NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
492722 |
2ka4   |
16014 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2ka4
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 1621
_Distance_constraint_stats_list.Viol_count 12
_Distance_constraint_stats_list.Viol_total 12.361
_Distance_constraint_stats_list.Viol_max 0.138
_Distance_constraint_stats_list.Viol_rms 0.0013
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0000
_Distance_constraint_stats_list.Viol_average_violations_only 0.0515
_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 3 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 6 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 18 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 21 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 26 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 27 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 VAL 0.023 0.023 10 0 "[ . 1 . 2]"
1 38 ARG 0.023 0.023 10 0 "[ . 1 . 2]"
1 39 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 45 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 HIS 0.005 0.005 20 0 "[ . 1 . 2]"
1 58 CYS 0.005 0.005 20 0 "[ . 1 . 2]"
1 59 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 GLN 0.192 0.079 17 0 "[ . 1 . 2]"
1 75 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 79 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 81 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 82 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 85 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 88 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 95 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 98 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
2 4 MET 0.000 0.000 . 0 "[ . 1 . 2]"
2 5 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
2 6 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
2 7 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 8 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
2 9 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 10 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
2 11 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
2 12 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
2 13 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 14 LEU 0.192 0.079 17 0 "[ . 1 . 2]"
2 15 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
2 16 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
2 17 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
2 18 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
2 19 THR 0.000 0.000 . 0 "[ . 1 . 2]"
2 20 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 21 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
2 22 MET 0.000 0.000 . 0 "[ . 1 . 2]"
2 23 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 24 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
2 25 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
2 26 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
2 28 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 29 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
2 30 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 31 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
2 32 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 33 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 34 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
2 35 MET 0.000 0.000 . 0 "[ . 1 . 2]"
2 37 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
2 38 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 39 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 40 PRO 0.205 0.106 18 0 "[ . 1 . 2]"
2 41 LEU 0.205 0.106 18 0 "[ . 1 . 2]"
2 42 LEU 0.175 0.138 14 0 "[ . 1 . 2]"
2 43 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
2 44 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 45 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
2 46 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
2 47 THR 0.000 0.000 . 0 "[ . 1 . 2]"
2 48 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
2 49 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 50 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 51 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
2 52 TYR 0.017 0.017 3 0 "[ . 1 . 2]"
2 53 VAL 0.017 0.017 3 0 "[ . 1 . 2]"
2 54 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 55 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
2 56 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 GLY QA 1 4 PRO QD 3.310 . 3.730 2.202 2.076 2.424 . 0 0 "[ . 1 . 2]" 1
2 1 3 GLY QA 1 4 PRO QG 5.710 . 6.210 3.882 3.742 4.076 . 0 0 "[ . 1 . 2]" 1
3 1 4 PRO HA 1 5 THR MG 6.200 . 6.700 4.969 4.010 5.153 . 0 0 "[ . 1 . 2]" 1
4 1 4 PRO QG 1 5 THR MG 5.470 . 5.970 2.964 2.768 4.068 . 0 0 "[ . 1 . 2]" 1
5 1 5 THR HA 1 5 THR MG 3.550 . 4.050 2.318 2.245 2.409 . 0 0 "[ . 1 . 2]" 1
6 1 5 THR HA 1 6 ALA H 3.450 . 3.950 3.391 3.164 3.472 . 0 0 "[ . 1 . 2]" 1
7 1 5 THR HA 2 15 ARG QD 5.610 . 6.110 3.324 2.241 4.503 . 0 0 "[ . 1 . 2]" 1
8 1 5 THR HB 2 9 ASP HA 5.000 . 5.500 3.819 2.747 4.721 . 0 0 "[ . 1 . 2]" 1
9 1 5 THR HB 2 9 ASP QB 5.610 . 6.110 3.331 2.377 4.496 . 0 0 "[ . 1 . 2]" 1
10 1 5 THR HB 2 15 ARG QD 6.170 . 6.670 4.015 2.151 5.501 . 0 0 "[ . 1 . 2]" 1
11 1 5 THR MG 2 9 ASP QB 6.740 . 7.240 4.195 3.227 4.928 . 0 0 "[ . 1 . 2]" 1
12 1 5 THR MG 2 15 ARG QD 6.070 . 6.570 3.575 2.626 4.380 . 0 0 "[ . 1 . 2]" 1
13 1 5 THR MG 2 15 ARG QG 7.410 . 7.910 5.009 3.363 5.522 . 0 0 "[ . 1 . 2]" 1
14 1 6 ALA H 2 7 GLU QB 5.990 . 6.490 5.389 5.354 5.460 . 0 0 "[ . 1 . 2]" 1
15 1 6 ALA HA 1 7 ASP H 3.390 . 3.890 2.982 2.206 3.478 . 0 0 "[ . 1 . 2]" 1
16 1 6 ALA HA 2 7 GLU QB 5.610 . 6.110 4.284 3.488 4.706 . 0 0 "[ . 1 . 2]" 1
17 1 6 ALA HA 2 7 GLU QG 4.630 . 5.130 3.629 3.185 4.170 . 0 0 "[ . 1 . 2]" 1
18 1 6 ALA HA 2 9 ASP HA 4.000 . 4.500 3.191 2.462 3.527 . 0 0 "[ . 1 . 2]" 1
19 1 6 ALA HA 2 9 ASP QB 5.610 . 6.110 4.788 4.096 5.084 . 0 0 "[ . 1 . 2]" 1
20 1 6 ALA HA 2 10 LEU H 3.300 . 3.800 2.412 1.933 3.038 . 0 0 "[ . 1 . 2]" 1
21 1 6 ALA HA 2 10 LEU QB 6.170 . 6.670 2.558 2.238 3.205 . 0 0 "[ . 1 . 2]" 1
22 1 6 ALA HA 2 10 LEU QD 6.740 . 7.240 3.673 3.348 4.325 . 0 0 "[ . 1 . 2]" 1
23 1 6 ALA HA 2 10 LEU HG 5.500 . 6.000 4.803 4.449 5.401 . 0 0 "[ . 1 . 2]" 1
24 1 6 ALA MB 1 7 ASP H 5.120 . 5.620 3.075 2.611 3.660 . 0 0 "[ . 1 . 2]" 1
25 1 6 ALA MB 1 7 ASP HA 5.920 . 6.420 4.131 3.906 4.367 . 0 0 "[ . 1 . 2]" 1
26 1 6 ALA MB 1 8 PRO QD 5.270 . 5.770 3.563 2.958 3.966 . 0 0 "[ . 1 . 2]" 1
27 1 6 ALA MB 2 7 GLU H 6.000 . 6.500 4.248 3.934 4.838 . 0 0 "[ . 1 . 2]" 1
28 1 6 ALA MB 2 7 GLU HA 6.610 . 7.110 4.259 3.999 4.655 . 0 0 "[ . 1 . 2]" 1
29 1 6 ALA MB 2 7 GLU QB 4.790 . 5.290 2.255 2.104 2.458 . 0 0 "[ . 1 . 2]" 1
30 1 6 ALA MB 2 7 GLU QG 4.330 . 4.830 2.496 2.073 3.246 . 0 0 "[ . 1 . 2]" 1
31 1 6 ALA MB 2 8 PRO HA 6.120 . 6.620 4.211 3.955 4.553 . 0 0 "[ . 1 . 2]" 1
32 1 6 ALA MB 2 8 PRO QB 7.200 . 7.700 4.917 4.621 5.360 . 0 0 "[ . 1 . 2]" 1
33 1 6 ALA MB 2 8 PRO QD 7.410 . 7.910 4.531 4.226 5.001 . 0 0 "[ . 1 . 2]" 1
34 1 6 ALA MB 2 9 ASP H 6.610 . 7.110 4.260 3.916 4.706 . 0 0 "[ . 1 . 2]" 1
35 1 6 ALA MB 2 9 ASP HA 3.920 . 4.420 2.766 2.226 3.281 . 0 0 "[ . 1 . 2]" 1
36 1 6 ALA MB 2 9 ASP QB 5.970 . 6.470 3.863 2.951 4.434 . 0 0 "[ . 1 . 2]" 1
37 1 6 ALA MB 2 10 LEU H 5.200 . 5.700 3.419 3.013 4.004 . 0 0 "[ . 1 . 2]" 1
38 1 6 ALA MB 2 10 LEU QD 8.090 . 8.590 4.606 4.093 5.022 . 0 0 "[ . 1 . 2]" 1
39 1 7 ASP HA 1 8 PRO QD 3.120 . 3.620 2.060 2.015 2.120 . 0 0 "[ . 1 . 2]" 1
40 1 7 ASP HA 1 8 PRO QG 4.600 . 5.100 4.002 3.942 4.079 . 0 0 "[ . 1 . 2]" 1
41 1 7 ASP HA 1 9 GLU H 4.340 . 4.840 4.029 3.806 4.268 . 0 0 "[ . 1 . 2]" 1
42 1 7 ASP HA 2 7 GLU QG 6.170 . 6.670 4.347 3.646 5.091 . 0 0 "[ . 1 . 2]" 1
43 1 7 ASP QB 1 8 PRO QD 4.780 . 5.280 3.786 3.709 3.813 . 0 0 "[ . 1 . 2]" 1
44 1 7 ASP QB 1 10 LYS QB 5.040 . 5.540 2.248 2.150 2.338 . 0 0 "[ . 1 . 2]" 1
45 1 7 ASP QB 2 10 LEU QD 8.080 . 8.580 3.014 2.493 3.629 . 0 0 "[ . 1 . 2]" 1
46 1 7 ASP HB2 1 8 PRO QD 4.860 . 5.360 4.155 4.058 4.196 . 0 0 "[ . 1 . 2]" 1
47 1 7 ASP HB3 1 8 PRO QD 4.860 . 5.360 4.362 4.293 4.384 . 0 0 "[ . 1 . 2]" 1
48 1 8 PRO HA 1 11 ARG H 4.440 . 4.940 3.849 3.596 4.091 . 0 0 "[ . 1 . 2]" 1
49 1 8 PRO HA 1 11 ARG QB 3.080 . 3.580 2.509 2.324 2.740 . 0 0 "[ . 1 . 2]" 1
50 1 8 PRO HA 1 11 ARG QD 5.990 . 6.490 3.963 2.491 5.137 . 0 0 "[ . 1 . 2]" 1
51 1 8 PRO HA 1 11 ARG QG 4.680 . 5.180 4.012 3.672 4.223 . 0 0 "[ . 1 . 2]" 1
52 1 8 PRO HA 2 7 GLU HA 5.500 . 6.000 5.478 4.636 5.593 . 0 0 "[ . 1 . 2]" 1
53 1 8 PRO HA 2 7 GLU QB 5.610 . 6.110 3.932 3.289 4.726 . 0 0 "[ . 1 . 2]" 1
54 1 8 PRO HA 2 7 GLU QG 5.610 . 6.110 2.854 2.255 5.010 . 0 0 "[ . 1 . 2]" 1
55 1 8 PRO QB 1 9 GLU H 3.230 . 3.730 2.644 2.551 2.893 . 0 0 "[ . 1 . 2]" 1
56 1 8 PRO QB 2 7 GLU QB 6.930 . 7.430 3.865 3.511 4.647 . 0 0 "[ . 1 . 2]" 1
57 1 8 PRO QB 2 7 GLU QG 6.300 . 6.800 3.790 3.158 5.002 . 0 0 "[ . 1 . 2]" 1
58 1 8 PRO QD 1 9 GLU H 3.790 . 4.290 2.958 2.756 3.166 . 0 0 "[ . 1 . 2]" 1
59 1 8 PRO QD 2 7 GLU QB 6.930 . 7.430 3.264 2.894 3.789 . 0 0 "[ . 1 . 2]" 1
60 1 8 PRO QD 2 7 GLU QG 6.930 . 7.430 2.907 2.451 3.989 . 0 0 "[ . 1 . 2]" 1
61 1 8 PRO QG 2 7 GLU HA 6.170 . 6.670 4.638 4.403 5.240 . 0 0 "[ . 1 . 2]" 1
62 1 8 PRO QG 2 7 GLU QB 6.930 . 7.430 2.386 2.170 3.576 . 0 0 "[ . 1 . 2]" 1
63 1 8 PRO QG 2 7 GLU QG 6.300 . 6.800 2.670 2.173 3.416 . 0 0 "[ . 1 . 2]" 1
64 1 9 GLU H 1 10 LYS H 3.550 . 4.050 2.674 2.472 2.735 . 0 0 "[ . 1 . 2]" 1
65 1 9 GLU HA 2 26 ARG QD 6.170 . 6.670 4.355 3.699 5.103 . 0 0 "[ . 1 . 2]" 1
66 1 9 GLU QB 1 13 LEU MD1 6.010 . 6.510 4.457 4.308 4.500 . 0 0 "[ . 1 . 2]" 1
67 1 9 GLU QG 1 10 LYS HA 5.990 . 6.490 4.111 3.850 4.620 . 0 0 "[ . 1 . 2]" 1
68 1 9 GLU QG 1 13 LEU MD1 5.400 . 5.760 3.256 2.988 3.731 . 0 0 "[ . 1 . 2]" 1
69 1 9 GLU QG 1 13 LEU HG 5.990 . 6.490 3.434 3.122 3.935 . 0 0 "[ . 1 . 2]" 1
70 1 9 GLU QG 2 26 ARG QD 6.930 . 7.430 2.518 2.087 3.596 . 0 0 "[ . 1 . 2]" 1
71 1 10 LYS H 1 11 ARG H 3.460 . 3.960 2.681 2.616 2.744 . 0 0 "[ . 1 . 2]" 1
72 1 10 LYS HA 1 10 LYS QE 5.080 . 5.580 4.479 4.235 4.591 . 0 0 "[ . 1 . 2]" 1
73 1 10 LYS HA 1 13 LEU H 4.050 . 4.550 3.266 3.158 3.347 . 0 0 "[ . 1 . 2]" 1
74 1 10 LYS HA 1 13 LEU QB 4.090 . 4.590 2.568 2.398 2.749 . 0 0 "[ . 1 . 2]" 1
75 1 10 LYS HA 1 13 LEU MD1 4.370 . 4.870 2.583 2.482 2.733 . 0 0 "[ . 1 . 2]" 1
76 1 10 LYS HA 1 13 LEU HG 3.500 . 4.000 3.558 3.519 3.648 . 0 0 "[ . 1 . 2]" 1
77 1 10 LYS HA 2 10 LEU QD 6.380 . 6.880 4.637 4.438 4.747 . 0 0 "[ . 1 . 2]" 1
78 1 10 LYS HA 2 19 THR HB 4.890 . 5.390 3.755 3.619 3.839 . 0 0 "[ . 1 . 2]" 1
79 1 10 LYS HA 2 19 THR MG 4.790 . 5.290 3.195 2.822 3.423 . 0 0 "[ . 1 . 2]" 1
80 1 10 LYS QB 1 11 ARG H 3.580 . 4.070 2.572 2.447 2.746 . 0 0 "[ . 1 . 2]" 1
81 1 10 LYS QB 2 10 LEU QD 5.190 . 5.690 2.836 2.572 3.074 . 0 0 "[ . 1 . 2]" 1
82 1 10 LYS QB 2 19 THR HB 5.610 . 6.110 4.840 4.691 4.961 . 0 0 "[ . 1 . 2]" 1
83 1 10 LYS QB 2 19 THR MG 5.480 . 5.980 3.907 3.671 4.076 . 0 0 "[ . 1 . 2]" 1
84 1 10 LYS QD 2 10 LEU QD 7.570 . 8.070 2.182 1.963 2.537 . 0 0 "[ . 1 . 2]" 1
85 1 10 LYS QD 2 10 LEU HG 5.610 . 6.110 4.657 4.202 5.029 . 0 0 "[ . 1 . 2]" 1
86 1 10 LYS QD 2 15 ARG HA 5.610 . 6.110 3.542 3.113 4.201 . 0 0 "[ . 1 . 2]" 1
87 1 10 LYS QD 2 19 THR HB 5.990 . 6.490 5.051 4.945 5.323 . 0 0 "[ . 1 . 2]" 1
88 1 10 LYS QD 2 19 THR MG 4.610 . 5.110 3.388 3.176 3.519 . 0 0 "[ . 1 . 2]" 1
89 1 10 LYS QE 2 10 LEU QD 7.080 . 7.080 2.678 2.498 3.436 . 0 0 "[ . 1 . 2]" 1
90 1 10 LYS QE 2 10 LEU HG 5.610 . 6.110 5.049 5.008 5.083 . 0 0 "[ . 1 . 2]" 1
91 1 10 LYS QE 2 15 ARG HA 5.050 . 5.550 2.229 1.950 2.880 . 0 0 "[ . 1 . 2]" 1
92 1 10 LYS QE 2 19 THR HA 6.170 . 6.670 5.139 4.658 5.499 . 0 0 "[ . 1 . 2]" 1
93 1 10 LYS QE 2 19 THR HB 5.610 . 6.110 4.558 4.176 4.869 . 0 0 "[ . 1 . 2]" 1
94 1 10 LYS QE 2 19 THR MG 4.040 . 4.540 2.245 1.933 2.501 . 0 0 "[ . 1 . 2]" 1
95 1 10 LYS QE 2 22 MET ME 6.740 . 7.240 4.562 4.018 5.000 . 0 0 "[ . 1 . 2]" 1
96 1 10 LYS QG 2 10 LEU QD 7.570 . 8.070 3.144 2.468 3.751 . 0 0 "[ . 1 . 2]" 1
97 1 10 LYS QG 2 19 THR HB 5.580 . 6.080 3.128 3.005 3.477 . 0 0 "[ . 1 . 2]" 1
98 1 10 LYS QG 2 19 THR MG 5.650 . 6.150 2.016 1.908 2.170 . 0 0 "[ . 1 . 2]" 1
99 1 11 ARG H 2 10 LEU QD 5.070 . 5.570 3.189 2.986 3.339 . 0 0 "[ . 1 . 2]" 1
100 1 11 ARG HA 1 14 ILE QG 4.060 . 4.290 2.843 2.525 3.142 . 0 0 "[ . 1 . 2]" 1
101 1 11 ARG HA 1 15 GLN H 4.330 . 4.830 4.287 3.974 4.447 . 0 0 "[ . 1 . 2]" 1
102 1 11 ARG HA 2 10 LEU QB 6.170 . 6.670 4.780 4.461 5.199 . 0 0 "[ . 1 . 2]" 1
103 1 11 ARG HA 2 10 LEU QD 4.840 . 4.990 2.667 2.273 2.933 . 0 0 "[ . 1 . 2]" 1
104 1 11 ARG HA 2 10 LEU HG 5.500 . 6.000 3.187 2.808 4.428 . 0 0 "[ . 1 . 2]" 1
105 1 11 ARG QB 1 89 VAL MG2 5.400 . 5.900 3.741 3.433 4.009 . 0 0 "[ . 1 . 2]" 1
106 1 11 ARG QB 2 10 LEU QD 4.370 . 4.870 2.694 1.900 2.902 . 0 0 "[ . 1 . 2]" 1
107 1 11 ARG QB 2 10 LEU HG 4.480 . 4.980 3.152 2.778 4.148 . 0 0 "[ . 1 . 2]" 1
108 1 11 ARG QD 1 89 VAL HA 5.130 . 5.630 3.326 2.518 4.557 . 0 0 "[ . 1 . 2]" 1
109 1 11 ARG QD 1 89 VAL MG2 5.590 . 6.090 3.511 2.894 4.156 . 0 0 "[ . 1 . 2]" 1
110 1 11 ARG QD 2 10 LEU QD 7.570 . 8.070 4.613 3.555 4.992 . 0 0 "[ . 1 . 2]" 1
111 1 11 ARG QG 1 15 GLN QG 5.350 . 5.850 3.525 2.697 4.063 . 0 0 "[ . 1 . 2]" 1
112 1 11 ARG QG 1 89 VAL MG2 4.800 . 5.150 2.321 2.138 2.657 . 0 0 "[ . 1 . 2]" 1
113 1 11 ARG QG 2 10 LEU QD 5.970 . 6.470 3.401 2.022 3.958 . 0 0 "[ . 1 . 2]" 1
114 1 12 LYS H 1 13 LEU H 3.740 . 4.240 2.778 2.686 2.863 . 0 0 "[ . 1 . 2]" 1
115 1 12 LYS HA 1 15 GLN H 3.780 . 4.280 3.586 3.180 3.793 . 0 0 "[ . 1 . 2]" 1
116 1 12 LYS HA 1 15 GLN QB 4.200 . 4.700 2.453 2.257 2.753 . 0 0 "[ . 1 . 2]" 1
117 1 12 LYS HA 1 16 GLN H 4.330 . 4.830 3.882 3.688 4.104 . 0 0 "[ . 1 . 2]" 1
118 1 12 LYS HA 2 31 ILE MD 5.400 . 5.900 3.710 3.522 3.884 . 0 0 "[ . 1 . 2]" 1
119 1 12 LYS HA 2 31 ILE MG 6.610 . 7.110 5.557 5.517 5.597 . 0 0 "[ . 1 . 2]" 1
120 1 12 LYS QG 1 15 GLN H 5.990 . 6.490 5.228 5.029 5.417 . 0 0 "[ . 1 . 2]" 1
121 1 12 LYS QG 1 16 GLN H 5.990 . 6.490 4.633 3.949 5.392 . 0 0 "[ . 1 . 2]" 1
122 1 13 LEU H 1 13 LEU MD1 4.370 . 4.870 3.665 3.625 3.700 . 0 0 "[ . 1 . 2]" 1
123 1 13 LEU H 1 13 LEU MD2 4.610 . 5.110 3.654 3.500 3.753 . 0 0 "[ . 1 . 2]" 1
124 1 13 LEU HA 1 13 LEU MD2 3.750 . 4.250 2.058 2.020 2.083 . 0 0 "[ . 1 . 2]" 1
125 1 13 LEU HA 2 19 THR HB 5.500 . 6.000 5.485 5.159 5.532 . 0 0 "[ . 1 . 2]" 1
126 1 13 LEU HA 2 23 GLU HA 5.500 . 6.000 5.411 5.236 5.524 . 0 0 "[ . 1 . 2]" 1
127 1 13 LEU HA 2 26 ARG HA 5.500 . 6.000 3.954 3.757 4.125 . 0 0 "[ . 1 . 2]" 1
128 1 13 LEU HA 2 26 ARG QD 6.170 . 6.670 4.653 3.923 5.047 . 0 0 "[ . 1 . 2]" 1
129 1 13 LEU QB 1 14 ILE H 3.980 . 4.480 2.703 2.561 2.789 . 0 0 "[ . 1 . 2]" 1
130 1 13 LEU QB 2 19 THR HA 5.000 . 5.500 3.698 3.534 3.862 . 0 0 "[ . 1 . 2]" 1
131 1 13 LEU QB 2 19 THR HB 5.000 . 5.500 2.702 2.440 2.755 . 0 0 "[ . 1 . 2]" 1
132 1 13 LEU QB 2 19 THR MG 6.000 . 6.500 2.281 2.052 2.430 . 0 0 "[ . 1 . 2]" 1
133 1 13 LEU QB 2 22 MET HA 5.610 . 6.110 4.901 4.779 5.000 . 0 0 "[ . 1 . 2]" 1
134 1 13 LEU QB 2 23 GLU HA 5.610 . 6.110 4.633 4.491 4.760 . 0 0 "[ . 1 . 2]" 1
135 1 13 LEU QB 2 26 ARG QD 5.500 . 6.000 4.371 4.260 4.431 . 0 0 "[ . 1 . 2]" 1
136 1 13 LEU QD 2 22 MET H 6.740 . 7.240 3.954 3.854 4.014 . 0 0 "[ . 1 . 2]" 1
137 1 13 LEU MD1 2 19 THR HA 5.240 . 5.740 3.873 3.717 4.102 . 0 0 "[ . 1 . 2]" 1
138 1 13 LEU MD1 2 19 THR HB 4.170 . 4.670 2.197 1.990 2.340 . 0 0 "[ . 1 . 2]" 1
139 1 13 LEU MD1 2 19 THR MG 5.830 . 6.330 3.124 2.955 3.262 . 0 0 "[ . 1 . 2]" 1
140 1 13 LEU MD1 2 20 GLU HA 6.000 . 6.500 4.069 3.961 4.146 . 0 0 "[ . 1 . 2]" 1
141 1 13 LEU MD1 2 22 MET HA 6.000 . 6.500 5.020 4.978 5.056 . 0 0 "[ . 1 . 2]" 1
142 1 13 LEU MD1 2 22 MET QB 6.070 . 6.570 2.744 2.642 2.876 . 0 0 "[ . 1 . 2]" 1
143 1 13 LEU MD1 2 22 MET QG 7.410 . 7.910 4.487 4.326 4.638 . 0 0 "[ . 1 . 2]" 1
144 1 13 LEU MD1 2 23 GLU H 5.320 . 5.820 3.467 3.365 3.552 . 0 0 "[ . 1 . 2]" 1
145 1 13 LEU MD1 2 23 GLU HA 4.200 . 4.700 2.921 2.784 3.018 . 0 0 "[ . 1 . 2]" 1
146 1 13 LEU MD1 2 23 GLU QB 6.070 . 6.570 3.879 3.783 3.947 . 0 0 "[ . 1 . 2]" 1
147 1 13 LEU MD1 2 23 GLU QG 4.120 . 4.620 2.170 2.098 2.217 . 0 0 "[ . 1 . 2]" 1
148 1 13 LEU MD1 2 25 PHE HB2 6.610 . 7.110 5.536 5.513 5.566 . 0 0 "[ . 1 . 2]" 1
149 1 13 LEU MD1 2 26 ARG HA 6.000 . 6.500 4.728 4.514 4.940 . 0 0 "[ . 1 . 2]" 1
150 1 13 LEU MD1 2 26 ARG HB2 6.000 . 6.500 3.696 3.620 3.778 . 0 0 "[ . 1 . 2]" 1
151 1 13 LEU MD1 2 26 ARG HB3 6.000 . 6.500 5.019 4.997 5.042 . 0 0 "[ . 1 . 2]" 1
152 1 13 LEU MD1 2 26 ARG QD 7.200 . 7.700 2.482 2.050 3.379 . 0 0 "[ . 1 . 2]" 1
153 1 13 LEU MD1 2 26 ARG QG 6.000 . 6.500 3.886 3.554 4.127 . 0 0 "[ . 1 . 2]" 1
154 1 13 LEU MD2 2 19 THR HA 6.610 . 7.110 4.894 4.681 5.109 . 0 0 "[ . 1 . 2]" 1
155 1 13 LEU MD2 2 19 THR HB 6.000 . 6.500 4.107 3.777 4.230 . 0 0 "[ . 1 . 2]" 1
156 1 13 LEU MD2 2 19 THR MG 7.210 . 7.710 4.152 3.899 4.344 . 0 0 "[ . 1 . 2]" 1
157 1 13 LEU MD2 2 20 GLU HA 6.610 . 7.110 5.540 5.522 5.557 . 0 0 "[ . 1 . 2]" 1
158 1 13 LEU MD2 2 22 MET HA 6.000 . 6.500 3.938 3.854 4.031 . 0 0 "[ . 1 . 2]" 1
159 1 13 LEU MD2 2 22 MET QB 6.740 . 7.240 2.305 2.157 2.501 . 0 0 "[ . 1 . 2]" 1
160 1 13 LEU MD2 2 22 MET QG 7.410 . 7.910 4.147 3.810 4.429 . 0 0 "[ . 1 . 2]" 1
161 1 13 LEU MD2 2 23 GLU H 5.730 . 6.230 3.525 3.465 3.574 . 0 0 "[ . 1 . 2]" 1
162 1 13 LEU MD2 2 23 GLU HA 3.940 . 4.440 2.033 1.980 2.062 . 0 0 "[ . 1 . 2]" 1
163 1 13 LEU MD2 2 23 GLU QB 6.070 . 6.570 3.812 3.691 3.875 . 0 0 "[ . 1 . 2]" 1
164 1 13 LEU MD2 2 23 GLU QG 4.860 . 5.360 2.898 2.647 3.020 . 0 0 "[ . 1 . 2]" 1
165 1 13 LEU MD2 2 25 PHE H 5.760 . 6.260 3.658 3.578 3.719 . 0 0 "[ . 1 . 2]" 1
166 1 13 LEU MD2 2 25 PHE HA 6.000 . 6.500 5.058 5.036 5.102 . 0 0 "[ . 1 . 2]" 1
167 1 13 LEU MD2 2 25 PHE HB2 5.880 . 6.380 3.214 3.144 3.287 . 0 0 "[ . 1 . 2]" 1
168 1 13 LEU MD2 2 25 PHE HB3 6.360 . 6.860 4.547 4.484 4.611 . 0 0 "[ . 1 . 2]" 1
169 1 13 LEU MD2 2 26 ARG H 4.700 . 5.200 2.928 2.840 2.985 . 0 0 "[ . 1 . 2]" 1
170 1 13 LEU MD2 2 26 ARG HA 4.310 . 4.810 2.321 2.157 2.495 . 0 0 "[ . 1 . 2]" 1
171 1 13 LEU MD2 2 26 ARG HB2 4.710 . 5.210 2.046 1.942 2.139 . 0 0 "[ . 1 . 2]" 1
172 1 13 LEU MD2 2 26 ARG HB3 4.710 . 5.210 3.524 3.397 3.620 . 0 0 "[ . 1 . 2]" 1
173 1 13 LEU MD2 2 26 ARG QD 5.220 . 5.720 2.251 2.063 2.474 . 0 0 "[ . 1 . 2]" 1
174 1 13 LEU MD2 2 26 ARG QG 4.800 . 5.300 2.838 2.274 3.458 . 0 0 "[ . 1 . 2]" 1
175 1 13 LEU HG 2 19 THR MG 6.610 . 7.110 4.580 4.345 4.716 . 0 0 "[ . 1 . 2]" 1
176 1 13 LEU HG 2 23 GLU HA 4.500 . 5.000 4.512 4.456 4.545 . 0 0 "[ . 1 . 2]" 1
177 1 13 LEU HG 2 23 GLU QG 5.000 . 5.500 4.386 4.253 4.481 . 0 0 "[ . 1 . 2]" 1
178 1 13 LEU HG 2 26 ARG HA 5.500 . 6.000 4.150 3.931 4.376 . 0 0 "[ . 1 . 2]" 1
179 1 13 LEU HG 2 26 ARG HB2 5.000 . 5.500 4.135 3.959 4.314 . 0 0 "[ . 1 . 2]" 1
180 1 13 LEU HG 2 26 ARG HB3 5.500 . 6.000 5.549 5.473 5.604 . 0 0 "[ . 1 . 2]" 1
181 1 13 LEU HG 2 26 ARG QD 6.170 . 6.670 2.635 2.285 2.881 . 0 0 "[ . 1 . 2]" 1
182 1 14 ILE H 1 14 ILE QG 3.370 . 3.870 2.398 2.240 2.482 . 0 0 "[ . 1 . 2]" 1
183 1 14 ILE H 1 14 ILE MG 3.530 . 4.030 2.924 2.791 2.954 . 0 0 "[ . 1 . 2]" 1
184 1 14 ILE H 1 15 GLN H 3.200 . 3.700 2.751 2.697 2.795 . 0 0 "[ . 1 . 2]" 1
185 1 14 ILE HA 1 17 GLN H 4.270 . 4.770 3.437 3.342 3.540 . 0 0 "[ . 1 . 2]" 1
186 1 14 ILE HA 1 75 ILE MD 4.130 . 4.630 2.238 2.135 2.383 . 0 0 "[ . 1 . 2]" 1
187 1 14 ILE HA 2 14 LEU MD1 6.000 . 6.500 5.039 5.009 5.074 . 0 0 "[ . 1 . 2]" 1
188 1 14 ILE HA 2 17 LEU HB2 5.500 . 6.000 5.492 5.410 5.537 . 0 0 "[ . 1 . 2]" 1
189 1 14 ILE HA 2 19 THR HA 5.500 . 6.000 5.537 5.516 5.558 . 0 0 "[ . 1 . 2]" 1
190 1 14 ILE HA 2 19 THR MG 6.000 . 6.500 3.634 3.458 3.817 . 0 0 "[ . 1 . 2]" 1
191 1 14 ILE HA 2 22 MET ME 4.800 . 5.300 3.109 2.691 3.289 . 0 0 "[ . 1 . 2]" 1
192 1 14 ILE HB 1 75 ILE MD 4.300 . 4.800 2.294 2.197 2.467 . 0 0 "[ . 1 . 2]" 1
193 1 14 ILE HB 2 14 LEU MD1 6.000 . 6.500 2.765 2.724 2.814 . 0 0 "[ . 1 . 2]" 1
194 1 14 ILE HB 2 14 LEU MD2 4.840 . 5.340 3.639 3.524 3.743 . 0 0 "[ . 1 . 2]" 1
195 1 14 ILE MD 1 15 GLN H 4.620 . 5.120 3.861 3.692 3.914 . 0 0 "[ . 1 . 2]" 1
196 1 14 ILE MD 2 14 LEU HA 5.390 . 5.890 4.498 4.367 4.539 . 0 0 "[ . 1 . 2]" 1
197 1 14 ILE MD 2 14 LEU HB2 5.430 . 5.930 3.690 3.143 3.820 . 0 0 "[ . 1 . 2]" 1
198 1 14 ILE MD 2 14 LEU HB3 4.200 . 4.700 2.887 2.611 3.040 . 0 0 "[ . 1 . 2]" 1
199 1 14 ILE MD 2 14 LEU MD1 5.970 . 6.470 3.670 3.162 3.881 . 0 0 "[ . 1 . 2]" 1
200 1 14 ILE MD 2 15 ARG HA 6.000 . 6.500 3.789 3.258 3.971 . 0 0 "[ . 1 . 2]" 1
201 1 14 ILE MD 2 19 THR MG 5.770 . 6.270 2.444 2.265 2.816 . 0 0 "[ . 1 . 2]" 1
202 1 14 ILE MD 2 22 MET ME 5.770 . 6.270 4.044 4.028 4.067 . 0 0 "[ . 1 . 2]" 1
203 1 14 ILE QG 1 15 GLN H 2.990 . 3.490 2.354 2.200 2.446 . 0 0 "[ . 1 . 2]" 1
204 1 14 ILE QG 2 14 LEU HA 6.170 . 6.670 5.020 4.860 5.499 . 0 0 "[ . 1 . 2]" 1
205 1 14 ILE QG 2 14 LEU MD1 6.740 . 7.240 2.538 2.408 2.700 . 0 0 "[ . 1 . 2]" 1
206 1 14 ILE QG 2 17 LEU QB 6.930 . 7.430 4.887 4.726 5.127 . 0 0 "[ . 1 . 2]" 1
207 1 14 ILE QG 2 17 LEU MD1 6.740 . 7.240 4.189 4.058 4.275 . 0 0 "[ . 1 . 2]" 1
208 1 14 ILE QG 2 19 THR MG 6.070 . 6.570 4.131 4.039 4.188 . 0 0 "[ . 1 . 2]" 1
209 1 14 ILE QG 2 22 MET ME 6.740 . 7.240 4.899 4.672 4.945 . 0 0 "[ . 1 . 2]" 1
210 1 14 ILE MG 2 14 LEU HA 6.610 . 7.110 3.704 3.532 4.026 . 0 0 "[ . 1 . 2]" 1
211 1 14 ILE MG 2 14 LEU HB2 6.200 . 6.700 4.146 4.052 4.266 . 0 0 "[ . 1 . 2]" 1
212 1 14 ILE MG 2 14 LEU HB3 5.150 . 5.650 2.626 2.533 2.761 . 0 0 "[ . 1 . 2]" 1
213 1 14 ILE MG 2 14 LEU MD1 5.580 . 6.080 3.349 3.268 3.452 . 0 0 "[ . 1 . 2]" 1
214 1 14 ILE MG 2 19 THR MG 7.930 . 8.430 2.224 2.129 2.325 . 0 0 "[ . 1 . 2]" 1
215 1 14 ILE MG 2 22 MET ME 5.770 . 6.270 2.056 1.983 2.174 . 0 0 "[ . 1 . 2]" 1
216 1 15 GLN H 1 15 GLN QG . . 3.800 2.370 2.239 2.539 . 0 0 "[ . 1 . 2]" 1
217 1 15 GLN HA 1 18 LEU QB 4.820 . 5.320 2.789 2.585 3.062 . 0 0 "[ . 1 . 2]" 1
218 1 15 GLN HA 1 19 VAL MG2 5.510 . 6.010 4.045 3.937 4.206 . 0 0 "[ . 1 . 2]" 1
219 1 15 GLN HA 1 89 VAL MG1 4.200 . 4.700 2.756 2.532 2.896 . 0 0 "[ . 1 . 2]" 1
220 1 15 GLN HA 1 93 LEU QD 5.640 . 6.140 3.175 3.077 3.374 . 0 0 "[ . 1 . 2]" 1
221 1 15 GLN HA 2 31 ILE MD 6.000 . 6.500 4.465 4.366 4.583 . 0 0 "[ . 1 . 2]" 1
222 1 15 GLN QB 1 16 GLN H 3.660 . 4.160 2.385 2.289 2.477 . 0 0 "[ . 1 . 2]" 1
223 1 15 GLN QB 2 31 ILE MD 4.720 . 5.220 2.101 2.044 2.177 . 0 0 "[ . 1 . 2]" 1
224 1 15 GLN QB 2 31 ILE QG 6.530 . 7.030 3.463 3.368 3.529 . 0 0 "[ . 1 . 2]" 1
225 1 15 GLN QB 2 31 ILE MG 6.070 . 6.570 2.577 2.406 2.739 . 0 0 "[ . 1 . 2]" 1
226 1 15 GLN QE 1 89 VAL HA 4.740 . 5.060 2.055 1.824 4.148 . 0 0 "[ . 1 . 2]" 1
227 1 15 GLN QE 1 92 PRO QG 5.120 . 5.620 2.236 2.078 2.728 . 0 0 "[ . 1 . 2]" 1
228 1 15 GLN QE 2 31 ILE MD 5.320 . 5.820 3.497 2.329 3.777 . 0 0 "[ . 1 . 2]" 1
229 1 15 GLN QG 1 19 VAL MG2 6.610 . 7.110 4.748 4.575 4.913 . 0 0 "[ . 1 . 2]" 1
230 1 15 GLN QG 1 89 VAL HA 4.290 . 4.790 2.421 2.231 2.611 . 0 0 "[ . 1 . 2]" 1
231 1 15 GLN QG 1 89 VAL MG1 4.770 . 5.160 2.025 1.961 2.115 . 0 0 "[ . 1 . 2]" 1
232 1 15 GLN QG 1 89 VAL MG2 5.460 . 5.690 2.695 2.356 2.994 . 0 0 "[ . 1 . 2]" 1
233 1 15 GLN QG 1 93 LEU QD 6.000 . 6.500 3.020 2.880 3.180 . 0 0 "[ . 1 . 2]" 1
234 1 15 GLN QG 2 31 ILE MD 5.390 . 5.890 3.496 3.323 3.619 . 0 0 "[ . 1 . 2]" 1
235 1 15 GLN QG 2 31 ILE MG 6.070 . 6.570 3.614 3.434 3.792 . 0 0 "[ . 1 . 2]" 1
236 1 16 GLN H 1 16 GLN QG 3.750 . 4.250 2.425 2.290 2.491 . 0 0 "[ . 1 . 2]" 1
237 1 16 GLN H 1 17 GLN H 3.940 . 4.440 2.901 2.847 2.958 . 0 0 "[ . 1 . 2]" 1
238 1 16 GLN HA 1 19 VAL H 4.000 . 4.500 3.705 3.525 3.818 . 0 0 "[ . 1 . 2]" 1
239 1 16 GLN HA 1 19 VAL HB 4.040 . 4.540 2.991 2.797 3.094 . 0 0 "[ . 1 . 2]" 1
240 1 16 GLN HA 1 19 VAL MG1 5.400 . 5.900 4.135 4.028 4.243 . 0 0 "[ . 1 . 2]" 1
241 1 16 GLN HA 1 19 VAL MG2 5.040 . 5.540 4.138 3.942 4.213 . 0 0 "[ . 1 . 2]" 1
242 1 16 GLN HA 2 25 PHE HB2 5.500 . 6.000 5.490 5.394 5.532 . 0 0 "[ . 1 . 2]" 1
243 1 16 GLN HA 2 25 PHE HB3 5.500 . 6.000 4.831 4.719 4.973 . 0 0 "[ . 1 . 2]" 1
244 1 16 GLN HA 2 29 VAL HB 4.000 . 4.500 3.218 3.086 3.464 . 0 0 "[ . 1 . 2]" 1
245 1 16 GLN HA 2 29 VAL MG1 4.410 . 4.910 2.789 2.564 3.004 . 0 0 "[ . 1 . 2]" 1
246 1 16 GLN HA 2 31 ILE MD 5.040 . 5.540 4.268 4.232 4.292 . 0 0 "[ . 1 . 2]" 1
247 1 16 GLN HA 2 31 ILE QG 5.050 . 5.550 3.560 3.430 3.679 . 0 0 "[ . 1 . 2]" 1
248 1 16 GLN HA 2 31 ILE MG 5.400 . 5.900 3.808 3.580 3.973 . 0 0 "[ . 1 . 2]" 1
249 1 16 GLN QB 2 31 ILE MD 6.740 . 7.240 4.921 4.760 5.012 . 0 0 "[ . 1 . 2]" 1
250 1 16 GLN QB 2 31 ILE MG 7.410 . 7.910 5.335 5.105 5.488 . 0 0 "[ . 1 . 2]" 1
251 1 16 GLN HB2 1 17 GLN H 3.760 . 4.260 2.828 2.718 3.070 . 0 0 "[ . 1 . 2]" 1
252 1 16 GLN HB2 2 25 PHE HB3 4.500 . 5.000 3.667 3.310 3.918 . 0 0 "[ . 1 . 2]" 1
253 1 16 GLN HB2 2 29 VAL HB 5.000 . 5.500 4.727 4.359 4.896 . 0 0 "[ . 1 . 2]" 1
254 1 16 GLN HB2 2 29 VAL MG1 6.000 . 6.500 4.919 4.682 5.029 . 0 0 "[ . 1 . 2]" 1
255 1 16 GLN HB2 2 29 VAL MG2 6.260 . 6.760 3.593 3.535 3.632 . 0 0 "[ . 1 . 2]" 1
256 1 16 GLN HB3 1 17 GLN H 5.000 . 5.500 3.547 3.431 3.766 . 0 0 "[ . 1 . 2]" 1
257 1 16 GLN HB3 1 20 LEU MD1 5.510 . 6.010 3.312 3.197 3.440 . 0 0 "[ . 1 . 2]" 1
258 1 16 GLN HB3 2 25 PHE HB3 5.000 . 5.500 2.536 2.456 2.661 . 0 0 "[ . 1 . 2]" 1
259 1 16 GLN QE 2 29 VAL HB 5.990 . 6.490 3.529 2.236 4.696 . 0 0 "[ . 1 . 2]" 1
260 1 16 GLN QE 2 29 VAL MG1 7.200 . 7.700 4.784 3.757 5.400 . 0 0 "[ . 1 . 2]" 1
261 1 16 GLN QG 1 17 GLN H 5.330 . 5.830 4.384 4.344 4.430 . 0 0 "[ . 1 . 2]" 1
262 1 16 GLN QG 2 25 PHE HB2 5.610 . 6.110 4.862 4.676 5.014 . 0 0 "[ . 1 . 2]" 1
263 1 16 GLN QG 2 25 PHE HB3 5.050 . 5.550 4.472 4.297 4.563 . 0 0 "[ . 1 . 2]" 1
264 1 16 GLN QG 2 26 ARG HA 5.610 . 6.110 4.546 4.392 4.768 . 0 0 "[ . 1 . 2]" 1
265 1 16 GLN QG 2 29 VAL HB 5.610 . 6.110 2.174 2.055 2.258 . 0 0 "[ . 1 . 2]" 1
266 1 16 GLN QG 2 29 VAL MG1 5.240 . 5.740 3.321 2.955 3.487 . 0 0 "[ . 1 . 2]" 1
267 1 16 GLN QG 2 31 ILE MD 6.740 . 7.240 3.164 2.954 3.280 . 0 0 "[ . 1 . 2]" 1
268 1 16 GLN QG 2 31 ILE MG 6.740 . 7.240 4.044 3.713 4.265 . 0 0 "[ . 1 . 2]" 1
269 1 17 GLN H 1 18 LEU H 3.870 . 4.370 2.738 2.713 2.759 . 0 0 "[ . 1 . 2]" 1
270 1 17 GLN H 1 75 ILE MD 5.220 . 5.720 3.832 3.714 3.953 . 0 0 "[ . 1 . 2]" 1
271 1 17 GLN H 2 25 PHE QD 5.150 . 5.650 3.715 3.627 3.784 . 0 0 "[ . 1 . 2]" 1
272 1 17 GLN HA 1 20 LEU H 4.820 . 5.320 3.457 3.338 3.567 . 0 0 "[ . 1 . 2]" 1
273 1 17 GLN HA 1 20 LEU MD1 4.720 . 5.220 2.714 2.578 2.863 . 0 0 "[ . 1 . 2]" 1
274 1 17 GLN HA 1 20 LEU MD2 6.100 . 6.600 4.914 4.810 4.990 . 0 0 "[ . 1 . 2]" 1
275 1 17 GLN HA 1 48 MET ME 4.920 . 5.420 3.802 3.211 4.057 . 0 0 "[ . 1 . 2]" 1
276 1 17 GLN HA 1 75 ILE MD 5.520 . 6.020 4.475 4.357 4.572 . 0 0 "[ . 1 . 2]" 1
277 1 17 GLN HA 2 25 PHE QD 6.170 . 6.670 3.457 3.270 3.570 . 0 0 "[ . 1 . 2]" 1
278 1 17 GLN QB 1 18 LEU H 3.890 . 4.390 2.663 2.571 2.757 . 0 0 "[ . 1 . 2]" 1
279 1 17 GLN QB 1 75 ILE MD 5.270 . 5.770 2.279 2.181 2.386 . 0 0 "[ . 1 . 2]" 1
280 1 17 GLN QB 2 22 MET QB 6.300 . 6.800 3.100 2.956 3.367 . 0 0 "[ . 1 . 2]" 1
281 1 17 GLN QB 2 22 MET QG 6.300 . 6.800 2.582 2.005 3.006 . 0 0 "[ . 1 . 2]" 1
282 1 17 GLN HB2 2 25 PHE QD 5.330 . 5.830 2.411 2.296 2.543 . 0 0 "[ . 1 . 2]" 1
283 1 17 GLN HB3 2 25 PHE QD 5.330 . 5.830 4.118 3.984 4.232 . 0 0 "[ . 1 . 2]" 1
284 1 17 GLN QE 1 21 LEU QD 6.200 . 6.700 2.856 2.101 3.172 . 0 0 "[ . 1 . 2]" 1
285 1 17 GLN QE 1 48 MET ME 7.200 . 7.700 4.448 3.486 4.794 . 0 0 "[ . 1 . 2]" 1
286 1 17 GLN QE 1 68 HIS HA 5.990 . 6.490 3.462 2.441 3.973 . 0 0 "[ . 1 . 2]" 1
287 1 17 GLN QE 1 71 SER H 5.990 . 6.490 4.396 3.932 4.874 . 0 0 "[ . 1 . 2]" 1
288 1 17 GLN QE 1 71 SER QB 5.990 . 6.490 2.188 2.049 2.533 . 0 0 "[ . 1 . 2]" 1
289 1 17 GLN QE 1 72 SER H 4.890 . 5.100 3.043 2.449 3.549 . 0 0 "[ . 1 . 2]" 1
290 1 17 GLN QE 1 72 SER HA 5.060 . 5.560 2.754 2.440 3.105 . 0 0 "[ . 1 . 2]" 1
291 1 17 GLN QE 1 75 ILE MD 6.610 . 7.110 2.319 1.879 3.513 . 0 0 "[ . 1 . 2]" 1
292 1 17 GLN QG 1 18 LEU H 5.440 . 5.940 3.688 3.590 3.771 . 0 0 "[ . 1 . 2]" 1
293 1 17 GLN QG 1 21 LEU QD 8.250 . 8.750 2.390 2.178 2.574 . 0 0 "[ . 1 . 2]" 1
294 1 17 GLN QG 1 48 MET ME 5.390 . 5.720 2.420 2.098 2.583 . 0 0 "[ . 1 . 2]" 1
295 1 17 GLN QG 1 75 ILE MD 5.390 . 5.890 2.960 2.763 3.119 . 0 0 "[ . 1 . 2]" 1
296 1 17 GLN QG 2 22 MET ME 6.660 . 7.160 4.172 4.001 4.326 . 0 0 "[ . 1 . 2]" 1
297 1 17 GLN QG 2 25 PHE QD 6.930 . 7.430 3.749 3.559 3.962 . 0 0 "[ . 1 . 2]" 1
298 1 18 LEU H 1 18 LEU HG 4.630 . 5.130 4.285 4.171 4.441 . 0 0 "[ . 1 . 2]" 1
299 1 18 LEU H 1 19 VAL H 3.890 . 4.390 2.941 2.883 3.003 . 0 0 "[ . 1 . 2]" 1
300 1 18 LEU H 1 21 LEU QD 5.930 . 6.430 4.268 4.130 4.397 . 0 0 "[ . 1 . 2]" 1
301 1 18 LEU H 1 75 ILE MD 3.770 . 4.270 2.489 2.444 2.550 . 0 0 "[ . 1 . 2]" 1
302 1 18 LEU HA 1 21 LEU HB2 3.690 . 4.190 3.262 3.104 3.398 . 0 0 "[ . 1 . 2]" 1
303 1 18 LEU HA 1 21 LEU QD 3.780 . 4.280 2.371 2.304 2.523 . 0 0 "[ . 1 . 2]" 1
304 1 18 LEU HA 1 75 ILE MD 4.850 . 5.350 2.941 2.801 3.154 . 0 0 "[ . 1 . 2]" 1
305 1 18 LEU HA 1 75 ILE MG 4.360 . 4.860 2.255 2.103 2.382 . 0 0 "[ . 1 . 2]" 1
306 1 18 LEU QB 1 19 VAL H 3.840 . 4.340 2.336 2.257 2.473 . 0 0 "[ . 1 . 2]" 1
307 1 18 LEU QB 1 75 ILE MG 4.930 . 5.430 2.965 2.655 3.143 . 0 0 "[ . 1 . 2]" 1
308 1 18 LEU HB2 1 19 VAL H 4.250 . 4.750 3.663 3.549 3.881 . 0 0 "[ . 1 . 2]" 1
309 1 18 LEU HB3 1 19 VAL H 4.250 . 4.750 2.364 2.281 2.502 . 0 0 "[ . 1 . 2]" 1
310 1 18 LEU QD 1 19 VAL H 5.390 . 5.890 3.465 3.256 3.789 . 0 0 "[ . 1 . 2]" 1
311 1 18 LEU QD 1 21 LEU HB2 5.190 . 5.690 3.587 3.471 3.693 . 0 0 "[ . 1 . 2]" 1
312 1 18 LEU QD 1 21 LEU QD 6.620 . 7.120 3.397 3.044 3.610 . 0 0 "[ . 1 . 2]" 1
313 1 18 LEU QD 1 22 LEU H 5.620 . 6.120 3.851 3.627 4.172 . 0 0 "[ . 1 . 2]" 1
314 1 18 LEU QD 1 22 LEU MD1 . . 6.170 2.446 2.168 3.110 . 0 0 "[ . 1 . 2]" 1
315 1 18 LEU QD 1 22 LEU MD2 6.120 . 6.620 2.801 2.252 3.575 . 0 0 "[ . 1 . 2]" 1
316 1 18 LEU QD 1 22 LEU HG 4.720 . 5.220 2.608 2.262 3.262 . 0 0 "[ . 1 . 2]" 1
317 1 18 LEU QD 1 75 ILE MG 4.730 . 5.230 2.633 2.074 2.936 . 0 0 "[ . 1 . 2]" 1
318 1 18 LEU QD 1 76 ILE HA 4.980 . 5.480 2.898 2.398 3.290 . 0 0 "[ . 1 . 2]" 1
319 1 18 LEU QD 1 78 HIS HD2 5.570 . 6.070 3.808 3.603 4.076 . 0 0 "[ . 1 . 2]" 1
320 1 18 LEU QD 1 79 TRP H 4.470 . 4.970 2.949 2.699 3.213 . 0 0 "[ . 1 . 2]" 1
321 1 18 LEU QD 1 79 TRP HA 5.160 . 5.660 3.737 3.624 3.836 . 0 0 "[ . 1 . 2]" 1
322 1 18 LEU QD 1 79 TRP QB . . 5.380 1.946 1.863 2.034 . 0 0 "[ . 1 . 2]" 1
323 1 18 LEU QD 1 79 TRP HD1 6.060 . 6.560 3.074 2.682 3.569 . 0 0 "[ . 1 . 2]" 1
324 1 18 LEU QD 1 79 TRP HE3 6.550 . 7.050 3.872 3.514 4.064 . 0 0 "[ . 1 . 2]" 1
325 1 18 LEU QD 2 35 MET ME 7.930 . 8.430 4.249 3.959 4.703 . 0 0 "[ . 1 . 2]" 1
326 1 18 LEU HG 1 75 ILE QG 5.150 . 5.650 3.183 2.277 4.640 . 0 0 "[ . 1 . 2]" 1
327 1 19 VAL H 1 19 VAL MG2 3.920 . 4.420 2.480 2.411 2.582 . 0 0 "[ . 1 . 2]" 1
328 1 19 VAL H 1 20 LEU H 3.700 . 4.200 2.833 2.740 2.898 . 0 0 "[ . 1 . 2]" 1
329 1 19 VAL H 1 20 LEU HB2 5.430 . 5.930 4.745 4.639 4.860 . 0 0 "[ . 1 . 2]" 1
330 1 19 VAL H 1 75 ILE MD 5.970 . 6.470 4.855 4.784 4.967 . 0 0 "[ . 1 . 2]" 1
331 1 19 VAL HA 1 22 LEU H 4.160 . 4.660 3.219 3.127 3.333 . 0 0 "[ . 1 . 2]" 1
332 1 19 VAL HA 1 22 LEU HB2 4.160 . 4.660 2.477 2.191 2.710 . 0 0 "[ . 1 . 2]" 1
333 1 19 VAL HA 1 22 LEU HB3 4.600 . 5.100 4.061 3.798 4.186 . 0 0 "[ . 1 . 2]" 1
334 1 19 VAL HA 1 22 LEU MD1 4.830 . 5.330 2.421 2.177 2.732 . 0 0 "[ . 1 . 2]" 1
335 1 19 VAL HA 1 93 LEU QD . . 6.060 3.450 3.305 3.560 . 0 0 "[ . 1 . 2]" 1
336 1 19 VAL HA 2 29 VAL MG1 6.530 . 7.030 4.725 4.616 4.824 . 0 0 "[ . 1 . 2]" 1
337 1 19 VAL HA 2 34 ILE HB 5.500 . 6.000 5.069 4.961 5.191 . 0 0 "[ . 1 . 2]" 1
338 1 19 VAL HA 2 34 ILE MD 6.610 . 7.110 4.710 4.616 4.786 . 0 0 "[ . 1 . 2]" 1
339 1 19 VAL HA 2 34 ILE MG 6.140 . 6.640 3.691 3.598 3.744 . 0 0 "[ . 1 . 2]" 1
340 1 19 VAL HA 2 35 MET ME 6.610 . 7.110 4.196 3.403 4.837 . 0 0 "[ . 1 . 2]" 1
341 1 19 VAL HB 1 20 LEU H 3.760 . 4.260 2.997 2.943 3.074 . 0 0 "[ . 1 . 2]" 1
342 1 19 VAL HB 2 29 VAL HB 5.000 . 5.500 4.611 4.332 4.727 . 0 0 "[ . 1 . 2]" 1
343 1 19 VAL HB 2 31 ILE HA 5.500 . 6.000 3.400 3.124 3.535 . 0 0 "[ . 1 . 2]" 1
344 1 19 VAL HB 2 31 ILE MD 6.000 . 6.500 5.009 4.972 5.035 . 0 0 "[ . 1 . 2]" 1
345 1 19 VAL HB 2 31 ILE QG 5.610 . 6.110 4.202 4.108 4.322 . 0 0 "[ . 1 . 2]" 1
346 1 19 VAL HB 2 31 ILE MG 3.710 . 4.210 3.045 2.945 3.098 . 0 0 "[ . 1 . 2]" 1
347 1 19 VAL HB 2 34 ILE HB 5.500 . 6.000 5.081 4.999 5.163 . 0 0 "[ . 1 . 2]" 1
348 1 19 VAL HB 2 34 ILE QG 5.000 . 5.500 4.395 4.345 4.452 . 0 0 "[ . 1 . 2]" 1
349 1 19 VAL HB 2 34 ILE MG 6.000 . 6.500 4.581 4.497 4.633 . 0 0 "[ . 1 . 2]" 1
350 1 19 VAL MG1 1 20 LEU H 3.980 . 4.480 3.263 3.206 3.315 . 0 0 "[ . 1 . 2]" 1
351 1 19 VAL MG1 1 20 LEU HA 4.000 . 4.500 3.338 3.327 3.351 . 0 0 "[ . 1 . 2]" 1
352 1 19 VAL MG1 1 20 LEU HG 4.440 . 4.940 3.715 3.702 3.723 . 0 0 "[ . 1 . 2]" 1
353 1 19 VAL MG1 1 22 LEU MD1 6.760 . 7.260 3.683 3.379 3.907 . 0 0 "[ . 1 . 2]" 1
354 1 19 VAL MG1 1 23 HIS HB2 5.870 . 6.370 3.613 3.547 3.678 . 0 0 "[ . 1 . 2]" 1
355 1 19 VAL MG1 2 29 VAL HA 6.050 . 6.550 4.689 4.585 4.799 . 0 0 "[ . 1 . 2]" 1
356 1 19 VAL MG1 2 29 VAL HB 5.400 . 5.900 4.237 4.038 4.365 . 0 0 "[ . 1 . 2]" 1
357 1 19 VAL MG1 2 31 ILE HA 5.100 . 5.600 2.056 2.031 2.085 . 0 0 "[ . 1 . 2]" 1
358 1 19 VAL MG1 2 31 ILE HB 6.000 . 6.500 4.761 4.673 4.802 . 0 0 "[ . 1 . 2]" 1
359 1 19 VAL MG1 2 31 ILE QG 6.070 . 6.570 4.001 3.915 4.174 . 0 0 "[ . 1 . 2]" 1
360 1 19 VAL MG1 2 34 ILE HA 5.640 . 6.140 4.471 4.413 4.533 . 0 0 "[ . 1 . 2]" 1
361 1 19 VAL MG1 2 34 ILE HB 5.310 . 5.810 2.261 2.197 2.331 . 0 0 "[ . 1 . 2]" 1
362 1 19 VAL MG1 2 34 ILE MD 5.050 . 5.550 2.203 2.169 2.230 . 0 0 "[ . 1 . 2]" 1
363 1 19 VAL MG1 2 34 ILE QG 4.800 . 5.300 2.075 2.039 2.128 . 0 0 "[ . 1 . 2]" 1
364 1 19 VAL MG1 2 34 ILE MG 5.050 . 5.550 2.035 1.988 2.080 . 0 0 "[ . 1 . 2]" 1
365 1 19 VAL MG1 2 35 MET QB . . 7.240 4.581 4.445 4.957 . 0 0 "[ . 1 . 2]" 1
366 1 19 VAL MG2 1 22 LEU HB2 5.380 . 5.880 3.692 3.496 3.834 . 0 0 "[ . 1 . 2]" 1
367 1 19 VAL MG2 1 22 LEU MD1 5.470 . 5.970 2.501 2.315 2.716 . 0 0 "[ . 1 . 2]" 1
368 1 19 VAL MG2 1 93 LEU QD 4.800 . 5.300 1.988 1.943 2.050 . 0 0 "[ . 1 . 2]" 1
369 1 19 VAL MG2 1 93 LEU HG 5.880 . 6.380 2.297 2.205 2.425 . 0 0 "[ . 1 . 2]" 1
370 1 19 VAL MG2 2 29 VAL HB 6.610 . 7.110 5.470 5.308 5.542 . 0 0 "[ . 1 . 2]" 1
371 1 19 VAL MG2 2 31 ILE HA 5.100 . 5.600 2.330 2.201 2.574 . 0 0 "[ . 1 . 2]" 1
372 1 19 VAL MG2 2 31 ILE HB 5.100 . 5.600 4.075 3.955 4.165 . 0 0 "[ . 1 . 2]" 1
373 1 19 VAL MG2 2 31 ILE QG 5.390 . 5.890 3.865 3.798 4.007 . 0 0 "[ . 1 . 2]" 1
374 1 19 VAL MG2 2 31 ILE MG 4.070 . 4.570 1.911 1.873 1.928 . 0 0 "[ . 1 . 2]" 1
375 1 19 VAL MG2 2 32 GLU QG 7.410 . 7.910 5.374 5.066 5.502 . 0 0 "[ . 1 . 2]" 1
376 1 19 VAL MG2 2 34 ILE HB 6.000 . 6.500 3.764 3.710 3.815 . 0 0 "[ . 1 . 2]" 1
377 1 19 VAL MG2 2 34 ILE MD 6.490 . 6.990 4.507 4.476 4.522 . 0 0 "[ . 1 . 2]" 1
378 1 19 VAL MG2 2 34 ILE QG 6.000 . 6.500 4.075 4.024 4.132 . 0 0 "[ . 1 . 2]" 1
379 1 19 VAL MG2 2 34 ILE MG 5.770 . 6.270 3.642 3.565 3.694 . 0 0 "[ . 1 . 2]" 1
380 1 19 VAL MG2 2 35 MET QB 6.580 . 7.080 4.491 4.329 4.792 . 0 0 "[ . 1 . 2]" 1
381 1 20 LEU H 1 20 LEU MD1 5.490 . 5.990 3.575 3.532 3.647 . 0 0 "[ . 1 . 2]" 1
382 1 20 LEU H 1 20 LEU MD2 5.200 . 5.700 4.004 3.936 4.056 . 0 0 "[ . 1 . 2]" 1
383 1 20 LEU H 1 20 LEU HG 3.380 . 3.880 2.874 2.752 2.962 . 0 0 "[ . 1 . 2]" 1
384 1 20 LEU H 1 21 LEU H 3.620 . 4.120 2.798 2.765 2.828 . 0 0 "[ . 1 . 2]" 1
385 1 20 LEU HA 1 20 LEU MD1 4.550 . 5.050 3.821 3.804 3.833 . 0 0 "[ . 1 . 2]" 1
386 1 20 LEU HA 1 20 LEU MD2 3.960 . 4.460 2.160 2.105 2.220 . 0 0 "[ . 1 . 2]" 1
387 1 20 LEU HA 1 23 HIS H 4.050 . 4.550 3.461 3.350 3.596 . 0 0 "[ . 1 . 2]" 1
388 1 20 LEU HA 1 23 HIS HB2 4.240 . 4.740 3.667 3.599 3.719 . 0 0 "[ . 1 . 2]" 1
389 1 20 LEU HA 1 23 HIS HB3 3.850 . 4.350 2.789 2.670 2.846 . 0 0 "[ . 1 . 2]" 1
390 1 20 LEU HA 1 23 HIS HD2 5.000 . 5.500 5.031 4.962 5.063 . 0 0 "[ . 1 . 2]" 1
391 1 20 LEU HA 1 42 LEU QD 5.210 . 5.710 3.713 3.538 3.769 . 0 0 "[ . 1 . 2]" 1
392 1 20 LEU HA 1 48 MET QG 5.990 . 6.490 3.642 3.581 3.698 . 0 0 "[ . 1 . 2]" 1
393 1 20 LEU HA 2 34 ILE MD 5.140 . 5.640 2.968 2.898 3.060 . 0 0 "[ . 1 . 2]" 1
394 1 20 LEU HA 2 34 ILE QG 5.500 . 6.000 4.880 4.822 4.916 . 0 0 "[ . 1 . 2]" 1
395 1 20 LEU HA 2 34 ILE MG 4.800 . 5.300 4.040 4.010 4.063 . 0 0 "[ . 1 . 2]" 1
396 1 20 LEU HB3 1 48 MET QG 5.160 . 5.660 2.003 1.925 2.066 . 0 0 "[ . 1 . 2]" 1
397 1 20 LEU MD1 1 21 LEU H 6.300 . 6.800 4.729 4.656 4.834 . 0 0 "[ . 1 . 2]" 1
398 1 20 LEU MD1 1 43 PRO QD 7.200 . 7.700 4.976 4.770 5.388 . 0 0 "[ . 1 . 2]" 1
399 1 20 LEU MD1 1 44 HIS HD2 6.040 . 6.540 2.775 2.529 3.005 . 0 0 "[ . 1 . 2]" 1
400 1 20 LEU MD1 1 48 MET ME 6.560 . 7.060 3.293 3.166 3.456 . 0 0 "[ . 1 . 2]" 1
401 1 20 LEU MD1 1 48 MET QG 6.320 . 6.550 3.253 3.130 3.647 . 0 0 "[ . 1 . 2]" 1
402 1 20 LEU MD1 2 25 PHE HA 5.220 . 5.720 3.252 3.137 3.321 . 0 0 "[ . 1 . 2]" 1
403 1 20 LEU MD1 2 25 PHE HB2 5.570 . 6.070 3.499 3.399 3.615 . 0 0 "[ . 1 . 2]" 1
404 1 20 LEU MD1 2 25 PHE HB3 5.020 . 5.520 2.242 2.155 2.308 . 0 0 "[ . 1 . 2]" 1
405 1 20 LEU MD1 2 25 PHE QD 5.230 . 5.730 2.381 2.283 2.486 . 0 0 "[ . 1 . 2]" 1
406 1 20 LEU MD1 2 25 PHE QE 7.410 . 7.910 3.137 3.015 3.235 . 0 0 "[ . 1 . 2]" 1
407 1 20 LEU MD1 2 28 SER HA 6.610 . 7.110 5.573 5.560 5.597 . 0 0 "[ . 1 . 2]" 1
408 1 20 LEU MD1 2 28 SER QB 4.800 . 5.300 3.296 3.155 3.568 . 0 0 "[ . 1 . 2]" 1
409 1 20 LEU MD1 2 29 VAL HA 6.000 . 6.500 4.550 4.495 4.630 . 0 0 "[ . 1 . 2]" 1
410 1 20 LEU MD1 2 29 VAL HB 6.000 . 6.500 4.413 4.280 4.474 . 0 0 "[ . 1 . 2]" 1
411 1 20 LEU MD1 2 29 VAL MG1 5.780 . 6.280 3.290 3.210 3.380 . 0 0 "[ . 1 . 2]" 1
412 1 20 LEU MD1 2 29 VAL MG2 4.930 . 5.430 1.976 1.939 2.005 . 0 0 "[ . 1 . 2]" 1
413 1 20 LEU MD2 1 23 HIS HD2 5.670 . 6.170 4.470 4.284 4.592 . 0 0 "[ . 1 . 2]" 1
414 1 20 LEU MD2 1 43 PRO QD 5.820 . 6.320 3.704 3.480 4.156 . 0 0 "[ . 1 . 2]" 1
415 1 20 LEU MD2 1 44 HIS QB 5.060 . 5.560 2.301 2.124 2.482 . 0 0 "[ . 1 . 2]" 1
416 1 20 LEU MD2 1 44 HIS HD2 5.460 . 5.960 3.312 3.037 3.532 . 0 0 "[ . 1 . 2]" 1
417 1 20 LEU MD2 1 48 MET ME 6.100 . 6.600 4.242 4.235 4.251 . 0 0 "[ . 1 . 2]" 1
418 1 20 LEU MD2 1 48 MET QG 4.740 . 5.180 2.686 2.410 2.938 . 0 0 "[ . 1 . 2]" 1
419 1 20 LEU MD2 2 25 PHE HA 6.000 . 6.500 5.015 4.997 5.039 . 0 0 "[ . 1 . 2]" 1
420 1 20 LEU MD2 2 25 PHE QD 6.080 . 6.580 4.044 3.972 4.106 . 0 0 "[ . 1 . 2]" 1
421 1 20 LEU MD2 2 28 SER QB 6.000 . 6.500 3.939 3.835 4.086 . 0 0 "[ . 1 . 2]" 1
422 1 20 LEU MD2 2 29 VAL HA 6.610 . 7.110 3.927 3.662 4.164 . 0 0 "[ . 1 . 2]" 1
423 1 20 LEU MD2 2 29 VAL HB 6.610 . 7.110 4.974 4.810 5.156 . 0 0 "[ . 1 . 2]" 1
424 1 20 LEU MD2 2 29 VAL MG2 4.020 . 4.520 2.574 2.464 2.770 . 0 0 "[ . 1 . 2]" 1
425 1 20 LEU HG 1 42 LEU QD 4.980 . 5.480 3.439 3.273 3.604 . 0 0 "[ . 1 . 2]" 1
426 1 20 LEU HG 2 29 VAL HB 5.500 . 6.000 4.241 4.030 4.367 . 0 0 "[ . 1 . 2]" 1
427 1 20 LEU HG 2 29 VAL MG1 4.190 . 4.690 2.203 2.137 2.342 . 0 0 "[ . 1 . 2]" 1
428 1 20 LEU HG 2 29 VAL MG2 4.490 . 4.990 2.170 2.076 2.232 . 0 0 "[ . 1 . 2]" 1
429 1 21 LEU H 1 21 LEU QD 4.430 . 4.930 3.121 3.067 3.200 . 0 0 "[ . 1 . 2]" 1
430 1 21 LEU H 1 21 LEU HG 3.270 . 3.770 2.362 2.305 2.437 . 0 0 "[ . 1 . 2]" 1
431 1 21 LEU H 1 24 ALA MB 5.960 . 6.460 4.598 4.527 4.696 . 0 0 "[ . 1 . 2]" 1
432 1 21 LEU HA 1 21 LEU QD 3.700 . 4.200 2.200 2.142 2.274 . 0 0 "[ . 1 . 2]" 1
433 1 21 LEU HA 1 24 ALA MB 4.290 . 4.790 2.482 2.421 2.587 . 0 0 "[ . 1 . 2]" 1
434 1 21 LEU HA 1 48 MET HB3 3.190 . 3.690 2.701 2.560 2.855 . 0 0 "[ . 1 . 2]" 1
435 1 21 LEU HA 1 48 MET ME 5.570 . 6.070 4.564 3.959 4.690 . 0 0 "[ . 1 . 2]" 1
436 1 21 LEU HA 1 52 LEU QD 4.700 . 5.200 2.618 2.480 2.829 . 0 0 "[ . 1 . 2]" 1
437 1 21 LEU HB2 1 22 LEU H 3.820 . 4.320 2.485 2.422 2.531 . 0 0 "[ . 1 . 2]" 1
438 1 21 LEU HB2 1 75 ILE MG 5.180 . 5.680 3.801 3.734 3.907 . 0 0 "[ . 1 . 2]" 1
439 1 21 LEU HB2 1 76 ILE MD 5.910 . 6.410 3.925 3.372 4.860 . 0 0 "[ . 1 . 2]" 1
440 1 21 LEU HB3 1 22 LEU H 3.740 . 4.240 3.524 3.419 3.616 . 0 0 "[ . 1 . 2]" 1
441 1 21 LEU QD 1 22 LEU H 5.280 . 5.780 3.953 3.918 3.969 . 0 0 "[ . 1 . 2]" 1
442 1 21 LEU QD 1 24 ALA MB 5.600 . 6.100 3.471 3.447 3.496 . 0 0 "[ . 1 . 2]" 1
443 1 21 LEU QD 1 48 MET HA 5.380 . 5.880 3.147 3.011 3.310 . 0 0 "[ . 1 . 2]" 1
444 1 21 LEU QD 1 48 MET HB2 5.540 . 6.040 4.124 4.112 4.134 . 0 0 "[ . 1 . 2]" 1
445 1 21 LEU QD 1 48 MET HB3 4.360 . 4.860 2.583 2.566 2.686 . 0 0 "[ . 1 . 2]" 1
446 1 21 LEU QD 1 48 MET ME 4.620 . 5.120 2.778 2.394 2.878 . 0 0 "[ . 1 . 2]" 1
447 1 21 LEU QD 1 48 MET QG 5.490 . 5.990 3.407 2.323 3.634 . 0 0 "[ . 1 . 2]" 1
448 1 21 LEU QD 1 51 VAL HB 5.140 . 5.640 3.491 3.371 3.654 . 0 0 "[ . 1 . 2]" 1
449 1 21 LEU QD 1 52 LEU QD 4.410 . 4.910 2.112 2.045 2.248 . 0 0 "[ . 1 . 2]" 1
450 1 21 LEU QD 1 55 MET ME 5.700 . 5.710 3.086 2.882 3.228 . 0 0 "[ . 1 . 2]" 1
451 1 21 LEU QD 1 72 SER H 6.000 . 6.500 3.977 3.892 4.075 . 0 0 "[ . 1 . 2]" 1
452 1 21 LEU QD 1 72 SER HA 4.060 . 4.560 2.351 2.264 2.466 . 0 0 "[ . 1 . 2]" 1
453 1 21 LEU QD 1 72 SER HB2 4.850 . 5.340 3.193 3.159 3.259 . 0 0 "[ . 1 . 2]" 1
454 1 21 LEU QD 1 72 SER HB3 4.620 . 5.120 2.090 2.045 2.138 . 0 0 "[ . 1 . 2]" 1
455 1 21 LEU QD 1 73 ARG H 5.980 . 6.480 4.497 4.455 4.527 . 0 0 "[ . 1 . 2]" 1
456 1 21 LEU QD 1 75 ILE MD 5.410 . 5.910 3.325 3.242 3.355 . 0 0 "[ . 1 . 2]" 1
457 1 21 LEU QD 1 76 ILE H 5.070 . 5.570 3.763 3.652 3.811 . 0 0 "[ . 1 . 2]" 1
458 1 21 LEU QD 1 76 ILE MD 6.030 . 6.530 2.279 2.075 2.934 . 0 0 "[ . 1 . 2]" 1
459 1 21 LEU HG 1 48 MET ME 5.460 . 5.960 3.476 2.556 3.677 . 0 0 "[ . 1 . 2]" 1
460 1 21 LEU HG 1 48 MET QG 4.780 . 5.280 3.968 2.828 4.288 . 0 0 "[ . 1 . 2]" 1
461 1 21 LEU HG 1 51 VAL MG1 6.500 . 7.000 5.014 4.761 5.268 . 0 0 "[ . 1 . 2]" 1
462 1 22 LEU H 1 22 LEU MD1 5.060 . 5.560 3.730 3.441 3.912 . 0 0 "[ . 1 . 2]" 1
463 1 22 LEU H 1 22 LEU MD2 5.040 . 5.540 3.296 2.775 3.801 . 0 0 "[ . 1 . 2]" 1
464 1 22 LEU H 1 22 LEU HG 3.540 . 4.040 2.385 2.269 2.562 . 0 0 "[ . 1 . 2]" 1
465 1 22 LEU H 1 23 HIS H 3.820 . 4.320 2.847 2.792 2.898 . 0 0 "[ . 1 . 2]" 1
466 1 22 LEU HA 1 22 LEU MD2 4.120 . 4.620 2.171 2.115 2.323 . 0 0 "[ . 1 . 2]" 1
467 1 22 LEU HA 1 25 HIS H 4.110 . 4.610 3.812 3.627 4.044 . 0 0 "[ . 1 . 2]" 1
468 1 22 LEU HB2 1 23 HIS H 3.900 . 4.400 2.681 2.501 2.898 . 0 0 "[ . 1 . 2]" 1
469 1 22 LEU HB2 2 35 MET ME 6.000 . 6.500 4.338 3.627 4.971 . 0 0 "[ . 1 . 2]" 1
470 1 22 LEU HB3 1 23 HIS H 4.120 . 4.620 3.653 3.527 3.770 . 0 0 "[ . 1 . 2]" 1
471 1 22 LEU HB3 2 35 MET ME 6.610 . 7.110 4.396 3.837 4.922 . 0 0 "[ . 1 . 2]" 1
472 1 22 LEU MD1 1 79 TRP QB 6.360 . 6.860 3.709 3.364 3.989 . 0 0 "[ . 1 . 2]" 1
473 1 22 LEU MD1 1 79 TRP HE1 5.490 . 5.990 2.602 2.323 2.866 . 0 0 "[ . 1 . 2]" 1
474 1 22 LEU MD1 1 79 TRP HH2 6.610 . 7.110 5.202 4.924 5.529 . 0 0 "[ . 1 . 2]" 1
475 1 22 LEU MD1 1 79 TRP HZ2 6.000 . 6.500 3.931 3.616 4.359 . 0 0 "[ . 1 . 2]" 1
476 1 22 LEU MD1 1 93 LEU QD 5.190 . 5.690 2.157 2.052 2.341 . 0 0 "[ . 1 . 2]" 1
477 1 22 LEU MD1 2 34 ILE MG 7.210 . 7.710 3.917 3.579 4.195 . 0 0 "[ . 1 . 2]" 1
478 1 22 LEU MD1 2 35 MET QB 7.410 . 7.910 4.790 4.298 5.206 . 0 0 "[ . 1 . 2]" 1
479 1 22 LEU MD1 2 35 MET ME 6.090 . 6.590 2.376 2.147 2.684 . 0 0 "[ . 1 . 2]" 1
480 1 22 LEU MD2 1 76 ILE MD 7.860 . 8.360 4.611 4.115 5.452 . 0 0 "[ . 1 . 2]" 1
481 1 22 LEU MD2 1 79 TRP QB 7.200 . 7.700 3.781 3.413 4.314 . 0 0 "[ . 1 . 2]" 1
482 1 22 LEU MD2 1 79 TRP HE1 5.200 . 5.700 2.689 2.111 3.335 . 0 0 "[ . 1 . 2]" 1
483 1 22 LEU MD2 2 35 MET ME 7.900 . 8.400 4.393 4.021 4.732 . 0 0 "[ . 1 . 2]" 1
484 1 22 LEU HG 2 35 MET ME 6.000 . 6.500 4.841 4.487 5.044 . 0 0 "[ . 1 . 2]" 1
485 1 23 HIS H 1 24 ALA H 3.480 . 3.980 2.787 2.707 2.856 . 0 0 "[ . 1 . 2]" 1
486 1 23 HIS H 1 24 ALA MB 5.580 . 6.080 4.264 4.172 4.365 . 0 0 "[ . 1 . 2]" 1
487 1 23 HIS H 1 25 HIS H 5.140 . 5.640 4.260 4.033 4.524 . 0 0 "[ . 1 . 2]" 1
488 1 23 HIS H 2 34 ILE MG 6.000 . 6.500 2.975 2.823 3.102 . 0 0 "[ . 1 . 2]" 1
489 1 23 HIS HA 2 34 ILE HA 5.500 . 6.000 5.477 5.339 5.565 . 0 0 "[ . 1 . 2]" 1
490 1 23 HIS HA 2 34 ILE MD 6.000 . 6.500 4.056 3.999 4.080 . 0 0 "[ . 1 . 2]" 1
491 1 23 HIS HA 2 34 ILE MG 4.200 . 4.700 2.834 2.733 2.906 . 0 0 "[ . 1 . 2]" 1
492 1 23 HIS HB2 1 24 ALA H 3.920 . 4.420 3.697 3.605 3.756 . 0 0 "[ . 1 . 2]" 1
493 1 23 HIS HB2 1 42 LEU QD 5.660 . 5.940 3.868 3.743 3.982 . 0 0 "[ . 1 . 2]" 1
494 1 23 HIS HB2 1 42 LEU HG 5.280 . 5.780 3.913 3.777 4.110 . 0 0 "[ . 1 . 2]" 1
495 1 23 HIS HB2 2 34 ILE HA 5.500 . 6.000 4.397 4.339 4.441 . 0 0 "[ . 1 . 2]" 1
496 1 23 HIS HB2 2 34 ILE HB 5.500 . 6.000 4.398 4.355 4.437 . 0 0 "[ . 1 . 2]" 1
497 1 23 HIS HB2 2 34 ILE MD 5.550 . 6.050 2.092 2.044 2.117 . 0 0 "[ . 1 . 2]" 1
498 1 23 HIS HB2 2 34 ILE QG 5.500 . 6.000 3.915 3.865 3.945 . 0 0 "[ . 1 . 2]" 1
499 1 23 HIS HB2 2 34 ILE MG 4.800 . 5.300 1.902 1.884 1.921 . 0 0 "[ . 1 . 2]" 1
500 1 23 HIS HB3 1 24 ALA H 3.760 . 4.260 2.324 2.195 2.412 . 0 0 "[ . 1 . 2]" 1
501 1 23 HIS HB3 2 34 ILE MD 5.280 . 5.780 2.802 2.780 2.820 . 0 0 "[ . 1 . 2]" 1
502 1 23 HIS HB3 2 34 ILE QG 5.500 . 6.000 4.951 4.942 4.961 . 0 0 "[ . 1 . 2]" 1
503 1 23 HIS HB3 2 34 ILE MG 4.800 . 5.300 3.244 3.222 3.264 . 0 0 "[ . 1 . 2]" 1
504 1 23 HIS HD2 1 24 ALA H 4.040 . 4.540 3.064 2.951 3.138 . 0 0 "[ . 1 . 2]" 1
505 1 23 HIS HD2 1 24 ALA HA 4.340 . 4.840 2.703 2.553 2.897 . 0 0 "[ . 1 . 2]" 1
506 1 23 HIS HD2 1 24 ALA MB 4.780 . 5.280 3.291 3.159 3.409 . 0 0 "[ . 1 . 2]" 1
507 1 23 HIS HD2 1 27 CYS HB2 5.240 . 5.740 3.063 2.921 3.208 . 0 0 "[ . 1 . 2]" 1
508 1 23 HIS HD2 1 27 CYS HB3 5.500 . 6.000 3.430 3.255 3.555 . 0 0 "[ . 1 . 2]" 1
509 1 23 HIS HD2 1 42 LEU QD 5.990 . 6.400 3.996 3.867 4.301 . 0 0 "[ . 1 . 2]" 1
510 1 23 HIS HD2 1 42 LEU HG 4.410 . 4.910 3.577 3.351 3.878 . 0 0 "[ . 1 . 2]" 1
511 1 23 HIS HD2 1 45 CYS HA 4.340 . 4.840 3.649 3.290 3.865 . 0 0 "[ . 1 . 2]" 1
512 1 23 HIS HD2 1 45 CYS HB2 4.620 . 5.120 4.099 3.536 4.560 . 0 0 "[ . 1 . 2]" 1
513 1 23 HIS HD2 2 34 ILE MD 6.000 . 6.500 4.312 4.210 4.429 . 0 0 "[ . 1 . 2]" 1
514 1 23 HIS HD2 2 34 ILE MG 6.000 . 6.500 5.020 4.997 5.048 . 0 0 "[ . 1 . 2]" 1
515 1 23 HIS HE1 1 27 CYS HB2 4.300 . 4.800 4.274 4.023 4.402 . 0 0 "[ . 1 . 2]" 1
516 1 23 HIS HE1 1 42 LEU QD 4.980 . 5.480 3.214 2.928 3.706 . 0 0 "[ . 1 . 2]" 1
517 1 23 HIS HE1 2 34 ILE HA 5.000 . 5.500 5.034 4.843 5.081 . 0 0 "[ . 1 . 2]" 1
518 1 23 HIS HE1 2 34 ILE MD 6.000 . 6.500 4.196 4.119 4.284 . 0 0 "[ . 1 . 2]" 1
519 1 23 HIS HE1 2 34 ILE MG 5.640 . 6.140 4.711 4.678 4.733 . 0 0 "[ . 1 . 2]" 1
520 1 24 ALA H 1 25 HIS H 3.680 . 4.180 3.019 2.894 3.198 . 0 0 "[ . 1 . 2]" 1
521 1 24 ALA H 1 27 CYS HB2 4.650 . 5.150 4.681 4.655 4.711 . 0 0 "[ . 1 . 2]" 1
522 1 24 ALA H 1 48 MET HB3 4.560 . 5.060 4.311 4.195 4.413 . 0 0 "[ . 1 . 2]" 1
523 1 24 ALA H 1 52 LEU QD 5.840 . 6.340 4.130 3.936 4.368 . 0 0 "[ . 1 . 2]" 1
524 1 24 ALA HA 1 27 CYS HB2 4.030 . 4.530 3.063 2.944 3.192 . 0 0 "[ . 1 . 2]" 1
525 1 24 ALA HA 1 27 CYS HB3 4.110 . 4.610 2.254 2.016 2.416 . 0 0 "[ . 1 . 2]" 1
526 1 24 ALA HA 1 28 GLN QB 5.990 . 6.490 4.386 4.178 4.622 . 0 0 "[ . 1 . 2]" 1
527 1 24 ALA HA 1 49 LYS QE 5.370 . 5.870 2.584 2.216 3.731 . 0 0 "[ . 1 . 2]" 1
528 1 24 ALA MB 1 25 HIS H 4.350 . 4.850 2.730 2.608 2.863 . 0 0 "[ . 1 . 2]" 1
529 1 24 ALA MB 1 27 CYS HB3 5.260 . 5.760 3.840 3.622 3.963 . 0 0 "[ . 1 . 2]" 1
530 1 24 ALA MB 1 28 GLN QB 5.660 . 6.160 4.004 3.732 4.202 . 0 0 "[ . 1 . 2]" 1
531 1 24 ALA MB 1 45 CYS HA 4.550 . 5.050 2.939 2.702 3.111 . 0 0 "[ . 1 . 2]" 1
532 1 24 ALA MB 1 45 CYS HB3 6.120 . 6.620 5.113 5.099 5.132 . 0 0 "[ . 1 . 2]" 1
533 1 24 ALA MB 1 48 MET HA 5.550 . 6.050 4.050 3.992 4.112 . 0 0 "[ . 1 . 2]" 1
534 1 24 ALA MB 1 48 MET HB2 4.140 . 4.640 2.039 1.988 2.130 . 0 0 "[ . 1 . 2]" 1
535 1 24 ALA MB 1 48 MET HB3 4.190 . 4.690 2.189 2.124 2.276 . 0 0 "[ . 1 . 2]" 1
536 1 24 ALA MB 1 48 MET QG 5.310 . 5.810 2.730 2.602 2.866 . 0 0 "[ . 1 . 2]" 1
537 1 24 ALA MB 1 49 LYS H 4.700 . 5.200 2.985 2.887 3.051 . 0 0 "[ . 1 . 2]" 1
538 1 24 ALA MB 1 49 LYS HA 4.100 . 4.600 3.208 2.987 3.354 . 0 0 "[ . 1 . 2]" 1
539 1 24 ALA MB 1 49 LYS HB2 5.540 . 6.040 4.270 4.228 4.353 . 0 0 "[ . 1 . 2]" 1
540 1 24 ALA MB 1 49 LYS QE 5.100 . 5.600 3.125 2.679 3.826 . 0 0 "[ . 1 . 2]" 1
541 1 24 ALA MB 1 49 LYS QG 5.940 . 6.440 2.177 2.096 2.337 . 0 0 "[ . 1 . 2]" 1
542 1 24 ALA MB 1 52 LEU QD 4.850 . 5.350 2.137 1.985 2.365 . 0 0 "[ . 1 . 2]" 1
543 1 24 ALA MB 1 52 LEU HG 5.210 . 5.710 3.962 3.797 4.173 . 0 0 "[ . 1 . 2]" 1
544 1 25 HIS H 1 26 LYS H 3.420 . 3.920 2.922 2.788 3.094 . 0 0 "[ . 1 . 2]" 1
545 1 25 HIS H 1 52 LEU QD 4.320 . 4.820 2.932 2.744 3.144 . 0 0 "[ . 1 . 2]" 1
546 1 25 HIS HA 1 25 HIS HD2 4.700 . 5.200 4.131 2.596 4.836 . 0 0 "[ . 1 . 2]" 1
547 1 25 HIS HA 1 52 LEU QD 3.770 . 4.270 2.590 2.323 2.831 . 0 0 "[ . 1 . 2]" 1
548 1 25 HIS HB2 1 52 LEU QD 4.890 . 5.390 2.699 2.197 3.083 . 0 0 "[ . 1 . 2]" 1
549 1 25 HIS HB3 1 52 LEU QD 5.400 . 5.900 3.836 3.533 4.016 . 0 0 "[ . 1 . 2]" 1
550 1 25 HIS HE1 2 51 VAL QG 7.410 . 7.910 4.766 2.158 5.528 . 0 0 "[ . 1 . 2]" 1
551 1 26 LYS H 1 27 CYS H 3.720 . 4.220 2.611 2.361 2.760 . 0 0 "[ . 1 . 2]" 1
552 1 26 LYS HA 1 29 ARG HB2 3.480 . 3.980 2.765 2.349 3.203 . 0 0 "[ . 1 . 2]" 1
553 1 26 LYS HA 1 29 ARG HB3 4.250 . 4.750 4.271 3.806 4.377 . 0 0 "[ . 1 . 2]" 1
554 1 26 LYS HA 1 29 ARG QD 5.140 . 5.640 4.051 2.955 4.613 . 0 0 "[ . 1 . 2]" 1
555 1 26 LYS HA 1 29 ARG QG 3.320 . 3.820 2.614 2.090 3.089 . 0 0 "[ . 1 . 2]" 1
556 1 26 LYS QB 1 27 CYS H 4.950 . 5.450 2.985 2.586 3.728 . 0 0 "[ . 1 . 2]" 1
557 1 27 CYS HA 1 30 ARG QB 4.840 . 5.340 2.958 2.072 4.318 . 0 0 "[ . 1 . 2]" 1
558 1 27 CYS HA 1 30 ARG QD 5.950 . 6.450 3.783 2.479 5.306 . 0 0 "[ . 1 . 2]" 1
559 1 27 CYS HA 1 30 ARG QG 4.520 . 5.020 2.817 2.034 4.071 . 0 0 "[ . 1 . 2]" 1
560 1 27 CYS HB3 1 49 LYS QE 4.470 . 4.540 2.156 1.971 2.984 . 0 0 "[ . 1 . 2]" 1
561 1 28 GLN H 1 28 GLN QG 4.760 . 5.260 3.944 3.860 4.104 . 0 0 "[ . 1 . 2]" 1
562 1 28 GLN HA 1 49 LYS QE 3.980 . 4.480 2.334 2.089 2.571 . 0 0 "[ . 1 . 2]" 1
563 1 28 GLN QB 1 49 LYS HA 5.990 . 6.490 3.907 3.593 4.215 . 0 0 "[ . 1 . 2]" 1
564 1 28 GLN QB 1 49 LYS QE . . 4.170 2.734 2.331 2.924 . 0 0 "[ . 1 . 2]" 1
565 1 28 GLN QB 1 49 LYS QG 4.570 . 5.070 2.312 2.166 2.537 . 0 0 "[ . 1 . 2]" 1
566 1 28 GLN HB2 1 49 LYS QG 4.960 . 5.460 2.327 2.178 2.558 . 0 0 "[ . 1 . 2]" 1
567 1 28 GLN HB3 1 49 LYS QG 4.960 . 5.460 3.952 3.780 4.228 . 0 0 "[ . 1 . 2]" 1
568 1 28 GLN QG 1 49 LYS HA 4.440 . 4.940 3.970 3.833 4.025 . 0 0 "[ . 1 . 2]" 1
569 1 29 ARG HA 1 29 ARG QD 4.100 . 4.600 3.094 2.122 3.747 . 0 0 "[ . 1 . 2]" 1
570 1 29 ARG HA 1 32 GLN QB 4.280 . 4.780 2.811 2.202 3.863 . 0 0 "[ . 1 . 2]" 1
571 1 29 ARG HA 1 32 GLN QG 6.010 . 6.510 3.927 2.217 5.192 . 0 0 "[ . 1 . 2]" 1
572 1 30 ARG H 1 30 ARG QG 4.440 . 4.730 2.763 2.183 3.901 . 0 0 "[ . 1 . 2]" 1
573 1 30 ARG HA 1 30 ARG QD 4.490 . 4.990 3.669 2.124 4.119 . 0 0 "[ . 1 . 2]" 1
574 1 30 ARG HA 1 33 ALA MB 4.720 . 5.220 2.807 2.220 3.671 . 0 0 "[ . 1 . 2]" 1
575 1 30 ARG QB 1 31 GLU H 4.390 . 4.630 2.667 2.239 3.681 . 0 0 "[ . 1 . 2]" 1
576 1 30 ARG QG 1 31 GLU H 5.990 . 6.490 3.889 2.492 4.546 . 0 0 "[ . 1 . 2]" 1
577 1 31 GLU H 1 31 GLU QG 4.470 . 4.970 2.923 2.227 3.994 . 0 0 "[ . 1 . 2]" 1
578 1 31 GLU HA 1 34 ASN QB 4.570 . 5.070 3.450 2.237 4.147 . 0 0 "[ . 1 . 2]" 1
579 1 31 GLU QB 1 32 GLN H 3.720 . 4.220 2.657 2.372 3.257 . 0 0 "[ . 1 . 2]" 1
580 1 31 GLU QG 1 37 VAL HA 5.670 . 6.170 4.756 3.709 5.153 . 0 0 "[ . 1 . 2]" 1
581 1 32 GLN H 1 32 GLN QG 4.490 . 4.990 3.178 2.207 4.021 . 0 0 "[ . 1 . 2]" 1
582 1 33 ALA MB 1 34 ASN HA 5.220 . 5.720 4.207 3.945 4.368 . 0 0 "[ . 1 . 2]" 1
583 1 34 ASN QB 1 37 VAL QG 6.480 . 6.980 3.123 2.109 4.319 . 0 0 "[ . 1 . 2]" 1
584 1 35 GLY QA 1 36 GLU H 3.570 . 4.070 2.808 2.253 2.988 . 0 0 "[ . 1 . 2]" 1
585 1 36 GLU HA 1 37 VAL H 3.050 . 3.550 2.763 2.167 3.185 . 0 0 "[ . 1 . 2]" 1
586 1 36 GLU HA 1 37 VAL QG 7.330 . 7.830 4.218 3.307 4.726 . 0 0 "[ . 1 . 2]" 1
587 1 36 GLU QB 1 37 VAL H 4.430 . 4.930 3.652 2.469 4.028 . 0 0 "[ . 1 . 2]" 1
588 1 37 VAL H 1 38 ARG H 4.820 . 5.320 4.386 3.596 4.689 . 0 0 "[ . 1 . 2]" 1
589 1 37 VAL HA 1 38 ARG H 4.000 . 4.500 2.278 2.096 3.519 . 0 0 "[ . 1 . 2]" 1
590 1 37 VAL HB 1 38 ARG H 4.420 . 4.920 4.010 3.788 4.201 . 0 0 "[ . 1 . 2]" 1
591 1 37 VAL QG 1 38 ARG H 5.660 . 5.970 2.299 1.777 2.574 0.023 10 0 "[ . 1 . 2]" 1
592 1 37 VAL QG 1 38 ARG HA 5.100 . 5.600 3.510 3.186 3.819 . 0 0 "[ . 1 . 2]" 1
593 1 37 VAL QG 1 38 ARG QD . . 6.890 3.921 2.947 4.259 . 0 0 "[ . 1 . 2]" 1
594 1 37 VAL QG 1 39 ALA HA 5.310 . 5.810 3.777 2.820 4.004 . 0 0 "[ . 1 . 2]" 1
595 1 38 ARG HA 1 38 ARG QD 3.960 . 4.460 3.040 1.995 3.671 . 0 0 "[ . 1 . 2]" 1
596 1 38 ARG HA 1 39 ALA MB 6.460 . 6.960 4.315 3.838 4.734 . 0 0 "[ . 1 . 2]" 1
597 1 38 ARG QB 1 39 ALA H 5.030 . 5.530 3.574 2.597 4.071 . 0 0 "[ . 1 . 2]" 1
598 1 39 ALA HA 1 40 CYS QB 5.860 . 6.360 4.251 3.785 5.131 . 0 0 "[ . 1 . 2]" 1
599 1 39 ALA MB 1 40 CYS H 5.740 . 6.240 2.661 1.916 3.821 . 0 0 "[ . 1 . 2]" 1
600 1 39 ALA MB 1 40 CYS HA 5.850 . 6.350 4.153 3.870 4.513 . 0 0 "[ . 1 . 2]" 1
601 1 39 ALA MB 1 40 CYS QB 6.040 . 6.540 4.213 3.950 4.523 . 0 0 "[ . 1 . 2]" 1
602 1 42 LEU HA 1 43 PRO QD 3.970 . 4.370 2.024 1.981 2.095 . 0 0 "[ . 1 . 2]" 1
603 1 42 LEU QB 1 43 PRO QD 6.000 . 6.500 3.516 3.413 3.737 . 0 0 "[ . 1 . 2]" 1
604 1 42 LEU QB 1 45 CYS H 4.520 . 4.690 2.818 2.575 3.769 . 0 0 "[ . 1 . 2]" 1
605 1 42 LEU QB 1 45 CYS HA 5.110 . 5.610 3.421 3.130 4.232 . 0 0 "[ . 1 . 2]" 1
606 1 42 LEU QB 1 45 CYS HB2 4.380 . 4.880 2.124 2.069 2.319 . 0 0 "[ . 1 . 2]" 1
607 1 42 LEU QB 1 45 CYS HB3 4.600 . 5.100 3.649 3.574 3.778 . 0 0 "[ . 1 . 2]" 1
608 1 42 LEU QD 1 43 PRO QD 4.790 . 5.140 1.886 1.868 1.911 . 0 0 "[ . 1 . 2]" 1
609 1 42 LEU QD 1 43 PRO QG 5.220 . 5.650 3.436 3.334 3.453 . 0 0 "[ . 1 . 2]" 1
610 1 42 LEU QD 1 45 CYS H 6.530 . 7.030 3.812 3.211 4.039 . 0 0 "[ . 1 . 2]" 1
611 1 42 LEU QD 1 45 CYS HA 6.360 . 6.860 4.382 3.764 4.543 . 0 0 "[ . 1 . 2]" 1
612 1 42 LEU QD 1 45 CYS HB2 5.620 . 6.010 3.834 3.272 3.956 . 0 0 "[ . 1 . 2]" 1
613 1 42 LEU QD 1 48 MET QG 7.200 . 7.700 4.786 4.538 4.821 . 0 0 "[ . 1 . 2]" 1
614 1 42 LEU QD 2 28 SER QB 6.000 . 6.500 3.981 3.881 3.998 . 0 0 "[ . 1 . 2]" 1
615 1 42 LEU QD 2 29 VAL HA 6.000 . 6.500 2.831 2.576 3.070 . 0 0 "[ . 1 . 2]" 1
616 1 42 LEU QD 2 29 VAL MG1 6.420 . 6.920 2.579 2.426 2.650 . 0 0 "[ . 1 . 2]" 1
617 1 42 LEU QD 2 29 VAL MG2 6.650 . 7.150 3.223 2.931 3.373 . 0 0 "[ . 1 . 2]" 1
618 1 42 LEU QD 2 34 ILE HA 5.400 . 5.900 4.011 3.931 4.055 . 0 0 "[ . 1 . 2]" 1
619 1 42 LEU QD 2 34 ILE HB 6.610 . 7.110 4.926 4.910 4.945 . 0 0 "[ . 1 . 2]" 1
620 1 42 LEU QD 2 34 ILE MD 7.210 . 7.450 1.863 1.836 1.900 . 0 0 "[ . 1 . 2]" 1
621 1 42 LEU QD 2 34 ILE QG 5.400 . 5.900 2.910 2.803 2.997 . 0 0 "[ . 1 . 2]" 1
622 1 42 LEU QD 2 34 ILE MG 6.940 . 7.440 3.859 3.798 3.967 . 0 0 "[ . 1 . 2]" 1
623 1 42 LEU HG 1 43 PRO QD 5.990 . 6.490 4.327 4.257 4.498 . 0 0 "[ . 1 . 2]" 1
624 1 42 LEU HG 2 29 VAL MG1 5.310 . 5.810 4.413 4.259 4.465 . 0 0 "[ . 1 . 2]" 1
625 1 42 LEU HG 2 34 ILE MD 5.400 . 5.900 2.551 2.326 2.674 . 0 0 "[ . 1 . 2]" 1
626 1 42 LEU HG 2 34 ILE MG 6.000 . 6.500 4.628 4.367 4.748 . 0 0 "[ . 1 . 2]" 1
627 1 43 PRO HA 2 28 SER QB 5.000 . 5.500 4.512 4.478 4.532 . 0 0 "[ . 1 . 2]" 1
628 1 43 PRO QB 1 44 HIS H 4.090 . 4.590 2.769 2.653 3.052 . 0 0 "[ . 1 . 2]" 1
629 1 43 PRO QB 1 45 CYS H 6.170 . 6.670 4.761 4.600 4.866 . 0 0 "[ . 1 . 2]" 1
630 1 43 PRO QB 2 28 SER HA 5.000 . 5.500 3.704 3.505 3.808 . 0 0 "[ . 1 . 2]" 1
631 1 43 PRO QB 2 28 SER QB 4.500 . 5.000 1.932 1.901 1.972 . 0 0 "[ . 1 . 2]" 1
632 1 43 PRO QG 1 44 HIS H 5.010 . 5.510 4.260 4.113 4.500 . 0 0 "[ . 1 . 2]" 1
633 1 43 PRO QG 2 28 SER HA 5.000 . 5.500 2.690 2.544 2.956 . 0 0 "[ . 1 . 2]" 1
634 1 43 PRO QG 2 28 SER QB 4.500 . 4.500 2.365 2.195 2.815 . 0 0 "[ . 1 . 2]" 1
635 1 44 HIS H 1 45 CYS H 4.370 . 4.870 2.443 2.310 3.133 . 0 0 "[ . 1 . 2]" 1
636 1 44 HIS QB 1 47 THR H 5.120 . 5.620 3.720 3.636 3.868 . 0 0 "[ . 1 . 2]" 1
637 1 44 HIS QB 1 47 THR HB 4.510 . 5.010 2.197 2.130 2.317 . 0 0 "[ . 1 . 2]" 1
638 1 44 HIS QB 1 47 THR MG 5.620 . 6.120 3.088 2.984 3.187 . 0 0 "[ . 1 . 2]" 1
639 1 44 HIS QB 2 24 ILE MD 7.410 . 7.910 3.910 3.627 4.212 . 0 0 "[ . 1 . 2]" 1
640 1 44 HIS HD2 2 24 ILE MD 6.610 . 7.110 5.273 5.097 5.521 . 0 0 "[ . 1 . 2]" 1
641 1 44 HIS HD2 2 25 PHE HA 4.850 . 5.350 3.187 2.999 3.350 . 0 0 "[ . 1 . 2]" 1
642 1 44 HIS HD2 2 25 PHE QD 6.170 . 6.670 2.776 2.563 3.036 . 0 0 "[ . 1 . 2]" 1
643 1 44 HIS HD2 2 28 SER HA 5.000 . 5.500 4.749 4.607 4.913 . 0 0 "[ . 1 . 2]" 1
644 1 44 HIS HD2 2 28 SER QB 4.000 . 4.500 2.141 2.043 2.217 . 0 0 "[ . 1 . 2]" 1
645 1 44 HIS HD2 2 29 VAL MG2 4.900 . 5.400 3.647 3.440 3.822 . 0 0 "[ . 1 . 2]" 1
646 1 44 HIS HE1 2 24 ILE HA 5.000 . 5.500 4.647 4.278 4.986 . 0 0 "[ . 1 . 2]" 1
647 1 44 HIS HE1 2 24 ILE HB 4.660 . 5.160 2.873 2.571 3.468 . 0 0 "[ . 1 . 2]" 1
648 1 44 HIS HE1 2 24 ILE MD 4.830 . 5.330 3.235 2.563 4.022 . 0 0 "[ . 1 . 2]" 1
649 1 44 HIS HE1 2 24 ILE QG 5.000 . 5.500 3.661 3.179 4.248 . 0 0 "[ . 1 . 2]" 1
650 1 44 HIS HE1 2 24 ILE MG 6.000 . 6.500 4.266 3.873 4.808 . 0 0 "[ . 1 . 2]" 1
651 1 44 HIS HE1 2 25 PHE QD 6.150 . 6.650 4.550 4.201 4.920 . 0 0 "[ . 1 . 2]" 1
652 1 44 HIS HE1 2 28 SER QB 5.500 . 6.000 4.661 4.391 4.919 . 0 0 "[ . 1 . 2]" 1
653 1 45 CYS H 1 46 ARG H 3.540 . 4.040 2.898 2.828 3.032 . 0 0 "[ . 1 . 2]" 1
654 1 45 CYS H 1 47 THR H 4.760 . 5.260 4.133 4.041 4.232 . 0 0 "[ . 1 . 2]" 1
655 1 45 CYS HA 1 48 MET H 4.200 . 4.700 3.779 3.684 3.961 . 0 0 "[ . 1 . 2]" 1
656 1 45 CYS HA 1 48 MET HB2 4.370 . 4.870 3.141 3.048 3.312 . 0 0 "[ . 1 . 2]" 1
657 1 45 CYS HB2 1 47 THR H 5.500 . 6.000 5.529 5.502 5.559 . 0 0 "[ . 1 . 2]" 1
658 1 46 ARG H 1 46 ARG QG 4.000 . 4.500 2.701 2.175 3.662 . 0 0 "[ . 1 . 2]" 1
659 1 46 ARG H 1 47 THR H 3.390 . 3.890 2.747 2.666 2.807 . 0 0 "[ . 1 . 2]" 1
660 1 46 ARG HA 1 46 ARG QD 4.570 . 5.070 3.760 3.614 4.127 . 0 0 "[ . 1 . 2]" 1
661 1 46 ARG HA 1 49 LYS HB2 3.810 . 4.310 2.356 2.167 2.483 . 0 0 "[ . 1 . 2]" 1
662 1 46 ARG HA 1 49 LYS QD 3.380 . 3.880 2.678 2.441 2.827 . 0 0 "[ . 1 . 2]" 1
663 1 46 ARG HA 1 49 LYS QE 5.430 . 5.930 4.818 4.605 4.857 . 0 0 "[ . 1 . 2]" 1
664 1 46 ARG HA 1 50 ASN H 4.300 . 4.800 3.904 3.719 4.001 . 0 0 "[ . 1 . 2]" 1
665 1 46 ARG HA 1 50 ASN QD 5.490 . 5.990 3.485 3.322 4.902 . 0 0 "[ . 1 . 2]" 1
666 1 46 ARG QB 1 47 THR H 4.420 . 4.920 3.601 3.458 3.703 . 0 0 "[ . 1 . 2]" 1
667 1 46 ARG QD 1 47 THR HA 3.840 . 4.270 3.216 2.578 3.434 . 0 0 "[ . 1 . 2]" 1
668 1 46 ARG QG 1 47 THR H 4.020 . 4.520 2.454 1.961 3.589 . 0 0 "[ . 1 . 2]" 1
669 1 46 ARG QG 1 47 THR HA 4.380 . 4.880 3.896 3.575 4.000 . 0 0 "[ . 1 . 2]" 1
670 1 47 THR H 1 48 MET H 3.680 . 4.180 2.644 2.525 2.702 . 0 0 "[ . 1 . 2]" 1
671 1 47 THR HA 1 50 ASN H 4.500 . 5.000 3.898 3.748 4.004 . 0 0 "[ . 1 . 2]" 1
672 1 47 THR HA 1 50 ASN HB2 3.880 . 4.380 3.089 2.968 3.161 . 0 0 "[ . 1 . 2]" 1
673 1 47 THR HA 1 50 ASN HB3 4.570 . 5.070 4.591 4.554 4.616 . 0 0 "[ . 1 . 2]" 1
674 1 47 THR HA 1 50 ASN QD 5.300 . 5.690 3.652 3.543 3.764 . 0 0 "[ . 1 . 2]" 1
675 1 47 THR HA 1 51 VAL MG2 5.920 . 6.420 4.116 3.983 4.243 . 0 0 "[ . 1 . 2]" 1
676 1 47 THR HA 2 24 ILE MD 6.610 . 7.110 5.534 5.506 5.557 . 0 0 "[ . 1 . 2]" 1
677 1 47 THR HB 1 48 MET H 3.890 . 4.390 2.352 2.281 2.422 . 0 0 "[ . 1 . 2]" 1
678 1 47 THR HB 1 48 MET ME 4.620 . 5.120 3.287 3.030 3.885 . 0 0 "[ . 1 . 2]" 1
679 1 47 THR HB 1 48 MET QG 5.990 . 6.490 3.304 2.934 4.537 . 0 0 "[ . 1 . 2]" 1
680 1 47 THR HB 2 24 ILE MD 6.000 . 6.500 4.294 4.175 4.406 . 0 0 "[ . 1 . 2]" 1
681 1 47 THR HB 2 25 PHE QD 6.170 . 6.670 5.175 5.118 5.280 . 0 0 "[ . 1 . 2]" 1
682 1 47 THR MG 1 48 MET H 5.240 . 5.740 3.474 3.377 3.547 . 0 0 "[ . 1 . 2]" 1
683 1 47 THR MG 1 48 MET HA 4.650 . 5.150 3.761 3.626 3.875 . 0 0 "[ . 1 . 2]" 1
684 1 47 THR MG 1 48 MET ME 5.490 . 5.990 2.631 2.345 3.144 . 0 0 "[ . 1 . 2]" 1
685 1 47 THR MG 1 48 MET QG 6.700 . 7.200 3.989 3.684 4.603 . 0 0 "[ . 1 . 2]" 1
686 1 47 THR MG 1 51 VAL HB 5.610 . 6.110 4.423 4.143 4.638 . 0 0 "[ . 1 . 2]" 1
687 1 47 THR MG 1 68 HIS HB3 5.750 . 6.250 4.743 4.503 4.827 . 0 0 "[ . 1 . 2]" 1
688 1 47 THR MG 1 68 HIS HD2 5.260 . 5.760 3.838 3.535 4.219 . 0 0 "[ . 1 . 2]" 1
689 1 47 THR MG 2 24 ILE MD 6.060 . 6.560 2.390 2.339 2.425 . 0 0 "[ . 1 . 2]" 1
690 1 47 THR MG 2 24 ILE MG 7.210 . 7.710 4.944 4.846 5.003 . 0 0 "[ . 1 . 2]" 1
691 1 47 THR MG 2 25 PHE QD 6.070 . 6.570 4.532 4.512 4.562 . 0 0 "[ . 1 . 2]" 1
692 1 47 THR MG 2 25 PHE QE 6.740 . 7.240 2.552 2.476 2.603 . 0 0 "[ . 1 . 2]" 1
693 1 48 MET H 1 48 MET QG 3.970 . 4.470 2.396 2.159 3.352 . 0 0 "[ . 1 . 2]" 1
694 1 48 MET H 1 49 LYS H 3.300 . 3.800 2.788 2.756 2.812 . 0 0 "[ . 1 . 2]" 1
695 1 48 MET HA 1 48 MET ME 4.240 . 4.740 2.135 2.037 2.365 . 0 0 "[ . 1 . 2]" 1
696 1 48 MET HA 1 51 VAL H 3.400 . 3.900 3.363 3.237 3.422 . 0 0 "[ . 1 . 2]" 1
697 1 48 MET HA 1 51 VAL HB 3.480 . 3.980 2.454 2.298 2.525 . 0 0 "[ . 1 . 2]" 1
698 1 48 MET HA 1 51 VAL MG1 4.560 . 5.060 3.737 3.501 3.810 . 0 0 "[ . 1 . 2]" 1
699 1 48 MET HA 1 51 VAL MG2 4.220 . 4.720 3.351 3.236 3.412 . 0 0 "[ . 1 . 2]" 1
700 1 48 MET HA 1 52 LEU H 4.750 . 5.250 3.876 3.798 3.995 . 0 0 "[ . 1 . 2]" 1
701 1 48 MET HB2 1 49 LYS H 3.970 . 4.470 2.524 2.432 2.631 . 0 0 "[ . 1 . 2]" 1
702 1 48 MET HB3 1 51 VAL HB 4.640 . 5.140 4.472 4.373 4.553 . 0 0 "[ . 1 . 2]" 1
703 1 48 MET ME 1 51 VAL MG1 5.750 . 6.250 3.312 3.058 3.545 . 0 0 "[ . 1 . 2]" 1
704 1 48 MET ME 1 51 VAL MG2 5.730 . 6.230 2.911 2.654 3.163 . 0 0 "[ . 1 . 2]" 1
705 1 48 MET ME 1 68 HIS HB2 5.020 . 5.520 4.200 4.147 4.226 . 0 0 "[ . 1 . 2]" 1
706 1 48 MET ME 1 68 HIS HB3 4.350 . 4.850 3.265 3.142 3.350 . 0 0 "[ . 1 . 2]" 1
707 1 48 MET ME 2 24 ILE MD 7.370 . 7.870 4.132 3.847 4.517 . 0 0 "[ . 1 . 2]" 1
708 1 48 MET ME 2 25 PHE QD 5.390 . 5.890 4.034 4.012 4.066 . 0 0 "[ . 1 . 2]" 1
709 1 48 MET ME 2 25 PHE QE 5.000 . 5.500 2.636 2.516 2.930 . 0 0 "[ . 1 . 2]" 1
710 1 49 LYS H 1 49 LYS QG 4.360 . 4.860 2.403 2.329 2.461 . 0 0 "[ . 1 . 2]" 1
711 1 49 LYS H 1 50 ASN H 3.250 . 3.750 2.853 2.801 2.896 . 0 0 "[ . 1 . 2]" 1
712 1 49 LYS H 1 50 ASN HB2 4.780 . 5.280 4.780 4.735 4.816 . 0 0 "[ . 1 . 2]" 1
713 1 49 LYS HA 1 52 LEU H 3.900 . 4.400 3.555 3.395 3.661 . 0 0 "[ . 1 . 2]" 1
714 1 49 LYS HA 1 52 LEU HB2 4.270 . 4.770 2.538 2.287 2.756 . 0 0 "[ . 1 . 2]" 1
715 1 49 LYS HA 1 52 LEU HB3 4.300 . 4.800 4.030 3.725 4.322 . 0 0 "[ . 1 . 2]" 1
716 1 49 LYS HA 1 52 LEU QD 4.480 . 4.980 2.633 2.500 2.792 . 0 0 "[ . 1 . 2]" 1
717 1 49 LYS HB2 1 50 ASN H 3.190 . 3.690 2.764 2.668 2.832 . 0 0 "[ . 1 . 2]" 1
718 1 49 LYS HB2 1 50 ASN HB2 5.480 . 5.980 4.770 4.664 4.876 . 0 0 "[ . 1 . 2]" 1
719 1 49 LYS HB3 1 49 LYS QE 4.340 . 4.840 3.905 3.882 3.930 . 0 0 "[ . 1 . 2]" 1
720 1 49 LYS HB3 1 50 ASN H 3.570 . 4.070 3.545 3.500 3.587 . 0 0 "[ . 1 . 2]" 1
721 1 49 LYS QD 1 50 ASN H 5.490 . 5.990 4.812 4.733 4.891 . 0 0 "[ . 1 . 2]" 1
722 1 49 LYS QG 1 50 ASN H 5.190 . 5.690 4.304 4.255 4.344 . 0 0 "[ . 1 . 2]" 1
723 1 50 ASN H 1 50 ASN HB2 3.350 . 3.850 2.229 2.181 2.316 . 0 0 "[ . 1 . 2]" 1
724 1 50 ASN H 1 50 ASN HB3 3.640 . 4.140 3.521 3.487 3.550 . 0 0 "[ . 1 . 2]" 1
725 1 50 ASN H 1 51 VAL HB 4.820 . 5.320 4.735 4.638 4.822 . 0 0 "[ . 1 . 2]" 1
726 1 50 ASN H 1 51 VAL MG2 5.980 . 6.480 4.474 4.374 4.560 . 0 0 "[ . 1 . 2]" 1
727 1 50 ASN HA 1 52 LEU H 5.080 . 5.580 4.538 4.418 4.667 . 0 0 "[ . 1 . 2]" 1
728 1 50 ASN HB2 1 51 VAL H 4.020 . 4.520 2.850 2.679 2.938 . 0 0 "[ . 1 . 2]" 1
729 1 50 ASN HB2 1 51 VAL MG2 5.390 . 5.890 3.671 3.516 3.799 . 0 0 "[ . 1 . 2]" 1
730 1 50 ASN HB3 1 51 VAL H 3.930 . 4.430 3.377 3.231 3.518 . 0 0 "[ . 1 . 2]" 1
731 1 50 ASN HB3 1 51 VAL HA 4.850 . 5.350 4.295 4.245 4.473 . 0 0 "[ . 1 . 2]" 1
732 1 50 ASN HB3 1 51 VAL MG2 5.320 . 5.820 3.843 3.653 4.067 . 0 0 "[ . 1 . 2]" 1
733 1 51 VAL H 1 51 VAL HB 3.400 . 3.900 2.309 2.230 2.369 . 0 0 "[ . 1 . 2]" 1
734 1 51 VAL H 1 51 VAL MG2 3.990 . 4.490 2.398 2.271 2.541 . 0 0 "[ . 1 . 2]" 1
735 1 51 VAL H 1 52 LEU H 3.250 . 3.750 2.675 2.600 2.753 . 0 0 "[ . 1 . 2]" 1
736 1 51 VAL H 1 52 LEU HB2 5.010 . 5.510 4.566 4.454 4.694 . 0 0 "[ . 1 . 2]" 1
737 1 51 VAL H 1 52 LEU HG 4.650 . 5.150 4.697 4.673 4.725 . 0 0 "[ . 1 . 2]" 1
738 1 51 VAL HA 1 54 HIS H 3.690 . 4.190 3.629 3.548 3.696 . 0 0 "[ . 1 . 2]" 1
739 1 51 VAL HA 1 54 HIS HB2 3.930 . 4.430 3.821 3.699 3.936 . 0 0 "[ . 1 . 2]" 1
740 1 51 VAL HA 1 54 HIS HB3 3.340 . 3.840 2.555 2.437 2.686 . 0 0 "[ . 1 . 2]" 1
741 1 51 VAL HA 1 55 MET QG 5.890 . 6.390 4.208 4.084 4.341 . 0 0 "[ . 1 . 2]" 1
742 1 51 VAL HA 1 66 VAL MG1 5.260 . 5.760 3.527 3.223 3.969 . 0 0 "[ . 1 . 2]" 1
743 1 51 VAL HB 1 52 LEU H 3.710 . 4.210 2.764 2.682 2.869 . 0 0 "[ . 1 . 2]" 1
744 1 51 VAL HB 1 52 LEU HG 4.920 . 5.420 3.639 3.531 3.776 . 0 0 "[ . 1 . 2]" 1
745 1 51 VAL MG1 1 52 LEU H 4.820 . 5.320 3.289 3.106 3.450 . 0 0 "[ . 1 . 2]" 1
746 1 51 VAL MG1 1 54 HIS HD2 5.360 . 5.860 3.885 3.563 4.289 . 0 0 "[ . 1 . 2]" 1
747 1 51 VAL MG1 1 55 MET H 5.580 . 6.080 4.009 3.938 4.100 . 0 0 "[ . 1 . 2]" 1
748 1 51 VAL MG1 1 55 MET HB2 5.780 . 6.280 4.058 3.905 4.222 . 0 0 "[ . 1 . 2]" 1
749 1 51 VAL MG1 1 55 MET HB3 6.150 . 6.650 4.931 4.814 5.014 . 0 0 "[ . 1 . 2]" 1
750 1 51 VAL MG1 1 55 MET QG 5.280 . 5.490 2.810 2.465 3.022 . 0 0 "[ . 1 . 2]" 1
751 1 51 VAL MG1 1 66 VAL MG1 6.240 . 6.740 3.273 3.005 3.756 . 0 0 "[ . 1 . 2]" 1
752 1 51 VAL MG1 1 68 HIS HB2 4.000 . 4.500 2.740 2.589 2.929 . 0 0 "[ . 1 . 2]" 1
753 1 51 VAL MG1 1 68 HIS HB3 4.960 . 5.460 2.353 2.264 2.533 . 0 0 "[ . 1 . 2]" 1
754 1 51 VAL MG1 1 68 HIS HD2 6.040 . 6.540 4.824 4.675 5.033 . 0 0 "[ . 1 . 2]" 1
755 1 51 VAL MG1 1 69 CYS H 5.090 . 5.590 3.378 3.156 3.719 . 0 0 "[ . 1 . 2]" 1
756 1 51 VAL MG1 1 69 CYS HA 4.160 . 4.660 2.472 2.307 2.675 . 0 0 "[ . 1 . 2]" 1
757 1 51 VAL MG1 1 69 CYS HB3 6.020 . 6.520 4.367 4.155 4.665 . 0 0 "[ . 1 . 2]" 1
758 1 51 VAL MG1 1 72 SER HB2 4.300 . 4.800 3.179 2.963 3.374 . 0 0 "[ . 1 . 2]" 1
759 1 51 VAL MG2 1 52 LEU H 5.260 . 5.760 4.062 4.001 4.122 . 0 0 "[ . 1 . 2]" 1
760 1 51 VAL MG2 1 54 HIS HB2 6.340 . 6.840 5.217 5.066 5.285 . 0 0 "[ . 1 . 2]" 1
761 1 51 VAL MG2 1 66 VAL MG1 6.160 . 6.660 2.789 2.497 3.263 . 0 0 "[ . 1 . 2]" 1
762 1 51 VAL MG2 1 68 HIS HA 5.320 . 5.820 4.464 4.424 4.487 . 0 0 "[ . 1 . 2]" 1
763 1 51 VAL MG2 1 68 HIS HB2 3.710 . 4.210 2.088 2.037 2.151 . 0 0 "[ . 1 . 2]" 1
764 1 51 VAL MG2 1 68 HIS HB3 4.180 . 4.680 2.595 2.471 2.686 . 0 0 "[ . 1 . 2]" 1
765 1 51 VAL MG2 1 68 HIS HD2 4.420 . 4.920 3.259 3.074 3.426 . 0 0 "[ . 1 . 2]" 1
766 1 51 VAL MG2 1 69 CYS H 6.210 . 6.710 3.933 3.740 4.118 . 0 0 "[ . 1 . 2]" 1
767 1 51 VAL MG2 1 69 CYS HA 5.510 . 6.010 4.361 4.186 4.454 . 0 0 "[ . 1 . 2]" 1
768 1 52 LEU H 1 52 LEU QD 4.800 . 5.300 3.192 3.104 3.258 . 0 0 "[ . 1 . 2]" 1
769 1 52 LEU H 1 52 LEU HG 3.370 . 3.870 2.539 2.416 2.687 . 0 0 "[ . 1 . 2]" 1
770 1 52 LEU H 1 53 ASN H 3.150 . 3.650 2.735 2.658 2.776 . 0 0 "[ . 1 . 2]" 1
771 1 52 LEU H 1 53 ASN QB 4.930 . 5.430 4.438 4.416 4.500 . 0 0 "[ . 1 . 2]" 1
772 1 52 LEU HA 1 52 LEU QD 3.660 . 4.160 2.064 2.038 2.098 . 0 0 "[ . 1 . 2]" 1
773 1 52 LEU HA 1 55 MET H 4.110 . 4.610 3.417 3.334 3.496 . 0 0 "[ . 1 . 2]" 1
774 1 52 LEU HA 1 55 MET HB2 3.440 . 3.940 2.311 2.263 2.397 . 0 0 "[ . 1 . 2]" 1
775 1 52 LEU HA 1 55 MET HB3 4.170 . 4.670 3.774 3.637 3.963 . 0 0 "[ . 1 . 2]" 1
776 1 52 LEU HA 1 55 MET ME 5.370 . 5.870 3.422 3.168 3.626 . 0 0 "[ . 1 . 2]" 1
777 1 52 LEU HA 1 55 MET QG 4.610 . 5.110 3.607 3.065 3.814 . 0 0 "[ . 1 . 2]" 1
778 1 52 LEU HA 2 52 TYR QE 6.170 . 6.670 3.842 3.048 5.552 . 0 0 "[ . 1 . 2]" 1
779 1 52 LEU HB2 1 53 ASN H 3.160 . 3.660 2.559 2.528 2.604 . 0 0 "[ . 1 . 2]" 1
780 1 52 LEU HB2 1 54 HIS H 5.180 . 5.680 5.010 4.928 5.088 . 0 0 "[ . 1 . 2]" 1
781 1 52 LEU HB3 1 53 ASN H 3.690 . 4.190 3.299 3.208 3.429 . 0 0 "[ . 1 . 2]" 1
782 1 52 LEU QD 1 53 ASN H 5.390 . 5.890 4.055 4.046 4.073 . 0 0 "[ . 1 . 2]" 1
783 1 52 LEU QD 1 55 MET H 6.610 . 7.110 4.802 4.689 4.899 . 0 0 "[ . 1 . 2]" 1
784 1 52 LEU QD 1 55 MET HB3 5.380 . 5.880 4.031 4.003 4.063 . 0 0 "[ . 1 . 2]" 1
785 1 52 LEU QD 2 52 TYR QD 8.320 . 8.820 2.935 2.250 3.376 . 0 0 "[ . 1 . 2]" 1
786 1 52 LEU QD 2 52 TYR QE 7.570 . 8.070 2.610 2.055 4.075 . 0 0 "[ . 1 . 2]" 1
787 1 53 ASN H 1 54 HIS H 3.340 . 3.840 2.787 2.698 2.850 . 0 0 "[ . 1 . 2]" 1
788 1 53 ASN H 1 54 HIS HB3 4.890 . 5.390 4.726 4.605 4.891 . 0 0 "[ . 1 . 2]" 1
789 1 53 ASN H 1 55 MET H 5.130 . 5.630 4.372 4.259 4.413 . 0 0 "[ . 1 . 2]" 1
790 1 53 ASN HA 1 56 THR H 4.450 . 4.950 3.514 3.204 3.724 . 0 0 "[ . 1 . 2]" 1
791 1 53 ASN HA 1 56 THR HB 4.630 . 5.130 3.132 2.832 3.754 . 0 0 "[ . 1 . 2]" 1
792 1 53 ASN HA 1 56 THR MG 4.920 . 5.420 4.160 4.118 4.198 . 0 0 "[ . 1 . 2]" 1
793 1 53 ASN QB 1 54 HIS H 3.810 . 4.310 2.633 2.559 2.828 . 0 0 "[ . 1 . 2]" 1
794 1 53 ASN QB 1 54 HIS HA 4.870 . 5.370 4.280 4.071 4.370 . 0 0 "[ . 1 . 2]" 1
795 1 53 ASN QB 1 56 THR HB 5.610 . 6.110 4.953 4.573 5.088 . 0 0 "[ . 1 . 2]" 1
796 1 54 HIS H 1 54 HIS HD2 4.960 . 5.460 4.564 4.396 4.623 . 0 0 "[ . 1 . 2]" 1
797 1 54 HIS H 1 55 MET H 3.320 . 3.820 2.796 2.662 2.875 . 0 0 "[ . 1 . 2]" 1
798 1 54 HIS H 1 55 MET HB2 4.710 . 5.210 4.532 4.402 4.664 . 0 0 "[ . 1 . 2]" 1
799 1 54 HIS HA 1 54 HIS HD2 4.980 . 5.480 4.315 4.248 4.432 . 0 0 "[ . 1 . 2]" 1
800 1 54 HIS HA 1 57 HIS HD2 5.020 . 5.520 3.941 3.471 4.992 . 0 0 "[ . 1 . 2]" 1
801 1 54 HIS HB2 1 55 MET H 4.240 . 4.740 3.949 3.919 3.998 . 0 0 "[ . 1 . 2]" 1
802 1 54 HIS HB3 1 55 MET H 3.610 . 4.110 2.570 2.526 2.645 . 0 0 "[ . 1 . 2]" 1
803 1 54 HIS HD2 1 55 MET H 4.260 . 4.760 2.745 2.601 2.818 . 0 0 "[ . 1 . 2]" 1
804 1 54 HIS HD2 1 55 MET HA 4.230 . 4.730 2.885 2.719 3.025 . 0 0 "[ . 1 . 2]" 1
805 1 54 HIS HD2 1 55 MET ME 6.460 . 6.960 5.382 5.264 5.435 . 0 0 "[ . 1 . 2]" 1
806 1 54 HIS HD2 1 55 MET QG 4.770 . 5.270 2.468 2.352 2.628 . 0 0 "[ . 1 . 2]" 1
807 1 54 HIS HD2 1 66 VAL MG1 5.070 . 5.570 3.664 3.195 3.850 . 0 0 "[ . 1 . 2]" 1
808 1 54 HIS HD2 1 66 VAL MG2 6.080 . 6.580 4.143 3.718 4.365 . 0 0 "[ . 1 . 2]" 1
809 1 54 HIS HD2 1 69 CYS H 5.220 . 5.720 4.989 4.792 5.147 . 0 0 "[ . 1 . 2]" 1
810 1 54 HIS HD2 1 69 CYS HA 4.420 . 4.920 3.886 3.735 3.979 . 0 0 "[ . 1 . 2]" 1
811 1 54 HIS HD2 1 69 CYS HB2 4.140 . 4.640 2.503 2.348 2.631 . 0 0 "[ . 1 . 2]" 1
812 1 54 HIS HD2 1 69 CYS HB3 4.380 . 4.880 3.980 3.809 4.202 . 0 0 "[ . 1 . 2]" 1
813 1 54 HIS HE1 1 58 CYS HA 4.760 . 5.260 4.597 3.783 4.803 . 0 0 "[ . 1 . 2]" 1
814 1 54 HIS HE1 1 58 CYS HB2 4.700 . 5.200 3.309 3.241 3.399 . 0 0 "[ . 1 . 2]" 1
815 1 54 HIS HE1 1 58 CYS HB3 4.800 . 5.300 4.858 4.804 4.887 . 0 0 "[ . 1 . 2]" 1
816 1 54 HIS HE1 1 60 ALA MB 6.530 . 7.030 5.220 4.629 5.458 . 0 0 "[ . 1 . 2]" 1
817 1 54 HIS HE1 1 66 VAL H 4.770 . 5.270 4.698 4.508 4.807 . 0 0 "[ . 1 . 2]" 1
818 1 54 HIS HE1 1 66 VAL HB 3.970 . 4.470 4.033 4.015 4.045 . 0 0 "[ . 1 . 2]" 1
819 1 54 HIS HE1 1 66 VAL MG1 5.690 . 6.190 4.660 4.453 4.745 . 0 0 "[ . 1 . 2]" 1
820 1 54 HIS HE1 1 66 VAL MG2 4.230 . 4.730 2.901 2.729 3.005 . 0 0 "[ . 1 . 2]" 1
821 1 55 MET H 1 55 MET ME 6.050 . 6.550 4.573 4.484 4.691 . 0 0 "[ . 1 . 2]" 1
822 1 55 MET H 1 55 MET QG 3.910 . 4.270 2.508 2.302 2.769 . 0 0 "[ . 1 . 2]" 1
823 1 55 MET H 1 56 THR H 3.500 . 4.000 2.864 2.813 2.917 . 0 0 "[ . 1 . 2]" 1
824 1 55 MET H 1 58 CYS HB2 5.290 . 5.790 4.822 4.483 4.967 . 0 0 "[ . 1 . 2]" 1
825 1 55 MET HA 1 58 CYS H 4.140 . 4.640 3.223 3.146 3.432 . 0 0 "[ . 1 . 2]" 1
826 1 55 MET HA 1 58 CYS HA 5.000 . 5.500 5.055 5.021 5.092 . 0 0 "[ . 1 . 2]" 1
827 1 55 MET HA 1 58 CYS HB2 3.360 . 3.860 3.298 2.750 3.407 . 0 0 "[ . 1 . 2]" 1
828 1 55 MET HA 1 58 CYS HB3 3.670 . 4.170 2.230 2.085 2.957 . 0 0 "[ . 1 . 2]" 1
829 1 55 MET QB 2 53 VAL QG 8.320 . 8.820 4.343 3.120 5.523 . 0 0 "[ . 1 . 2]" 1
830 1 55 MET HB2 1 55 MET ME 4.260 . 4.760 2.810 2.605 2.975 . 0 0 "[ . 1 . 2]" 1
831 1 55 MET HB2 1 56 THR H 3.890 . 4.390 2.770 2.570 2.909 . 0 0 "[ . 1 . 2]" 1
832 1 55 MET HB2 1 56 THR MG 6.610 . 7.110 5.393 4.938 5.552 . 0 0 "[ . 1 . 2]" 1
833 1 55 MET HB2 2 52 TYR QD 6.170 . 6.670 4.022 3.497 4.508 . 0 0 "[ . 1 . 2]" 1
834 1 55 MET HB2 2 52 TYR QE 6.170 . 6.670 4.477 3.743 5.153 . 0 0 "[ . 1 . 2]" 1
835 1 55 MET HB3 1 55 MET ME 4.380 . 4.880 2.179 2.116 2.253 . 0 0 "[ . 1 . 2]" 1
836 1 55 MET HB3 1 56 THR H 4.090 . 4.590 3.399 3.195 3.602 . 0 0 "[ . 1 . 2]" 1
837 1 55 MET HB3 1 56 THR MG 6.610 . 7.110 5.343 4.831 5.548 . 0 0 "[ . 1 . 2]" 1
838 1 55 MET HB3 1 76 ILE MD 6.530 . 7.030 5.011 4.766 5.440 . 0 0 "[ . 1 . 2]" 1
839 1 55 MET HB3 2 52 TYR QD 6.170 . 6.670 3.789 2.873 4.314 . 0 0 "[ . 1 . 2]" 1
840 1 55 MET HB3 2 52 TYR QE 5.570 . 6.070 4.769 3.507 5.064 . 0 0 "[ . 1 . 2]" 1
841 1 55 MET ME 1 56 THR H 5.920 . 6.420 4.852 4.679 4.940 . 0 0 "[ . 1 . 2]" 1
842 1 55 MET ME 1 69 CYS HA 4.860 . 5.360 3.984 3.487 4.125 . 0 0 "[ . 1 . 2]" 1
843 1 55 MET ME 1 72 SER H 6.000 . 6.500 4.717 4.042 5.009 . 0 0 "[ . 1 . 2]" 1
844 1 55 MET ME 1 72 SER HB2 4.140 . 4.640 2.814 2.376 3.106 . 0 0 "[ . 1 . 2]" 1
845 1 55 MET ME 1 72 SER HB3 4.110 . 4.610 2.506 2.215 2.780 . 0 0 "[ . 1 . 2]" 1
846 1 55 MET ME 1 73 ARG HA 3.600 . 4.100 2.667 2.351 2.971 . 0 0 "[ . 1 . 2]" 1
847 1 55 MET ME 1 73 ARG QD 5.440 . 5.720 3.238 2.079 3.892 . 0 0 "[ . 1 . 2]" 1
848 1 55 MET ME 1 73 ARG QG 5.810 . 6.310 3.034 1.995 4.339 . 0 0 "[ . 1 . 2]" 1
849 1 55 MET ME 1 76 ILE MD 4.720 . 5.220 2.072 1.945 2.393 . 0 0 "[ . 1 . 2]" 1
850 1 55 MET ME 2 52 TYR HA 6.610 . 7.110 5.491 5.361 5.562 . 0 0 "[ . 1 . 2]" 1
851 1 55 MET ME 2 52 TYR QB 6.000 . 6.480 4.212 3.713 4.469 . 0 0 "[ . 1 . 2]" 1
852 1 55 MET ME 2 52 TYR QD 5.690 . 6.190 3.027 2.097 3.538 . 0 0 "[ . 1 . 2]" 1
853 1 55 MET ME 2 52 TYR QE 5.920 . 6.420 3.747 1.970 4.434 . 0 0 "[ . 1 . 2]" 1
854 1 55 MET ME 2 53 VAL HA 6.000 . 6.500 3.644 2.220 5.064 . 0 0 "[ . 1 . 2]" 1
855 1 55 MET ME 2 53 VAL QG 8.090 . 8.590 3.331 2.121 5.019 . 0 0 "[ . 1 . 2]" 1
856 1 55 MET QG 1 69 CYS H 5.990 . 6.490 4.751 4.527 5.002 . 0 0 "[ . 1 . 2]" 1
857 1 55 MET QG 1 69 CYS HA 4.510 . 4.890 2.534 2.338 2.728 . 0 0 "[ . 1 . 2]" 1
858 1 55 MET QG 1 69 CYS HB3 5.990 . 6.490 4.212 3.988 4.410 . 0 0 "[ . 1 . 2]" 1
859 1 55 MET QG 1 73 ARG H 5.990 . 6.490 4.162 3.952 4.484 . 0 0 "[ . 1 . 2]" 1
860 1 56 THR H 1 57 HIS H 3.760 . 4.260 2.798 2.664 2.917 . 0 0 "[ . 1 . 2]" 1
861 1 56 THR H 1 58 CYS H 4.490 . 4.990 4.119 3.911 4.272 . 0 0 "[ . 1 . 2]" 1
862 1 56 THR H 2 52 TYR QD 5.880 . 6.380 4.791 4.244 5.272 . 0 0 "[ . 1 . 2]" 1
863 1 56 THR HA 2 52 TYR QD 6.170 . 6.670 4.548 3.816 5.446 . 0 0 "[ . 1 . 2]" 1
864 1 56 THR HA 2 54 SER HA 5.500 . 6.000 4.312 3.112 5.304 . 0 0 "[ . 1 . 2]" 1
865 1 56 THR HB 1 57 HIS H 4.260 . 4.760 3.506 3.088 3.834 . 0 0 "[ . 1 . 2]" 1
866 1 56 THR HB 1 57 HIS HD2 4.460 . 4.960 3.453 2.583 4.086 . 0 0 "[ . 1 . 2]" 1
867 1 56 THR MG 1 57 HIS H 5.700 . 6.200 4.205 3.887 4.429 . 0 0 "[ . 1 . 2]" 1
868 1 56 THR MG 1 57 HIS HA 5.880 . 6.380 4.451 4.094 4.900 . 0 0 "[ . 1 . 2]" 1
869 1 56 THR MG 1 57 HIS HD2 5.660 . 6.160 4.482 3.500 4.725 . 0 0 "[ . 1 . 2]" 1
870 1 56 THR MG 2 52 TYR QD 6.740 . 7.240 3.975 2.921 5.052 . 0 0 "[ . 1 . 2]" 1
871 1 56 THR MG 2 53 VAL HA 6.610 . 7.110 5.374 4.706 5.573 . 0 0 "[ . 1 . 2]" 1
872 1 56 THR MG 2 53 VAL QG 8.090 . 8.590 4.953 3.917 5.085 . 0 0 "[ . 1 . 2]" 1
873 1 56 THR MG 2 54 SER HA 6.610 . 7.110 5.133 4.288 5.573 . 0 0 "[ . 1 . 2]" 1
874 1 56 THR MG 2 54 SER QB 7.410 . 7.910 5.295 4.388 5.581 . 0 0 "[ . 1 . 2]" 1
875 1 57 HIS H 1 58 CYS H 3.200 . 3.700 1.917 1.795 2.165 0.005 20 0 "[ . 1 . 2]" 1
876 1 57 HIS H 1 58 CYS HB2 4.810 . 5.310 4.139 3.992 4.265 . 0 0 "[ . 1 . 2]" 1
877 1 57 HIS H 1 58 CYS HB3 5.190 . 5.690 3.891 3.545 4.466 . 0 0 "[ . 1 . 2]" 1
878 1 57 HIS HA 1 57 HIS HD2 4.920 . 5.420 4.416 3.770 4.751 . 0 0 "[ . 1 . 2]" 1
879 1 57 HIS HA 1 58 CYS HA 5.200 . 5.700 4.866 4.741 4.914 . 0 0 "[ . 1 . 2]" 1
880 1 57 HIS HA 1 59 GLN QG 5.610 . 6.110 4.588 4.241 5.039 . 0 0 "[ . 1 . 2]" 1
881 1 57 HIS QB 1 58 CYS H 4.580 . 5.080 3.114 2.896 3.623 . 0 0 "[ . 1 . 2]" 1
882 1 57 HIS QB 1 58 CYS HA 5.610 . 6.110 4.159 4.054 4.379 . 0 0 "[ . 1 . 2]" 1
883 1 57 HIS HB2 1 58 CYS H 4.860 . 5.360 3.237 2.977 3.840 . 0 0 "[ . 1 . 2]" 1
884 1 57 HIS HB3 1 58 CYS H 4.860 . 5.360 4.062 3.758 4.444 . 0 0 "[ . 1 . 2]" 1
885 1 58 CYS HA 1 59 GLN HA 5.500 . 6.000 4.535 4.483 4.600 . 0 0 "[ . 1 . 2]" 1
886 1 58 CYS HA 1 60 ALA H 4.200 . 4.700 3.857 3.673 4.035 . 0 0 "[ . 1 . 2]" 1
887 1 58 CYS HA 1 60 ALA MB 6.490 . 6.990 4.809 4.655 5.180 . 0 0 "[ . 1 . 2]" 1
888 1 59 GLN HA 1 60 ALA MB 6.040 . 6.540 4.835 4.476 4.945 . 0 0 "[ . 1 . 2]" 1
889 1 59 GLN QB 1 60 ALA H 4.890 . 5.390 3.570 3.262 4.082 . 0 0 "[ . 1 . 2]" 1
890 1 59 GLN QB 1 60 ALA HA 5.990 . 6.490 4.255 4.100 4.926 . 0 0 "[ . 1 . 2]" 1
891 1 59 GLN QB 1 60 ALA MB 6.940 . 7.440 4.385 3.935 5.160 . 0 0 "[ . 1 . 2]" 1
892 1 59 GLN QB 1 61 GLY H 5.500 . 6.000 4.700 4.370 4.914 . 0 0 "[ . 1 . 2]" 1
893 1 59 GLN QG 1 60 ALA H 5.990 . 6.490 4.524 3.942 4.777 . 0 0 "[ . 1 . 2]" 1
894 1 60 ALA H 1 61 GLY H 3.300 . 3.800 2.672 2.326 2.951 . 0 0 "[ . 1 . 2]" 1
895 1 60 ALA H 1 61 GLY QA 5.570 . 6.070 4.528 4.212 4.748 . 0 0 "[ . 1 . 2]" 1
896 1 60 ALA H 1 64 CYS QB 5.070 . 5.570 3.950 3.791 4.120 . 0 0 "[ . 1 . 2]" 1
897 1 60 ALA HA 1 61 GLY H 3.950 . 4.450 3.379 3.236 3.504 . 0 0 "[ . 1 . 2]" 1
898 1 60 ALA HA 1 64 CYS HA 5.000 . 5.500 4.859 4.715 5.036 . 0 0 "[ . 1 . 2]" 1
899 1 60 ALA HA 1 64 CYS QB 5.480 . 5.980 4.789 4.613 4.907 . 0 0 "[ . 1 . 2]" 1
900 1 60 ALA MB 1 61 GLY H 4.710 . 5.210 3.224 2.862 3.491 . 0 0 "[ . 1 . 2]" 1
901 1 60 ALA MB 1 64 CYS H 3.860 . 4.360 3.169 2.778 3.226 . 0 0 "[ . 1 . 2]" 1
902 1 60 ALA MB 1 64 CYS HA 3.720 . 4.220 2.196 2.056 2.444 . 0 0 "[ . 1 . 2]" 1
903 1 60 ALA MB 1 64 CYS QB 3.990 . 4.490 2.244 2.070 2.495 . 0 0 "[ . 1 . 2]" 1
904 1 60 ALA MB 1 65 GLN H 5.930 . 6.430 3.712 3.500 4.095 . 0 0 "[ . 1 . 2]" 1
905 1 61 GLY H 1 64 CYS H 5.500 . 6.000 4.914 4.288 5.357 . 0 0 "[ . 1 . 2]" 1
906 1 61 GLY H 1 64 CYS QB 5.500 . 6.000 3.929 2.945 4.899 . 0 0 "[ . 1 . 2]" 1
907 1 61 GLY QA 1 63 ALA MB 6.740 . 7.240 4.616 4.049 5.022 . 0 0 "[ . 1 . 2]" 1
908 1 62 LYS HA 1 64 CYS H 4.530 . 5.030 3.923 3.688 4.128 . 0 0 "[ . 1 . 2]" 1
909 1 62 LYS HA 1 70 ALA HA 5.000 . 5.500 3.562 2.405 5.013 . 0 0 "[ . 1 . 2]" 1
910 1 62 LYS HA 1 70 ALA MB 4.100 . 4.600 2.510 2.069 3.116 . 0 0 "[ . 1 . 2]" 1
911 1 63 ALA H 1 64 CYS H 3.370 . 3.870 2.320 1.883 2.620 . 0 0 "[ . 1 . 2]" 1
912 1 63 ALA H 1 64 CYS QB 4.920 . 5.420 3.854 3.509 4.188 . 0 0 "[ . 1 . 2]" 1
913 1 63 ALA HA 1 64 CYS HA 5.500 . 6.000 4.866 4.833 4.913 . 0 0 "[ . 1 . 2]" 1
914 1 63 ALA MB 1 64 CYS QB 6.740 . 7.240 4.674 4.538 4.751 . 0 0 "[ . 1 . 2]" 1
915 1 64 CYS H 1 65 GLN H 4.900 . 5.400 4.612 4.497 4.641 . 0 0 "[ . 1 . 2]" 1
916 1 64 CYS H 1 66 VAL H 5.500 . 6.000 5.398 5.252 5.520 . 0 0 "[ . 1 . 2]" 1
917 1 64 CYS HA 1 65 GLN HA 5.000 . 5.500 4.414 4.375 4.540 . 0 0 "[ . 1 . 2]" 1
918 1 64 CYS HA 1 65 GLN QB 5.300 . 5.800 4.287 3.938 4.492 . 0 0 "[ . 1 . 2]" 1
919 1 64 CYS HA 1 66 VAL H 4.400 . 4.900 4.005 3.876 4.262 . 0 0 "[ . 1 . 2]" 1
920 1 64 CYS QB 1 66 VAL H 4.940 . 5.440 3.307 3.121 3.582 . 0 0 "[ . 1 . 2]" 1
921 1 64 CYS QB 1 70 ALA MB 5.110 . 5.610 2.429 2.147 3.150 . 0 0 "[ . 1 . 2]" 1
922 1 65 GLN H 1 66 VAL H 4.150 . 4.650 2.483 1.997 2.593 . 0 0 "[ . 1 . 2]" 1
923 1 65 GLN HA 1 65 GLN QE 5.400 . 5.900 3.967 2.543 4.822 . 0 0 "[ . 1 . 2]" 1
924 1 65 GLN HA 1 66 VAL MG2 5.990 . 6.490 4.978 4.891 5.014 . 0 0 "[ . 1 . 2]" 1
925 1 66 VAL H 1 66 VAL MG2 3.750 . 4.250 2.533 2.416 2.647 . 0 0 "[ . 1 . 2]" 1
926 1 66 VAL H 1 67 ALA H 4.710 . 5.210 4.379 4.255 4.481 . 0 0 "[ . 1 . 2]" 1
927 1 66 VAL H 1 69 CYS HB2 4.640 . 5.140 4.655 4.641 4.667 . 0 0 "[ . 1 . 2]" 1
928 1 66 VAL H 1 69 CYS HB3 4.680 . 5.180 3.671 3.573 3.896 . 0 0 "[ . 1 . 2]" 1
929 1 66 VAL HA 1 67 ALA H 3.000 . 3.500 2.117 2.091 2.144 . 0 0 "[ . 1 . 2]" 1
930 1 66 VAL HA 1 67 ALA MB 6.000 . 6.500 3.927 3.893 3.955 . 0 0 "[ . 1 . 2]" 1
931 1 66 VAL HB 1 67 ALA H 4.470 . 4.970 4.475 4.429 4.499 . 0 0 "[ . 1 . 2]" 1
932 1 66 VAL HB 1 69 CYS H 4.180 . 4.680 3.364 3.145 3.526 . 0 0 "[ . 1 . 2]" 1
933 1 66 VAL HB 1 69 CYS HB3 4.400 . 4.900 2.397 2.320 2.523 . 0 0 "[ . 1 . 2]" 1
934 1 66 VAL HB 1 70 ALA H 4.490 . 4.990 4.405 4.243 4.559 . 0 0 "[ . 1 . 2]" 1
935 1 66 VAL MG1 1 67 ALA H 4.220 . 4.720 3.124 2.977 3.271 . 0 0 "[ . 1 . 2]" 1
936 1 66 VAL MG1 1 67 ALA HA 5.740 . 6.240 4.546 4.481 4.622 . 0 0 "[ . 1 . 2]" 1
937 1 66 VAL MG1 1 67 ALA MB 5.960 . 6.460 3.894 3.708 4.046 . 0 0 "[ . 1 . 2]" 1
938 1 66 VAL MG1 1 69 CYS H 4.860 . 5.360 2.001 1.924 2.143 . 0 0 "[ . 1 . 2]" 1
939 1 66 VAL MG1 1 69 CYS HA 5.780 . 6.280 3.853 3.680 4.005 . 0 0 "[ . 1 . 2]" 1
940 1 66 VAL MG1 1 69 CYS HB2 4.650 . 5.150 2.497 2.371 2.617 . 0 0 "[ . 1 . 2]" 1
941 1 66 VAL MG1 1 69 CYS HB3 4.780 . 5.280 2.926 2.729 3.081 . 0 0 "[ . 1 . 2]" 1
942 1 66 VAL MG2 1 67 ALA H 4.950 . 5.450 4.011 3.900 4.124 . 0 0 "[ . 1 . 2]" 1
943 1 66 VAL MG2 1 69 CYS HB2 4.960 . 5.460 3.802 3.635 3.909 . 0 0 "[ . 1 . 2]" 1
944 1 66 VAL MG2 1 69 CYS HB3 5.380 . 5.880 4.087 4.022 4.199 . 0 0 "[ . 1 . 2]" 1
945 1 67 ALA H 1 68 HIS H 4.350 . 4.850 3.078 2.965 3.182 . 0 0 "[ . 1 . 2]" 1
946 1 67 ALA HA 1 69 CYS H 4.500 . 5.000 4.459 4.256 4.541 . 0 0 "[ . 1 . 2]" 1
947 1 67 ALA HA 2 21 PRO QB 5.500 . 6.000 4.892 4.769 4.912 . 0 0 "[ . 1 . 2]" 1
948 1 67 ALA HA 2 21 PRO QG 6.170 . 6.670 4.009 3.918 4.090 . 0 0 "[ . 1 . 2]" 1
949 1 67 ALA MB 1 68 HIS H 4.200 . 4.700 2.673 2.545 2.863 . 0 0 "[ . 1 . 2]" 1
950 1 67 ALA MB 1 68 HIS HA 5.880 . 6.380 4.005 3.949 4.074 . 0 0 "[ . 1 . 2]" 1
951 1 67 ALA MB 1 68 HIS HD2 4.380 . 4.880 3.610 3.475 3.658 . 0 0 "[ . 1 . 2]" 1
952 1 67 ALA MB 1 68 HIS HE1 6.510 . 7.010 4.824 4.647 4.975 . 0 0 "[ . 1 . 2]" 1
953 1 67 ALA MB 2 21 PRO HA 6.000 . 6.500 4.540 4.315 4.792 . 0 0 "[ . 1 . 2]" 1
954 1 67 ALA MB 2 21 PRO QB 6.410 . 6.500 2.579 2.462 2.647 . 0 0 "[ . 1 . 2]" 1
955 1 67 ALA MB 2 21 PRO QG 7.410 . 7.910 2.220 2.051 2.411 . 0 0 "[ . 1 . 2]" 1
956 1 68 HIS H 2 21 PRO QG 5.990 . 6.490 4.937 4.660 5.146 . 0 0 "[ . 1 . 2]" 1
957 1 68 HIS HA 1 68 HIS HD2 4.970 . 5.470 4.411 4.357 4.452 . 0 0 "[ . 1 . 2]" 1
958 1 68 HIS HB3 1 72 SER H 5.500 . 6.000 4.510 4.407 4.629 . 0 0 "[ . 1 . 2]" 1
959 1 68 HIS HD2 2 21 PRO QB 5.500 . 6.000 4.183 4.056 4.359 . 0 0 "[ . 1 . 2]" 1
960 1 68 HIS HD2 2 24 ILE MD 5.400 . 5.900 4.505 4.471 4.517 . 0 0 "[ . 1 . 2]" 1
961 1 68 HIS HE1 2 21 PRO HA 4.510 . 5.010 4.147 3.853 4.387 . 0 0 "[ . 1 . 2]" 1
962 1 68 HIS HE1 2 21 PRO QB 4.260 . 4.760 2.566 2.451 2.761 . 0 0 "[ . 1 . 2]" 1
963 1 68 HIS HE1 2 21 PRO QD 5.500 . 6.000 4.866 4.753 4.925 . 0 0 "[ . 1 . 2]" 1
964 1 68 HIS HE1 2 21 PRO QG 5.000 . 5.500 4.011 3.255 4.485 . 0 0 "[ . 1 . 2]" 1
965 1 68 HIS HE1 2 22 MET HA 4.500 . 5.000 2.598 2.408 2.879 . 0 0 "[ . 1 . 2]" 1
966 1 68 HIS HE1 2 22 MET QB 6.170 . 6.670 4.445 4.221 4.756 . 0 0 "[ . 1 . 2]" 1
967 1 68 HIS HE1 2 24 ILE MD 4.640 . 5.140 3.618 3.329 3.871 . 0 0 "[ . 1 . 2]" 1
968 1 68 HIS HE1 2 24 ILE QG 5.000 . 5.500 3.448 3.266 3.625 . 0 0 "[ . 1 . 2]" 1
969 1 68 HIS HE1 2 24 ILE MG 5.870 . 6.370 4.694 4.455 4.894 . 0 0 "[ . 1 . 2]" 1
970 1 68 HIS HE1 2 25 PHE QD 5.610 . 6.110 4.345 4.179 4.541 . 0 0 "[ . 1 . 2]" 1
971 1 68 HIS HE1 2 25 PHE QE 6.170 . 6.670 2.683 2.599 2.784 . 0 0 "[ . 1 . 2]" 1
972 1 69 CYS H 1 70 ALA H 3.500 . 4.000 3.029 2.827 3.189 . 0 0 "[ . 1 . 2]" 1
973 1 69 CYS H 1 70 ALA MB 5.660 . 6.160 4.583 4.371 4.721 . 0 0 "[ . 1 . 2]" 1
974 1 69 CYS H 1 71 SER H 4.600 . 5.100 4.158 3.942 4.382 . 0 0 "[ . 1 . 2]" 1
975 1 69 CYS HA 1 72 SER HB2 4.400 . 4.900 2.941 2.890 3.021 . 0 0 "[ . 1 . 2]" 1
976 1 69 CYS HA 1 72 SER HB3 4.500 . 5.000 4.542 4.510 4.585 . 0 0 "[ . 1 . 2]" 1
977 1 69 CYS HA 1 73 ARG H 5.160 . 5.660 4.007 3.834 4.145 . 0 0 "[ . 1 . 2]" 1
978 1 69 CYS HB2 1 70 ALA H 4.000 . 4.500 3.701 3.665 3.770 . 0 0 "[ . 1 . 2]" 1
979 1 69 CYS HB3 1 70 ALA H 3.040 . 3.540 2.211 2.154 2.313 . 0 0 "[ . 1 . 2]" 1
980 1 69 CYS HB3 1 70 ALA MB 5.430 . 5.930 3.839 3.788 3.923 . 0 0 "[ . 1 . 2]" 1
981 1 70 ALA H 1 71 SER H 3.480 . 3.980 2.901 2.778 2.982 . 0 0 "[ . 1 . 2]" 1
982 1 70 ALA HA 1 73 ARG H 4.230 . 4.730 3.664 3.492 3.811 . 0 0 "[ . 1 . 2]" 1
983 1 70 ALA HA 1 73 ARG QB 4.110 . 4.530 2.572 2.477 2.660 . 0 0 "[ . 1 . 2]" 1
984 1 70 ALA MB 1 71 SER H 4.130 . 4.630 2.701 2.596 2.826 . 0 0 "[ . 1 . 2]" 1
985 1 70 ALA MB 1 71 SER HA 6.000 . 6.500 3.965 3.922 4.038 . 0 0 "[ . 1 . 2]" 1
986 1 70 ALA MB 1 71 SER QB 6.390 . 6.890 4.336 3.937 4.521 . 0 0 "[ . 1 . 2]" 1
987 1 70 ALA MB 1 72 SER H 6.290 . 6.790 4.802 4.700 4.927 . 0 0 "[ . 1 . 2]" 1
988 1 70 ALA MB 1 73 ARG QB 5.240 . 5.740 3.932 3.912 3.968 . 0 0 "[ . 1 . 2]" 1
989 1 70 ALA MB 2 17 LEU MD2 7.930 . 8.430 4.489 4.408 4.555 . 0 0 "[ . 1 . 2]" 1
990 1 71 SER H 1 72 SER H 3.870 . 4.370 2.723 2.676 2.776 . 0 0 "[ . 1 . 2]" 1
991 1 71 SER H 1 73 ARG QB 5.480 . 5.980 4.761 4.583 4.906 . 0 0 "[ . 1 . 2]" 1
992 1 71 SER H 2 17 LEU MD2 5.080 . 5.580 4.237 4.190 4.250 . 0 0 "[ . 1 . 2]" 1
993 1 71 SER HA 2 17 LEU HA 5.000 . 5.500 4.235 4.027 4.374 . 0 0 "[ . 1 . 2]" 1
994 1 71 SER HA 2 17 LEU QB 6.170 . 6.670 4.061 3.884 4.281 . 0 0 "[ . 1 . 2]" 1
995 1 71 SER HA 2 17 LEU MD1 4.140 . 4.640 3.450 3.359 3.471 . 0 0 "[ . 1 . 2]" 1
996 1 71 SER HA 2 17 LEU MD2 4.200 . 4.700 1.933 1.914 1.968 . 0 0 "[ . 1 . 2]" 1
997 1 71 SER HA 2 22 MET ME 5.380 . 5.880 4.359 4.228 4.484 . 0 0 "[ . 1 . 2]" 1
998 1 71 SER QB 1 72 SER H . . 3.930 2.777 2.423 3.149 . 0 0 "[ . 1 . 2]" 1
999 1 71 SER QB 2 17 LEU HA 5.500 . 5.500 4.239 3.889 4.478 . 0 0 "[ . 1 . 2]" 1
1000 1 71 SER QB 2 17 LEU QB 6.930 . 7.430 3.158 2.925 3.973 . 0 0 "[ . 1 . 2]" 1
1001 1 71 SER QB 2 17 LEU MD1 5.340 . 5.840 2.877 2.675 3.974 . 0 0 "[ . 1 . 2]" 1
1002 1 71 SER QB 2 17 LEU MD2 4.200 . 4.700 2.548 2.381 2.968 . 0 0 "[ . 1 . 2]" 1
1003 1 71 SER QB 2 22 MET ME 4.560 . 5.060 2.413 2.220 3.411 . 0 0 "[ . 1 . 2]" 1
1004 1 72 SER H 1 72 SER HG 3.640 . 4.140 2.201 2.113 2.262 . 0 0 "[ . 1 . 2]" 1
1005 1 72 SER H 1 73 ARG H 3.420 . 3.920 2.825 2.713 2.939 . 0 0 "[ . 1 . 2]" 1
1006 1 72 SER H 1 75 ILE HB 4.660 . 5.160 4.676 4.580 4.729 . 0 0 "[ . 1 . 2]" 1
1007 1 72 SER HA 1 75 ILE HB 3.940 . 4.440 2.883 2.721 3.016 . 0 0 "[ . 1 . 2]" 1
1008 1 72 SER HA 1 75 ILE MD 4.480 . 4.980 3.736 3.627 3.798 . 0 0 "[ . 1 . 2]" 1
1009 1 72 SER HA 1 75 ILE MG 5.000 . 5.500 2.062 2.001 2.145 . 0 0 "[ . 1 . 2]" 1
1010 1 72 SER HA 1 76 ILE H 4.130 . 4.630 3.733 3.598 3.824 . 0 0 "[ . 1 . 2]" 1
1011 1 72 SER HA 1 76 ILE MD 5.030 . 5.530 3.903 3.660 4.271 . 0 0 "[ . 1 . 2]" 1
1012 1 72 SER HA 2 17 LEU MD1 6.610 . 7.110 4.533 4.382 4.677 . 0 0 "[ . 1 . 2]" 1
1013 1 72 SER HA 2 17 LEU MD2 6.000 . 6.500 5.021 5.008 5.043 . 0 0 "[ . 1 . 2]" 1
1014 1 72 SER HB2 1 73 ARG H 3.880 . 4.380 2.469 2.386 2.587 . 0 0 "[ . 1 . 2]" 1
1015 1 72 SER HB2 1 76 ILE MD 5.420 . 5.920 3.952 3.625 4.152 . 0 0 "[ . 1 . 2]" 1
1016 1 72 SER HB3 1 73 ARG H 4.170 . 4.670 3.474 3.416 3.538 . 0 0 "[ . 1 . 2]" 1
1017 1 72 SER HB3 1 75 ILE MG 4.770 . 5.270 3.515 3.386 3.627 . 0 0 "[ . 1 . 2]" 1
1018 1 72 SER HB3 1 76 ILE MD 4.970 . 5.470 2.807 2.470 3.143 . 0 0 "[ . 1 . 2]" 1
1019 1 72 SER HG 1 73 ARG H 5.020 . 5.520 4.096 4.008 4.223 . 0 0 "[ . 1 . 2]" 1
1020 1 73 ARG H 1 74 GLN H 3.790 . 4.290 2.895 2.803 2.961 . 0 0 "[ . 1 . 2]" 1
1021 1 73 ARG H 1 76 ILE MD 5.180 . 5.680 4.197 3.933 4.358 . 0 0 "[ . 1 . 2]" 1
1022 1 73 ARG HA 1 75 ILE H 5.370 . 5.870 4.814 4.660 4.917 . 0 0 "[ . 1 . 2]" 1
1023 1 73 ARG HA 1 76 ILE HB 3.940 . 4.440 3.560 3.356 3.680 . 0 0 "[ . 1 . 2]" 1
1024 1 73 ARG HA 1 76 ILE MD 4.120 . 4.620 2.991 2.722 3.323 . 0 0 "[ . 1 . 2]" 1
1025 1 73 ARG HA 1 76 ILE MG 5.430 . 5.930 4.516 4.262 4.594 . 0 0 "[ . 1 . 2]" 1
1026 1 73 ARG HA 1 77 SER H 4.880 . 5.380 4.776 4.425 4.938 . 0 0 "[ . 1 . 2]" 1
1027 1 73 ARG QD 1 74 GLN H 5.990 . 6.490 5.296 4.759 5.407 . 0 0 "[ . 1 . 2]" 1
1028 1 73 ARG QD 2 54 SER HA 6.170 . 6.670 5.209 4.304 5.685 . 0 0 "[ . 1 . 2]" 1
1029 1 74 GLN H 1 75 ILE H 3.490 . 3.990 2.527 2.366 2.712 . 0 0 "[ . 1 . 2]" 1
1030 1 74 GLN HA 1 74 GLN QE 4.790 . 5.290 3.937 3.771 4.102 . 0 0 "[ . 1 . 2]" 1
1031 1 74 GLN HA 1 77 SER QB 3.770 . 4.270 3.027 2.550 3.361 . 0 0 "[ . 1 . 2]" 1
1032 1 74 GLN HA 2 17 LEU MD1 6.000 . 6.500 4.999 4.927 5.027 . 0 0 "[ . 1 . 2]" 1
1033 1 74 GLN HA 2 17 LEU MD2 5.400 . 5.900 4.527 4.506 4.550 . 0 0 "[ . 1 . 2]" 1
1034 1 74 GLN QB 1 75 ILE H 3.960 . 4.460 2.838 2.661 2.909 . 0 0 "[ . 1 . 2]" 1
1035 1 74 GLN QB 2 14 LEU HA 6.170 . 6.670 5.477 5.139 5.536 . 0 0 "[ . 1 . 2]" 1
1036 1 74 GLN QB 2 14 LEU MD2 6.150 . 6.650 4.379 4.216 4.492 . 0 0 "[ . 1 . 2]" 1
1037 1 74 GLN QB 2 17 LEU HA 5.610 . 6.110 5.065 5.045 5.103 . 0 0 "[ . 1 . 2]" 1
1038 1 74 GLN QB 2 17 LEU MD1 5.640 . 6.140 3.301 3.135 3.366 . 0 0 "[ . 1 . 2]" 1
1039 1 74 GLN QB 2 17 LEU MD2 4.360 . 4.860 2.010 1.962 2.032 . 0 0 "[ . 1 . 2]" 1
1040 1 74 GLN QB 2 17 LEU HG 5.610 . 6.110 4.073 3.912 4.225 . 0 0 "[ . 1 . 2]" 1
1041 1 74 GLN QE 2 13 ASP QB 5.280 . 5.780 2.172 2.068 2.331 . 0 0 "[ . 1 . 2]" 1
1042 1 74 GLN QE 2 14 LEU HA . . 4.370 3.349 3.085 3.453 . 0 0 "[ . 1 . 2]" 1
1043 1 74 GLN QE 2 14 LEU HB3 5.500 . 6.000 4.927 4.846 4.957 . 0 0 "[ . 1 . 2]" 1
1044 1 74 GLN QE 2 14 LEU MD2 6.460 . 6.960 1.859 1.721 2.079 0.079 17 0 "[ . 1 . 2]" 1
1045 1 74 GLN QG 1 75 ILE HA 5.990 . 6.490 3.416 3.332 3.586 . 0 0 "[ . 1 . 2]" 1
1046 1 74 GLN QG 1 78 HIS QB 6.530 . 7.030 4.562 4.234 4.849 . 0 0 "[ . 1 . 2]" 1
1047 1 74 GLN QG 2 13 ASP HA 6.170 . 6.670 4.847 4.602 5.125 . 0 0 "[ . 1 . 2]" 1
1048 1 74 GLN QG 2 14 LEU HA 5.610 . 6.110 3.558 3.253 3.642 . 0 0 "[ . 1 . 2]" 1
1049 1 74 GLN QG 2 14 LEU MD1 7.410 . 7.910 5.086 4.960 5.251 . 0 0 "[ . 1 . 2]" 1
1050 1 74 GLN QG 2 14 LEU MD2 5.840 . 6.340 2.702 2.554 2.869 . 0 0 "[ . 1 . 2]" 1
1051 1 74 GLN QG 2 17 LEU HA 5.610 . 6.110 4.546 4.461 4.651 . 0 0 "[ . 1 . 2]" 1
1052 1 74 GLN QG 2 17 LEU MD1 6.070 . 6.570 2.385 2.301 2.464 . 0 0 "[ . 1 . 2]" 1
1053 1 74 GLN QG 2 17 LEU MD2 4.720 . 5.220 2.202 2.126 2.318 . 0 0 "[ . 1 . 2]" 1
1054 1 74 GLN QG 2 17 LEU HG 5.050 . 5.550 2.763 2.601 2.906 . 0 0 "[ . 1 . 2]" 1
1055 1 75 ILE H 1 75 ILE QG 4.210 . 4.710 3.704 3.632 3.738 . 0 0 "[ . 1 . 2]" 1
1056 1 75 ILE H 2 17 LEU MD1 6.000 . 6.500 2.952 2.857 3.120 . 0 0 "[ . 1 . 2]" 1
1057 1 75 ILE HA 1 78 HIS QB 5.080 . 5.580 3.310 3.159 3.400 . 0 0 "[ . 1 . 2]" 1
1058 1 75 ILE HA 2 14 LEU HA 5.000 . 5.500 4.996 4.825 5.038 . 0 0 "[ . 1 . 2]" 1
1059 1 75 ILE HA 2 14 LEU MD1 6.000 . 6.500 3.840 3.744 3.911 . 0 0 "[ . 1 . 2]" 1
1060 1 75 ILE HA 2 14 LEU MD2 4.800 . 5.300 2.294 2.241 2.335 . 0 0 "[ . 1 . 2]" 1
1061 1 75 ILE HA 2 14 LEU HG 5.000 . 5.500 4.980 4.912 5.029 . 0 0 "[ . 1 . 2]" 1
1062 1 75 ILE HA 2 17 LEU MD1 4.860 . 5.360 2.709 2.597 2.911 . 0 0 "[ . 1 . 2]" 1
1063 1 75 ILE HA 2 17 LEU MD2 6.390 . 6.890 4.321 4.218 4.441 . 0 0 "[ . 1 . 2]" 1
1064 1 75 ILE HA 2 17 LEU HG 5.500 . 6.000 5.001 4.908 5.263 . 0 0 "[ . 1 . 2]" 1
1065 1 75 ILE HB 2 14 LEU MD1 6.610 . 7.110 5.329 5.258 5.410 . 0 0 "[ . 1 . 2]" 1
1066 1 75 ILE HB 2 17 LEU MD1 6.000 . 6.500 2.468 2.336 2.677 . 0 0 "[ . 1 . 2]" 1
1067 1 75 ILE HB 2 22 MET ME 6.000 . 6.500 4.199 4.083 4.347 . 0 0 "[ . 1 . 2]" 1
1068 1 75 ILE MD 2 14 LEU HA 6.610 . 7.110 5.454 5.348 5.517 . 0 0 "[ . 1 . 2]" 1
1069 1 75 ILE MD 2 14 LEU MD1 7.210 . 7.710 3.854 3.689 4.053 . 0 0 "[ . 1 . 2]" 1
1070 1 75 ILE MD 2 17 LEU QB 7.200 . 7.700 3.867 3.810 3.954 . 0 0 "[ . 1 . 2]" 1
1071 1 75 ILE MD 2 22 MET ME 5.050 . 5.550 2.510 2.316 2.663 . 0 0 "[ . 1 . 2]" 1
1072 1 75 ILE QG 2 14 LEU MD2 6.740 . 7.240 2.242 2.164 2.333 . 0 0 "[ . 1 . 2]" 1
1073 1 75 ILE MG 2 14 LEU MD1 7.210 . 7.710 5.016 4.956 5.033 . 0 0 "[ . 1 . 2]" 1
1074 1 75 ILE MG 2 22 MET ME 6.490 . 6.990 4.470 4.281 4.521 . 0 0 "[ . 1 . 2]" 1
1075 1 76 ILE H 1 76 ILE MD 4.000 . 4.500 3.248 3.045 3.364 . 0 0 "[ . 1 . 2]" 1
1076 1 76 ILE H 1 76 ILE QG 3.940 . 4.180 2.342 2.242 2.542 . 0 0 "[ . 1 . 2]" 1
1077 1 76 ILE H 1 77 SER H 3.280 . 3.780 2.797 2.620 3.008 . 0 0 "[ . 1 . 2]" 1
1078 1 76 ILE H 1 78 HIS H 5.250 . 5.750 4.283 4.180 4.396 . 0 0 "[ . 1 . 2]" 1
1079 1 76 ILE HA 1 79 TRP H 3.990 . 4.490 3.944 3.756 4.071 . 0 0 "[ . 1 . 2]" 1
1080 1 76 ILE HA 1 79 TRP QB 4.110 . 4.610 3.383 3.002 3.681 . 0 0 "[ . 1 . 2]" 1
1081 1 76 ILE HB 1 77 SER H 3.550 . 4.050 2.544 2.341 2.647 . 0 0 "[ . 1 . 2]" 1
1082 1 76 ILE MD 1 77 SER H 5.280 . 5.780 4.423 4.210 4.472 . 0 0 "[ . 1 . 2]" 1
1083 1 76 ILE MD 2 47 THR MG 7.930 . 8.430 5.148 4.039 5.664 . 0 0 "[ . 1 . 2]" 1
1084 1 76 ILE MD 2 48 VAL HB 6.000 . 6.500 3.315 2.189 5.092 . 0 0 "[ . 1 . 2]" 1
1085 1 76 ILE MD 2 52 TYR QB 6.000 . 6.500 4.387 4.124 4.537 . 0 0 "[ . 1 . 2]" 1
1086 1 76 ILE MD 2 52 TYR QD 7.410 . 7.910 4.077 3.112 4.633 . 0 0 "[ . 1 . 2]" 1
1087 1 76 ILE MD 2 52 TYR QE 7.410 . 7.910 4.497 2.170 5.490 . 0 0 "[ . 1 . 2]" 1
1088 1 76 ILE QG 1 77 SER H 5.020 . 5.520 4.214 4.155 4.299 . 0 0 "[ . 1 . 2]" 1
1089 1 76 ILE MG 1 77 SER H 4.590 . 5.090 3.048 2.842 3.227 . 0 0 "[ . 1 . 2]" 1
1090 1 76 ILE MG 1 77 SER HA 4.730 . 5.230 3.259 2.998 3.434 . 0 0 "[ . 1 . 2]" 1
1091 1 76 ILE MG 1 80 LYS QE 5.160 . 5.660 2.501 1.939 3.702 . 0 0 "[ . 1 . 2]" 1
1092 1 76 ILE MG 1 80 LYS QG 4.650 . 5.150 2.526 2.034 2.988 . 0 0 "[ . 1 . 2]" 1
1093 1 76 ILE MG 2 47 THR MG 7.930 . 8.430 3.580 2.064 5.467 . 0 0 "[ . 1 . 2]" 1
1094 1 76 ILE MG 2 48 VAL HA 6.000 . 6.500 4.637 2.105 5.131 . 0 0 "[ . 1 . 2]" 1
1095 1 76 ILE MG 2 48 VAL HB 5.400 . 5.900 3.118 2.112 4.521 . 0 0 "[ . 1 . 2]" 1
1096 1 76 ILE MG 2 49 ASP HA 6.610 . 7.110 4.875 3.679 5.689 . 0 0 "[ . 1 . 2]" 1
1097 1 76 ILE MG 2 52 TYR QB 6.610 . 7.110 4.786 4.445 4.945 . 0 0 "[ . 1 . 2]" 1
1098 1 76 ILE MG 2 52 TYR QD 7.410 . 7.910 5.175 4.036 5.576 . 0 0 "[ . 1 . 2]" 1
1099 1 77 SER H 1 78 HIS H 3.520 . 4.020 2.975 2.902 3.046 . 0 0 "[ . 1 . 2]" 1
1100 1 77 SER HA 1 80 LYS H 4.150 . 4.650 3.546 3.360 3.753 . 0 0 "[ . 1 . 2]" 1
1101 1 77 SER HA 1 80 LYS QB 4.010 . 4.510 2.381 2.210 2.603 . 0 0 "[ . 1 . 2]" 1
1102 1 77 SER HA 1 80 LYS QG 3.770 . 4.270 3.225 2.751 3.432 . 0 0 "[ . 1 . 2]" 1
1103 1 77 SER HA 1 81 ASN H 5.000 . 5.500 4.920 4.740 5.015 . 0 0 "[ . 1 . 2]" 1
1104 1 77 SER HA 1 81 ASN QD 4.990 . 5.490 3.289 2.917 4.281 . 0 0 "[ . 1 . 2]" 1
1105 1 77 SER QB 1 80 LYS QB 5.430 . 5.930 4.068 3.887 4.329 . 0 0 "[ . 1 . 2]" 1
1106 1 78 HIS H 1 78 HIS HD2 5.000 . 5.500 5.010 4.952 5.052 . 0 0 "[ . 1 . 2]" 1
1107 1 78 HIS H 1 79 TRP H 3.470 . 3.970 2.779 2.691 2.888 . 0 0 "[ . 1 . 2]" 1
1108 1 78 HIS H 2 14 LEU MD1 6.610 . 7.110 4.882 4.759 5.005 . 0 0 "[ . 1 . 2]" 1
1109 1 78 HIS H 2 14 LEU MD2 5.540 . 6.040 3.694 3.628 3.791 . 0 0 "[ . 1 . 2]" 1
1110 1 78 HIS HA 1 81 ASN H 4.760 . 5.260 3.907 3.767 4.113 . 0 0 "[ . 1 . 2]" 1
1111 1 78 HIS HA 1 81 ASN QB 4.330 . 4.830 3.615 3.380 3.961 . 0 0 "[ . 1 . 2]" 1
1112 1 78 HIS HA 1 81 ASN QD 5.990 . 6.490 3.756 2.027 4.189 . 0 0 "[ . 1 . 2]" 1
1113 1 78 HIS HA 2 13 ASP QB 6.170 . 6.670 5.516 5.476 5.539 . 0 0 "[ . 1 . 2]" 1
1114 1 78 HIS HA 2 14 LEU MD1 6.000 . 6.500 4.920 4.810 5.014 . 0 0 "[ . 1 . 2]" 1
1115 1 78 HIS HA 2 14 LEU MD2 5.400 . 5.900 4.369 4.310 4.401 . 0 0 "[ . 1 . 2]" 1
1116 1 78 HIS HA 2 14 LEU HG 5.200 . 5.700 5.253 5.231 5.281 . 0 0 "[ . 1 . 2]" 1
1117 1 78 HIS QB 1 79 TRP H 4.610 . 5.110 2.316 2.145 2.437 . 0 0 "[ . 1 . 2]" 1
1118 1 78 HIS QB 2 14 LEU H 5.990 . 6.490 5.331 5.197 5.372 . 0 0 "[ . 1 . 2]" 1
1119 1 78 HIS HB2 2 14 LEU MD1 6.000 . 6.500 3.198 3.014 3.315 . 0 0 "[ . 1 . 2]" 1
1120 1 78 HIS HB2 2 14 LEU MD2 4.900 . 5.400 2.185 2.145 2.230 . 0 0 "[ . 1 . 2]" 1
1121 1 78 HIS HB2 2 14 LEU HG 5.000 . 5.500 3.313 3.267 3.359 . 0 0 "[ . 1 . 2]" 1
1122 1 78 HIS HB3 2 14 LEU MD1 6.610 . 7.110 2.833 2.742 3.074 . 0 0 "[ . 1 . 2]" 1
1123 1 78 HIS HB3 2 14 LEU MD2 4.900 . 5.400 2.658 2.482 2.854 . 0 0 "[ . 1 . 2]" 1
1124 1 78 HIS HB3 2 14 LEU HG 5.000 . 5.500 4.114 3.986 4.285 . 0 0 "[ . 1 . 2]" 1
1125 1 78 HIS HD2 1 79 TRP H 4.390 . 4.890 3.396 3.072 3.622 . 0 0 "[ . 1 . 2]" 1
1126 1 78 HIS HD2 1 79 TRP HA 3.990 . 4.490 2.985 2.672 3.211 . 0 0 "[ . 1 . 2]" 1
1127 1 78 HIS HD2 1 89 VAL MG1 5.500 . 6.000 4.178 3.785 4.504 . 0 0 "[ . 1 . 2]" 1
1128 1 78 HIS HD2 2 11 PRO QG 6.170 . 6.670 4.565 4.392 4.816 . 0 0 "[ . 1 . 2]" 1
1129 1 78 HIS HD2 2 14 LEU MD1 5.400 . 5.900 3.516 3.254 3.824 . 0 0 "[ . 1 . 2]" 1
1130 1 78 HIS HD2 2 14 LEU MD2 6.030 . 6.530 4.670 4.481 4.917 . 0 0 "[ . 1 . 2]" 1
1131 1 78 HIS HD2 2 14 LEU HG 5.500 . 6.000 5.092 4.875 5.340 . 0 0 "[ . 1 . 2]" 1
1132 1 78 HIS HE1 2 11 PRO HA 4.280 . 4.780 4.301 4.257 4.320 . 0 0 "[ . 1 . 2]" 1
1133 1 78 HIS HE1 2 11 PRO QB 4.620 . 5.120 2.033 2.000 2.063 . 0 0 "[ . 1 . 2]" 1
1134 1 78 HIS HE1 2 11 PRO QD 5.370 . 5.870 4.218 4.106 4.351 . 0 0 "[ . 1 . 2]" 1
1135 1 78 HIS HE1 2 11 PRO QG 4.160 . 4.480 2.698 2.560 2.859 . 0 0 "[ . 1 . 2]" 1
1136 1 78 HIS HE1 2 13 ASP QB 6.170 . 6.670 5.407 5.261 5.509 . 0 0 "[ . 1 . 2]" 1
1137 1 78 HIS HE1 2 14 LEU MD1 4.800 . 5.300 4.024 4.005 4.054 . 0 0 "[ . 1 . 2]" 1
1138 1 78 HIS HE1 2 14 LEU MD2 6.000 . 6.500 5.016 5.002 5.042 . 0 0 "[ . 1 . 2]" 1
1139 1 78 HIS HE1 2 14 LEU HG 5.000 . 5.500 3.882 3.830 3.930 . 0 0 "[ . 1 . 2]" 1
1140 1 79 TRP H 1 79 TRP HD1 4.690 . 5.190 4.641 4.199 4.762 . 0 0 "[ . 1 . 2]" 1
1141 1 79 TRP HA 1 79 TRP HE3 4.250 . 4.750 2.666 2.476 3.069 . 0 0 "[ . 1 . 2]" 1
1142 1 79 TRP HA 1 80 LYS HA 4.970 . 5.470 4.880 4.773 4.970 . 0 0 "[ . 1 . 2]" 1
1143 1 79 TRP HA 1 82 CYS H 4.800 . 5.300 3.551 3.366 3.675 . 0 0 "[ . 1 . 2]" 1
1144 1 79 TRP HA 1 82 CYS QB 4.680 . 5.180 3.124 2.778 3.281 . 0 0 "[ . 1 . 2]" 1
1145 1 79 TRP QB 1 80 LYS H 4.130 . 4.630 2.854 2.697 2.990 . 0 0 "[ . 1 . 2]" 1
1146 1 79 TRP HD1 1 80 LYS H 5.500 . 6.000 4.131 3.386 4.517 . 0 0 "[ . 1 . 2]" 1
1147 1 79 TRP HE1 1 93 LEU QD 5.200 . 5.700 3.898 3.860 3.916 . 0 0 "[ . 1 . 2]" 1
1148 1 79 TRP HE3 1 93 LEU QD 6.610 . 7.110 3.011 2.915 3.170 . 0 0 "[ . 1 . 2]" 1
1149 1 79 TRP HH2 1 93 LEU HA 5.380 . 5.880 4.848 4.632 5.086 . 0 0 "[ . 1 . 2]" 1
1150 1 79 TRP HH2 1 93 LEU QB 4.670 . 5.170 3.100 2.980 3.213 . 0 0 "[ . 1 . 2]" 1
1151 1 79 TRP HH2 1 93 LEU QD 5.550 . 6.050 4.136 4.064 4.159 . 0 0 "[ . 1 . 2]" 1
1152 1 79 TRP HH2 1 94 LYS HA 5.500 . 6.000 3.194 2.746 3.696 . 0 0 "[ . 1 . 2]" 1
1153 1 79 TRP HH2 1 94 LYS QG 5.000 . 5.500 3.658 3.173 4.105 . 0 0 "[ . 1 . 2]" 1
1154 1 79 TRP HH2 2 35 MET ME 4.910 . 5.410 3.492 2.888 4.096 . 0 0 "[ . 1 . 2]" 1
1155 1 79 TRP HH2 2 42 LEU QD 7.410 . 7.910 5.548 5.440 5.589 . 0 0 "[ . 1 . 2]" 1
1156 1 79 TRP HZ2 1 93 LEU QD 6.610 . 7.110 4.049 3.901 4.172 . 0 0 "[ . 1 . 2]" 1
1157 1 79 TRP HZ2 2 35 MET ME 4.760 . 5.260 3.432 2.869 3.976 . 0 0 "[ . 1 . 2]" 1
1158 1 79 TRP HZ2 2 40 PRO QB 6.170 . 6.670 4.050 3.795 4.569 . 0 0 "[ . 1 . 2]" 1
1159 1 79 TRP HZ2 2 40 PRO QG 6.170 . 6.670 5.582 5.318 5.650 . 0 0 "[ . 1 . 2]" 1
1160 1 79 TRP HZ2 2 42 LEU QD 6.740 . 7.240 4.427 3.922 5.132 . 0 0 "[ . 1 . 2]" 1
1161 1 79 TRP HZ2 2 43 ALA HA 5.500 . 6.000 4.556 2.042 5.174 . 0 0 "[ . 1 . 2]" 1
1162 1 79 TRP HZ2 2 43 ALA MB 6.610 . 7.110 3.098 2.047 4.379 . 0 0 "[ . 1 . 2]" 1
1163 1 79 TRP HZ2 2 46 ASN QB 6.170 . 6.670 5.345 4.142 5.637 . 0 0 "[ . 1 . 2]" 1
1164 1 79 TRP HZ3 1 93 LEU QB 5.500 . 6.000 2.687 2.532 2.868 . 0 0 "[ . 1 . 2]" 1
1165 1 79 TRP HZ3 1 93 LEU QD 5.260 . 5.760 3.665 3.587 3.776 . 0 0 "[ . 1 . 2]" 1
1166 1 79 TRP HZ3 2 35 MET ME 6.610 . 7.110 4.518 4.061 4.950 . 0 0 "[ . 1 . 2]" 1
1167 1 80 LYS H 1 80 LYS QG . . 3.880 2.511 2.133 2.827 . 0 0 "[ . 1 . 2]" 1
1168 1 80 LYS H 1 81 ASN H 3.360 . 3.860 2.824 2.777 2.882 . 0 0 "[ . 1 . 2]" 1
1169 1 80 LYS H 1 82 CYS H 4.920 . 5.420 4.461 4.387 4.548 . 0 0 "[ . 1 . 2]" 1
1170 1 80 LYS HA 1 80 LYS QD 4.220 . 4.720 3.155 2.280 3.814 . 0 0 "[ . 1 . 2]" 1
1171 1 80 LYS HA 1 80 LYS QE 5.140 . 5.640 4.240 3.652 4.649 . 0 0 "[ . 1 . 2]" 1
1172 1 80 LYS QB 1 81 ASN H 4.010 . 4.510 3.251 3.069 3.405 . 0 0 "[ . 1 . 2]" 1
1173 1 80 LYS QB 1 81 ASN HA 5.610 . 6.110 4.292 4.143 4.486 . 0 0 "[ . 1 . 2]" 1
1174 1 80 LYS QB 1 81 ASN QD 5.300 . 5.720 2.790 2.475 4.156 . 0 0 "[ . 1 . 2]" 1
1175 1 80 LYS QB 1 82 CYS H 6.170 . 6.670 5.107 4.932 5.239 . 0 0 "[ . 1 . 2]" 1
1176 1 80 LYS QD 2 49 ASP HA 6.170 . 6.670 4.664 2.743 5.579 . 0 0 "[ . 1 . 2]" 1
1177 1 80 LYS QE 2 49 ASP HA 5.610 . 6.110 3.880 2.694 5.034 . 0 0 "[ . 1 . 2]" 1
1178 1 80 LYS QG 1 81 ASN H 5.400 . 5.900 4.539 4.436 4.725 . 0 0 "[ . 1 . 2]" 1
1179 1 80 LYS QG 2 43 ALA HA 6.170 . 6.670 5.223 4.531 5.563 . 0 0 "[ . 1 . 2]" 1
1180 1 81 ASN H 1 82 CYS H 3.520 . 4.020 2.088 2.024 2.124 . 0 0 "[ . 1 . 2]" 1
1181 1 81 ASN H 1 82 CYS QB 5.990 . 6.490 3.812 3.723 3.868 . 0 0 "[ . 1 . 2]" 1
1182 1 81 ASN HA 1 83 THR MG 6.550 . 7.050 4.448 4.010 5.492 . 0 0 "[ . 1 . 2]" 1
1183 1 82 CYS HA 1 83 THR H 3.630 . 4.130 2.178 2.117 2.356 . 0 0 "[ . 1 . 2]" 1
1184 1 82 CYS HA 1 83 THR MG 6.020 . 6.520 3.725 3.172 4.067 . 0 0 "[ . 1 . 2]" 1
1185 1 84 ARG QB 1 86 ASP H 4.150 . 4.650 3.245 2.001 3.817 . 0 0 "[ . 1 . 2]" 1
1186 1 84 ARG QB 1 87 CYS H 4.410 . 4.910 3.061 2.427 3.522 . 0 0 "[ . 1 . 2]" 1
1187 1 84 ARG QB 1 87 CYS QB 4.600 . 4.850 2.169 2.002 3.532 . 0 0 "[ . 1 . 2]" 1
1188 1 84 ARG QD 1 87 CYS H 5.990 . 6.490 4.103 3.470 5.367 . 0 0 "[ . 1 . 2]" 1
1189 1 84 ARG QG 1 86 ASP H 4.430 . 4.930 2.777 1.890 4.037 . 0 0 "[ . 1 . 2]" 1
1190 1 84 ARG QG 1 87 CYS H 5.460 . 5.960 3.226 2.385 4.665 . 0 0 "[ . 1 . 2]" 1
1191 1 84 ARG QG 1 87 CYS QB 6.730 . 7.230 3.207 1.969 4.154 . 0 0 "[ . 1 . 2]" 1
1192 1 85 HIS HA 1 85 HIS HD2 4.770 . 5.270 4.386 4.337 4.613 . 0 0 "[ . 1 . 2]" 1
1193 1 85 HIS HA 1 91 LEU QD 5.800 . 6.300 4.185 3.928 4.309 . 0 0 "[ . 1 . 2]" 1
1194 1 85 HIS QB 1 86 ASP H 4.370 . 4.870 3.797 2.762 3.925 . 0 0 "[ . 1 . 2]" 1
1195 1 85 HIS QB 1 91 LEU QD 6.440 . 6.940 4.269 4.214 4.290 . 0 0 "[ . 1 . 2]" 1
1196 1 85 HIS HD2 1 86 ASP HA 5.340 . 5.840 3.999 3.677 4.616 . 0 0 "[ . 1 . 2]" 1
1197 1 85 HIS HD2 1 86 ASP HB2 5.390 . 5.890 4.347 4.149 5.399 . 0 0 "[ . 1 . 2]" 1
1198 1 85 HIS HD2 1 86 ASP QB 5.110 . 5.610 2.687 2.386 3.911 . 0 0 "[ . 1 . 2]" 1
1199 1 85 HIS HD2 1 86 ASP HB3 5.390 . 5.890 2.717 2.401 4.017 . 0 0 "[ . 1 . 2]" 1
1200 1 86 ASP H 1 87 CYS H 3.450 . 3.950 2.318 2.141 2.777 . 0 0 "[ . 1 . 2]" 1
1201 1 86 ASP H 1 87 CYS QB 4.990 . 5.490 3.863 3.632 4.370 . 0 0 "[ . 1 . 2]" 1
1202 1 86 ASP HA 1 91 LEU QB 5.990 . 6.490 3.330 3.024 4.337 . 0 0 "[ . 1 . 2]" 1
1203 1 86 ASP HA 1 91 LEU QD 4.550 . 5.050 2.646 2.287 2.879 . 0 0 "[ . 1 . 2]" 1
1204 1 86 ASP QB 1 91 LEU QD 5.690 . 6.190 3.689 3.288 3.776 . 0 0 "[ . 1 . 2]" 1
1205 1 86 ASP HB2 1 91 LEU QD 5.800 . 6.300 4.032 3.528 4.224 . 0 0 "[ . 1 . 2]" 1
1206 1 86 ASP HB3 1 91 LEU QD 5.800 . 6.300 4.284 3.927 4.352 . 0 0 "[ . 1 . 2]" 1
1207 1 87 CYS HA 1 88 PRO QD 3.940 . 4.440 2.098 2.023 2.157 . 0 0 "[ . 1 . 2]" 1
1208 1 87 CYS HA 1 89 VAL H 5.040 . 5.540 4.151 3.916 4.270 . 0 0 "[ . 1 . 2]" 1
1209 1 87 CYS QB 1 89 VAL H 4.680 . 5.180 4.002 3.591 4.207 . 0 0 "[ . 1 . 2]" 1
1210 1 87 CYS QB 1 90 CYS H 3.580 . 4.080 2.868 2.316 3.082 . 0 0 "[ . 1 . 2]" 1
1211 1 87 CYS QB 1 91 LEU H 4.680 . 5.180 3.092 2.726 3.525 . 0 0 "[ . 1 . 2]" 1
1212 1 88 PRO HA 1 91 LEU QB 4.200 . 4.700 3.573 3.130 3.836 . 0 0 "[ . 1 . 2]" 1
1213 1 88 PRO HA 2 7 GLU HA 5.500 . 6.000 5.476 4.980 5.567 . 0 0 "[ . 1 . 2]" 1
1214 1 88 PRO HA 2 8 PRO HA 5.500 . 6.000 5.602 5.516 5.648 . 0 0 "[ . 1 . 2]" 1
1215 1 88 PRO HA 2 8 PRO QB 5.610 . 6.110 2.891 2.658 3.071 . 0 0 "[ . 1 . 2]" 1
1216 1 88 PRO HA 2 8 PRO QD 5.610 . 6.110 2.922 2.770 3.104 . 0 0 "[ . 1 . 2]" 1
1217 1 88 PRO HA 2 8 PRO QG 5.610 . 6.110 2.684 2.456 3.005 . 0 0 "[ . 1 . 2]" 1
1218 1 88 PRO QB 1 89 VAL MG2 4.460 . 4.960 3.008 2.589 3.234 . 0 0 "[ . 1 . 2]" 1
1219 1 88 PRO QB 2 7 GLU HA 6.170 . 6.670 4.428 3.700 5.172 . 0 0 "[ . 1 . 2]" 1
1220 1 88 PRO QB 2 8 PRO HA 6.170 . 6.670 4.253 4.080 4.508 . 0 0 "[ . 1 . 2]" 1
1221 1 88 PRO QB 2 8 PRO QB 6.300 . 6.800 2.170 2.109 2.261 . 0 0 "[ . 1 . 2]" 1
1222 1 88 PRO QB 2 8 PRO QD 6.300 . 6.800 2.379 2.163 3.096 . 0 0 "[ . 1 . 2]" 1
1223 1 88 PRO QD 1 89 VAL H 5.200 . 5.700 2.877 2.696 3.209 . 0 0 "[ . 1 . 2]" 1
1224 1 88 PRO QD 2 8 PRO QB 6.930 . 7.430 2.238 2.040 2.983 . 0 0 "[ . 1 . 2]" 1
1225 1 88 PRO QD 2 8 PRO QG 5.670 . 6.170 3.721 3.499 4.083 . 0 0 "[ . 1 . 2]" 1
1226 1 88 PRO QD 2 11 PRO QB 6.930 . 7.430 4.233 3.771 4.513 . 0 0 "[ . 1 . 2]" 1
1227 1 88 PRO QD 2 11 PRO QD 6.930 . 7.430 2.439 2.165 2.851 . 0 0 "[ . 1 . 2]" 1
1228 1 89 VAL H 1 89 VAL MG2 4.550 . 5.050 2.608 2.326 3.194 . 0 0 "[ . 1 . 2]" 1
1229 1 89 VAL H 1 90 CYS H 3.150 . 3.650 2.603 2.176 2.833 . 0 0 "[ . 1 . 2]" 1
1230 1 89 VAL HA 1 92 PRO QG 4.610 . 5.110 4.166 4.064 4.211 . 0 0 "[ . 1 . 2]" 1
1231 1 89 VAL HA 2 14 LEU MD1 6.000 . 6.500 4.768 4.673 4.857 . 0 0 "[ . 1 . 2]" 1
1232 1 89 VAL HA 2 31 ILE MD 6.610 . 7.110 5.530 5.480 5.594 . 0 0 "[ . 1 . 2]" 1
1233 1 89 VAL HB 1 90 CYS H 3.070 . 3.570 2.800 2.590 3.078 . 0 0 "[ . 1 . 2]" 1
1234 1 89 VAL HB 2 10 LEU QD 5.400 . 5.900 4.041 3.712 4.078 . 0 0 "[ . 1 . 2]" 1
1235 1 89 VAL HB 2 10 LEU HG 5.480 . 5.980 5.208 4.873 5.599 . 0 0 "[ . 1 . 2]" 1
1236 1 89 VAL HB 2 14 LEU MD1 6.000 . 6.500 2.684 2.437 2.973 . 0 0 "[ . 1 . 2]" 1
1237 1 89 VAL QG 1 90 CYS H 5.390 . 5.890 3.121 2.987 3.333 . 0 0 "[ . 1 . 2]" 1
1238 1 89 VAL MG1 1 90 CYS HA 5.090 . 5.590 3.333 3.160 3.567 . 0 0 "[ . 1 . 2]" 1
1239 1 89 VAL MG1 1 92 PRO QD 6.080 . 6.580 4.543 4.504 4.562 . 0 0 "[ . 1 . 2]" 1
1240 1 89 VAL MG1 2 14 LEU HB3 6.610 . 7.110 4.076 3.851 4.509 . 0 0 "[ . 1 . 2]" 1
1241 1 89 VAL MG1 2 14 LEU MD1 5.930 . 6.430 2.013 1.975 2.045 . 0 0 "[ . 1 . 2]" 1
1242 1 89 VAL MG1 2 14 LEU HG 6.610 . 7.110 4.455 4.365 4.553 . 0 0 "[ . 1 . 2]" 1
1243 1 89 VAL MG2 2 10 LEU HA 5.270 . 5.770 3.197 3.068 3.682 . 0 0 "[ . 1 . 2]" 1
1244 1 89 VAL MG2 2 10 LEU QB 7.410 . 7.910 4.127 4.009 4.403 . 0 0 "[ . 1 . 2]" 1
1245 1 89 VAL MG2 2 10 LEU QD 6.480 . 6.980 2.269 1.834 2.501 . 0 0 "[ . 1 . 2]" 1
1246 1 89 VAL MG2 2 10 LEU HG 6.000 . 6.500 2.685 2.415 3.339 . 0 0 "[ . 1 . 2]" 1
1247 1 89 VAL MG2 2 11 PRO HA 6.610 . 7.110 5.544 5.508 5.595 . 0 0 "[ . 1 . 2]" 1
1248 1 89 VAL MG2 2 11 PRO QB 6.740 . 7.240 4.444 4.265 4.496 . 0 0 "[ . 1 . 2]" 1
1249 1 89 VAL MG2 2 11 PRO QD 4.830 . 5.330 2.184 2.103 2.359 . 0 0 "[ . 1 . 2]" 1
1250 1 89 VAL MG2 2 11 PRO QG 5.800 . 6.300 2.746 2.572 2.834 . 0 0 "[ . 1 . 2]" 1
1251 1 89 VAL MG2 2 14 LEU MD1 5.250 . 5.750 2.295 2.052 2.534 . 0 0 "[ . 1 . 2]" 1
1252 1 90 CYS H 1 91 LEU H 3.820 . 4.320 2.858 2.723 2.920 . 0 0 "[ . 1 . 2]" 1
1253 1 90 CYS H 1 91 LEU QB 5.340 . 5.840 4.609 4.478 4.678 . 0 0 "[ . 1 . 2]" 1
1254 1 90 CYS HA 1 93 LEU QB 5.050 . 5.550 2.840 2.722 2.937 . 0 0 "[ . 1 . 2]" 1
1255 1 90 CYS HA 1 93 LEU QD 4.310 . 4.810 2.454 2.355 2.556 . 0 0 "[ . 1 . 2]" 1
1256 1 90 CYS HB2 1 91 LEU H 4.430 . 4.930 2.912 2.819 3.144 . 0 0 "[ . 1 . 2]" 1
1257 1 90 CYS HB3 1 91 LEU H 4.860 . 5.360 3.888 3.710 4.104 . 0 0 "[ . 1 . 2]" 1
1258 1 91 LEU H 1 92 PRO QD 4.120 . 4.280 2.747 2.710 2.774 . 0 0 "[ . 1 . 2]" 1
1259 1 91 LEU HA 1 91 LEU QD 4.040 . 4.540 2.251 2.170 2.323 . 0 0 "[ . 1 . 2]" 1
1260 1 91 LEU HA 1 94 LYS H 4.080 . 4.580 3.427 3.326 3.506 . 0 0 "[ . 1 . 2]" 1
1261 1 91 LEU HA 1 94 LYS QD 5.410 . 5.910 3.210 2.924 4.842 . 0 0 "[ . 1 . 2]" 1
1262 1 91 LEU HA 1 94 LYS QG 4.170 . 4.670 3.656 2.563 3.802 . 0 0 "[ . 1 . 2]" 1
1263 1 91 LEU QB 1 92 PRO QD . . 4.060 2.217 2.019 2.295 . 0 0 "[ . 1 . 2]" 1
1264 1 91 LEU QD 1 92 PRO QD . . 5.360 3.059 2.247 3.261 . 0 0 "[ . 1 . 2]" 1
1265 1 91 LEU QD 1 95 ASN HA 6.030 . 6.530 4.478 4.266 4.516 . 0 0 "[ . 1 . 2]" 1
1266 1 91 LEU QD 1 95 ASN QB 6.230 . 6.570 3.337 2.420 4.020 . 0 0 "[ . 1 . 2]" 1
1267 1 91 LEU QD 1 95 ASN QD 5.720 . 6.130 2.793 1.865 3.733 . 0 0 "[ . 1 . 2]" 1
1268 1 91 LEU HG 1 92 PRO QD 4.510 . 4.730 3.259 2.823 3.847 . 0 0 "[ . 1 . 2]" 1
1269 1 91 LEU HG 1 95 ASN QD 5.430 . 5.930 3.701 2.582 4.883 . 0 0 "[ . 1 . 2]" 1
1270 1 92 PRO HA 1 95 ASN QB 4.820 . 5.320 2.555 2.325 2.702 . 0 0 "[ . 1 . 2]" 1
1271 1 92 PRO HA 1 95 ASN QD 5.990 . 6.490 3.309 2.758 3.946 . 0 0 "[ . 1 . 2]" 1
1272 1 92 PRO HA 2 31 ILE HB 5.500 . 6.000 4.642 4.592 4.724 . 0 0 "[ . 1 . 2]" 1
1273 1 92 PRO HA 2 31 ILE MD 5.400 . 5.900 4.579 4.547 4.612 . 0 0 "[ . 1 . 2]" 1
1274 1 92 PRO HA 2 31 ILE MG 5.400 . 5.900 4.416 4.365 4.505 . 0 0 "[ . 1 . 2]" 1
1275 1 92 PRO HA 2 32 GLU HA 5.500 . 6.000 5.442 5.238 5.531 . 0 0 "[ . 1 . 2]" 1
1276 1 92 PRO HA 2 32 GLU QG 6.170 . 6.670 3.222 2.993 3.346 . 0 0 "[ . 1 . 2]" 1
1277 1 92 PRO QB 2 31 ILE HB 5.500 . 6.000 2.253 2.222 2.313 . 0 0 "[ . 1 . 2]" 1
1278 1 92 PRO QB 2 31 ILE MD 6.000 . 6.500 2.332 2.300 2.388 . 0 0 "[ . 1 . 2]" 1
1279 1 92 PRO QB 2 31 ILE QG 5.990 . 6.490 3.739 3.696 3.766 . 0 0 "[ . 1 . 2]" 1
1280 1 92 PRO QB 2 31 ILE MG 4.800 . 5.300 2.151 2.113 2.183 . 0 0 "[ . 1 . 2]" 1
1281 1 92 PRO QB 2 35 MET ME 7.410 . 7.910 5.432 5.156 5.534 . 0 0 "[ . 1 . 2]" 1
1282 1 92 PRO QD 1 93 LEU H 4.610 . 5.110 3.055 2.987 3.143 . 0 0 "[ . 1 . 2]" 1
1283 1 92 PRO QD 1 93 LEU QD . . 6.420 3.441 3.345 3.584 . 0 0 "[ . 1 . 2]" 1
1284 1 92 PRO QD 2 31 ILE MD 6.610 . 7.110 4.003 3.945 4.052 . 0 0 "[ . 1 . 2]" 1
1285 1 92 PRO QG 2 31 ILE MD 6.740 . 7.240 2.342 2.282 2.394 . 0 0 "[ . 1 . 2]" 1
1286 1 92 PRO QG 2 31 ILE QG 5.280 . 5.780 4.213 4.192 4.233 . 0 0 "[ . 1 . 2]" 1
1287 1 92 PRO QG 2 31 ILE MG 6.070 . 6.570 2.297 2.246 2.357 . 0 0 "[ . 1 . 2]" 1
1288 1 93 LEU H 1 93 LEU QD 4.680 . 5.180 2.149 2.084 2.194 . 0 0 "[ . 1 . 2]" 1
1289 1 93 LEU H 1 94 LYS H 3.140 . 3.640 2.520 2.458 2.608 . 0 0 "[ . 1 . 2]" 1
1290 1 93 LEU HA 2 31 ILE HB 5.500 . 6.000 5.197 5.096 5.296 . 0 0 "[ . 1 . 2]" 1
1291 1 93 LEU HA 2 31 ILE MG 4.800 . 5.300 3.440 3.350 3.539 . 0 0 "[ . 1 . 2]" 1
1292 1 93 LEU HA 2 35 MET QB 5.610 . 6.110 4.245 4.116 4.490 . 0 0 "[ . 1 . 2]" 1
1293 1 93 LEU HA 2 35 MET ME 4.440 . 4.940 2.420 2.151 2.671 . 0 0 "[ . 1 . 2]" 1
1294 1 93 LEU HA 2 35 MET QG 6.170 . 6.670 4.090 3.063 4.616 . 0 0 "[ . 1 . 2]" 1
1295 1 93 LEU QB 1 94 LYS H 4.910 . 5.410 2.582 2.503 2.705 . 0 0 "[ . 1 . 2]" 1
1296 1 93 LEU QB 2 35 MET ME 5.640 . 6.140 2.262 2.142 2.350 . 0 0 "[ . 1 . 2]" 1
1297 1 93 LEU QD 2 31 ILE HA . . 6.500 4.205 4.139 4.286 . 0 0 "[ . 1 . 2]" 1
1298 1 93 LEU QD 2 31 ILE HB . . 5.900 4.034 4.022 4.055 . 0 0 "[ . 1 . 2]" 1
1299 1 93 LEU QD 2 31 ILE MD 5.770 . 6.270 3.558 3.494 3.582 . 0 0 "[ . 1 . 2]" 1
1300 1 93 LEU QD 2 31 ILE QG 7.410 . 7.910 4.395 4.342 4.491 . 0 0 "[ . 1 . 2]" 1
1301 1 93 LEU QD 2 31 ILE MG 5.770 . 6.270 1.995 1.973 2.018 . 0 0 "[ . 1 . 2]" 1
1302 1 93 LEU QD 2 32 GLU QG 7.410 . 7.910 4.871 4.604 4.916 . 0 0 "[ . 1 . 2]" 1
1303 1 93 LEU QD 2 35 MET QB 7.410 . 7.910 4.889 4.821 4.921 . 0 0 "[ . 1 . 2]" 1
1304 1 93 LEU QD 2 35 MET ME 4.980 . 5.480 2.232 2.096 2.326 . 0 0 "[ . 1 . 2]" 1
1305 1 93 LEU HG 2 35 MET QB 6.170 . 6.670 4.852 4.765 5.117 . 0 0 "[ . 1 . 2]" 1
1306 1 93 LEU HG 2 35 MET ME 5.400 . 5.900 2.322 2.148 2.633 . 0 0 "[ . 1 . 2]" 1
1307 1 94 LYS H 1 94 LYS QG 3.380 . 3.880 2.296 2.145 2.412 . 0 0 "[ . 1 . 2]" 1
1308 1 94 LYS H 1 95 ASN H 3.980 . 4.480 2.630 2.512 2.688 . 0 0 "[ . 1 . 2]" 1
1309 1 94 LYS HA 1 94 LYS QD 4.750 . 5.080 3.984 2.791 4.093 . 0 0 "[ . 1 . 2]" 1
1310 1 96 ALA HA 1 97 SER H 3.640 . 4.140 3.455 2.606 3.591 . 0 0 "[ . 1 . 2]" 1
1311 1 96 ALA HA 2 32 GLU HA 5.000 . 5.500 3.005 2.806 3.262 . 0 0 "[ . 1 . 2]" 1
1312 1 96 ALA HA 2 32 GLU QB 5.000 . 5.500 3.243 2.625 3.609 . 0 0 "[ . 1 . 2]" 1
1313 1 96 ALA HA 2 32 GLU QG 5.610 . 6.110 3.268 2.754 3.974 . 0 0 "[ . 1 . 2]" 1
1314 1 96 ALA HA 2 33 GLU HA 5.500 . 6.000 5.533 5.360 5.584 . 0 0 "[ . 1 . 2]" 1
1315 1 96 ALA HA 2 35 MET QB 5.610 . 6.110 3.694 3.584 3.865 . 0 0 "[ . 1 . 2]" 1
1316 1 96 ALA HA 2 35 MET ME 6.000 . 6.500 4.853 4.652 5.009 . 0 0 "[ . 1 . 2]" 1
1317 1 96 ALA HA 2 35 MET QG 5.500 . 6.000 4.412 4.227 4.910 . 0 0 "[ . 1 . 2]" 1
1318 1 96 ALA HA 2 37 ASN HA 5.000 . 5.500 5.026 4.713 5.133 . 0 0 "[ . 1 . 2]" 1
1319 1 96 ALA HA 2 37 ASN QB 6.170 . 6.670 4.665 4.055 5.495 . 0 0 "[ . 1 . 2]" 1
1320 1 96 ALA MB 1 97 SER H 6.100 . 6.600 2.817 2.380 3.090 . 0 0 "[ . 1 . 2]" 1
1321 1 96 ALA MB 1 97 SER HA 5.500 . 6.000 4.116 3.746 4.342 . 0 0 "[ . 1 . 2]" 1
1322 1 96 ALA MB 1 97 SER QB 7.200 . 7.700 3.485 3.213 3.825 . 0 0 "[ . 1 . 2]" 1
1323 1 96 ALA MB 2 31 ILE HB 6.000 . 6.500 4.411 4.358 4.505 . 0 0 "[ . 1 . 2]" 1
1324 1 96 ALA MB 2 31 ILE MD 7.930 . 8.430 5.547 5.525 5.604 . 0 0 "[ . 1 . 2]" 1
1325 1 96 ALA MB 2 31 ILE MG 7.210 . 7.710 3.699 3.611 3.796 . 0 0 "[ . 1 . 2]" 1
1326 1 96 ALA MB 2 32 GLU HA 4.200 . 4.700 1.875 1.809 1.905 . 0 0 "[ . 1 . 2]" 1
1327 1 96 ALA MB 2 32 GLU QB 5.400 . 5.900 3.382 2.828 3.487 . 0 0 "[ . 1 . 2]" 1
1328 1 96 ALA MB 2 32 GLU QG 6.070 . 6.570 2.628 2.404 2.943 . 0 0 "[ . 1 . 2]" 1
1329 1 96 ALA MB 2 33 GLU HA 6.610 . 7.110 4.705 4.589 4.839 . 0 0 "[ . 1 . 2]" 1
1330 1 96 ALA MB 2 34 ILE HB 6.000 . 6.500 4.678 4.525 4.769 . 0 0 "[ . 1 . 2]" 1
1331 1 96 ALA MB 2 34 ILE QG 7.410 . 7.910 5.557 5.507 5.606 . 0 0 "[ . 1 . 2]" 1
1332 1 96 ALA MB 2 34 ILE MG 7.210 . 7.710 4.983 4.774 5.068 . 0 0 "[ . 1 . 2]" 1
1333 1 96 ALA MB 2 35 MET H 6.210 . 6.710 3.255 2.990 3.484 . 0 0 "[ . 1 . 2]" 1
1334 1 96 ALA MB 2 35 MET HA 5.400 . 5.900 4.380 4.300 4.474 . 0 0 "[ . 1 . 2]" 1
1335 1 96 ALA MB 2 35 MET QB 4.720 . 5.220 2.019 1.983 2.067 . 0 0 "[ . 1 . 2]" 1
1336 1 96 ALA MB 2 35 MET ME 6.660 . 7.160 2.246 2.088 2.422 . 0 0 "[ . 1 . 2]" 1
1337 1 96 ALA MB 2 35 MET QG . . 5.440 2.348 1.915 2.750 . 0 0 "[ . 1 . 2]" 1
1338 1 96 ALA MB 2 37 ASN HA 6.000 . 6.500 4.705 4.510 5.017 . 0 0 "[ . 1 . 2]" 1
1339 1 96 ALA MB 2 37 ASN QB 7.410 . 7.910 4.736 4.303 5.500 . 0 0 "[ . 1 . 2]" 1
1340 1 97 SER HA 2 35 MET QB 5.610 . 6.110 3.812 2.856 4.499 . 0 0 "[ . 1 . 2]" 1
1341 1 97 SER HA 2 35 MET ME 6.000 . 6.500 4.956 4.720 5.043 . 0 0 "[ . 1 . 2]" 1
1342 1 97 SER HA 2 37 ASN H 4.880 . 5.380 3.438 2.687 4.134 . 0 0 "[ . 1 . 2]" 1
1343 1 97 SER HA 2 37 ASN HA 4.500 . 5.000 1.983 1.836 2.119 . 0 0 "[ . 1 . 2]" 1
1344 1 97 SER HA 2 37 ASN QB 5.610 . 6.110 3.681 3.313 4.035 . 0 0 "[ . 1 . 2]" 1
1345 1 97 SER HA 2 40 PRO HA 5.500 . 6.000 5.472 4.698 5.579 . 0 0 "[ . 1 . 2]" 1
1346 1 97 SER QB 2 35 MET QB 4.490 . 4.990 3.553 2.949 3.649 . 0 0 "[ . 1 . 2]" 1
1347 1 97 SER QB 2 35 MET ME 4.800 . 5.300 3.289 2.710 3.576 . 0 0 "[ . 1 . 2]" 1
1348 1 97 SER QB 2 35 MET QG 5.500 . 6.000 2.223 1.911 4.375 . 0 0 "[ . 1 . 2]" 1
1349 1 97 SER QB 2 37 ASN HA 5.500 . 6.000 3.491 2.249 3.979 . 0 0 "[ . 1 . 2]" 1
1350 1 97 SER QB 2 37 ASN QB 6.170 . 6.670 4.882 4.142 4.961 . 0 0 "[ . 1 . 2]" 1
1351 1 98 ASP QB 1 99 LYS H 4.880 . 5.380 3.397 2.371 3.967 . 0 0 "[ . 1 . 2]" 1
1352 1 99 LYS HA 1 99 LYS QD 4.100 . 4.600 2.553 2.107 3.718 . 0 0 "[ . 1 . 2]" 1
1353 1 99 LYS HA 1 99 LYS QE 4.740 . 5.240 3.531 1.908 4.266 . 0 0 "[ . 1 . 2]" 1
1354 1 100 ARG HA 1 100 ARG QD 4.640 . 5.140 3.642 2.117 4.172 . 0 0 "[ . 1 . 2]" 1
1355 2 4 MET HA 2 5 VAL H 3.220 . 3.720 2.552 2.203 3.402 . 0 0 "[ . 1 . 2]" 1
1356 2 4 MET HA 2 5 VAL QG 5.640 . 6.140 3.498 3.157 4.131 . 0 0 "[ . 1 . 2]" 1
1357 2 4 MET QB 2 5 VAL H 4.490 . 4.990 3.106 2.214 3.956 . 0 0 "[ . 1 . 2]" 1
1358 2 5 VAL HA 2 6 PRO QD 2.940 . 3.440 2.143 2.009 2.283 . 0 0 "[ . 1 . 2]" 1
1359 2 5 VAL HB 2 6 PRO QD 3.480 . 3.830 2.261 2.109 2.491 . 0 0 "[ . 1 . 2]" 1
1360 2 5 VAL QG 2 6 PRO HA 5.930 . 6.430 4.404 4.305 4.423 . 0 0 "[ . 1 . 2]" 1
1361 2 5 VAL QG 2 6 PRO QD 5.210 . 5.220 2.928 2.859 3.021 . 0 0 "[ . 1 . 2]" 1
1362 2 6 PRO HA 2 7 GLU H 2.870 . 3.370 2.482 2.163 3.047 . 0 0 "[ . 1 . 2]" 1
1363 2 6 PRO QB 2 7 GLU H 4.230 . 4.730 3.164 2.348 3.920 . 0 0 "[ . 1 . 2]" 1
1364 2 7 GLU H 2 8 PRO QD 5.090 . 5.180 3.916 3.021 4.286 . 0 0 "[ . 1 . 2]" 1
1365 2 7 GLU HA 2 8 PRO QB 5.250 . 5.750 4.716 4.681 4.744 . 0 0 "[ . 1 . 2]" 1
1366 2 7 GLU HA 2 8 PRO QD 3.220 . 3.610 2.032 1.934 2.242 . 0 0 "[ . 1 . 2]" 1
1367 2 7 GLU HA 2 8 PRO QG 4.760 . 5.260 3.958 3.888 4.204 . 0 0 "[ . 1 . 2]" 1
1368 2 7 GLU QB 2 8 PRO QD 4.840 . 5.340 3.758 3.219 3.890 . 0 0 "[ . 1 . 2]" 1
1369 2 7 GLU QG 2 8 PRO QD 5.290 . 5.790 3.235 2.468 4.398 . 0 0 "[ . 1 . 2]" 1
1370 2 8 PRO QB 2 9 ASP H 3.680 . 4.180 2.768 2.680 2.888 . 0 0 "[ . 1 . 2]" 1
1371 2 8 PRO QB 2 9 ASP HA 5.990 . 6.490 4.635 4.478 4.682 . 0 0 "[ . 1 . 2]" 1
1372 2 8 PRO QD 2 9 ASP H 5.500 . 6.000 4.906 4.819 4.925 . 0 0 "[ . 1 . 2]" 1
1373 2 8 PRO QG 2 9 ASP H 5.050 . 5.550 4.491 4.432 4.588 . 0 0 "[ . 1 . 2]" 1
1374 2 9 ASP H 2 10 LEU H 4.930 . 5.430 4.416 4.287 4.516 . 0 0 "[ . 1 . 2]" 1
1375 2 9 ASP HA 2 10 LEU H 3.240 . 3.740 2.109 2.017 2.168 . 0 0 "[ . 1 . 2]" 1
1376 2 9 ASP QB 2 10 LEU H 4.570 . 5.070 3.474 3.380 3.634 . 0 0 "[ . 1 . 2]" 1
1377 2 10 LEU H 2 10 LEU HG 4.560 . 5.060 4.172 4.048 4.602 . 0 0 "[ . 1 . 2]" 1
1378 2 10 LEU H 2 11 PRO QD 5.220 . 5.720 4.414 4.380 4.473 . 0 0 "[ . 1 . 2]" 1
1379 2 10 LEU HA 2 11 PRO QD 3.650 . 4.150 2.066 2.012 2.139 . 0 0 "[ . 1 . 2]" 1
1380 2 10 LEU HA 2 11 PRO QG 5.000 . 5.500 3.959 3.901 4.032 . 0 0 "[ . 1 . 2]" 1
1381 2 10 LEU HA 2 14 LEU MD1 6.610 . 7.110 5.398 5.328 5.512 . 0 0 "[ . 1 . 2]" 1
1382 2 10 LEU QB 2 11 PRO QD 4.960 . 5.410 3.664 3.372 3.706 . 0 0 "[ . 1 . 2]" 1
1383 2 10 LEU QD 2 11 PRO QB 6.560 . 7.060 3.846 3.740 4.412 . 0 0 "[ . 1 . 2]" 1
1384 2 10 LEU QD 2 11 PRO QD . . 5.300 2.035 1.837 2.101 . 0 0 "[ . 1 . 2]" 1
1385 2 10 LEU QD 2 11 PRO QG 4.830 . 5.330 2.536 2.457 3.263 . 0 0 "[ . 1 . 2]" 1
1386 2 10 LEU QD 2 14 LEU MD1 5.810 . 6.270 3.188 3.059 3.624 . 0 0 "[ . 1 . 2]" 1
1387 2 10 LEU HG 2 11 PRO QD 5.030 . 5.530 3.027 2.079 3.198 . 0 0 "[ . 1 . 2]" 1
1388 2 10 LEU HG 2 11 PRO QG 5.110 . 5.610 4.460 3.530 4.571 . 0 0 "[ . 1 . 2]" 1
1389 2 11 PRO HA 2 12 HIS QB 5.590 . 6.090 4.182 3.953 4.542 . 0 0 "[ . 1 . 2]" 1
1390 2 11 PRO HA 2 14 LEU HB2 5.500 . 6.000 5.175 5.080 5.424 . 0 0 "[ . 1 . 2]" 1
1391 2 11 PRO HA 2 14 LEU MD1 6.610 . 7.110 5.539 5.523 5.560 . 0 0 "[ . 1 . 2]" 1
1392 2 11 PRO QB 2 13 ASP H 5.990 . 6.490 3.197 2.990 3.280 . 0 0 "[ . 1 . 2]" 1
1393 2 11 PRO QB 2 14 LEU H 5.610 . 6.110 2.958 2.668 3.112 . 0 0 "[ . 1 . 2]" 1
1394 2 11 PRO QB 2 14 LEU MD1 5.510 . 6.010 3.560 3.504 3.618 . 0 0 "[ . 1 . 2]" 1
1395 2 11 PRO QB 2 14 LEU HG 5.500 . 6.000 2.990 2.811 3.127 . 0 0 "[ . 1 . 2]" 1
1396 2 11 PRO QD 2 14 LEU HB2 5.990 . 6.490 3.687 3.379 3.789 . 0 0 "[ . 1 . 2]" 1
1397 2 11 PRO QD 2 14 LEU HB3 5.990 . 6.490 4.917 4.744 5.029 . 0 0 "[ . 1 . 2]" 1
1398 2 11 PRO QD 2 14 LEU MD1 5.490 . 5.990 3.428 3.179 3.501 . 0 0 "[ . 1 . 2]" 1
1399 2 11 PRO QD 2 14 LEU MD2 7.410 . 7.910 5.523 5.338 5.552 . 0 0 "[ . 1 . 2]" 1
1400 2 11 PRO QG 2 14 LEU H 5.000 . 5.500 3.424 3.147 3.507 . 0 0 "[ . 1 . 2]" 1
1401 2 11 PRO QG 2 14 LEU MD1 5.340 . 5.830 2.091 2.073 2.109 . 0 0 "[ . 1 . 2]" 1
1402 2 11 PRO QG 2 14 LEU MD2 5.360 . 5.860 3.987 3.927 3.999 . 0 0 "[ . 1 . 2]" 1
1403 2 12 HIS HA 2 12 HIS HD2 5.010 . 5.510 3.719 2.817 4.831 . 0 0 "[ . 1 . 2]" 1
1404 2 12 HIS HA 2 14 LEU H 5.190 . 5.690 4.106 3.805 4.266 . 0 0 "[ . 1 . 2]" 1
1405 2 12 HIS HA 2 15 ARG H 4.680 . 5.180 3.191 2.741 3.589 . 0 0 "[ . 1 . 2]" 1
1406 2 12 HIS HA 2 15 ARG QB 4.250 . 4.750 2.700 2.268 3.830 . 0 0 "[ . 1 . 2]" 1
1407 2 12 HIS HA 2 15 ARG QD 4.430 . 4.930 2.700 2.206 4.018 . 0 0 "[ . 1 . 2]" 1
1408 2 12 HIS HA 2 15 ARG QG 3.830 . 4.330 2.506 2.078 3.078 . 0 0 "[ . 1 . 2]" 1
1409 2 12 HIS QB 2 13 ASP H 4.650 . 5.150 2.838 2.538 3.576 . 0 0 "[ . 1 . 2]" 1
1410 2 12 HIS QB 2 14 LEU H 6.170 . 6.670 4.749 4.562 5.093 . 0 0 "[ . 1 . 2]" 1
1411 2 13 ASP H 2 14 LEU H 4.040 . 4.540 2.666 2.560 2.748 . 0 0 "[ . 1 . 2]" 1
1412 2 13 ASP H 2 15 ARG H 5.500 . 6.000 4.062 3.951 4.271 . 0 0 "[ . 1 . 2]" 1
1413 2 13 ASP QB 2 14 LEU H 4.910 . 5.410 3.697 3.647 3.774 . 0 0 "[ . 1 . 2]" 1
1414 2 14 LEU H 2 14 LEU MD1 4.950 . 5.450 4.035 3.924 4.108 . 0 0 "[ . 1 . 2]" 1
1415 2 14 LEU H 2 14 LEU MD2 5.020 . 5.520 3.450 3.396 3.511 . 0 0 "[ . 1 . 2]" 1
1416 2 14 LEU H 2 14 LEU HG 4.500 . 5.000 2.767 2.680 2.860 . 0 0 "[ . 1 . 2]" 1
1417 2 14 LEU H 2 15 ARG H 3.020 . 3.520 2.348 2.298 2.442 . 0 0 "[ . 1 . 2]" 1
1418 2 14 LEU H 2 15 ARG HA 5.390 . 5.890 5.028 4.993 5.096 . 0 0 "[ . 1 . 2]" 1
1419 2 14 LEU HA 2 14 LEU MD2 3.670 . 4.170 2.114 2.072 2.227 . 0 0 "[ . 1 . 2]" 1
1420 2 14 LEU HA 2 17 LEU HB2 4.000 . 4.500 3.581 3.357 3.848 . 0 0 "[ . 1 . 2]" 1
1421 2 14 LEU HA 2 17 LEU HB3 5.000 . 5.500 4.856 4.719 5.000 . 0 0 "[ . 1 . 2]" 1
1422 2 14 LEU HA 2 17 LEU MD1 4.490 . 4.990 2.830 2.733 3.032 . 0 0 "[ . 1 . 2]" 1
1423 2 14 LEU HA 2 17 LEU MD2 5.160 . 5.660 4.004 3.846 4.159 . 0 0 "[ . 1 . 2]" 1
1424 2 14 LEU HA 2 17 LEU HG 4.180 . 4.680 2.370 2.196 2.523 . 0 0 "[ . 1 . 2]" 1
1425 2 14 LEU MD1 2 17 LEU MD1 6.850 . 7.350 3.531 3.464 3.682 . 0 0 "[ . 1 . 2]" 1
1426 2 15 ARG H 2 15 ARG QG 3.430 . 3.930 2.404 2.275 2.582 . 0 0 "[ . 1 . 2]" 1
1427 2 16 HIS HA 2 16 HIS HD2 4.650 . 5.150 3.530 2.423 4.599 . 0 0 "[ . 1 . 2]" 1
1428 2 17 LEU H 2 17 LEU HG 5.120 . 5.620 2.599 2.462 2.698 . 0 0 "[ . 1 . 2]" 1
1429 2 17 LEU HA 2 22 MET ME 6.610 . 7.110 4.234 3.982 4.344 . 0 0 "[ . 1 . 2]" 1
1430 2 17 LEU QB 2 18 ASN HA 5.990 . 6.490 4.505 4.445 4.569 . 0 0 "[ . 1 . 2]" 1
1431 2 17 LEU MD1 2 22 MET ME 7.210 . 7.710 2.532 2.359 2.781 . 0 0 "[ . 1 . 2]" 1
1432 2 17 LEU MD2 2 18 ASN H 5.840 . 6.340 3.245 3.006 3.570 . 0 0 "[ . 1 . 2]" 1
1433 2 17 LEU MD2 2 22 MET ME 7.210 . 7.710 3.426 3.194 3.580 . 0 0 "[ . 1 . 2]" 1
1434 2 18 ASN HA 2 19 THR H 3.010 . 3.510 2.177 2.152 2.207 . 0 0 "[ . 1 . 2]" 1
1435 2 18 ASN HA 2 19 THR MG 5.240 . 5.740 4.243 3.910 4.383 . 0 0 "[ . 1 . 2]" 1
1436 2 18 ASN HA 2 20 GLU H 4.040 . 4.540 3.630 3.493 3.879 . 0 0 "[ . 1 . 2]" 1
1437 2 18 ASN HA 2 21 PRO QD 5.500 . 6.000 4.323 4.090 4.715 . 0 0 "[ . 1 . 2]" 1
1438 2 18 ASN HA 2 22 MET ME 6.610 . 7.110 4.625 4.367 5.021 . 0 0 "[ . 1 . 2]" 1
1439 2 18 ASN QB 2 19 THR H 4.860 . 5.360 3.985 3.898 4.025 . 0 0 "[ . 1 . 2]" 1
1440 2 18 ASN QB 2 20 GLU H 4.830 . 5.330 4.211 3.995 4.315 . 0 0 "[ . 1 . 2]" 1
1441 2 18 ASN QD 2 20 GLU H 6.170 . 6.670 3.992 3.458 4.210 . 0 0 "[ . 1 . 2]" 1
1442 2 18 ASN QD 2 21 PRO QD 6.930 . 7.430 2.858 2.551 3.924 . 0 0 "[ . 1 . 2]" 1
1443 2 19 THR H 2 19 THR MG 4.320 . 4.820 2.843 2.519 3.023 . 0 0 "[ . 1 . 2]" 1
1444 2 19 THR H 2 20 GLU H 3.980 . 4.480 2.666 2.592 2.833 . 0 0 "[ . 1 . 2]" 1
1445 2 19 THR HA 2 21 PRO QD 4.710 . 5.210 3.241 3.041 3.423 . 0 0 "[ . 1 . 2]" 1
1446 2 19 THR HA 2 22 MET H 5.000 . 5.500 3.172 3.098 3.258 . 0 0 "[ . 1 . 2]" 1
1447 2 19 THR HA 2 22 MET HA 5.230 . 5.730 5.107 4.925 5.263 . 0 0 "[ . 1 . 2]" 1
1448 2 19 THR HA 2 22 MET QB 4.010 . 4.510 2.694 2.501 2.891 . 0 0 "[ . 1 . 2]" 1
1449 2 19 THR HA 2 22 MET ME 4.470 . 4.970 2.463 2.319 2.730 . 0 0 "[ . 1 . 2]" 1
1450 2 19 THR HA 2 22 MET QG 4.410 . 4.910 2.698 2.119 3.761 . 0 0 "[ . 1 . 2]" 1
1451 2 19 THR HB 2 22 MET QB 4.860 . 5.360 3.265 2.952 3.364 . 0 0 "[ . 1 . 2]" 1
1452 2 19 THR HB 2 23 GLU QG 4.640 . 5.140 4.170 4.142 4.202 . 0 0 "[ . 1 . 2]" 1
1453 2 19 THR MG 2 20 GLU H 5.560 . 6.060 4.468 4.415 4.534 . 0 0 "[ . 1 . 2]" 1
1454 2 19 THR MG 2 22 MET QB 6.740 . 7.240 3.024 2.696 3.302 . 0 0 "[ . 1 . 2]" 1
1455 2 19 THR MG 2 22 MET ME 5.550 . 6.050 2.342 2.037 2.658 . 0 0 "[ . 1 . 2]" 1
1456 2 19 THR MG 2 22 MET QG 6.400 . 6.900 3.345 2.895 3.531 . 0 0 "[ . 1 . 2]" 1
1457 2 20 GLU H 2 20 GLU QG 4.160 . 4.660 2.469 2.054 3.849 . 0 0 "[ . 1 . 2]" 1
1458 2 20 GLU H 2 21 PRO QD 3.570 . 3.740 2.435 2.355 2.530 . 0 0 "[ . 1 . 2]" 1
1459 2 20 GLU H 2 21 PRO QG 5.610 . 6.110 4.382 4.286 4.496 . 0 0 "[ . 1 . 2]" 1
1460 2 20 GLU H 2 22 MET H 5.480 . 5.980 4.152 4.013 4.336 . 0 0 "[ . 1 . 2]" 1
1461 2 20 GLU HA 2 21 PRO QD 4.630 . 4.700 3.655 3.624 3.689 . 0 0 "[ . 1 . 2]" 1
1462 2 20 GLU HA 2 23 GLU H 3.940 . 4.440 3.687 3.573 3.839 . 0 0 "[ . 1 . 2]" 1
1463 2 20 GLU HA 2 23 GLU QB 4.710 . 5.210 3.995 3.837 4.151 . 0 0 "[ . 1 . 2]" 1
1464 2 20 GLU HA 2 23 GLU QG . . 4.220 2.513 2.274 2.718 . 0 0 "[ . 1 . 2]" 1
1465 2 20 GLU QB 2 21 PRO HA 4.680 . 5.180 4.107 4.006 4.247 . 0 0 "[ . 1 . 2]" 1
1466 2 20 GLU QB 2 21 PRO QD 3.750 . 4.160 2.109 1.982 2.214 . 0 0 "[ . 1 . 2]" 1
1467 2 20 GLU QB 2 21 PRO QG 5.570 . 6.070 3.782 3.499 4.146 . 0 0 "[ . 1 . 2]" 1
1468 2 20 GLU QG 2 21 PRO QD 4.590 . 4.930 3.545 3.470 3.571 . 0 0 "[ . 1 . 2]" 1
1469 2 21 PRO HA 2 24 ILE MG 6.610 . 7.110 4.100 4.015 4.205 . 0 0 "[ . 1 . 2]" 1
1470 2 21 PRO QB 2 22 MET H 4.530 . 5.030 3.093 2.714 3.574 . 0 0 "[ . 1 . 2]" 1
1471 2 21 PRO QB 2 24 ILE MD 7.200 . 7.700 4.612 4.464 4.752 . 0 0 "[ . 1 . 2]" 1
1472 2 21 PRO QB 2 24 ILE MG 6.510 . 7.010 4.817 4.730 4.843 . 0 0 "[ . 1 . 2]" 1
1473 2 21 PRO QD 2 22 MET H 4.430 . 4.930 2.442 2.282 2.650 . 0 0 "[ . 1 . 2]" 1
1474 2 21 PRO QD 2 23 GLU H 5.500 . 6.000 4.454 4.351 4.584 . 0 0 "[ . 1 . 2]" 1
1475 2 21 PRO QG 2 22 MET H 4.790 . 5.290 3.306 2.589 3.823 . 0 0 "[ . 1 . 2]" 1
1476 2 22 MET H 2 22 MET ME 5.600 . 6.100 4.149 3.970 4.262 . 0 0 "[ . 1 . 2]" 1
1477 2 22 MET H 2 22 MET QG 4.080 . 4.360 2.594 2.116 3.366 . 0 0 "[ . 1 . 2]" 1
1478 2 22 MET H 2 23 GLU H 3.120 . 3.620 2.773 2.687 2.866 . 0 0 "[ . 1 . 2]" 1
1479 2 22 MET H 2 24 ILE H 4.780 . 5.280 4.798 4.782 4.814 . 0 0 "[ . 1 . 2]" 1
1480 2 22 MET H 2 25 PHE QD 5.680 . 6.180 5.032 4.897 5.094 . 0 0 "[ . 1 . 2]" 1
1481 2 22 MET HA 2 25 PHE QD 4.010 . 4.510 2.535 2.368 2.636 . 0 0 "[ . 1 . 2]" 1
1482 2 22 MET QB 2 23 GLU H 4.090 . 4.590 3.211 3.170 3.269 . 0 0 "[ . 1 . 2]" 1
1483 2 22 MET QB 2 25 PHE H 5.370 . 5.870 4.129 4.074 4.171 . 0 0 "[ . 1 . 2]" 1
1484 2 22 MET QB 2 25 PHE QD 5.100 . 5.600 2.351 2.215 2.632 . 0 0 "[ . 1 . 2]" 1
1485 2 22 MET ME 2 25 PHE QD 6.920 . 7.420 5.069 4.878 5.145 . 0 0 "[ . 1 . 2]" 1
1486 2 22 MET QG 2 23 GLU H 5.990 . 6.490 4.492 4.222 4.872 . 0 0 "[ . 1 . 2]" 1
1487 2 22 MET QG 2 25 PHE QD 5.650 . 5.780 2.993 2.449 3.331 . 0 0 "[ . 1 . 2]" 1
1488 2 23 GLU H 2 23 GLU QG 3.920 . 4.290 2.359 2.267 2.589 . 0 0 "[ . 1 . 2]" 1
1489 2 23 GLU H 2 24 ILE H 3.730 . 4.230 2.973 2.948 3.001 . 0 0 "[ . 1 . 2]" 1
1490 2 23 GLU QB 2 24 ILE H 4.210 . 4.710 3.152 3.108 3.259 . 0 0 "[ . 1 . 2]" 1
1491 2 23 GLU QB 2 24 ILE MG 6.740 . 7.240 3.668 3.553 3.798 . 0 0 "[ . 1 . 2]" 1
1492 2 23 GLU QG 2 24 ILE H 5.500 . 6.000 4.484 4.406 4.555 . 0 0 "[ . 1 . 2]" 1
1493 2 24 ILE H 2 24 ILE QG 3.880 . 4.380 2.256 2.136 2.328 . 0 0 "[ . 1 . 2]" 1
1494 2 24 ILE H 2 24 ILE MG 3.580 . 4.080 2.238 2.191 2.295 . 0 0 "[ . 1 . 2]" 1
1495 2 24 ILE H 2 25 PHE H 3.120 . 3.620 2.635 2.584 2.670 . 0 0 "[ . 1 . 2]" 1
1496 2 24 ILE H 2 26 ARG H 4.240 . 4.740 4.151 4.039 4.249 . 0 0 "[ . 1 . 2]" 1
1497 2 24 ILE HA 2 25 PHE QD 6.170 . 6.670 5.431 5.378 5.472 . 0 0 "[ . 1 . 2]" 1
1498 2 24 ILE HB 2 25 PHE H 4.200 . 4.700 4.095 4.019 4.149 . 0 0 "[ . 1 . 2]" 1
1499 2 24 ILE HB 2 25 PHE QD 6.170 . 6.670 4.637 4.552 4.695 . 0 0 "[ . 1 . 2]" 1
1500 2 24 ILE MD 2 25 PHE QD 5.120 . 5.620 3.702 3.636 3.791 . 0 0 "[ . 1 . 2]" 1
1501 2 24 ILE MD 2 25 PHE QE 5.860 . 6.360 2.562 2.458 2.629 . 0 0 "[ . 1 . 2]" 1
1502 2 24 ILE QG 2 25 PHE H 4.120 . 4.620 2.566 2.450 2.636 . 0 0 "[ . 1 . 2]" 1
1503 2 24 ILE QG 2 25 PHE QD 5.130 . 5.630 2.672 2.565 2.756 . 0 0 "[ . 1 . 2]" 1
1504 2 24 ILE MG 2 25 PHE H 6.000 . 6.500 4.074 4.047 4.108 . 0 0 "[ . 1 . 2]" 1
1505 2 24 ILE MG 2 25 PHE QD 7.410 . 7.910 5.134 5.103 5.167 . 0 0 "[ . 1 . 2]" 1
1506 2 24 ILE MG 2 25 PHE QE 7.410 . 7.910 5.021 4.951 5.080 . 0 0 "[ . 1 . 2]" 1
1507 2 25 PHE H 2 26 ARG H 3.390 . 3.890 2.517 2.449 2.563 . 0 0 "[ . 1 . 2]" 1
1508 2 25 PHE HA 2 25 PHE QD 3.700 . 4.200 2.477 2.371 2.561 . 0 0 "[ . 1 . 2]" 1
1509 2 25 PHE HA 2 28 SER QB 5.990 . 6.490 2.447 2.275 3.513 . 0 0 "[ . 1 . 2]" 1
1510 2 25 PHE HA 2 29 VAL MG2 4.660 . 5.160 3.409 3.265 3.489 . 0 0 "[ . 1 . 2]" 1
1511 2 25 PHE HB2 2 26 ARG H 4.780 . 5.280 3.300 3.158 3.362 . 0 0 "[ . 1 . 2]" 1
1512 2 25 PHE HB3 2 26 ARG H 4.400 . 4.900 4.273 4.165 4.322 . 0 0 "[ . 1 . 2]" 1
1513 2 25 PHE HB3 2 29 VAL MG1 5.560 . 6.060 4.666 4.648 4.686 . 0 0 "[ . 1 . 2]" 1
1514 2 25 PHE HB3 2 29 VAL MG2 4.360 . 4.860 2.529 2.440 2.597 . 0 0 "[ . 1 . 2]" 1
1515 2 25 PHE QD 2 29 VAL MG2 5.680 . 6.180 3.896 3.807 3.981 . 0 0 "[ . 1 . 2]" 1
1516 2 28 SER HA 2 29 VAL MG2 5.580 . 6.080 4.155 4.103 4.216 . 0 0 "[ . 1 . 2]" 1
1517 2 28 SER QB 2 29 VAL MG2 4.900 . 5.400 2.912 2.624 3.256 . 0 0 "[ . 1 . 2]" 1
1518 2 29 VAL HA 2 30 LYS H 3.210 . 3.710 2.229 2.103 2.283 . 0 0 "[ . 1 . 2]" 1
1519 2 29 VAL HB 2 30 LYS H 4.780 . 5.280 3.538 3.383 3.986 . 0 0 "[ . 1 . 2]" 1
1520 2 29 VAL MG1 2 30 LYS H 3.990 . 4.490 2.182 2.033 2.709 . 0 0 "[ . 1 . 2]" 1
1521 2 29 VAL MG1 2 31 ILE HA 5.190 . 5.690 3.211 3.064 3.391 . 0 0 "[ . 1 . 2]" 1
1522 2 30 LYS H 2 30 LYS QG 4.250 . 4.750 3.201 2.837 3.346 . 0 0 "[ . 1 . 2]" 1
1523 2 30 LYS HA 2 30 LYS QD 3.970 . 4.470 3.081 2.222 3.637 . 0 0 "[ . 1 . 2]" 1
1524 2 30 LYS HA 2 30 LYS QE 4.740 . 5.240 4.173 3.892 4.266 . 0 0 "[ . 1 . 2]" 1
1525 2 30 LYS HA 2 31 ILE H 3.330 . 3.830 2.257 2.231 2.311 . 0 0 "[ . 1 . 2]" 1
1526 2 30 LYS HA 2 33 GLU QG 6.170 . 6.670 4.548 4.321 4.828 . 0 0 "[ . 1 . 2]" 1
1527 2 30 LYS HB2 2 33 GLU HA 5.500 . 6.000 5.430 5.314 5.514 . 0 0 "[ . 1 . 2]" 1
1528 2 30 LYS HB2 2 33 GLU QG 5.050 . 5.550 3.816 3.293 4.357 . 0 0 "[ . 1 . 2]" 1
1529 2 30 LYS HB3 2 31 ILE H 4.030 . 4.530 4.063 4.035 4.090 . 0 0 "[ . 1 . 2]" 1
1530 2 30 LYS HB3 2 33 GLU H 3.420 . 3.920 2.647 2.422 2.889 . 0 0 "[ . 1 . 2]" 1
1531 2 30 LYS QD 2 33 GLU HA 6.170 . 6.670 5.410 4.973 5.543 . 0 0 "[ . 1 . 2]" 1
1532 2 30 LYS QD 2 33 GLU QG 5.670 . 6.170 2.520 2.366 2.808 . 0 0 "[ . 1 . 2]" 1
1533 2 30 LYS QG 2 31 ILE H 5.500 . 6.000 4.427 4.211 4.755 . 0 0 "[ . 1 . 2]" 1
1534 2 30 LYS QG 2 33 GLU H 5.500 . 6.000 4.735 4.542 4.938 . 0 0 "[ . 1 . 2]" 1
1535 2 30 LYS QG 2 33 GLU HB2 5.500 . 6.000 3.794 3.219 4.246 . 0 0 "[ . 1 . 2]" 1
1536 2 30 LYS QG 2 33 GLU QG 5.150 . 5.650 3.901 3.218 4.107 . 0 0 "[ . 1 . 2]" 1
1537 2 31 ILE H 2 31 ILE QG 4.220 . 4.720 1.856 1.830 1.896 . 0 0 "[ . 1 . 2]" 1
1538 2 31 ILE H 2 31 ILE MG 4.310 . 4.810 3.624 3.613 3.641 . 0 0 "[ . 1 . 2]" 1
1539 2 31 ILE H 2 32 GLU H 4.510 . 5.010 3.009 2.929 3.126 . 0 0 "[ . 1 . 2]" 1
1540 2 31 ILE HA 2 34 ILE H 5.500 . 6.000 4.397 4.287 4.679 . 0 0 "[ . 1 . 2]" 1
1541 2 31 ILE HA 2 34 ILE HB 4.810 . 5.310 3.964 3.796 4.249 . 0 0 "[ . 1 . 2]" 1
1542 2 31 ILE HA 2 34 ILE QG 5.990 . 6.490 3.546 3.433 3.654 . 0 0 "[ . 1 . 2]" 1
1543 2 31 ILE HB 2 32 GLU H 4.550 . 5.050 2.768 2.515 2.874 . 0 0 "[ . 1 . 2]" 1
1544 2 31 ILE QG 2 32 GLU QB 6.530 . 7.030 5.165 5.101 5.222 . 0 0 "[ . 1 . 2]" 1
1545 2 32 GLU H 2 32 GLU QG 4.380 . 4.880 2.661 2.416 2.808 . 0 0 "[ . 1 . 2]" 1
1546 2 32 GLU H 2 33 GLU H 4.080 . 4.580 2.608 2.563 2.707 . 0 0 "[ . 1 . 2]" 1
1547 2 32 GLU HA 2 35 MET QB 5.610 . 6.110 3.828 3.684 3.974 . 0 0 "[ . 1 . 2]" 1
1548 2 32 GLU HA 2 35 MET ME 5.260 . 5.760 4.427 4.398 4.522 . 0 0 "[ . 1 . 2]" 1
1549 2 33 GLU H 2 33 GLU QG 3.650 . 4.150 2.595 2.463 2.738 . 0 0 "[ . 1 . 2]" 1
1550 2 33 GLU H 2 34 ILE H 3.380 . 3.880 2.367 2.273 2.453 . 0 0 "[ . 1 . 2]" 1
1551 2 33 GLU HB2 2 34 ILE H 3.760 . 4.260 3.230 2.993 3.423 . 0 0 "[ . 1 . 2]" 1
1552 2 34 ILE H 2 34 ILE QG 4.540 . 5.040 2.412 2.315 2.524 . 0 0 "[ . 1 . 2]" 1
1553 2 34 ILE H 2 34 ILE MG 4.380 . 4.880 3.684 3.660 3.696 . 0 0 "[ . 1 . 2]" 1
1554 2 34 ILE H 2 35 MET H 3.620 . 4.120 2.657 2.569 2.778 . 0 0 "[ . 1 . 2]" 1
1555 2 34 ILE HB 2 35 MET H 4.300 . 4.800 2.568 2.426 2.726 . 0 0 "[ . 1 . 2]" 1
1556 2 34 ILE QG 2 35 MET H 5.990 . 6.490 4.060 3.930 4.213 . 0 0 "[ . 1 . 2]" 1
1557 2 35 MET HA 2 35 MET ME 4.850 . 5.350 3.603 3.387 3.839 . 0 0 "[ . 1 . 2]" 1
1558 2 37 ASN HA 2 38 GLY QA 5.500 . 6.000 4.177 3.943 4.558 . 0 0 "[ . 1 . 2]" 1
1559 2 37 ASN QB 2 38 GLY QA 6.300 . 6.800 4.538 4.038 4.740 . 0 0 "[ . 1 . 2]" 1
1560 2 39 ASP HA 2 40 PRO QB 5.500 . 6.000 4.717 4.536 4.914 . 0 0 "[ . 1 . 2]" 1
1561 2 39 ASP HA 2 40 PRO QD 2.910 . 3.410 2.103 1.961 2.253 . 0 0 "[ . 1 . 2]" 1
1562 2 39 ASP HA 2 40 PRO QG 4.850 . 5.350 4.005 3.720 4.223 . 0 0 "[ . 1 . 2]" 1
1563 2 39 ASP HA 2 41 LEU H 5.080 . 5.580 4.388 3.993 5.150 . 0 0 "[ . 1 . 2]" 1
1564 2 39 ASP HA 2 42 LEU QB 4.860 . 5.360 4.260 4.133 4.543 . 0 0 "[ . 1 . 2]" 1
1565 2 39 ASP HA 2 42 LEU HG 5.500 . 6.000 5.388 4.117 5.638 . 0 0 "[ . 1 . 2]" 1
1566 2 39 ASP QB 2 40 PRO QD . . 4.790 2.681 2.439 3.158 . 0 0 "[ . 1 . 2]" 1
1567 2 39 ASP QB 2 40 PRO QG 5.500 . 6.000 4.311 3.968 4.505 . 0 0 "[ . 1 . 2]" 1
1568 2 39 ASP QB 2 41 LEU H 5.500 . 6.000 3.111 2.278 4.943 . 0 0 "[ . 1 . 2]" 1
1569 2 39 ASP QB 2 42 LEU H 5.500 . 6.000 2.721 2.441 3.519 . 0 0 "[ . 1 . 2]" 1
1570 2 39 ASP QB 2 42 LEU QB 4.630 . 4.730 2.144 1.963 2.853 . 0 0 "[ . 1 . 2]" 1
1571 2 39 ASP QB 2 42 LEU QD 4.660 . 5.160 3.001 1.867 3.166 . 0 0 "[ . 1 . 2]" 1
1572 2 39 ASP QB 2 42 LEU HG 4.670 . 4.850 2.869 2.323 3.885 . 0 0 "[ . 1 . 2]" 1
1573 2 40 PRO HA 2 43 ALA MB 5.610 . 6.110 4.196 2.933 4.729 . 0 0 "[ . 1 . 2]" 1
1574 2 40 PRO QB 2 41 LEU QD 6.170 . 6.670 2.873 2.120 3.950 . 0 0 "[ . 1 . 2]" 1
1575 2 40 PRO QD 2 41 LEU H 4.490 . 4.990 2.331 1.983 3.303 . 0 0 "[ . 1 . 2]" 1
1576 2 40 PRO QD 2 41 LEU QD 5.850 . 6.350 3.083 2.120 3.868 . 0 0 "[ . 1 . 2]" 1
1577 2 40 PRO QG 2 41 LEU H 3.990 . 4.490 2.596 1.694 3.564 0.106 18 0 "[ . 1 . 2]" 1
1578 2 40 PRO QG 2 41 LEU QD 4.340 . 4.840 2.589 2.076 2.893 . 0 0 "[ . 1 . 2]" 1
1579 2 41 LEU H 2 41 LEU QD 4.710 . 5.210 2.328 1.852 2.995 . 0 0 "[ . 1 . 2]" 1
1580 2 41 LEU H 2 41 LEU HG 4.430 . 4.930 3.465 2.136 4.016 . 0 0 "[ . 1 . 2]" 1
1581 2 41 LEU H 2 42 LEU H 3.430 . 3.930 2.689 2.568 2.869 . 0 0 "[ . 1 . 2]" 1
1582 2 41 LEU HA 2 41 LEU QD 3.780 . 4.280 2.279 2.049 2.783 . 0 0 "[ . 1 . 2]" 1
1583 2 42 LEU H 2 42 LEU QD 4.480 . 4.980 3.214 1.662 3.454 0.138 14 0 "[ . 1 . 2]" 1
1584 2 42 LEU HA 2 42 LEU QD . . 4.040 2.555 2.183 2.827 . 0 0 "[ . 1 . 2]" 1
1585 2 42 LEU QB 2 43 ALA H 4.320 . 4.820 3.196 2.736 3.639 . 0 0 "[ . 1 . 2]" 1
1586 2 42 LEU QD 2 43 ALA H 5.560 . 6.060 3.380 2.697 4.150 . 0 0 "[ . 1 . 2]" 1
1587 2 43 ALA HA 2 44 GLY QA 5.440 . 5.940 4.510 3.942 4.623 . 0 0 "[ . 1 . 2]" 1
1588 2 43 ALA MB 2 44 GLY QA 5.270 . 5.770 3.812 3.693 4.022 . 0 0 "[ . 1 . 2]" 1
1589 2 44 GLY QA 2 45 GLN HB2 5.050 . 5.550 4.492 3.927 4.638 . 0 0 "[ . 1 . 2]" 1
1590 2 44 GLY QA 2 45 GLN QG 5.980 . 6.480 3.618 3.305 4.697 . 0 0 "[ . 1 . 2]" 1
1591 2 44 GLY QA 2 47 THR MG 6.520 . 7.020 4.657 3.818 4.996 . 0 0 "[ . 1 . 2]" 1
1592 2 45 GLN HA 2 45 GLN QG 3.700 . 4.200 2.552 2.165 2.915 . 0 0 "[ . 1 . 2]" 1
1593 2 45 GLN HB2 2 46 ASN HA 5.310 . 5.810 4.867 4.555 5.310 . 0 0 "[ . 1 . 2]" 1
1594 2 45 GLN HB3 2 46 ASN HA 4.640 . 5.140 4.662 4.508 4.773 . 0 0 "[ . 1 . 2]" 1
1595 2 46 ASN HA 2 47 THR MG 5.750 . 6.250 4.674 3.660 4.865 . 0 0 "[ . 1 . 2]" 1
1596 2 46 ASN QB 2 47 THR HA 5.500 . 6.000 4.700 4.168 4.918 . 0 0 "[ . 1 . 2]" 1
1597 2 46 ASN QB 2 47 THR MG 6.610 . 7.110 3.387 2.635 4.938 . 0 0 "[ . 1 . 2]" 1
1598 2 47 THR HB 2 48 VAL H 3.960 . 4.460 3.356 1.990 4.012 . 0 0 "[ . 1 . 2]" 1
1599 2 47 THR HB 2 48 VAL QG 6.280 . 6.550 3.998 3.030 4.509 . 0 0 "[ . 1 . 2]" 1
1600 2 47 THR MG 2 48 VAL H 5.850 . 6.350 3.041 2.062 3.827 . 0 0 "[ . 1 . 2]" 1
1601 2 48 VAL QG 2 49 ASP H 6.000 . 6.500 3.166 2.050 3.822 . 0 0 "[ . 1 . 2]" 1
1602 2 49 ASP HA 2 52 TYR QD 6.170 . 6.670 4.922 2.699 5.584 . 0 0 "[ . 1 . 2]" 1
1603 2 49 ASP HA 2 53 VAL QG 5.300 . 5.800 3.867 2.804 4.048 . 0 0 "[ . 1 . 2]" 1
1604 2 49 ASP QB 2 50 GLU H 4.170 . 4.440 2.873 1.878 3.720 . 0 0 "[ . 1 . 2]" 1
1605 2 49 ASP QB 2 51 VAL H 5.990 . 6.490 3.474 2.779 4.504 . 0 0 "[ . 1 . 2]" 1
1606 2 49 ASP QB 2 51 VAL QG 6.080 . 6.580 3.009 2.247 4.076 . 0 0 "[ . 1 . 2]" 1
1607 2 49 ASP QB 2 52 TYR QD 6.800 . 7.300 3.861 3.169 5.411 . 0 0 "[ . 1 . 2]" 1
1608 2 49 ASP QB 2 52 TYR QE 6.800 . 7.300 5.188 4.122 5.435 . 0 0 "[ . 1 . 2]" 1
1609 2 50 GLU H 2 50 GLU QG 4.690 . 5.190 2.716 2.068 4.191 . 0 0 "[ . 1 . 2]" 1
1610 2 50 GLU HA 2 51 VAL H 3.500 . 4.000 3.440 2.948 3.558 . 0 0 "[ . 1 . 2]" 1
1611 2 50 GLU QG 2 51 VAL H 5.030 . 5.530 3.854 2.348 4.504 . 0 0 "[ . 1 . 2]" 1
1612 2 51 VAL HA 2 52 TYR H 3.540 . 4.040 3.366 3.121 3.594 . 0 0 "[ . 1 . 2]" 1
1613 2 52 TYR H 2 53 VAL H 4.920 . 5.420 2.241 1.783 2.676 0.017 3 0 "[ . 1 . 2]" 1
1614 2 52 TYR HA 2 53 VAL HA 5.200 . 5.700 4.744 4.639 4.861 . 0 0 "[ . 1 . 2]" 1
1615 2 52 TYR QB 2 53 VAL H 4.160 . 4.660 2.979 2.475 3.778 . 0 0 "[ . 1 . 2]" 1
1616 2 52 TYR QD 2 53 VAL H 6.170 . 6.670 3.954 2.588 4.802 . 0 0 "[ . 1 . 2]" 1
1617 2 52 TYR QD 2 53 VAL HA 6.120 . 6.620 4.262 3.644 5.440 . 0 0 "[ . 1 . 2]" 1
1618 2 55 ARG HA 2 55 ARG QD 4.830 . 5.330 3.520 2.102 4.384 . 0 0 "[ . 1 . 2]" 1
1619 2 55 ARG HA 2 56 PRO QD 3.150 . 3.650 2.187 1.999 2.834 . 0 0 "[ . 1 . 2]" 1
1620 2 55 ARG QB 2 56 PRO QD 4.740 . 5.240 3.021 2.024 3.857 . 0 0 "[ . 1 . 2]" 1
1621 2 55 ARG QG 2 56 PRO QD 5.690 . 6.190 3.534 2.151 4.499 . 0 0 "[ . 1 . 2]" 1
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