QE 2 17 LEU HG 9.130 . 9.630 4.566 3.896 7.349 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
521 2 17 LEU H 2 17 LEU HB2 3.480 . 3.980 2.365 2.337 2.395 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
522 2 17 LEU H 2 17 LEU QB 3.310 . 3.810 2.335 2.308 2.362 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
523 2 17 LEU H 2 17 LEU HB3 3.630 . 4.130 3.597 3.585 3.614 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
524 2 17 LEU H 2 17 LEU HG 3.080 . 3.580 2.556 2.504 2.660 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
525 2 17 LEU H 2 18 VAL H 3.120 . 3.620 2.673 2.594 2.724 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
526 2 17 LEU H 2 19 CYS H 4.150 . 4.650 4.176 4.061 4.219 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
527 2 17 LEU HA 2 18 VAL H 3.480 . 3.980 3.528 3.505 3.556 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
528 2 17 LEU HA 2 19 CYS H 4.440 . 4.940 4.470 4.418 4.518 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
529 2 17 LEU HA 2 20 GLY H 4.160 . 4.660 3.603 3.304 4.166 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
530 2 17 LEU QB 2 18 VAL CB 6.360 . 6.860 4.755 4.635 4.831 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
531 2 17 LEU QB 2 18 VAL HA 5.080 . 5.580 4.135 4.078 4.197 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
532 2 17 LEU HB2 2 18 VAL H 3.370 . 3.870 2.861 2.739 3.013 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
533 2 17 LEU HB2 2 18 VAL HA 5.140 . 5.640 4.745 4.660 4.872 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
534 2 17 LEU HB3 2 18 VAL H 3.970 . 4.470 3.672 3.547 3.753 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
535 2 17 LEU HB3 2 18 VAL HA 5.140 . 5.640 4.552 4.463 4.643 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
536 2 17 LEU HG 2 18 VAL H 5.350 . 5.850 4.666 4.613 4.762 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
537 2 18 VAL CB 2 19 CYS HA 5.440 . 5.940 4.595 4.504 4.760 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
538 2 18 VAL CB 2 19 CYS QB 6.470 . 6.970 4.960 3.403 5.311 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
539 2 18 VAL H 2 18 VAL HB 2.940 . 3.440 2.395 2.335 2.514 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
540 2 18 VAL H 2 19 CYS H 2.980 . 3.480 2.652 2.463 2.743 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
541 2 18 VAL H 2 19 CYS HA 5.420 . 5.920 5.319 5.179 5.380 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
542 2 18 VAL H 2 19 CYS QB 5.880 . 6.380 4.709 4.294 4.875 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
543 2 18 VAL H 2 20 GLY H 4.110 . 4.710 4.159 3.998 4.190 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
544 2 18 VAL HA 2 19 CYS H 3.550 . 4.050 3.582 3.552 3.601 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
545 2 18 VAL HB 2 19 CYS H 3.050 . 3.550 2.718 2.617 2.842 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
546 2 18 VAL HB 2 19 CYS HA 4.570 . 5.070 4.594 4.521 4.689 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
547 2 18 VAL MG1 2 19 CYS H 6.180 . 6.680 3.275 3.124 3.564 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
548 2 18 VAL MG1 2 19 CYS HA 8.170 . 8.670 3.298 3.138 3.693 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
549 2 18 VAL MG2 2 19 CYS H 6.180 . 6.680 4.056 3.987 4.097 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
550 2 18 VAL MG2 2 19 CYS HA 8.170 . 8.670 5.453 5.367 5.585 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
551 2 19 CYS H 2 19 CYS HB2 3.340 . 3.840 2.480 2.405 2.782 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
552 2 19 CYS H 2 19 CYS QB 3.210 . 3.710 2.427 2.157 2.609 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
553 2 19 CYS H 2 19 CYS HB3 3.740 . 4.240 3.558 2.400 3.701 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
554 2 19 CYS H 2 20 GLY H 2.940 . 3.440 2.589 2.273 2.735 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
555 2 19 CYS H 2 20 GLY QA 5.780 . 6.280 4.438 3.919 4.559 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
556 2 19 CYS H 2 24 PHE QD 9.130 . 9.630 5.077 4.333 6.578 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
557 2 19 CYS HA 2 20 GLY H 3.570 . 4.070 3.504 3.190 3.582 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
558 2 19 CYS HA 2 22 ARG QB 4.570 . 5.070 3.438 2.781 4.083 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
559 2 19 CYS HA 2 22 ARG HE 5.750 . 6.250 4.087 2.586 5.857 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
560 2 19 CYS HA 2 22 ARG QG 7.720 . 8.220 4.684 3.129 5.866 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
561 2 19 CYS QB 2 23 GLY H 5.120 . 5.620 3.655 2.705 4.651 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
562 2 19 CYS QB 2 23 GLY QA 5.870 . 6.370 3.861 3.334 4.684 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
563 2 19 CYS QB 2 24 PHE QB 5.130 . 5.630 2.939 2.137 3.914 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
564 2 19 CYS QB 2 24 PHE QD 9.790 . 10.290 3.182 2.262 4.306 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
565 2 19 CYS QB 2 24 PHE QE 9.800 . 10.300 4.948 4.015 6.251 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
566 2 19 CYS HB2 2 20 GLY H 4.340 . 4.840 3.113 2.771 4.357 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
567 2 19 CYS HB3 2 20 GLY H 4.340 . 4.840 3.926 2.872 4.400 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
568 2 21 GLU H 2 22 ARG H 2.980 . 3.480 2.721 2.515 2.950 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
569 2 21 GLU QB 2 22 ARG H 4.160 . 4.660 3.277 2.862 3.758 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
570 2 21 GLU HB2 2 22 ARG H 4.520 . 5.020 3.686 3.072 4.265 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
571 2 21 GLU HB3 2 22 ARG H 4.520 . 5.020 3.934 2.927 4.348 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
572 2 22 ARG H 2 22 ARG HB2 3.480 . 3.980 2.455 2.191 2.643 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
573 2 22 ARG H 2 22 ARG QB 3.330 . 3.830 2.403 2.106 2.584 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
574 2 22 ARG H 2 22 ARG HB3 3.630 . 4.130 3.525 2.411 3.665 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
575 2 22 ARG H 2 22 ARG HE 6.000 . 6.500 4.232 2.344 5.765 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
576 2 22 ARG QB 2 23 GLY H 4.410 . 4.910 2.731 2.348 3.549 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
577 2 23 GLY QA 2 24 PHE QB 6.310 . 6.810 3.871 3.654 4.131 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
578 2 23 GLY HA2 2 24 PHE H 3.300 . 3.800 2.477 2.152 2.724 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
579 2 23 GLY HA2 2 24 PHE QD 9.130 . 9.630 3.051 2.536 3.677 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
580 2 23 GLY HA2 2 24 PHE QE 9.130 . 9.630 4.401 3.722 5.271 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
581 2 23 GLY HA3 2 24 PHE H 3.300 . 3.800 2.656 2.403 3.197 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
582 2 23 GLY HA3 2 24 PHE QD 9.130 . 9.630 4.459 4.023 5.141 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
583 2 23 GLY HA3 2 24 PHE QE 9.130 . 9.630 5.812 5.204 6.476 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
584 2 24 PHE H 2 24 PHE QB 3.610 . 4.110 3.122 2.696 3.249 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
585 2 24 PHE H 2 25 PHE H 4.610 . 5.110 4.442 4.350 4.585 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
586 2 24 PHE HA 2 25 PHE H 3.010 . 3.510 2.314 2.159 2.520 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
587 2 24 PHE HA 2 25 PHE QB 4.740 . 5.240 4.056 3.858 4.295 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
588 2 24 PHE HA 2 25 PHE QD 9.130 . 9.630 5.653 3.345 6.060 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
589 2 24 PHE QB 2 25 PHE H 3.870 . 4.370 2.451 2.262 2.751 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
590 2 24 PHE QD 2 25 PHE H 9.130 . 9.630 3.430 2.898 3.923 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
591 2 24 PHE QD 2 26 TYR H 9.130 . 9.630 3.610 2.083 4.600 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
592 2 24 PHE QE 2 26 TYR QB 9.800 . 10.300 3.326 2.309 4.794 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
593 2 25 PHE H 2 25 PHE HB2 3.950 . 4.450 3.100 2.328 3.855 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
594 2 25 PHE H 2 25 PHE QB 3.640 . 4.140 2.548 2.182 3.024 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
595 2 25 PHE H 2 25 PHE HB3 3.950 . 4.450 2.822 2.280 3.748 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
596 2 25 PHE H 2 26 TYR H 4.510 . 5.010 4.100 2.288 4.554 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
597 2 25 PHE QB 2 26 TYR H 4.970 . 5.470 3.603 2.513 4.065 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
598 2 25 PHE QD 2 27 THR H 9.130 . 9.630 5.171 3.371 7.786 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
599 2 25 PHE QD 2 27 THR MG 12.330 . 12.830 4.209 2.343 5.986 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
600 2 26 TYR H 2 26 TYR HA 3.000 . 3.500 2.892 2.238 3.002 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
601 2 26 TYR H 2 26 TYR HB2 3.480 . 3.980 3.332 2.444 3.717 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
602 2 26 TYR H 2 26 TYR QB 3.360 . 3.860 2.643 2.149 3.036 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
603 2 26 TYR H 2 26 TYR HB3 3.480 . 3.980 2.812 2.221 3.538 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
604 2 26 TYR QB 2 27 THR H 4.470 . 4.970 3.354 2.088 4.062 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
605 2 26 TYR QD 2 27 THR H 9.130 . 9.630 3.726 2.441 5.000 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
606 2 26 TYR QD 2 28 PRO HA 9.130 . 9.630 5.501 2.851 6.970 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
607 2 26 TYR QD 2 28 PRO QD 11.360 . 11.860 3.940 2.360 5.286 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
608 2 26 TYR QE 2 28 PRO HA 9.130 . 9.630 5.614 2.273 8.149 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
609 2 26 TYR QE 2 28 PRO QB 9.800 . 10.300 4.819 2.449 7.173 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
610 2 26 TYR QE 2 28 PRO QD 11.360 . 11.860 4.161 2.614 6.421 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
611 2 26 TYR QE 2 28 PRO QG 9.800 . 10.300 5.085 2.443 7.631 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
612 2 27 THR H 2 27 THR HB 3.770 . 4.270 3.449 2.576 3.855 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
613 2 27 THR H 2 28 PRO QD 7.730 . 8.230 4.186 2.916 4.853 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
614 2 27 THR HB 2 28 PRO QD 7.730 . 8.230 3.460 2.158 4.522 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
615 2 27 THR MG 2 28 PRO QB 9.100 . 9.600 5.263 3.723 6.047 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
616 2 27 THR MG 2 28 PRO QD 10.660 . 11.160 3.308 2.091 5.094 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
617 2 28 PRO HA 2 29 LYS QB 5.280 . 5.780 4.505 4.032 4.841 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
618 2 28 PRO QD 2 29 LYS HA 7.730 . 8.230 5.589 4.437 6.530 . 0 0 "[ . 1 . 2 . 3 . 4 . 5]" 1
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