NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
529713 |
2lml   |
16860 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lml
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 1126
_Distance_constraint_stats_list.Viol_count 457
_Distance_constraint_stats_list.Viol_total 897.455
_Distance_constraint_stats_list.Viol_max 0.408
_Distance_constraint_stats_list.Viol_rms 0.0177
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0020
_Distance_constraint_stats_list.Viol_average_violations_only 0.0982
_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 2 PRO 1.071 0.264 5 0 "[ . 1 . 2]"
1 3 THR 1.058 0.254 19 0 "[ . 1 . 2]"
1 4 LEU 0.578 0.282 4 0 "[ . 1 . 2]"
1 5 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 6 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 LEU 0.927 0.183 20 0 "[ . 1 . 2]"
1 8 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 ILE 1.126 0.215 4 0 "[ . 1 . 2]"
1 11 PHE 0.033 0.033 8 0 "[ . 1 . 2]"
1 12 ARG 0.091 0.091 8 0 "[ . 1 . 2]"
1 13 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 VAL 0.115 0.077 20 0 "[ . 1 . 2]"
1 15 PHE 0.123 0.104 17 0 "[ . 1 . 2]"
1 16 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 18 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 ILE 0.153 0.091 8 0 "[ . 1 . 2]"
1 21 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 LEU 0.612 0.282 4 0 "[ . 1 . 2]"
1 23 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 ARG 0.281 0.111 14 0 "[ . 1 . 2]"
1 25 GLU 0.120 0.068 10 0 "[ . 1 . 2]"
1 26 THR 0.066 0.064 7 0 "[ . 1 . 2]"
1 27 SER 0.542 0.153 2 0 "[ . 1 . 2]"
1 28 ALA 1.823 0.408 7 0 "[ . 1 . 2]"
1 29 ASN 0.919 0.408 7 0 "[ . 1 . 2]"
1 30 ASP 0.545 0.153 2 0 "[ . 1 . 2]"
1 31 ILE 0.092 0.062 17 0 "[ . 1 . 2]"
1 32 ASP 0.133 0.133 8 0 "[ . 1 . 2]"
1 33 ALA 0.256 0.133 8 0 "[ . 1 . 2]"
1 34 TRP 0.700 0.116 9 0 "[ . 1 . 2]"
1 35 ASP 0.244 0.082 10 0 "[ . 1 . 2]"
1 36 SER 0.408 0.198 14 0 "[ . 1 . 2]"
1 37 LEU 0.087 0.038 15 0 "[ . 1 . 2]"
1 38 SER 0.146 0.080 2 0 "[ . 1 . 2]"
1 39 HIS 0.870 0.215 19 0 "[ . 1 . 2]"
1 40 MET 0.374 0.100 15 0 "[ . 1 . 2]"
1 41 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 LEU 2.759 0.286 9 0 "[ . 1 . 2]"
1 43 ILE 0.263 0.079 11 0 "[ . 1 . 2]"
1 44 VAL 4.489 0.155 10 0 "[ . 1 . 2]"
1 45 SER 2.091 0.155 10 0 "[ . 1 . 2]"
1 46 LEU 1.686 0.286 9 0 "[ . 1 . 2]"
1 47 GLU 1.865 0.164 4 0 "[ . 1 . 2]"
1 48 VAL 3.226 0.138 11 0 "[ . 1 . 2]"
1 49 HIS 0.379 0.052 19 0 "[ . 1 . 2]"
1 50 TYR 0.787 0.084 7 0 "[ . 1 . 2]"
1 51 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 ILE 1.577 0.164 4 0 "[ . 1 . 2]"
1 53 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 PHE 6.101 0.275 20 0 "[ . 1 . 2]"
1 55 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 LEU 4.161 0.349 3 0 "[ . 1 . 2]"
1 57 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 LEU 6.995 0.349 3 0 "[ . 1 . 2]"
1 60 GLN 0.085 0.069 4 0 "[ . 1 . 2]"
1 61 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 LEU 0.218 0.068 11 0 "[ . 1 . 2]"
1 63 LYS 1.947 0.355 18 0 "[ . 1 . 2]"
1 64 ASN 3.080 0.294 9 0 "[ . 1 . 2]"
1 65 VAL 0.319 0.094 4 0 "[ . 1 . 2]"
1 66 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 ASP 0.129 0.068 11 0 "[ . 1 . 2]"
1 68 LEU 4.460 0.305 9 0 "[ . 1 . 2]"
1 69 ALA 1.282 0.264 5 0 "[ . 1 . 2]"
1 70 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 LEU 3.133 0.213 5 0 "[ . 1 . 2]"
1 72 VAL 4.851 0.305 9 0 "[ . 1 . 2]"
1 73 ASP 0.030 0.030 17 0 "[ . 1 . 2]"
1 74 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 LYS 0.921 0.255 3 0 "[ . 1 . 2]"
1 76 LEU 0.434 0.118 11 0 "[ . 1 . 2]"
1 77 ALA 0.044 0.044 9 0 "[ . 1 . 2]"
1 78 ARG 0.598 0.255 3 0 "[ . 1 . 2]"
1 79 LYS 0.473 0.132 4 0 "[ . 1 . 2]"
1 80 LEU 0.901 0.264 20 0 "[ . 1 . 2]"
1 81 GLU 0.654 0.264 20 0 "[ . 1 . 2]"
2 1 PNS 8.031 0.355 18 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 28 ALA MB 2 1 PNS H36 1.800 . 5.000 4.299 3.725 5.020 0.020 20 0 "[ . 1 . 2]" 1
2 1 28 ALA MB 2 1 PNS H371 1.800 . 5.000 4.324 2.805 5.217 0.217 11 0 "[ . 1 . 2]" 1
3 1 28 ALA MB 2 1 PNS H381 1.800 . 5.000 4.581 3.904 5.128 0.128 15 0 "[ . 1 . 2]" 1
4 1 28 ALA MB 2 1 PNS H41 1.800 . 5.000 4.032 2.743 4.732 . 0 0 "[ . 1 . 2]" 1
5 1 36 SER HA 2 1 PNS H281 1.800 . 4.000 3.293 1.845 4.198 0.198 14 0 "[ . 1 . 2]" 1
6 1 36 SER QB 2 1 PNS H281 1.800 . 5.000 3.771 2.413 4.451 . 0 0 "[ . 1 . 2]" 1
7 1 63 LYS HA 2 1 PNS H381 1.800 . 3.000 2.222 1.723 3.149 0.149 11 0 "[ . 1 . 2]" 1
8 1 63 LYS HA 2 1 PNS H41 1.800 . 3.000 2.939 2.499 3.355 0.355 18 0 "[ . 1 . 2]" 1
9 1 64 ASN HA 2 1 PNS H421 1.800 . 4.000 3.460 2.866 4.144 0.144 13 0 "[ . 1 . 2]" 1
10 1 64 ASN HA 2 1 PNS H431 1.800 . 3.000 2.511 1.966 3.294 0.294 9 0 "[ . 1 . 2]" 1
11 1 64 ASN HA 2 1 PNS H432 1.800 . 3.000 2.816 1.619 3.173 0.181 9 0 "[ . 1 . 2]" 1
12 2 1 PNS H371 2 1 PNS H41 1.800 . 5.000 3.337 2.215 4.071 . 0 0 "[ . 1 . 2]" 1
13 2 1 PNS H381 2 1 PNS H41 1.800 . 4.000 2.328 2.137 2.558 . 0 0 "[ . 1 . 2]" 1
14 2 1 PNS H41 2 1 PNS H421 1.800 . 3.000 2.649 2.281 2.958 . 0 0 "[ . 1 . 2]" 1
15 2 1 PNS H41 2 1 PNS H422 1.800 . 3.000 2.772 2.309 2.966 . 0 0 "[ . 1 . 2]" 1
16 2 1 PNS H41 2 1 PNS H431 1.800 . 4.000 2.731 2.306 3.272 . 0 0 "[ . 1 . 2]" 1
17 2 1 PNS H32 2 1 PNS H36 1.800 . 4.000 3.197 2.405 3.660 . 0 0 "[ . 1 . 2]" 1
18 2 1 PNS H36 2 1 PNS H371 1.800 . 3.000 2.723 2.281 2.901 . 0 0 "[ . 1 . 2]" 1
19 2 1 PNS H36 2 1 PNS H372 1.800 . 3.000 2.683 2.250 2.963 . 0 0 "[ . 1 . 2]" 1
20 2 1 PNS H36 2 1 PNS H381 1.800 . 3.000 2.759 2.334 3.318 0.318 1 0 "[ . 1 . 2]" 1
21 2 1 PNS H421 2 1 PNS H431 1.800 . 5.000 2.039 2.007 2.100 . 0 0 "[ . 1 . 2]" 1
22 1 2 PRO QB 1 76 LEU MD1 1.800 . 7.800 4.757 3.110 6.738 . 0 0 "[ . 1 . 2]" 1
23 1 2 PRO QB 1 6 ALA MB 1.800 . 5.410 3.132 1.899 4.379 . 0 0 "[ . 1 . 2]" 1
24 1 2 PRO QD 1 69 ALA MB 1.800 . 6.560 6.388 5.363 6.824 0.264 5 0 "[ . 1 . 2]" 1
25 1 2 PRO QD 1 72 VAL MG1 1.800 . 7.800 5.385 4.279 6.346 . 0 0 "[ . 1 . 2]" 1
26 1 2 PRO QD 1 72 VAL MG2 1.800 . 7.800 7.329 6.364 7.931 0.131 14 0 "[ . 1 . 2]" 1
27 1 2 PRO QD 1 73 ASP H 1.800 . 7.800 6.310 5.500 7.548 . 0 0 "[ . 1 . 2]" 1
28 1 2 PRO QG 1 72 VAL MG1 1.800 . 7.800 5.258 3.871 6.638 . 0 0 "[ . 1 . 2]" 1
29 1 3 THR HA 1 3 THR MG 1.800 . 3.390 2.319 2.241 2.383 . 0 0 "[ . 1 . 2]" 1
30 1 3 THR HA 1 6 ALA MB 1.800 . 5.060 3.399 2.650 4.723 . 0 0 "[ . 1 . 2]" 1
31 1 3 THR HA 1 6 ALA H 1.800 . 6.050 3.982 3.402 4.784 . 0 0 "[ . 1 . 2]" 1
32 1 3 THR HB 1 4 LEU H 1.800 . 4.630 2.989 2.136 3.866 . 0 0 "[ . 1 . 2]" 1
33 1 3 THR HB 1 5 ASP H 1.800 . 6.550 5.224 4.641 5.967 . 0 0 "[ . 1 . 2]" 1
34 1 3 THR HB 1 69 ALA MB 1.800 . 5.000 2.648 1.725 4.008 0.075 17 0 "[ . 1 . 2]" 1
35 1 3 THR MG 1 4 LEU H 1.800 . 5.360 3.859 3.538 4.113 . 0 0 "[ . 1 . 2]" 1
36 1 3 THR MG 1 6 ALA MB 1.800 . 6.740 4.643 3.645 5.613 . 0 0 "[ . 1 . 2]" 1
37 1 3 THR MG 1 6 ALA H 1.800 . 6.050 5.438 4.761 6.017 . 0 0 "[ . 1 . 2]" 1
38 1 3 THR MG 1 7 LEU MD1 1.800 . 5.030 3.961 2.130 5.143 0.113 18 0 "[ . 1 . 2]" 1
39 1 3 THR MG 1 7 LEU HG 1.800 . 6.200 4.497 2.369 5.839 . 0 0 "[ . 1 . 2]" 1
40 1 3 THR MG 1 69 ALA HA 1.800 . 4.410 3.232 1.931 4.238 . 0 0 "[ . 1 . 2]" 1
41 1 3 THR MG 1 69 ALA MB 1.800 . 5.210 3.301 2.746 4.028 . 0 0 "[ . 1 . 2]" 1
42 1 3 THR MG 1 72 VAL HB 1.800 . 4.510 3.320 1.983 4.764 0.254 19 0 "[ . 1 . 2]" 1
43 1 3 THR MG 1 72 VAL MG1 1.800 . 6.000 3.350 2.157 5.002 . 0 0 "[ . 1 . 2]" 1
44 1 4 LEU HA 1 4 LEU MD1 1.800 . 4.280 3.930 3.896 3.961 . 0 0 "[ . 1 . 2]" 1
45 1 4 LEU HA 1 4 LEU MD2 1.800 . 4.280 2.090 2.031 2.157 . 0 0 "[ . 1 . 2]" 1
46 1 4 LEU HA 1 7 LEU MD1 1.800 . 5.370 2.631 2.085 3.347 . 0 0 "[ . 1 . 2]" 1
47 1 4 LEU HA 1 7 LEU H 1.800 . 4.360 3.471 3.043 4.112 . 0 0 "[ . 1 . 2]" 1
48 1 4 LEU HA 1 65 VAL MG1 1.800 . 5.280 3.644 3.039 4.155 . 0 0 "[ . 1 . 2]" 1
49 1 4 LEU HA 1 69 ALA MB 1.800 . 6.000 3.886 2.912 4.480 . 0 0 "[ . 1 . 2]" 1
50 1 4 LEU QB 1 4 LEU MD2 1.800 . 3.650 2.390 2.336 2.429 . 0 0 "[ . 1 . 2]" 1
51 1 4 LEU QB 1 6 ALA H 1.800 . 5.920 4.896 4.524 5.221 . 0 0 "[ . 1 . 2]" 1
52 1 4 LEU HB3 1 4 LEU MD1 1.800 . 3.940 2.435 2.400 2.480 . 0 0 "[ . 1 . 2]" 1
53 1 4 LEU HB2 1 4 LEU MD1 1.800 . 3.940 2.383 2.332 2.433 . 0 0 "[ . 1 . 2]" 1
54 1 4 LEU MD1 1 22 LEU QB 1.800 . 4.000 3.422 2.963 4.015 0.015 4 0 "[ . 1 . 2]" 1
55 1 4 LEU MD1 1 22 LEU MD1 1.800 . 5.010 4.672 4.219 5.292 0.282 4 0 "[ . 1 . 2]" 1
56 1 4 LEU MD1 1 23 THR HA 1.800 . 4.420 2.566 2.027 3.594 . 0 0 "[ . 1 . 2]" 1
57 1 4 LEU MD1 1 23 THR HB 1.800 . 6.070 4.496 3.942 5.475 . 0 0 "[ . 1 . 2]" 1
58 1 4 LEU MD1 1 23 THR MG 1.800 . 7.010 4.110 3.321 4.976 . 0 0 "[ . 1 . 2]" 1
59 1 4 LEU MD1 1 24 ARG HA 1.800 . 4.690 3.372 2.601 4.301 . 0 0 "[ . 1 . 2]" 1
60 1 4 LEU MD1 1 24 ARG QG 1.800 . 5.360 2.598 1.832 4.187 . 0 0 "[ . 1 . 2]" 1
61 1 4 LEU MD1 1 24 ARG H 1.800 . 5.450 3.216 2.653 4.099 . 0 0 "[ . 1 . 2]" 1
62 1 4 LEU MD1 1 69 ALA MB 1.800 . 5.010 3.438 2.664 4.184 . 0 0 "[ . 1 . 2]" 1
63 1 4 LEU MD2 1 22 LEU HB3 1.800 . 5.330 2.454 2.044 3.305 . 0 0 "[ . 1 . 2]" 1
64 1 4 LEU MD2 1 22 LEU HB2 1.800 . 5.330 3.225 2.802 3.965 . 0 0 "[ . 1 . 2]" 1
65 1 4 LEU MD2 1 22 LEU MD1 1.800 . 5.000 3.073 2.586 3.699 . 0 0 "[ . 1 . 2]" 1
66 1 4 LEU MD2 1 23 THR HA 1.800 . 5.000 3.876 3.304 4.557 . 0 0 "[ . 1 . 2]" 1
67 1 4 LEU MD2 1 23 THR MG 1.800 . 6.450 5.192 4.656 5.690 . 0 0 "[ . 1 . 2]" 1
68 1 4 LEU MD2 1 24 ARG HA 1.800 . 4.530 3.187 2.393 3.877 . 0 0 "[ . 1 . 2]" 1
69 1 4 LEU MD2 1 24 ARG QG 1.800 . 4.980 3.528 2.424 5.059 0.079 4 0 "[ . 1 . 2]" 1
70 1 4 LEU MD2 1 24 ARG H 1.800 . 4.830 4.325 3.693 4.941 0.111 14 0 "[ . 1 . 2]" 1
71 1 4 LEU MD2 1 65 VAL HB 1.800 . 5.280 3.430 3.095 3.835 . 0 0 "[ . 1 . 2]" 1
72 1 4 LEU MD2 1 69 ALA MB 1.800 . 4.060 2.047 1.845 2.210 . 0 0 "[ . 1 . 2]" 1
73 1 4 LEU H 1 4 LEU QB 1.800 . 3.420 2.486 2.414 2.588 . 0 0 "[ . 1 . 2]" 1
74 1 4 LEU H 1 4 LEU MD1 1.800 . 4.960 3.723 3.590 3.882 . 0 0 "[ . 1 . 2]" 1
75 1 4 LEU H 1 4 LEU MD2 1.800 . 4.620 3.322 3.096 3.571 . 0 0 "[ . 1 . 2]" 1
76 1 4 LEU H 1 4 LEU HG 1.800 . 5.480 2.369 2.128 2.663 . 0 0 "[ . 1 . 2]" 1
77 1 4 LEU H 1 5 ASP H 1.800 . 5.080 2.641 2.257 2.864 . 0 0 "[ . 1 . 2]" 1
78 1 5 ASP HA 1 8 THR HG1 1.800 . 4.290 3.279 2.448 4.073 . 0 0 "[ . 1 . 2]" 1
79 1 5 ASP HA 1 8 THR H 1.800 . 4.740 3.866 3.075 4.307 . 0 0 "[ . 1 . 2]" 1
80 1 5 ASP QB 1 6 ALA H 1.800 . 3.630 2.466 2.218 3.618 . 0 0 "[ . 1 . 2]" 1
81 1 5 ASP H 1 6 ALA H 1.800 . 4.030 2.842 2.563 2.992 . 0 0 "[ . 1 . 2]" 1
82 1 6 ALA HA 1 8 THR H 1.800 . 5.320 4.243 4.023 4.473 . 0 0 "[ . 1 . 2]" 1
83 1 6 ALA HA 1 9 PRO HD3 1.800 . 4.910 4.119 3.848 4.618 . 0 0 "[ . 1 . 2]" 1
84 1 6 ALA HA 1 9 PRO HD2 1.800 . 4.910 3.280 2.964 3.625 . 0 0 "[ . 1 . 2]" 1
85 1 6 ALA HA 1 9 PRO QG 1.800 . 5.330 3.567 2.743 4.093 . 0 0 "[ . 1 . 2]" 1
86 1 6 ALA MB 1 7 LEU H 1.800 . 3.780 2.828 2.654 3.135 . 0 0 "[ . 1 . 2]" 1
87 1 6 ALA MB 1 8 THR H 1.800 . 6.100 4.612 4.416 4.871 . 0 0 "[ . 1 . 2]" 1
88 1 6 ALA MB 1 50 TYR QE 1.800 . 4.790 2.575 1.999 3.033 . 0 0 "[ . 1 . 2]" 1
89 1 6 ALA H 1 6 ALA MB 1.800 . 3.080 2.265 2.229 2.328 . 0 0 "[ . 1 . 2]" 1
90 1 6 ALA H 1 7 LEU MD2 1.800 . 7.050 5.129 4.749 5.592 . 0 0 "[ . 1 . 2]" 1
91 1 6 ALA H 1 7 LEU H 1.800 . 3.620 2.514 2.317 2.693 . 0 0 "[ . 1 . 2]" 1
92 1 7 LEU HA 1 7 LEU MD1 1.800 . 5.730 3.914 3.824 3.969 . 0 0 "[ . 1 . 2]" 1
93 1 7 LEU HA 1 7 LEU MD2 1.800 . 4.040 2.069 1.991 2.164 . 0 0 "[ . 1 . 2]" 1
94 1 7 LEU HA 1 9 PRO QD 1.800 . 5.410 3.921 3.768 4.085 . 0 0 "[ . 1 . 2]" 1
95 1 7 LEU HA 1 10 ILE HB 1.800 . 5.500 2.850 2.566 3.201 . 0 0 "[ . 1 . 2]" 1
96 1 7 LEU HA 1 10 ILE MD 1.800 . 4.200 4.078 2.396 4.383 0.183 20 0 "[ . 1 . 2]" 1
97 1 7 LEU HA 1 10 ILE H 1.800 . 4.620 3.534 3.343 3.718 . 0 0 "[ . 1 . 2]" 1
98 1 7 LEU QB 1 7 LEU MD2 1.800 . 3.810 2.410 2.344 2.498 . 0 0 "[ . 1 . 2]" 1
99 1 7 LEU QB 1 11 PHE H 1.800 . 5.390 4.318 4.134 4.489 . 0 0 "[ . 1 . 2]" 1
100 1 7 LEU HB3 1 7 LEU MD1 1.800 . 4.220 2.414 2.332 2.468 . 0 0 "[ . 1 . 2]" 1
101 1 7 LEU HB3 1 8 THR H 1.800 . 4.920 3.892 3.598 4.123 . 0 0 "[ . 1 . 2]" 1
102 1 7 LEU HB3 1 22 LEU MD1 1.800 . 4.570 2.509 2.329 2.965 . 0 0 "[ . 1 . 2]" 1
103 1 7 LEU HB2 1 7 LEU MD1 1.800 . 4.220 2.398 2.335 2.484 . 0 0 "[ . 1 . 2]" 1
104 1 7 LEU HB2 1 8 THR H 1.800 . 4.920 3.007 2.775 3.226 . 0 0 "[ . 1 . 2]" 1
105 1 7 LEU HB2 1 22 LEU MD1 1.800 . 4.570 2.364 2.061 2.779 . 0 0 "[ . 1 . 2]" 1
106 1 7 LEU MD1 1 8 THR H 1.800 . 5.700 4.927 4.744 5.109 . 0 0 "[ . 1 . 2]" 1
107 1 7 LEU MD1 1 11 PHE QE 1.800 . 4.440 2.837 2.373 3.144 . 0 0 "[ . 1 . 2]" 1
108 1 7 LEU MD2 1 8 THR H 1.800 . 6.470 4.792 4.665 4.896 . 0 0 "[ . 1 . 2]" 1
109 1 7 LEU MD2 1 10 ILE H 1.800 . 6.270 4.968 4.767 5.251 . 0 0 "[ . 1 . 2]" 1
110 1 7 LEU MD2 1 11 PHE QD 1.800 . 5.000 3.873 3.557 4.637 . 0 0 "[ . 1 . 2]" 1
111 1 7 LEU MD2 1 11 PHE QE 1.800 . 5.000 2.399 1.802 3.586 . 0 0 "[ . 1 . 2]" 1
112 1 7 LEU MD2 1 11 PHE H 1.800 . 6.400 5.172 4.920 5.670 . 0 0 "[ . 1 . 2]" 1
113 1 7 LEU H 1 7 LEU HB3 1.800 . 4.170 3.630 3.601 3.662 . 0 0 "[ . 1 . 2]" 1
114 1 7 LEU H 1 7 LEU HB2 1.800 . 4.170 2.460 2.397 2.568 . 0 0 "[ . 1 . 2]" 1
115 1 7 LEU H 1 7 LEU MD1 1.800 . 4.480 3.840 3.636 4.010 . 0 0 "[ . 1 . 2]" 1
116 1 7 LEU H 1 7 LEU MD2 1.800 . 4.620 3.462 3.083 3.713 . 0 0 "[ . 1 . 2]" 1
117 1 7 LEU H 1 7 LEU HG 1.800 . 4.650 2.605 2.389 2.874 . 0 0 "[ . 1 . 2]" 1
118 1 7 LEU H 1 8 THR H 1.800 . 3.790 2.533 2.419 2.655 . 0 0 "[ . 1 . 2]" 1
119 1 7 LEU H 1 22 LEU MD1 1.800 . 5.500 3.949 3.599 4.379 . 0 0 "[ . 1 . 2]" 1
120 1 8 THR HA 1 8 THR HG1 1.800 . 3.930 2.844 2.356 3.437 . 0 0 "[ . 1 . 2]" 1
121 1 8 THR HA 1 8 THR MG 1.800 . 3.690 2.464 2.388 2.587 . 0 0 "[ . 1 . 2]" 1
122 1 8 THR HA 1 9 PRO QG 1.800 . 5.790 5.340 5.207 5.453 . 0 0 "[ . 1 . 2]" 1
123 1 8 THR HA 1 22 LEU MD1 1.800 . 5.540 2.227 2.017 2.414 . 0 0 "[ . 1 . 2]" 1
124 1 8 THR HB 1 22 LEU MD1 1.800 . 4.490 4.138 3.972 4.411 . 0 0 "[ . 1 . 2]" 1
125 1 8 THR HB 1 22 LEU HG 1.800 . 5.980 4.913 4.276 5.645 . 0 0 "[ . 1 . 2]" 1
126 1 8 THR HB 1 22 LEU H 1.800 . 7.860 5.231 4.223 6.337 . 0 0 "[ . 1 . 2]" 1
127 1 8 THR HG1 1 9 PRO HD3 1.800 . 5.090 4.131 3.527 4.748 . 0 0 "[ . 1 . 2]" 1
128 1 8 THR HG1 1 9 PRO HD2 1.800 . 5.090 4.496 3.899 4.984 . 0 0 "[ . 1 . 2]" 1
129 1 8 THR HG1 1 22 LEU MD1 1.800 . 4.920 2.633 1.924 3.388 . 0 0 "[ . 1 . 2]" 1
130 1 8 THR HG1 1 22 LEU H 1.800 . 5.180 3.999 3.008 4.723 . 0 0 "[ . 1 . 2]" 1
131 1 8 THR HG1 1 8 THR MG 1.800 . 4.310 2.931 2.800 3.054 . 0 0 "[ . 1 . 2]" 1
132 1 8 THR MG 1 9 PRO HA 1.800 . 5.290 3.744 3.447 3.977 . 0 0 "[ . 1 . 2]" 1
133 1 8 THR MG 1 9 PRO HD3 1.800 . 4.770 3.290 2.965 3.520 . 0 0 "[ . 1 . 2]" 1
134 1 8 THR MG 1 9 PRO HD2 1.800 . 4.770 4.256 3.918 4.626 . 0 0 "[ . 1 . 2]" 1
135 1 8 THR MG 1 10 ILE H 1.800 . 6.010 4.990 4.818 5.160 . 0 0 "[ . 1 . 2]" 1
136 1 8 THR MG 1 12 ARG QD 1.800 . 5.020 2.453 2.037 2.942 . 0 0 "[ . 1 . 2]" 1
137 1 8 THR MG 1 12 ARG HE 1.800 . 4.710 2.778 1.921 4.435 . 0 0 "[ . 1 . 2]" 1
138 1 8 THR MG 1 12 ARG QG 1.800 . 5.320 2.745 2.458 3.161 . 0 0 "[ . 1 . 2]" 1
139 1 8 THR MG 1 12 ARG H 1.800 . 5.720 4.158 3.947 4.392 . 0 0 "[ . 1 . 2]" 1
140 1 8 THR MG 1 20 ILE MG 1.800 . 4.990 3.295 2.261 4.333 . 0 0 "[ . 1 . 2]" 1
141 1 8 THR MG 1 21 VAL HA 1.800 . 4.410 3.041 2.161 4.197 . 0 0 "[ . 1 . 2]" 1
142 1 8 THR MG 1 22 LEU MD1 1.800 . 4.940 3.600 3.315 3.774 . 0 0 "[ . 1 . 2]" 1
143 1 8 THR H 1 8 THR HB 1.800 . 4.020 2.626 2.463 2.741 . 0 0 "[ . 1 . 2]" 1
144 1 8 THR H 1 8 THR HG1 1.800 . 3.550 2.300 1.966 2.720 . 0 0 "[ . 1 . 2]" 1
145 1 8 THR H 1 8 THR MG 1.800 . 4.400 3.828 3.804 3.851 . 0 0 "[ . 1 . 2]" 1
146 1 8 THR H 1 9 PRO HD3 1.800 . 4.200 3.198 2.837 3.712 . 0 0 "[ . 1 . 2]" 1
147 1 8 THR H 1 9 PRO HD2 1.800 . 4.200 2.735 2.325 3.164 . 0 0 "[ . 1 . 2]" 1
148 1 8 THR H 1 9 PRO QG 1.800 . 4.920 4.470 4.128 4.691 . 0 0 "[ . 1 . 2]" 1
149 1 8 THR H 1 10 ILE H 1.800 . 5.380 4.190 4.099 4.289 . 0 0 "[ . 1 . 2]" 1
150 1 8 THR H 1 22 LEU MD1 1.800 . 4.430 2.862 2.677 3.064 . 0 0 "[ . 1 . 2]" 1
151 1 9 PRO HA 1 11 PHE H 1.800 . 5.380 4.681 4.496 4.918 . 0 0 "[ . 1 . 2]" 1
152 1 9 PRO HA 1 12 ARG QD 1.800 . 4.710 3.042 2.428 3.779 . 0 0 "[ . 1 . 2]" 1
153 1 9 PRO HA 1 12 ARG H 1.800 . 5.490 3.725 3.341 4.123 . 0 0 "[ . 1 . 2]" 1
154 1 9 PRO QB 1 10 ILE H 1.800 . 3.970 3.014 2.571 3.413 . 0 0 "[ . 1 . 2]" 1
155 1 9 PRO HD3 1 10 ILE H 1.800 . 4.660 4.051 3.863 4.210 . 0 0 "[ . 1 . 2]" 1
156 1 9 PRO HD2 1 10 ILE H 1.800 . 4.660 2.881 2.608 3.166 . 0 0 "[ . 1 . 2]" 1
157 1 9 PRO QG 1 10 ILE H 1.800 . 4.820 3.488 2.509 4.095 . 0 0 "[ . 1 . 2]" 1
158 1 10 ILE HA 1 10 ILE MD 1.800 . 4.620 2.277 2.113 3.882 . 0 0 "[ . 1 . 2]" 1
159 1 10 ILE HA 1 10 ILE HG13 1.800 . 4.330 3.803 3.115 3.904 . 0 0 "[ . 1 . 2]" 1
160 1 10 ILE HA 1 10 ILE HG12 1.800 . 4.330 3.141 2.570 3.352 . 0 0 "[ . 1 . 2]" 1
161 1 10 ILE HA 1 10 ILE MG 1.800 . 3.610 2.459 2.337 2.520 . 0 0 "[ . 1 . 2]" 1
162 1 10 ILE HA 1 12 ARG H 1.800 . 5.830 4.729 4.527 4.871 . 0 0 "[ . 1 . 2]" 1
163 1 10 ILE HA 1 13 GLN QB 1.800 . 4.110 2.856 2.619 3.190 . 0 0 "[ . 1 . 2]" 1
164 1 10 ILE HA 1 13 GLN H 1.800 . 4.430 3.666 3.410 3.842 . 0 0 "[ . 1 . 2]" 1
165 1 10 ILE HA 1 14 VAL H 1.800 . 6.050 4.173 3.988 4.506 . 0 0 "[ . 1 . 2]" 1
166 1 10 ILE HB 1 10 ILE MD 1.800 . 3.760 3.239 2.509 3.288 . 0 0 "[ . 1 . 2]" 1
167 1 10 ILE HB 1 11 PHE QD 1.800 . 4.630 2.344 1.911 2.815 . 0 0 "[ . 1 . 2]" 1
168 1 10 ILE HB 1 11 PHE H 1.800 . 4.000 2.494 2.343 2.660 . 0 0 "[ . 1 . 2]" 1
169 1 10 ILE MD 1 46 LEU MD2 1.800 . 4.040 3.157 2.101 3.730 . 0 0 "[ . 1 . 2]" 1
170 1 10 ILE MD 1 49 HIS HB3 1.800 . 5.050 3.269 2.879 4.056 . 0 0 "[ . 1 . 2]" 1
171 1 10 ILE MD 1 49 HIS HB2 1.800 . 5.050 3.242 2.836 3.780 . 0 0 "[ . 1 . 2]" 1
172 1 10 ILE MD 1 49 HIS HD2 1.800 . 4.490 3.726 2.776 4.427 . 0 0 "[ . 1 . 2]" 1
173 1 10 ILE MD 1 50 TYR QE 1.800 . 4.250 2.966 2.318 4.276 0.026 8 0 "[ . 1 . 2]" 1
174 1 10 ILE HG13 1 11 PHE H 1.800 . 5.730 4.799 4.249 4.934 . 0 0 "[ . 1 . 2]" 1
175 1 10 ILE HG12 1 11 PHE H 1.800 . 5.730 4.174 3.890 5.007 . 0 0 "[ . 1 . 2]" 1
176 1 10 ILE MD 1 10 ILE MG 1.800 . 3.300 2.108 1.993 2.163 . 0 0 "[ . 1 . 2]" 1
177 1 10 ILE HG13 1 10 ILE MG 1.800 . 4.610 2.463 2.393 3.263 . 0 0 "[ . 1 . 2]" 1
178 1 10 ILE HG12 1 10 ILE MG 1.800 . 4.610 3.224 2.486 3.272 . 0 0 "[ . 1 . 2]" 1
179 1 10 ILE MG 1 11 PHE H 1.800 . 4.600 3.440 3.126 3.736 . 0 0 "[ . 1 . 2]" 1
180 1 10 ILE MG 1 14 VAL MG1 1.800 . 5.680 4.468 4.233 5.089 . 0 0 "[ . 1 . 2]" 1
181 1 10 ILE MG 1 42 LEU HA 1.800 . 5.440 3.515 3.144 4.093 . 0 0 "[ . 1 . 2]" 1
182 1 10 ILE MG 1 42 LEU MD2 1.800 . 4.150 2.732 1.892 4.365 0.215 4 0 "[ . 1 . 2]" 1
183 1 10 ILE MG 1 45 SER QB 1.800 . 3.990 2.234 1.965 2.474 . 0 0 "[ . 1 . 2]" 1
184 1 10 ILE MG 1 46 LEU MD2 1.800 . 3.690 1.914 1.743 2.205 0.057 15 0 "[ . 1 . 2]" 1
185 1 10 ILE MG 1 46 LEU HG 1.800 . 5.180 3.068 2.016 3.680 . 0 0 "[ . 1 . 2]" 1
186 1 10 ILE MG 1 46 LEU H 1.800 . 5.640 3.742 3.164 4.094 . 0 0 "[ . 1 . 2]" 1
187 1 10 ILE H 1 10 ILE HB 1.800 . 3.340 2.624 2.547 2.825 . 0 0 "[ . 1 . 2]" 1
188 1 10 ILE H 1 10 ILE MD 1.800 . 4.150 3.263 2.926 3.745 . 0 0 "[ . 1 . 2]" 1
189 1 10 ILE H 1 10 ILE QG 1.800 . 3.320 2.164 2.045 2.297 . 0 0 "[ . 1 . 2]" 1
190 1 10 ILE H 1 10 ILE MG 1.800 . 4.370 3.854 3.831 3.876 . 0 0 "[ . 1 . 2]" 1
191 1 10 ILE H 1 11 PHE QB 1.800 . 5.260 4.551 4.386 4.733 . 0 0 "[ . 1 . 2]" 1
192 1 10 ILE H 1 11 PHE H 1.800 . 3.520 2.648 2.541 2.835 . 0 0 "[ . 1 . 2]" 1
193 1 10 ILE H 1 12 ARG H 1.800 . 4.800 4.074 3.910 4.206 . 0 0 "[ . 1 . 2]" 1
194 1 11 PHE HA 1 11 PHE QD 1.800 . 4.580 3.103 3.025 3.189 . 0 0 "[ . 1 . 2]" 1
195 1 11 PHE HA 1 14 VAL HB 1.800 . 4.470 2.754 2.464 3.015 . 0 0 "[ . 1 . 2]" 1
196 1 11 PHE HA 1 14 VAL H 1.800 . 4.720 3.528 3.381 3.693 . 0 0 "[ . 1 . 2]" 1
197 1 11 PHE HA 1 15 PHE H 1.800 . 4.980 3.726 3.432 4.438 . 0 0 "[ . 1 . 2]" 1
198 1 11 PHE HA 1 42 LEU MD2 1.800 . 4.940 2.686 2.135 3.953 . 0 0 "[ . 1 . 2]" 1
199 1 11 PHE QB 1 14 VAL H 1.800 . 6.050 5.105 4.993 5.246 . 0 0 "[ . 1 . 2]" 1
200 1 11 PHE QB 1 20 ILE HB 1.800 . 5.150 3.879 3.398 4.372 . 0 0 "[ . 1 . 2]" 1
201 1 11 PHE HB3 1 12 ARG H 1.800 . 4.620 3.486 3.273 3.623 . 0 0 "[ . 1 . 2]" 1
202 1 11 PHE HB3 1 20 ILE MD 1.800 . 5.870 2.700 1.988 3.595 . 0 0 "[ . 1 . 2]" 1
203 1 11 PHE HB3 1 20 ILE MG 1.800 . 4.870 2.334 1.959 2.757 . 0 0 "[ . 1 . 2]" 1
204 1 11 PHE HB3 1 22 LEU MD1 1.800 . 5.430 3.809 3.406 4.267 . 0 0 "[ . 1 . 2]" 1
205 1 11 PHE QB 1 22 LEU MD2 1.800 . 6.370 2.738 2.306 3.019 . 0 0 "[ . 1 . 2]" 1
206 1 11 PHE HB2 1 12 ARG H 1.800 . 4.620 2.666 2.555 2.813 . 0 0 "[ . 1 . 2]" 1
207 1 11 PHE HB2 1 20 ILE MD 1.800 . 5.870 3.818 3.076 4.658 . 0 0 "[ . 1 . 2]" 1
208 1 11 PHE HB2 1 20 ILE MG 1.800 . 4.870 2.782 2.250 3.451 . 0 0 "[ . 1 . 2]" 1
209 1 11 PHE HB2 1 22 LEU MD1 1.800 . 5.430 2.759 2.258 3.235 . 0 0 "[ . 1 . 2]" 1
210 1 11 PHE QD 1 20 ILE MG 1.800 . 5.740 3.296 2.722 3.794 . 0 0 "[ . 1 . 2]" 1
211 1 11 PHE QD 1 22 LEU MD1 1.800 . 7.090 2.784 2.581 2.958 . 0 0 "[ . 1 . 2]" 1
212 1 11 PHE QD 1 22 LEU MD2 1.800 . 5.430 2.627 2.389 3.010 . 0 0 "[ . 1 . 2]" 1
213 1 11 PHE QD 1 31 ILE MD 1.800 . 5.020 3.338 2.542 4.764 . 0 0 "[ . 1 . 2]" 1
214 1 11 PHE QE 1 22 LEU MD2 1.800 . 5.240 3.298 3.007 3.604 . 0 0 "[ . 1 . 2]" 1
215 1 11 PHE QE 1 65 VAL MG2 1.800 . 5.090 2.141 1.824 2.504 . 0 0 "[ . 1 . 2]" 1
216 1 11 PHE QE 1 68 LEU MD2 1.800 . 5.000 3.823 2.762 4.644 . 0 0 "[ . 1 . 2]" 1
217 1 11 PHE H 1 11 PHE HB3 1.800 . 4.270 3.593 3.574 3.615 . 0 0 "[ . 1 . 2]" 1
218 1 11 PHE H 1 11 PHE HB2 1.800 . 4.270 2.366 2.309 2.406 . 0 0 "[ . 1 . 2]" 1
219 1 11 PHE H 1 11 PHE QD 1.800 . 3.780 2.015 1.916 2.223 . 0 0 "[ . 1 . 2]" 1
220 1 11 PHE H 1 12 ARG QB 1.800 . 5.600 4.522 4.337 4.665 . 0 0 "[ . 1 . 2]" 1
221 1 11 PHE H 1 12 ARG H 1.800 . 4.070 2.624 2.574 2.683 . 0 0 "[ . 1 . 2]" 1
222 1 11 PHE H 1 13 GLN H 1.800 . 4.910 3.971 3.808 4.219 . 0 0 "[ . 1 . 2]" 1
223 1 11 PHE H 1 22 LEU MD1 1.800 . 5.370 3.709 3.416 3.949 . 0 0 "[ . 1 . 2]" 1
224 1 11 PHE HZ 1 42 LEU MD1 1.800 . 4.790 2.754 2.386 3.574 . 0 0 "[ . 1 . 2]" 1
225 1 11 PHE HZ 1 65 VAL MG2 1.800 . 5.470 2.965 2.431 3.703 . 0 0 "[ . 1 . 2]" 1
226 1 11 PHE HZ 1 68 LEU MD2 1.800 . 4.480 3.209 1.767 3.914 0.033 8 0 "[ . 1 . 2]" 1
227 1 12 ARG HA 1 15 PHE H 1.800 . 5.080 4.138 3.702 4.507 . 0 0 "[ . 1 . 2]" 1
228 1 12 ARG HA 1 16 ASP H 1.800 . 4.720 3.949 3.232 4.635 . 0 0 "[ . 1 . 2]" 1
229 1 12 ARG HA 1 17 ASP H 1.800 . 3.940 2.967 2.408 3.619 . 0 0 "[ . 1 . 2]" 1
230 1 12 ARG HA 1 20 ILE MD 1.800 . 4.320 2.512 1.953 3.650 . 0 0 "[ . 1 . 2]" 1
231 1 12 ARG HA 1 20 ILE QG 1.800 . 4.970 4.068 3.519 5.061 0.091 8 0 "[ . 1 . 2]" 1
232 1 12 ARG QB 1 20 ILE MD 1.800 . 6.050 4.288 3.766 5.116 . 0 0 "[ . 1 . 2]" 1
233 1 12 ARG HB3 1 13 GLN H 1.800 . 4.510 3.783 3.443 4.042 . 0 0 "[ . 1 . 2]" 1
234 1 12 ARG HB2 1 13 GLN H 1.800 . 4.510 2.974 2.690 3.234 . 0 0 "[ . 1 . 2]" 1
235 1 12 ARG QB 1 18 ASP HA 1.800 . 5.230 3.241 2.350 4.215 . 0 0 "[ . 1 . 2]" 1
236 1 12 ARG QD 1 18 ASP HA 1.800 . 3.880 2.494 2.072 3.680 . 0 0 "[ . 1 . 2]" 1
237 1 12 ARG HE 1 20 ILE HB 1.800 . 5.350 3.314 2.572 5.313 . 0 0 "[ . 1 . 2]" 1
238 1 12 ARG QG 1 18 ASP HA 1.800 . 5.800 2.842 2.059 3.586 . 0 0 "[ . 1 . 2]" 1
239 1 12 ARG QG 1 20 ILE MG 1.800 . 5.540 3.151 2.725 3.862 . 0 0 "[ . 1 . 2]" 1
240 1 12 ARG QG 1 20 ILE HB 1.800 . 4.720 2.275 1.921 3.031 . 0 0 "[ . 1 . 2]" 1
241 1 12 ARG QG 1 20 ILE H 1.800 . 5.260 3.322 2.882 4.032 . 0 0 "[ . 1 . 2]" 1
242 1 12 ARG H 1 12 ARG QD 1.800 . 5.490 3.941 3.778 4.094 . 0 0 "[ . 1 . 2]" 1
243 1 12 ARG H 1 12 ARG HG3 1.800 . 4.680 2.466 2.201 2.797 . 0 0 "[ . 1 . 2]" 1
244 1 12 ARG H 1 12 ARG HG2 1.800 . 4.680 3.612 3.431 3.919 . 0 0 "[ . 1 . 2]" 1
245 1 12 ARG H 1 13 GLN H 1.800 . 3.830 2.749 2.636 2.863 . 0 0 "[ . 1 . 2]" 1
246 1 12 ARG H 1 17 ASP H 1.800 . 7.050 5.615 5.209 6.287 . 0 0 "[ . 1 . 2]" 1
247 1 12 ARG H 1 20 ILE MD 1.800 . 5.900 3.954 3.408 5.029 . 0 0 "[ . 1 . 2]" 1
248 1 13 GLN HA 1 13 GLN QG 1.800 . 3.940 2.872 2.424 3.097 . 0 0 "[ . 1 . 2]" 1
249 1 13 GLN HA 1 16 ASP H 1.800 . 4.970 3.781 3.441 4.039 . 0 0 "[ . 1 . 2]" 1
250 1 13 GLN QB 1 14 VAL H 1.800 . 3.610 2.322 2.166 2.493 . 0 0 "[ . 1 . 2]" 1
251 1 13 GLN QB 1 16 ASP H 1.800 . 5.630 4.957 4.671 5.169 . 0 0 "[ . 1 . 2]" 1
252 1 13 GLN HG3 1 14 VAL H 1.800 . 5.370 3.929 3.289 4.942 . 0 0 "[ . 1 . 2]" 1
253 1 13 GLN HG2 1 14 VAL H 1.800 . 5.370 4.137 3.349 4.521 . 0 0 "[ . 1 . 2]" 1
254 1 13 GLN H 1 13 GLN QB 1.800 . 3.170 2.269 2.210 2.456 . 0 0 "[ . 1 . 2]" 1
255 1 13 GLN H 1 13 GLN QG 1.800 . 4.520 3.962 2.397 4.087 . 0 0 "[ . 1 . 2]" 1
256 1 13 GLN H 1 14 VAL HA 1.800 . 5.540 5.275 5.203 5.377 . 0 0 "[ . 1 . 2]" 1
257 1 13 GLN H 1 14 VAL HB 1.800 . 6.240 4.696 4.568 4.905 . 0 0 "[ . 1 . 2]" 1
258 1 13 GLN H 1 14 VAL MG2 1.800 . 6.080 4.156 4.014 4.270 . 0 0 "[ . 1 . 2]" 1
259 1 13 GLN H 1 14 VAL H 1.800 . 4.180 2.654 2.569 2.764 . 0 0 "[ . 1 . 2]" 1
260 1 14 VAL HA 1 14 VAL MG1 1.800 . 3.900 2.553 2.478 2.608 . 0 0 "[ . 1 . 2]" 1
261 1 14 VAL HA 1 14 VAL MG2 1.800 . 3.610 2.385 2.351 2.455 . 0 0 "[ . 1 . 2]" 1
262 1 14 VAL HA 1 16 ASP H 1.800 . 5.040 4.280 4.075 4.545 . 0 0 "[ . 1 . 2]" 1
263 1 14 VAL HB 1 15 PHE H 1.800 . 3.620 2.490 2.371 2.654 . 0 0 "[ . 1 . 2]" 1
264 1 14 VAL HB 1 16 ASP H 1.800 . 5.390 4.638 4.473 4.768 . 0 0 "[ . 1 . 2]" 1
265 1 14 VAL MG1 1 15 PHE H 1.800 . 4.300 3.152 2.978 3.371 . 0 0 "[ . 1 . 2]" 1
266 1 14 VAL MG1 1 41 ASN QB 1.800 . 4.810 2.080 1.954 2.248 . 0 0 "[ . 1 . 2]" 1
267 1 14 VAL MG1 1 42 LEU HA 1.800 . 4.690 2.832 2.184 4.323 . 0 0 "[ . 1 . 2]" 1
268 1 14 VAL MG1 1 42 LEU QB 1.800 . 5.060 2.912 2.126 4.483 . 0 0 "[ . 1 . 2]" 1
269 1 14 VAL MG1 1 42 LEU MD1 1.800 . 6.000 4.192 3.312 4.627 . 0 0 "[ . 1 . 2]" 1
270 1 14 VAL MG1 1 42 LEU H 1.800 . 5.000 3.019 2.694 3.623 . 0 0 "[ . 1 . 2]" 1
271 1 14 VAL MG2 1 15 PHE H 1.800 . 5.020 3.897 3.798 3.984 . 0 0 "[ . 1 . 2]" 1
272 1 14 VAL MG2 1 42 LEU HA 1.800 . 4.200 2.116 1.723 2.906 0.077 20 0 "[ . 1 . 2]" 1
273 1 14 VAL MG2 1 42 LEU MD2 1.800 . 3.780 2.242 1.987 2.845 . 0 0 "[ . 1 . 2]" 1
274 1 14 VAL MG2 1 45 SER QB 1.800 . 4.220 2.769 2.398 3.545 . 0 0 "[ . 1 . 2]" 1
275 1 14 VAL H 1 14 VAL HB 1.800 . 3.500 2.485 2.393 2.625 . 0 0 "[ . 1 . 2]" 1
276 1 14 VAL H 1 14 VAL MG1 1.800 . 4.350 3.799 3.770 3.837 . 0 0 "[ . 1 . 2]" 1
277 1 14 VAL H 1 14 VAL MG2 1.800 . 3.400 2.154 2.084 2.289 . 0 0 "[ . 1 . 2]" 1
278 1 14 VAL H 1 15 PHE H 1.800 . 3.640 2.888 2.775 3.002 . 0 0 "[ . 1 . 2]" 1
279 1 14 VAL H 1 16 ASP H 1.800 . 4.930 3.874 3.739 4.141 . 0 0 "[ . 1 . 2]" 1
280 1 15 PHE HA 1 15 PHE QD 1.800 . 3.980 2.694 2.439 3.019 . 0 0 "[ . 1 . 2]" 1
281 1 15 PHE HA 1 33 ALA MB 1.800 . 5.800 4.612 3.847 5.439 . 0 0 "[ . 1 . 2]" 1
282 1 15 PHE QB 1 20 ILE QG 1.800 . 6.050 3.817 3.610 4.177 . 0 0 "[ . 1 . 2]" 1
283 1 15 PHE QB 1 31 ILE MG 1.800 . 5.440 3.764 3.053 4.846 . 0 0 "[ . 1 . 2]" 1
284 1 15 PHE QB 1 33 ALA MB 1.800 . 4.960 3.436 2.772 4.324 . 0 0 "[ . 1 . 2]" 1
285 1 15 PHE HB3 1 16 ASP H 1.800 . 5.300 4.184 4.007 4.412 . 0 0 "[ . 1 . 2]" 1
286 1 15 PHE HB3 1 20 ILE MD 1.800 . 4.380 2.867 2.581 3.194 . 0 0 "[ . 1 . 2]" 1
287 1 15 PHE HB2 1 16 ASP H 1.800 . 5.300 3.309 3.047 3.770 . 0 0 "[ . 1 . 2]" 1
288 1 15 PHE HB2 1 20 ILE MD 1.800 . 4.380 2.143 1.890 2.490 . 0 0 "[ . 1 . 2]" 1
289 1 15 PHE QD 1 31 ILE MG 1.800 . 5.330 3.721 3.057 4.974 . 0 0 "[ . 1 . 2]" 1
290 1 15 PHE QD 1 33 ALA MB 1.800 . 4.150 3.345 2.337 4.254 0.104 17 0 "[ . 1 . 2]" 1
291 1 15 PHE QE 1 34 TRP HA 1.800 . 5.260 2.197 1.841 2.952 . 0 0 "[ . 1 . 2]" 1
292 1 15 PHE QE 1 42 LEU MD2 1.800 . 5.040 2.457 2.081 2.966 . 0 0 "[ . 1 . 2]" 1
293 1 15 PHE H 1 16 ASP H 1.800 . 3.580 2.401 2.289 2.564 . 0 0 "[ . 1 . 2]" 1
294 1 15 PHE HZ 1 42 LEU MD1 1.800 . 5.300 4.374 3.637 5.114 . 0 0 "[ . 1 . 2]" 1
295 1 16 ASP HA 1 17 ASP H 1.800 . 3.480 2.467 2.225 3.322 . 0 0 "[ . 1 . 2]" 1
296 1 16 ASP HB3 1 17 ASP H 1.800 . 5.180 4.419 3.593 4.604 . 0 0 "[ . 1 . 2]" 1
297 1 16 ASP HB2 1 17 ASP H 1.800 . 5.180 4.597 4.432 4.678 . 0 0 "[ . 1 . 2]" 1
298 1 16 ASP H 1 16 ASP QB 1.800 . 3.890 2.977 2.885 3.115 . 0 0 "[ . 1 . 2]" 1
299 1 16 ASP H 1 17 ASP H 1.800 . 3.650 3.007 2.574 3.287 . 0 0 "[ . 1 . 2]" 1
300 1 17 ASP QB 1 18 ASP H 1.800 . 4.600 3.526 2.879 3.997 . 0 0 "[ . 1 . 2]" 1
301 1 17 ASP QB 1 20 ILE MD 1.800 . 3.630 2.345 2.139 3.153 . 0 0 "[ . 1 . 2]" 1
302 1 17 ASP QB 1 20 ILE HG13 1.800 . 5.870 2.423 1.995 3.287 . 0 0 "[ . 1 . 2]" 1
303 1 17 ASP QB 1 20 ILE HG12 1.800 . 5.870 3.738 3.323 4.365 . 0 0 "[ . 1 . 2]" 1
304 1 17 ASP H 1 17 ASP QB 1.800 . 3.600 2.786 2.326 3.001 . 0 0 "[ . 1 . 2]" 1
305 1 17 ASP H 1 18 ASP H 1.800 . 4.750 4.144 3.684 4.516 . 0 0 "[ . 1 . 2]" 1
306 1 18 ASP H 1 18 ASP QB 1.800 . 3.340 2.493 2.200 3.045 . 0 0 "[ . 1 . 2]" 1
307 1 19 SER H 1 19 SER QB 1.800 . 3.900 2.524 2.445 2.826 . 0 0 "[ . 1 . 2]" 1
308 1 19 SER H 1 20 ILE H 1.800 . 3.740 2.490 2.382 2.627 . 0 0 "[ . 1 . 2]" 1
309 1 20 ILE HA 1 20 ILE MD 1.800 . 4.280 3.873 3.836 3.928 . 0 0 "[ . 1 . 2]" 1
310 1 20 ILE HA 1 20 ILE HG13 1.800 . 4.300 3.045 2.955 3.162 . 0 0 "[ . 1 . 2]" 1
311 1 20 ILE HA 1 20 ILE HG12 1.800 . 4.300 2.553 2.498 2.663 . 0 0 "[ . 1 . 2]" 1
312 1 20 ILE HA 1 20 ILE MG 1.800 . 3.710 2.531 2.457 2.625 . 0 0 "[ . 1 . 2]" 1
313 1 20 ILE HA 1 21 VAL H 1.800 . 3.610 2.153 2.127 2.204 . 0 0 "[ . 1 . 2]" 1
314 1 20 ILE MD 1 21 VAL H 1.800 . 6.050 5.383 5.244 5.544 . 0 0 "[ . 1 . 2]" 1
315 1 20 ILE MD 1 31 ILE MD 1.800 . 5.040 2.709 2.022 3.678 . 0 0 "[ . 1 . 2]" 1
316 1 20 ILE MD 1 31 ILE MG 1.800 . 3.970 3.239 2.193 4.032 0.062 17 0 "[ . 1 . 2]" 1
317 1 20 ILE QG 1 21 VAL H 1.800 . 4.910 4.266 4.095 4.401 . 0 0 "[ . 1 . 2]" 1
318 1 20 ILE MD 1 20 ILE MG 1.800 . 3.200 1.994 1.964 2.029 . 0 0 "[ . 1 . 2]" 1
319 1 20 ILE HG13 1 20 ILE MG 1.800 . 4.290 3.257 3.245 3.270 . 0 0 "[ . 1 . 2]" 1
320 1 20 ILE HG12 1 20 ILE MG 1.800 . 4.290 2.475 2.424 2.524 . 0 0 "[ . 1 . 2]" 1
321 1 20 ILE MG 1 21 VAL HA 1.800 . 4.640 3.651 3.478 3.878 . 0 0 "[ . 1 . 2]" 1
322 1 20 ILE MG 1 22 LEU HA 1.800 . 5.140 3.773 3.412 4.135 . 0 0 "[ . 1 . 2]" 1
323 1 20 ILE MG 1 22 LEU MD1 1.800 . 4.660 3.538 3.037 4.091 . 0 0 "[ . 1 . 2]" 1
324 1 20 ILE MG 1 22 LEU MD2 1.800 . 3.640 2.210 2.098 2.317 . 0 0 "[ . 1 . 2]" 1
325 1 20 ILE MG 1 22 LEU HG 1.800 . 3.930 2.716 2.246 3.381 . 0 0 "[ . 1 . 2]" 1
326 1 20 ILE H 1 20 ILE HB 1.800 . 3.560 2.523 2.446 2.612 . 0 0 "[ . 1 . 2]" 1
327 1 20 ILE H 1 20 ILE MD 1.800 . 4.860 3.698 3.526 3.803 . 0 0 "[ . 1 . 2]" 1
328 1 20 ILE H 1 20 ILE HG13 1.800 . 4.570 2.263 2.038 2.427 . 0 0 "[ . 1 . 2]" 1
329 1 20 ILE H 1 20 ILE HG12 1.800 . 4.570 3.477 3.303 3.612 . 0 0 "[ . 1 . 2]" 1
330 1 20 ILE H 1 20 ILE MG 1.800 . 4.260 3.823 3.794 3.844 . 0 0 "[ . 1 . 2]" 1
331 1 20 ILE H 1 21 VAL H 1.800 . 5.210 4.379 4.209 4.497 . 0 0 "[ . 1 . 2]" 1
332 1 21 VAL HA 1 21 VAL MG1 1.800 . 3.470 2.447 2.394 2.483 . 0 0 "[ . 1 . 2]" 1
333 1 21 VAL HA 1 21 VAL MG2 1.800 . 3.340 2.499 2.443 2.576 . 0 0 "[ . 1 . 2]" 1
334 1 21 VAL HA 1 22 LEU H 1.800 . 3.130 2.185 2.110 2.254 . 0 0 "[ . 1 . 2]" 1
335 1 21 VAL HB 1 22 LEU H 1.800 . 5.020 4.368 4.135 4.465 . 0 0 "[ . 1 . 2]" 1
336 1 21 VAL MG1 1 22 LEU H 1.800 . 4.360 3.159 2.661 3.579 . 0 0 "[ . 1 . 2]" 1
337 1 21 VAL H 1 21 VAL HB 1.800 . 3.740 2.709 2.591 2.824 . 0 0 "[ . 1 . 2]" 1
338 1 21 VAL H 1 21 VAL MG1 1.800 . 4.880 3.915 3.865 3.971 . 0 0 "[ . 1 . 2]" 1
339 1 21 VAL H 1 21 VAL MG2 1.800 . 3.890 2.773 2.628 2.950 . 0 0 "[ . 1 . 2]" 1
340 1 21 VAL H 1 22 LEU MD2 1.800 . 5.960 4.325 4.027 4.534 . 0 0 "[ . 1 . 2]" 1
341 1 22 LEU HA 1 22 LEU MD1 1.800 . 4.980 3.873 3.795 3.909 . 0 0 "[ . 1 . 2]" 1
342 1 22 LEU HA 1 22 LEU MD2 1.800 . 3.490 2.026 1.969 2.086 . 0 0 "[ . 1 . 2]" 1
343 1 22 LEU HA 1 23 THR MG 1.800 . 6.240 3.990 3.688 5.318 . 0 0 "[ . 1 . 2]" 1
344 1 22 LEU HA 1 23 THR H 1.800 . 3.380 2.114 2.064 2.167 . 0 0 "[ . 1 . 2]" 1
345 1 22 LEU HA 1 26 THR MG 1.800 . 4.790 2.976 2.366 3.481 . 0 0 "[ . 1 . 2]" 1
346 1 22 LEU HA 1 65 VAL MG1 1.800 . 5.910 3.894 3.546 4.480 . 0 0 "[ . 1 . 2]" 1
347 1 22 LEU HA 1 65 VAL MG2 1.800 . 5.830 4.059 3.613 4.781 . 0 0 "[ . 1 . 2]" 1
348 1 22 LEU QB 1 22 LEU MD2 1.800 . 3.620 2.412 2.371 2.485 . 0 0 "[ . 1 . 2]" 1
349 1 22 LEU QB 1 23 THR H 1.800 . 4.330 2.981 2.802 3.167 . 0 0 "[ . 1 . 2]" 1
350 1 22 LEU HB3 1 22 LEU MD1 1.800 . 3.950 2.401 2.318 2.453 . 0 0 "[ . 1 . 2]" 1
351 1 22 LEU HB3 1 65 VAL MG1 1.800 . 5.980 2.287 1.952 2.906 . 0 0 "[ . 1 . 2]" 1
352 1 22 LEU HB2 1 22 LEU MD1 1.800 . 3.950 2.391 2.362 2.462 . 0 0 "[ . 1 . 2]" 1
353 1 22 LEU HB2 1 65 VAL MG1 1.800 . 5.980 3.617 3.351 4.224 . 0 0 "[ . 1 . 2]" 1
354 1 22 LEU MD1 1 65 VAL MG1 1.800 . 3.950 1.936 1.706 2.284 0.094 4 0 "[ . 1 . 2]" 1
355 1 22 LEU MD2 1 23 THR H 1.800 . 4.400 3.451 3.239 3.623 . 0 0 "[ . 1 . 2]" 1
356 1 22 LEU MD2 1 26 THR HB 1.800 . 4.910 3.202 2.899 3.474 . 0 0 "[ . 1 . 2]" 1
357 1 22 LEU MD2 1 26 THR MG 1.800 . 3.510 2.309 1.949 2.866 . 0 0 "[ . 1 . 2]" 1
358 1 22 LEU MD2 1 26 THR H 1.800 . 7.050 5.270 4.912 5.520 . 0 0 "[ . 1 . 2]" 1
359 1 22 LEU MD2 1 31 ILE MD 1.800 . 3.980 3.166 2.630 3.895 . 0 0 "[ . 1 . 2]" 1
360 1 22 LEU MD2 1 65 VAL MG2 1.800 . 4.000 2.001 1.746 2.702 0.054 4 0 "[ . 1 . 2]" 1
361 1 22 LEU H 1 22 LEU HB3 1.800 . 4.020 3.617 3.586 3.690 . 0 0 "[ . 1 . 2]" 1
362 1 22 LEU H 1 22 LEU HB2 1.800 . 4.020 2.472 2.405 2.513 . 0 0 "[ . 1 . 2]" 1
363 1 22 LEU H 1 22 LEU MD1 1.800 . 4.420 3.762 3.627 4.082 . 0 0 "[ . 1 . 2]" 1
364 1 22 LEU H 1 22 LEU MD2 1.800 . 4.390 3.351 3.127 3.511 . 0 0 "[ . 1 . 2]" 1
365 1 22 LEU H 1 22 LEU HG 1.800 . 3.700 2.450 2.238 2.851 . 0 0 "[ . 1 . 2]" 1
366 1 23 THR HA 1 23 THR MG 1.800 . 3.400 2.444 2.312 2.521 . 0 0 "[ . 1 . 2]" 1
367 1 23 THR HB 1 24 ARG H 1.800 . 4.340 2.374 2.111 3.118 . 0 0 "[ . 1 . 2]" 1
368 1 23 THR HB 1 25 GLU H 1.800 . 4.040 2.911 2.627 3.321 . 0 0 "[ . 1 . 2]" 1
369 1 23 THR MG 1 24 ARG H 1.800 . 4.320 3.640 1.852 3.860 . 0 0 "[ . 1 . 2]" 1
370 1 23 THR MG 1 25 GLU H 1.800 . 4.860 4.277 3.259 4.775 . 0 0 "[ . 1 . 2]" 1
371 1 23 THR H 1 23 THR MG 1.800 . 4.250 3.091 2.855 4.020 . 0 0 "[ . 1 . 2]" 1
372 1 23 THR H 1 25 GLU H 1.800 . 5.420 4.568 4.036 5.112 . 0 0 "[ . 1 . 2]" 1
373 1 23 THR H 1 26 THR HB 1.800 . 4.550 2.671 2.254 3.135 . 0 0 "[ . 1 . 2]" 1
374 1 23 THR H 1 26 THR HG1 1.800 . 6.300 2.802 2.492 3.125 . 0 0 "[ . 1 . 2]" 1
375 1 23 THR H 1 26 THR H 1.800 . 5.000 3.372 3.017 3.746 . 0 0 "[ . 1 . 2]" 1
376 1 24 ARG HA 1 65 VAL HB 1.800 . 5.140 4.066 3.272 4.729 . 0 0 "[ . 1 . 2]" 1
377 1 24 ARG HA 1 66 GLY H 1.800 . 3.900 3.104 2.698 3.822 . 0 0 "[ . 1 . 2]" 1
378 1 24 ARG QB 1 24 ARG HE 1.800 . 5.570 3.218 2.090 4.166 . 0 0 "[ . 1 . 2]" 1
379 1 24 ARG QB 1 66 GLY QA 1.800 . 4.860 2.686 2.063 3.117 . 0 0 "[ . 1 . 2]" 1
380 1 24 ARG HB3 1 25 GLU H 1.800 . 4.810 3.972 3.485 4.423 . 0 0 "[ . 1 . 2]" 1
381 1 24 ARG QB 1 66 GLY H 1.800 . 6.020 4.251 3.502 4.819 . 0 0 "[ . 1 . 2]" 1
382 1 24 ARG HB2 1 25 GLU H 1.800 . 4.810 3.151 2.354 4.087 . 0 0 "[ . 1 . 2]" 1
383 1 24 ARG QG 1 25 GLU H 1.800 . 5.630 4.260 2.467 4.838 . 0 0 "[ . 1 . 2]" 1
384 1 24 ARG QG 1 66 GLY H 1.800 . 6.870 4.909 4.157 5.572 . 0 0 "[ . 1 . 2]" 1
385 1 24 ARG H 1 24 ARG HG3 1.800 . 4.530 2.552 1.951 3.744 . 0 0 "[ . 1 . 2]" 1
386 1 24 ARG H 1 24 ARG HG2 1.800 . 4.530 3.447 2.293 3.990 . 0 0 "[ . 1 . 2]" 1
387 1 24 ARG H 1 25 GLU H 1.800 . 4.140 2.747 2.641 2.907 . 0 0 "[ . 1 . 2]" 1
388 1 24 ARG H 1 66 GLY QA 1.800 . 6.080 4.654 4.368 5.189 . 0 0 "[ . 1 . 2]" 1
389 1 25 GLU HA 1 25 GLU QG 1.800 . 3.840 3.176 2.441 3.561 . 0 0 "[ . 1 . 2]" 1
390 1 25 GLU HA 1 64 ASN QB 1.800 . 4.720 3.022 2.387 3.969 . 0 0 "[ . 1 . 2]" 1
391 1 25 GLU HA 1 64 ASN QD 1.800 . 4.610 3.734 2.458 4.577 . 0 0 "[ . 1 . 2]" 1
392 1 25 GLU HA 1 64 ASN HD21 1.800 . 5.390 4.337 2.737 5.458 0.068 10 0 "[ . 1 . 2]" 1
393 1 25 GLU HA 1 64 ASN HD22 1.800 . 5.390 4.117 2.782 4.968 . 0 0 "[ . 1 . 2]" 1
394 1 25 GLU QG 1 26 THR H 1.800 . 4.880 3.447 2.712 4.487 . 0 0 "[ . 1 . 2]" 1
395 1 25 GLU H 1 25 GLU HB3 1.800 . 4.190 3.117 2.674 3.785 . 0 0 "[ . 1 . 2]" 1
396 1 25 GLU H 1 25 GLU HB2 1.800 . 4.190 3.409 2.429 3.867 . 0 0 "[ . 1 . 2]" 1
397 1 25 GLU H 1 25 GLU HG3 1.800 . 4.530 3.120 2.480 4.078 . 0 0 "[ . 1 . 2]" 1
398 1 25 GLU H 1 25 GLU HG2 1.800 . 4.530 2.606 1.820 4.024 . 0 0 "[ . 1 . 2]" 1
399 1 25 GLU H 1 26 THR H 1.800 . 3.610 2.360 1.947 2.768 . 0 0 "[ . 1 . 2]" 1
400 1 25 GLU H 1 64 ASN QB 1.800 . 5.710 4.759 4.226 5.713 0.003 10 0 "[ . 1 . 2]" 1
401 1 26 THR HA 1 26 THR MG 1.800 . 3.970 2.480 2.424 2.564 . 0 0 "[ . 1 . 2]" 1
402 1 26 THR HA 1 27 SER H 1.800 . 3.370 2.244 2.173 2.340 . 0 0 "[ . 1 . 2]" 1
403 1 26 THR HA 1 30 ASP H 1.800 . 6.050 4.812 4.317 5.858 . 0 0 "[ . 1 . 2]" 1
404 1 26 THR HB 1 65 VAL HB 1.800 . 4.530 2.535 2.150 2.891 . 0 0 "[ . 1 . 2]" 1
405 1 26 THR HB 1 65 VAL MG1 1.800 . 4.970 3.637 3.175 3.957 . 0 0 "[ . 1 . 2]" 1
406 1 26 THR HB 1 65 VAL MG2 1.800 . 4.030 2.498 2.123 2.940 . 0 0 "[ . 1 . 2]" 1
407 1 26 THR HB 1 65 VAL H 1.800 . 4.760 3.654 3.169 4.134 . 0 0 "[ . 1 . 2]" 1
408 1 26 THR HG1 1 27 SER H 1.800 . 5.200 4.489 4.204 4.887 . 0 0 "[ . 1 . 2]" 1
409 1 26 THR MG 1 27 SER H 1.800 . 4.070 2.869 2.367 3.541 . 0 0 "[ . 1 . 2]" 1
410 1 26 THR MG 1 30 ASP QB 1.800 . 4.740 2.769 2.015 3.989 . 0 0 "[ . 1 . 2]" 1
411 1 26 THR MG 1 30 ASP H 1.800 . 5.350 4.649 4.064 5.353 0.003 17 0 "[ . 1 . 2]" 1
412 1 26 THR MG 1 31 ILE MD 1.800 . 3.730 2.402 2.010 3.239 . 0 0 "[ . 1 . 2]" 1
413 1 26 THR MG 1 34 TRP HZ3 1.800 . 4.090 2.680 1.736 4.029 0.064 7 0 "[ . 1 . 2]" 1
414 1 26 THR MG 1 65 VAL HB 1.800 . 4.940 3.747 3.023 4.055 . 0 0 "[ . 1 . 2]" 1
415 1 26 THR MG 1 65 VAL MG2 1.800 . 3.710 2.329 1.998 2.722 . 0 0 "[ . 1 . 2]" 1
416 1 26 THR MG 1 65 VAL H 1.800 . 5.390 4.131 3.823 4.429 . 0 0 "[ . 1 . 2]" 1
417 1 26 THR H 1 26 THR HB 1.800 . 3.490 2.580 2.495 2.679 . 0 0 "[ . 1 . 2]" 1
418 1 26 THR H 1 26 THR HG1 1.800 . 4.980 2.612 2.126 3.245 . 0 0 "[ . 1 . 2]" 1
419 1 26 THR H 1 26 THR MG 1.800 . 4.250 3.819 3.793 3.840 . 0 0 "[ . 1 . 2]" 1
420 1 26 THR H 1 27 SER H 1.800 . 5.180 4.518 4.202 4.694 . 0 0 "[ . 1 . 2]" 1
421 1 26 THR H 1 65 VAL HB 1.800 . 5.490 3.825 3.383 4.095 . 0 0 "[ . 1 . 2]" 1
422 1 26 THR H 1 65 VAL MG1 1.800 . 7.050 5.092 4.709 5.323 . 0 0 "[ . 1 . 2]" 1
423 1 26 THR H 1 65 VAL MG2 1.800 . 5.040 4.281 3.926 4.739 . 0 0 "[ . 1 . 2]" 1
424 1 26 THR H 1 65 VAL H 1.800 . 5.010 4.237 3.781 4.840 . 0 0 "[ . 1 . 2]" 1
425 1 27 SER HA 1 28 ALA H 1.800 . 3.900 2.538 2.330 2.698 . 0 0 "[ . 1 . 2]" 1
426 1 27 SER HA 1 29 ASN H 1.800 . 6.040 4.329 3.934 5.791 . 0 0 "[ . 1 . 2]" 1
427 1 27 SER HA 1 64 ASN HA 1.800 . 5.000 2.642 2.073 3.117 . 0 0 "[ . 1 . 2]" 1
428 1 27 SER HA 1 65 VAL MG2 1.800 . 5.030 3.205 2.307 3.992 . 0 0 "[ . 1 . 2]" 1
429 1 27 SER QB 1 28 ALA H 1.800 . 3.650 2.253 1.979 2.534 . 0 0 "[ . 1 . 2]" 1
430 1 27 SER QB 1 29 ASN H 1.800 . 4.990 2.873 2.239 4.791 . 0 0 "[ . 1 . 2]" 1
431 1 27 SER QB 1 64 ASN HA 1.800 . 5.190 2.898 2.007 3.817 . 0 0 "[ . 1 . 2]" 1
432 1 27 SER H 1 28 ALA H 1.800 . 5.350 4.435 4.341 4.614 . 0 0 "[ . 1 . 2]" 1
433 1 27 SER H 1 30 ASP QB 1.800 . 4.100 2.126 1.647 3.196 0.153 2 0 "[ . 1 . 2]" 1
434 1 27 SER H 1 30 ASP H 1.800 . 4.640 3.144 2.719 3.933 . 0 0 "[ . 1 . 2]" 1
435 1 27 SER H 1 65 VAL MG2 1.800 . 6.050 4.270 3.642 4.814 . 0 0 "[ . 1 . 2]" 1
436 1 28 ALA HA 1 31 ILE H 1.800 . 4.680 3.309 2.688 4.033 . 0 0 "[ . 1 . 2]" 1
437 1 28 ALA HA 1 34 TRP QB 1.800 . 4.530 2.358 1.811 3.024 . 0 0 "[ . 1 . 2]" 1
438 1 28 ALA HA 1 34 TRP HE3 1.800 . 4.220 2.937 2.354 4.143 . 0 0 "[ . 1 . 2]" 1
439 1 28 ALA MB 1 29 ASN H 1.800 . 3.970 3.063 2.720 3.523 . 0 0 "[ . 1 . 2]" 1
440 1 28 ALA MB 1 34 TRP QB 1.800 . 4.410 2.665 2.245 3.604 . 0 0 "[ . 1 . 2]" 1
441 1 28 ALA MB 1 34 TRP HE3 1.800 . 5.910 4.013 3.329 4.734 . 0 0 "[ . 1 . 2]" 1
442 1 28 ALA MB 1 35 ASP HA 1.800 . 8.000 4.594 3.855 5.855 . 0 0 "[ . 1 . 2]" 1
443 1 28 ALA H 1 28 ALA MB 1.800 . 3.410 2.217 2.160 2.298 . 0 0 "[ . 1 . 2]" 1
444 1 28 ALA H 1 29 ASN QB 1.800 . 4.850 4.411 3.496 4.905 0.055 3 0 "[ . 1 . 2]" 1
445 1 28 ALA H 1 29 ASN H 1.800 . 3.900 2.907 2.603 4.308 0.408 7 0 "[ . 1 . 2]" 1
446 1 29 ASN HA 1 31 ILE H 1.800 . 5.000 4.075 3.719 4.427 . 0 0 "[ . 1 . 2]" 1
447 1 29 ASN QB 1 30 ASP H 1.800 . 4.000 2.742 2.018 3.681 . 0 0 "[ . 1 . 2]" 1
448 1 29 ASN H 1 29 ASN QB 1.800 . 3.130 2.373 2.129 3.219 0.089 17 0 "[ . 1 . 2]" 1
449 1 29 ASN H 1 30 ASP QB 1.800 . 5.160 4.304 3.746 4.735 . 0 0 "[ . 1 . 2]" 1
450 1 29 ASN H 1 30 ASP H 1.800 . 3.730 2.457 2.086 2.917 . 0 0 "[ . 1 . 2]" 1
451 1 29 ASN H 1 31 ILE H 1.800 . 4.980 3.675 1.960 4.291 . 0 0 "[ . 1 . 2]" 1
452 1 30 ASP QB 1 31 ILE H 1.800 . 4.300 3.092 2.835 3.258 . 0 0 "[ . 1 . 2]" 1
453 1 30 ASP H 1 30 ASP QB 1.800 . 3.450 2.318 2.178 2.475 . 0 0 "[ . 1 . 2]" 1
454 1 30 ASP H 1 31 ILE H 1.800 . 3.450 2.501 2.301 2.749 . 0 0 "[ . 1 . 2]" 1
455 1 31 ILE HA 1 31 ILE MD 1.800 . 4.610 3.887 3.841 3.918 . 0 0 "[ . 1 . 2]" 1
456 1 31 ILE HA 1 31 ILE QG 1.800 . 3.860 2.465 2.407 2.542 . 0 0 "[ . 1 . 2]" 1
457 1 31 ILE HB 1 33 ALA H 1.800 . 5.470 4.664 4.380 5.222 . 0 0 "[ . 1 . 2]" 1
458 1 31 ILE HB 1 34 TRP QB 1.800 . 4.640 2.198 1.941 2.733 . 0 0 "[ . 1 . 2]" 1
459 1 31 ILE HB 1 34 TRP HE3 1.800 . 3.950 2.163 1.770 2.711 0.030 11 0 "[ . 1 . 2]" 1
460 1 31 ILE HB 1 34 TRP H 1.800 . 5.110 3.539 3.240 3.975 . 0 0 "[ . 1 . 2]" 1
461 1 31 ILE MD 1 34 TRP QB 1.800 . 6.840 3.391 3.103 3.693 . 0 0 "[ . 1 . 2]" 1
462 1 31 ILE MD 1 34 TRP HE3 1.800 . 3.870 2.086 1.813 2.524 . 0 0 "[ . 1 . 2]" 1
463 1 31 ILE MD 1 34 TRP HZ3 1.800 . 5.090 2.623 2.148 3.230 . 0 0 "[ . 1 . 2]" 1
464 1 31 ILE MD 1 31 ILE MG 1.800 . 3.390 2.007 1.973 2.034 . 0 0 "[ . 1 . 2]" 1
465 1 31 ILE HG13 1 31 ILE MG 1.800 . 4.540 3.264 3.249 3.274 . 0 0 "[ . 1 . 2]" 1
466 1 31 ILE HG12 1 31 ILE MG 1.800 . 4.540 2.504 2.442 2.548 . 0 0 "[ . 1 . 2]" 1
467 1 31 ILE MG 1 32 ASP H 1.800 . 4.840 3.179 2.511 3.586 . 0 0 "[ . 1 . 2]" 1
468 1 31 ILE MG 1 33 ALA MB 1.800 . 3.850 2.453 1.908 2.998 . 0 0 "[ . 1 . 2]" 1
469 1 31 ILE MG 1 33 ALA H 1.800 . 3.640 2.509 2.068 3.596 . 0 0 "[ . 1 . 2]" 1
470 1 31 ILE MG 1 34 TRP HB3 1.800 . 4.680 3.424 3.016 3.802 . 0 0 "[ . 1 . 2]" 1
471 1 31 ILE MG 1 34 TRP HB2 1.800 . 4.680 2.315 2.145 2.651 . 0 0 "[ . 1 . 2]" 1
472 1 31 ILE MG 1 34 TRP HE3 1.800 . 5.520 3.149 2.608 3.668 . 0 0 "[ . 1 . 2]" 1
473 1 31 ILE MG 1 34 TRP H 1.800 . 3.740 2.178 1.800 2.485 . 12 0 "[ . 1 . 2]" 1
474 1 31 ILE H 1 31 ILE HB 1.800 . 3.760 2.712 2.553 2.792 . 0 0 "[ . 1 . 2]" 1
475 1 31 ILE H 1 31 ILE MD 1.800 . 4.830 4.248 4.126 4.408 . 0 0 "[ . 1 . 2]" 1
476 1 31 ILE H 1 31 ILE QG 1.800 . 3.880 2.936 2.739 3.123 . 0 0 "[ . 1 . 2]" 1
477 1 31 ILE H 1 31 ILE MG 1.800 . 4.600 3.916 3.843 3.945 . 0 0 "[ . 1 . 2]" 1
478 1 31 ILE H 1 32 ASP H 1.800 . 6.050 4.067 3.733 4.338 . 0 0 "[ . 1 . 2]" 1
479 1 31 ILE H 1 34 TRP QB 1.800 . 5.080 3.874 3.454 4.499 . 0 0 "[ . 1 . 2]" 1
480 1 31 ILE H 1 34 TRP HZ3 1.800 . 7.000 5.684 5.029 6.447 . 0 0 "[ . 1 . 2]" 1
481 1 32 ASP QB 1 33 ALA H 1.800 . 3.820 2.895 2.629 3.953 0.133 8 0 "[ . 1 . 2]" 1
482 1 32 ASP H 1 33 ALA H 1.800 . 4.970 2.792 2.362 4.235 . 0 0 "[ . 1 . 2]" 1
483 1 33 ALA MB 1 34 TRP H 1.800 . 4.380 3.179 2.506 3.601 . 0 0 "[ . 1 . 2]" 1
484 1 33 ALA H 1 33 ALA MB 1.800 . 3.400 2.339 2.214 3.119 . 0 0 "[ . 1 . 2]" 1
485 1 33 ALA H 1 34 TRP QB 1.800 . 5.220 4.251 3.909 4.442 . 0 0 "[ . 1 . 2]" 1
486 1 33 ALA H 1 34 TRP H 1.800 . 4.230 2.649 2.032 2.912 . 0 0 "[ . 1 . 2]" 1
487 1 34 TRP HA 1 34 TRP HD1 1.800 . 4.570 2.819 2.356 3.423 . 0 0 "[ . 1 . 2]" 1
488 1 34 TRP HA 1 35 ASP H 1.800 . 3.690 2.292 2.087 2.546 . 0 0 "[ . 1 . 2]" 1
489 1 34 TRP HD1 1 35 ASP H 1.800 . 4.030 3.230 1.957 4.112 0.082 10 0 "[ . 1 . 2]" 1
490 1 34 TRP HD1 1 39 HIS QB 1.800 . 5.140 3.890 2.298 5.248 0.108 4 0 "[ . 1 . 2]" 1
491 1 34 TRP HD1 1 39 HIS H 1.800 . 4.830 3.387 2.960 4.319 . 0 0 "[ . 1 . 2]" 1
492 1 34 TRP HE1 1 39 HIS HA 1.800 . 5.260 2.476 2.069 3.189 . 0 0 "[ . 1 . 2]" 1
493 1 34 TRP HE1 1 39 HIS QB 1.800 . 4.900 3.069 1.842 4.111 . 0 0 "[ . 1 . 2]" 1
494 1 34 TRP HE1 1 39 HIS HE1 1.800 . 5.610 3.481 2.834 3.978 . 0 0 "[ . 1 . 2]" 1
495 1 34 TRP HH2 1 65 VAL MG1 1.800 . 5.700 4.118 3.634 4.746 . 0 0 "[ . 1 . 2]" 1
496 1 34 TRP HH2 1 65 VAL MG2 1.800 . 3.820 2.190 1.933 2.954 . 0 0 "[ . 1 . 2]" 1
497 1 34 TRP H 1 34 TRP HB3 1.800 . 3.970 2.663 2.548 2.799 . 0 0 "[ . 1 . 2]" 1
498 1 34 TRP H 1 34 TRP HB2 1.800 . 3.970 2.484 2.324 2.800 . 0 0 "[ . 1 . 2]" 1
499 1 34 TRP H 1 34 TRP HD1 1.800 . 5.720 4.971 4.906 5.096 . 0 0 "[ . 1 . 2]" 1
500 1 34 TRP H 1 34 TRP HE3 1.800 . 6.050 4.795 4.576 5.018 . 0 0 "[ . 1 . 2]" 1
501 1 34 TRP H 1 35 ASP H 1.800 . 5.560 4.065 3.510 4.458 . 0 0 "[ . 1 . 2]" 1
502 1 34 TRP HZ2 1 39 HIS HE1 1.800 . 3.820 3.162 2.508 3.874 0.054 20 0 "[ . 1 . 2]" 1
503 1 34 TRP HZ2 1 42 LEU MD1 1.800 . 4.190 3.552 2.758 4.306 0.116 9 0 "[ . 1 . 2]" 1
504 1 34 TRP HZ3 1 65 VAL MG2 1.800 . 4.270 2.536 2.036 3.311 . 0 0 "[ . 1 . 2]" 1
505 1 35 ASP QB 1 36 SER H 1.800 . 3.860 2.654 1.937 3.711 . 0 0 "[ . 1 . 2]" 1
506 1 35 ASP H 1 38 SER QB 1.800 . 6.830 2.294 1.720 3.017 0.080 2 0 "[ . 1 . 2]" 1
507 1 35 ASP H 1 38 SER H 1.800 . 6.860 3.551 2.834 4.403 . 0 0 "[ . 1 . 2]" 1
508 1 35 ASP H 1 39 HIS H 1.800 . 5.550 4.398 3.425 5.338 . 0 0 "[ . 1 . 2]" 1
509 1 36 SER HA 1 39 HIS QB 1.800 . 5.000 2.708 1.883 3.853 . 0 0 "[ . 1 . 2]" 1
510 1 36 SER HA 1 39 HIS H 1.800 . 5.630 3.438 2.672 3.904 . 0 0 "[ . 1 . 2]" 1
511 1 36 SER H 1 37 LEU H 1.800 . 4.630 2.766 2.526 3.369 . 0 0 "[ . 1 . 2]" 1
512 1 37 LEU HA 1 37 LEU QD 1.800 . 3.580 2.058 1.969 2.152 . 0 0 "[ . 1 . 2]" 1
513 1 37 LEU HA 1 37 LEU MD1 1.800 . 4.570 2.359 1.998 3.367 . 0 0 "[ . 1 . 2]" 1
514 1 37 LEU HA 1 37 LEU MD2 1.800 . 4.570 2.836 2.035 3.308 . 0 0 "[ . 1 . 2]" 1
515 1 37 LEU HA 1 40 MET H 1.800 . 5.700 3.416 2.792 3.973 . 0 0 "[ . 1 . 2]" 1
516 1 37 LEU HB3 1 37 LEU MD1 1.800 . 4.530 2.450 2.328 2.549 . 0 0 "[ . 1 . 2]" 1
517 1 37 LEU HB3 1 37 LEU MD2 1.800 . 4.530 3.248 3.229 3.265 . 0 0 "[ . 1 . 2]" 1
518 1 37 LEU HB3 1 38 SER H 1.800 . 4.370 3.450 2.580 4.112 . 0 0 "[ . 1 . 2]" 1
519 1 37 LEU HB2 1 37 LEU MD1 1.800 . 4.530 3.249 3.227 3.263 . 0 0 "[ . 1 . 2]" 1
520 1 37 LEU HB2 1 37 LEU MD2 1.800 . 4.530 2.404 2.314 2.587 . 0 0 "[ . 1 . 2]" 1
521 1 37 LEU HB2 1 38 SER H 1.800 . 4.370 3.057 2.503 3.876 . 0 0 "[ . 1 . 2]" 1
522 1 37 LEU QD 1 38 SER H 1.800 . 5.520 3.705 3.302 3.973 . 0 0 "[ . 1 . 2]" 1
523 1 37 LEU H 1 37 LEU QB 1.800 . 3.470 2.368 2.141 2.507 . 0 0 "[ . 1 . 2]" 1
524 1 37 LEU H 1 37 LEU QD 1.800 . 4.540 2.382 1.762 3.751 0.038 15 0 "[ . 1 . 2]" 1
525 1 37 LEU H 1 37 LEU MD1 1.800 . 5.270 3.654 3.118 4.420 . 0 0 "[ . 1 . 2]" 1
526 1 37 LEU H 1 37 LEU MD2 1.800 . 5.270 2.467 1.771 4.135 0.029 15 0 "[ . 1 . 2]" 1
527 1 37 LEU H 1 37 LEU HG 1.800 . 4.610 4.119 3.833 4.615 0.005 3 0 "[ . 1 . 2]" 1
528 1 37 LEU H 1 38 SER H 1.800 . 3.640 2.628 2.539 2.766 . 0 0 "[ . 1 . 2]" 1
529 1 38 SER HA 1 41 ASN QB 1.800 . 4.730 2.716 2.195 3.831 . 0 0 "[ . 1 . 2]" 1
530 1 38 SER HA 1 41 ASN QD 1.800 . 5.080 2.292 1.805 3.750 . 0 0 "[ . 1 . 2]" 1
531 1 38 SER HA 1 41 ASN H 1.800 . 5.050 3.359 3.158 3.556 . 0 0 "[ . 1 . 2]" 1
532 1 38 SER HB3 1 39 HIS H 1.800 . 5.950 3.866 3.670 4.081 . 0 0 "[ . 1 . 2]" 1
533 1 38 SER HB2 1 39 HIS H 1.800 . 5.950 2.761 2.517 3.140 . 0 0 "[ . 1 . 2]" 1
534 1 38 SER H 1 39 HIS QB 1.800 . 5.320 4.403 4.041 4.706 . 0 0 "[ . 1 . 2]" 1
535 1 38 SER H 1 39 HIS H 1.800 . 3.990 2.579 2.389 2.674 . 0 0 "[ . 1 . 2]" 1
536 1 39 HIS HA 1 42 LEU HB3 1.800 . 5.680 3.094 2.320 4.500 . 0 0 "[ . 1 . 2]" 1
537 1 39 HIS HA 1 42 LEU HB2 1.800 . 5.680 2.974 1.992 4.034 . 0 0 "[ . 1 . 2]" 1
538 1 39 HIS HA 1 42 LEU H 1.800 . 5.030 3.429 3.097 3.981 . 0 0 "[ . 1 . 2]" 1
539 1 39 HIS QB 1 40 MET H 1.800 . 4.060 2.603 2.474 2.852 . 0 0 "[ . 1 . 2]" 1
540 1 39 HIS HE1 1 42 LEU MD1 1.800 . 6.000 5.503 4.006 6.215 0.215 19 0 "[ . 1 . 2]" 1
541 1 39 HIS H 1 39 HIS HB3 1.800 . 4.170 3.267 2.424 3.699 . 0 0 "[ . 1 . 2]" 1
542 1 39 HIS H 1 39 HIS HB2 1.800 . 4.170 2.439 2.137 2.576 . 0 0 "[ . 1 . 2]" 1
543 1 39 HIS H 1 40 MET H 1.800 . 4.420 2.776 2.637 2.930 . 0 0 "[ . 1 . 2]" 1
544 1 40 MET HA 1 40 MET ME 1.800 . 4.880 2.659 1.782 2.989 0.018 13 0 "[ . 1 . 2]" 1
545 1 40 MET HA 1 40 MET QG 1.800 . 3.770 2.973 2.832 3.070 . 0 0 "[ . 1 . 2]" 1
546 1 40 MET HA 1 43 ILE HB 1.800 . 4.190 2.916 2.498 3.395 . 0 0 "[ . 1 . 2]" 1
547 1 40 MET HA 1 43 ILE QG 1.800 . 5.910 4.319 3.708 5.007 . 0 0 "[ . 1 . 2]" 1
548 1 40 MET HA 1 43 ILE MG 1.800 . 6.640 4.009 3.525 4.471 . 0 0 "[ . 1 . 2]" 1
549 1 40 MET HA 1 43 ILE H 1.800 . 4.790 3.583 3.163 3.922 . 0 0 "[ . 1 . 2]" 1
550 1 40 MET HA 1 44 VAL MG2 1.800 . 4.720 4.565 4.400 4.689 . 0 0 "[ . 1 . 2]" 1
551 1 40 MET QB 1 41 ASN H 1.800 . 3.740 2.613 2.412 2.851 . 0 0 "[ . 1 . 2]" 1
552 1 40 MET ME 1 43 ILE MG 1.800 . 5.640 3.661 2.982 4.461 . 0 0 "[ . 1 . 2]" 1
553 1 40 MET ME 1 44 VAL MG2 1.800 . 5.070 4.625 4.372 5.122 0.052 13 0 "[ . 1 . 2]" 1
554 1 40 MET ME 1 56 LEU MD1 1.800 . 6.120 5.792 4.825 6.220 0.100 15 0 "[ . 1 . 2]" 1
555 1 40 MET ME 1 40 MET QG 1.800 . 3.870 2.496 2.420 2.561 . 0 0 "[ . 1 . 2]" 1
556 1 40 MET H 1 40 MET QB 1.800 . 3.750 2.451 2.380 2.519 . 0 0 "[ . 1 . 2]" 1
557 1 40 MET H 1 40 MET QG 1.800 . 4.140 2.349 2.224 2.523 . 0 0 "[ . 1 . 2]" 1
558 1 40 MET H 1 41 ASN H 1.800 . 3.950 2.685 2.543 2.813 . 0 0 "[ . 1 . 2]" 1
559 1 41 ASN HA 1 44 VAL MG1 1.800 . 4.470 3.910 3.732 4.140 . 0 0 "[ . 1 . 2]" 1
560 1 41 ASN HA 1 44 VAL MG2 1.800 . 4.140 2.141 1.966 2.360 . 0 0 "[ . 1 . 2]" 1
561 1 41 ASN HA 1 44 VAL H 1.800 . 4.610 3.897 3.694 4.131 . 0 0 "[ . 1 . 2]" 1
562 1 41 ASN HA 1 45 SER H 1.800 . 4.970 4.258 4.085 4.501 . 0 0 "[ . 1 . 2]" 1
563 1 41 ASN QB 1 42 LEU H 1.800 . 4.140 2.629 2.400 2.786 . 0 0 "[ . 1 . 2]" 1
564 1 41 ASN QB 1 44 VAL H 1.800 . 6.560 5.287 5.135 5.460 . 0 0 "[ . 1 . 2]" 1
565 1 41 ASN H 1 41 ASN QB 1.800 . 3.620 2.462 2.369 2.564 . 0 0 "[ . 1 . 2]" 1
566 1 41 ASN H 1 42 LEU H 1.800 . 3.620 2.659 2.551 2.732 . 0 0 "[ . 1 . 2]" 1
567 1 42 LEU HA 1 42 LEU MD1 1.800 . 5.330 2.906 1.959 3.374 . 0 0 "[ . 1 . 2]" 1
568 1 42 LEU HA 1 42 LEU MD2 1.800 . 3.660 2.191 2.040 2.857 . 0 0 "[ . 1 . 2]" 1
569 1 42 LEU HA 1 45 SER QB 1.800 . 4.640 2.949 2.691 3.206 . 0 0 "[ . 1 . 2]" 1
570 1 42 LEU HA 1 45 SER H 1.800 . 5.580 3.856 3.627 4.025 . 0 0 "[ . 1 . 2]" 1
571 1 42 LEU QB 1 43 ILE H 1.800 . 4.170 2.473 2.368 2.574 . 0 0 "[ . 1 . 2]" 1
572 1 42 LEU HB3 1 42 LEU MD1 1.800 . 4.540 2.350 2.317 2.442 . 0 0 "[ . 1 . 2]" 1
573 1 42 LEU HB2 1 42 LEU MD1 1.800 . 4.540 3.227 3.215 3.243 . 0 0 "[ . 1 . 2]" 1
574 1 42 LEU MD1 1 43 ILE H 1.800 . 5.830 3.733 3.167 4.723 . 0 0 "[ . 1 . 2]" 1
575 1 42 LEU MD2 1 43 ILE H 1.800 . 6.280 4.398 4.005 4.590 . 0 0 "[ . 1 . 2]" 1
576 1 42 LEU MD2 1 46 LEU MD2 1.800 . 5.000 3.889 2.719 5.144 0.144 4 0 "[ . 1 . 2]" 1
577 1 42 LEU MD2 1 46 LEU HG 1.800 . 5.160 4.066 3.211 5.446 0.286 9 0 "[ . 1 . 2]" 1
578 1 42 LEU H 1 42 LEU HB3 1.800 . 4.040 2.869 2.499 3.638 . 0 0 "[ . 1 . 2]" 1
579 1 42 LEU H 1 42 LEU HB2 1.800 . 4.040 2.326 2.129 2.453 . 0 0 "[ . 1 . 2]" 1
580 1 42 LEU H 1 42 LEU MD1 1.800 . 5.130 4.213 3.610 4.348 . 0 0 "[ . 1 . 2]" 1
581 1 42 LEU H 1 42 LEU MD2 1.800 . 5.370 3.568 2.158 4.109 . 0 0 "[ . 1 . 2]" 1
582 1 43 ILE HA 1 43 ILE MD 1.800 . 3.920 2.462 1.964 2.695 . 0 0 "[ . 1 . 2]" 1
583 1 43 ILE HA 1 46 LEU QB 1.800 . 4.710 2.908 2.577 3.225 . 0 0 "[ . 1 . 2]" 1
584 1 43 ILE HA 1 46 LEU MD1 1.800 . 4.310 2.556 2.163 3.107 . 0 0 "[ . 1 . 2]" 1
585 1 43 ILE HA 1 46 LEU H 1.800 . 4.680 3.438 3.210 3.793 . 0 0 "[ . 1 . 2]" 1
586 1 43 ILE HA 1 47 GLU H 1.800 . 5.310 4.315 4.087 4.569 . 0 0 "[ . 1 . 2]" 1
587 1 43 ILE HB 1 44 VAL H 1.800 . 3.900 2.870 2.602 3.059 . 0 0 "[ . 1 . 2]" 1
588 1 43 ILE MD 1 59 LEU MD2 1.800 . 3.780 3.281 2.398 3.836 0.056 7 0 "[ . 1 . 2]" 1
589 1 43 ILE MD 1 43 ILE MG 1.800 . 3.720 3.251 2.116 3.323 . 0 0 "[ . 1 . 2]" 1
590 1 43 ILE QG 1 43 ILE MG 1.800 . 3.950 2.154 2.125 2.319 . 0 0 "[ . 1 . 2]" 1
591 1 43 ILE MG 1 44 VAL HA 1.800 . 5.150 3.039 2.831 3.241 . 0 0 "[ . 1 . 2]" 1
592 1 43 ILE MG 1 44 VAL MG2 1.800 . 5.650 4.260 3.971 4.599 . 0 0 "[ . 1 . 2]" 1
593 1 43 ILE MG 1 44 VAL H 1.800 . 4.410 2.869 2.645 3.242 . 0 0 "[ . 1 . 2]" 1
594 1 43 ILE MG 1 45 SER H 1.800 . 5.960 4.725 4.606 4.861 . 0 0 "[ . 1 . 2]" 1
595 1 43 ILE MG 1 47 GLU HG3 1.800 . 5.420 2.896 2.551 3.272 . 0 0 "[ . 1 . 2]" 1
596 1 43 ILE MG 1 47 GLU HG2 1.800 . 5.420 2.964 2.486 3.960 . 0 0 "[ . 1 . 2]" 1
597 1 43 ILE MG 1 47 GLU H 1.800 . 5.300 4.143 3.957 4.377 . 0 0 "[ . 1 . 2]" 1
598 1 43 ILE MG 1 54 PHE QB 1.800 . 5.390 2.811 1.881 5.406 0.016 19 0 "[ . 1 . 2]" 1
599 1 43 ILE MG 1 54 PHE QD 1.800 . 3.700 2.590 1.823 3.588 . 0 0 "[ . 1 . 2]" 1
600 1 43 ILE MG 1 54 PHE QE 1.800 . 4.970 3.830 1.962 5.049 0.079 11 0 "[ . 1 . 2]" 1
601 1 43 ILE MG 1 54 PHE H 1.800 . 5.290 4.026 3.301 5.134 . 0 0 "[ . 1 . 2]" 1
602 1 43 ILE MG 1 59 LEU MD2 1.800 . 4.150 2.911 1.983 3.852 . 0 0 "[ . 1 . 2]" 1
603 1 43 ILE H 1 43 ILE HB 1.800 . 3.630 2.274 2.148 2.407 . 0 0 "[ . 1 . 2]" 1
604 1 43 ILE H 1 43 ILE MD 1.800 . 5.410 2.419 2.104 3.484 . 0 0 "[ . 1 . 2]" 1
605 1 43 ILE H 1 43 ILE QG 1.800 . 3.880 3.515 2.449 3.719 . 0 0 "[ . 1 . 2]" 1
606 1 43 ILE H 1 43 ILE MG 1.800 . 4.740 3.693 3.572 3.791 . 0 0 "[ . 1 . 2]" 1
607 1 43 ILE H 1 44 VAL MG2 1.800 . 5.390 4.080 3.941 4.175 . 0 0 "[ . 1 . 2]" 1
608 1 43 ILE H 1 44 VAL H 1.800 . 3.960 2.809 2.687 2.993 . 0 0 "[ . 1 . 2]" 1
609 1 44 VAL HA 1 44 VAL MG1 1.800 . 3.830 2.384 2.348 2.414 . 0 0 "[ . 1 . 2]" 1
610 1 44 VAL HA 1 44 VAL MG2 1.800 . 3.630 3.266 3.251 3.272 . 0 0 "[ . 1 . 2]" 1
611 1 44 VAL HA 1 47 GLU QB 1.800 . 4.320 2.464 2.233 2.748 . 0 0 "[ . 1 . 2]" 1
612 1 44 VAL HA 1 47 GLU H 1.800 . 4.640 3.223 3.051 3.665 . 0 0 "[ . 1 . 2]" 1
613 1 44 VAL HB 1 45 SER H 1.800 . 3.850 3.952 3.872 4.005 0.155 10 0 "[ . 1 . 2]" 1
614 1 44 VAL MG1 1 45 SER H 1.800 . 4.140 4.073 4.026 4.167 0.027 7 0 "[ . 1 . 2]" 1
615 1 44 VAL MG1 1 47 GLU H 1.800 . 6.000 5.075 4.921 5.401 . 0 0 "[ . 1 . 2]" 1
616 1 44 VAL MG1 1 48 VAL H 1.800 . 6.050 5.604 5.442 5.811 . 0 0 "[ . 1 . 2]" 1
617 1 44 VAL MG2 1 45 SER H 1.800 . 4.990 2.385 2.248 2.521 . 0 0 "[ . 1 . 2]" 1
618 1 44 VAL H 1 44 VAL HB 1.800 . 3.550 3.668 3.641 3.702 0.152 1 0 "[ . 1 . 2]" 1
619 1 44 VAL H 1 44 VAL MG1 1.800 . 4.330 2.255 2.197 2.372 . 0 0 "[ . 1 . 2]" 1
620 1 44 VAL H 1 44 VAL MG2 1.800 . 3.510 2.190 2.048 2.263 . 0 0 "[ . 1 . 2]" 1
621 1 44 VAL H 1 45 SER H 1.800 . 3.840 2.677 2.609 2.770 . 0 0 "[ . 1 . 2]" 1
622 1 45 SER HA 1 48 VAL HB 1.800 . 5.430 5.177 4.930 5.447 0.017 6 0 "[ . 1 . 2]" 1
623 1 45 SER HA 1 48 VAL MG2 1.800 . 4.480 2.167 1.928 2.414 . 0 0 "[ . 1 . 2]" 1
624 1 45 SER HA 1 48 VAL H 1.800 . 4.580 3.699 3.418 3.985 . 0 0 "[ . 1 . 2]" 1
625 1 45 SER QB 1 46 LEU H 1.800 . 3.880 2.627 2.531 2.762 . 0 0 "[ . 1 . 2]" 1
626 1 45 SER H 1 45 SER QB 1.800 . 3.450 2.462 2.411 2.560 . 0 0 "[ . 1 . 2]" 1
627 1 45 SER H 1 46 LEU HG 1.800 . 5.630 4.424 4.245 4.751 . 0 0 "[ . 1 . 2]" 1
628 1 45 SER H 1 46 LEU H 1.800 . 3.700 2.699 2.591 2.781 . 0 0 "[ . 1 . 2]" 1
629 1 45 SER H 1 47 GLU H 1.800 . 5.150 4.042 3.920 4.213 . 0 0 "[ . 1 . 2]" 1
630 1 46 LEU HA 1 46 LEU MD1 1.800 . 5.210 3.932 3.900 3.971 . 0 0 "[ . 1 . 2]" 1
631 1 46 LEU HA 1 46 LEU MD2 1.800 . 3.560 2.121 2.058 2.168 . 0 0 "[ . 1 . 2]" 1
632 1 46 LEU HA 1 48 VAL H 1.800 . 5.010 4.723 4.592 4.884 . 0 0 "[ . 1 . 2]" 1
633 1 46 LEU HA 1 49 HIS HB3 1.800 . 5.030 4.479 3.990 4.801 . 0 0 "[ . 1 . 2]" 1
634 1 46 LEU HA 1 49 HIS HB2 1.800 . 5.030 2.988 2.556 3.257 . 0 0 "[ . 1 . 2]" 1
635 1 46 LEU HA 1 49 HIS H 1.800 . 4.300 3.859 3.585 3.996 . 0 0 "[ . 1 . 2]" 1
636 1 46 LEU HA 1 50 TYR QD 1.800 . 4.750 2.195 1.979 2.753 . 0 0 "[ . 1 . 2]" 1
637 1 46 LEU HA 1 50 TYR H 1.800 . 4.890 3.576 3.161 3.952 . 0 0 "[ . 1 . 2]" 1
638 1 46 LEU QB 1 46 LEU MD1 1.800 . 3.560 2.152 2.139 2.162 . 0 0 "[ . 1 . 2]" 1
639 1 46 LEU QB 1 46 LEU MD2 1.800 . 3.550 2.401 2.319 2.483 . 0 0 "[ . 1 . 2]" 1
640 1 46 LEU QB 1 47 GLU H 1.800 . 3.780 2.675 2.532 2.830 . 0 0 "[ . 1 . 2]" 1
641 1 46 LEU QB 1 54 PHE QE 1.800 . 4.440 2.043 1.775 2.971 0.025 18 0 "[ . 1 . 2]" 1
642 1 46 LEU MD1 1 50 TYR QE 1.800 . 6.050 4.468 3.470 5.085 . 0 0 "[ . 1 . 2]" 1
643 1 46 LEU MD1 1 54 PHE QE 1.800 . 5.160 2.663 1.983 3.412 . 0 0 "[ . 1 . 2]" 1
644 1 46 LEU MD1 1 54 PHE HZ 1.800 . 4.840 2.567 2.007 3.354 . 0 0 "[ . 1 . 2]" 1
645 1 46 LEU MD1 1 59 LEU MD2 1.800 . 5.440 4.950 4.265 5.463 0.023 9 0 "[ . 1 . 2]" 1
646 1 46 LEU MD1 1 68 LEU MD1 1.800 . 4.050 2.217 2.037 2.512 . 0 0 "[ . 1 . 2]" 1
647 1 46 LEU MD1 1 72 VAL MG2 1.800 . 5.010 2.419 2.068 3.385 . 0 0 "[ . 1 . 2]" 1
648 1 46 LEU MD2 1 47 GLU H 1.800 . 6.080 4.666 4.568 4.797 . 0 0 "[ . 1 . 2]" 1
649 1 46 LEU MD2 1 50 TYR QD 1.800 . 4.460 3.063 2.603 3.443 . 0 0 "[ . 1 . 2]" 1
650 1 46 LEU MD2 1 50 TYR QE 1.800 . 3.220 2.128 1.757 2.691 0.043 13 0 "[ . 1 . 2]" 1
651 1 46 LEU H 1 46 LEU QB 1.800 . 3.510 2.498 2.385 2.572 . 0 0 "[ . 1 . 2]" 1
652 1 46 LEU H 1 46 LEU MD1 1.800 . 4.230 3.702 3.558 3.877 . 0 0 "[ . 1 . 2]" 1
653 1 46 LEU H 1 46 LEU MD2 1.800 . 4.350 3.214 2.949 3.570 . 0 0 "[ . 1 . 2]" 1
654 1 46 LEU H 1 46 LEU HG 1.800 . 3.750 2.304 2.189 2.429 . 0 0 "[ . 1 . 2]" 1
655 1 46 LEU H 1 47 GLU H 1.800 . 3.750 2.577 2.496 2.679 . 0 0 "[ . 1 . 2]" 1
656 1 47 GLU HA 1 52 ILE MD 1.800 . 5.040 4.016 3.408 5.011 . 0 0 "[ . 1 . 2]" 1
657 1 47 GLU HA 1 52 ILE HG13 1.800 . 4.260 2.893 2.132 3.972 . 0 0 "[ . 1 . 2]" 1
658 1 47 GLU HA 1 52 ILE HG12 1.800 . 4.260 2.959 2.305 3.987 . 0 0 "[ . 1 . 2]" 1
659 1 47 GLU HA 1 52 ILE H 1.800 . 3.730 2.801 2.482 3.048 . 0 0 "[ . 1 . 2]" 1
660 1 47 GLU QB 1 52 ILE H 1.800 . 5.240 4.427 3.887 4.987 . 0 0 "[ . 1 . 2]" 1
661 1 47 GLU HB3 1 48 VAL H 1.800 . 5.250 3.468 3.241 3.693 . 0 0 "[ . 1 . 2]" 1
662 1 47 GLU HB2 1 48 VAL H 1.800 . 5.250 2.431 2.235 2.704 . 0 0 "[ . 1 . 2]" 1
663 1 47 GLU QG 1 48 VAL H 1.800 . 5.700 4.004 3.848 4.196 . 0 0 "[ . 1 . 2]" 1
664 1 47 GLU QG 1 52 ILE QG 1.800 . 6.000 3.955 2.799 5.249 . 0 0 "[ . 1 . 2]" 1
665 1 47 GLU QG 1 52 ILE H 1.800 . 5.370 5.213 4.310 5.534 0.164 4 0 "[ . 1 . 2]" 1
666 1 47 GLU QG 1 53 LYS HA 1.800 . 4.950 3.926 2.018 4.821 . 0 0 "[ . 1 . 2]" 1
667 1 47 GLU QG 1 54 PHE QE 1.800 . 5.710 3.826 2.737 4.778 . 0 0 "[ . 1 . 2]" 1
668 1 47 GLU HG3 1 54 PHE QD 1.800 . 4.600 4.008 2.116 4.752 0.152 5 0 "[ . 1 . 2]" 1
669 1 47 GLU QG 1 54 PHE H 1.800 . 5.530 3.639 2.234 4.185 . 0 0 "[ . 1 . 2]" 1
670 1 47 GLU HG2 1 54 PHE QD 1.800 . 4.600 3.149 1.813 4.084 . 0 0 "[ . 1 . 2]" 1
671 1 47 GLU H 1 47 GLU QB 1.800 . 3.840 2.466 2.386 2.550 . 0 0 "[ . 1 . 2]" 1
672 1 47 GLU H 1 47 GLU HG3 1.800 . 4.460 3.259 2.319 3.675 . 0 0 "[ . 1 . 2]" 1
673 1 47 GLU H 1 47 GLU HG2 1.800 . 4.460 2.521 2.067 3.492 . 0 0 "[ . 1 . 2]" 1
674 1 47 GLU H 1 52 ILE H 1.800 . 6.050 5.265 4.932 5.597 . 0 0 "[ . 1 . 2]" 1
675 1 47 GLU H 1 54 PHE QE 1.800 . 5.480 4.153 3.479 4.807 . 0 0 "[ . 1 . 2]" 1
676 1 48 VAL HA 1 48 VAL MG1 1.800 . 3.530 2.361 2.336 2.383 . 0 0 "[ . 1 . 2]" 1
677 1 48 VAL HA 1 48 VAL MG2 1.800 . 3.360 3.274 3.264 3.289 . 0 0 "[ . 1 . 2]" 1
678 1 48 VAL HA 1 51 LYS H 1.800 . 4.960 3.848 3.554 4.194 . 0 0 "[ . 1 . 2]" 1
679 1 48 VAL HB 1 49 HIS H 1.800 . 3.770 3.772 3.660 3.822 0.052 19 0 "[ . 1 . 2]" 1
680 1 48 VAL HB 1 50 TYR H 1.800 . 6.050 6.063 5.902 6.134 0.084 7 0 "[ . 1 . 2]" 1
681 1 48 VAL MG1 1 49 HIS HA 1.800 . 5.560 5.518 5.460 5.560 . 0 0 "[ . 1 . 2]" 1
682 1 48 VAL MG1 1 49 HIS H 1.800 . 4.180 4.045 4.007 4.091 . 0 0 "[ . 1 . 2]" 1
683 1 48 VAL MG2 1 49 HIS H 1.800 . 4.350 2.164 2.058 2.225 . 0 0 "[ . 1 . 2]" 1
684 1 48 VAL H 1 48 VAL HB 1.800 . 3.550 3.660 3.630 3.688 0.138 11 0 "[ . 1 . 2]" 1
685 1 48 VAL H 1 48 VAL MG1 1.800 . 4.430 2.334 2.250 2.419 . 0 0 "[ . 1 . 2]" 1
686 1 48 VAL H 1 48 VAL MG2 1.800 . 3.720 2.105 2.009 2.161 . 0 0 "[ . 1 . 2]" 1
687 1 48 VAL H 1 49 HIS H 1.800 . 3.780 2.682 2.642 2.743 . 0 0 "[ . 1 . 2]" 1
688 1 48 VAL H 1 52 ILE H 1.800 . 6.050 5.302 4.884 5.709 . 0 0 "[ . 1 . 2]" 1
689 1 49 HIS HB3 1 50 TYR H 1.800 . 4.250 3.262 3.019 3.466 . 0 0 "[ . 1 . 2]" 1
690 1 49 HIS HB2 1 50 TYR H 1.800 . 4.250 2.634 2.450 2.737 . 0 0 "[ . 1 . 2]" 1
691 1 49 HIS H 1 49 HIS HB3 1.800 . 3.630 3.601 3.561 3.638 0.008 4 0 "[ . 1 . 2]" 1
692 1 49 HIS H 1 49 HIS HB2 1.800 . 3.630 2.349 2.268 2.419 . 0 0 "[ . 1 . 2]" 1
693 1 49 HIS H 1 50 TYR QD 1.800 . 5.240 4.239 3.863 4.827 . 0 0 "[ . 1 . 2]" 1
694 1 49 HIS H 1 51 LYS H 1.800 . 4.970 3.848 3.639 4.028 . 0 0 "[ . 1 . 2]" 1
695 1 50 TYR HA 1 50 TYR QD 1.800 . 3.770 2.955 2.637 3.131 . 0 0 "[ . 1 . 2]" 1
696 1 50 TYR HA 1 52 ILE QG 1.800 . 5.290 4.729 4.390 4.901 . 0 0 "[ . 1 . 2]" 1
697 1 50 TYR HA 1 76 LEU MD2 1.800 . 5.800 3.879 3.082 4.597 . 0 0 "[ . 1 . 2]" 1
698 1 50 TYR QB 1 52 ILE QG 1.800 . 5.370 2.089 1.843 2.359 . 0 0 "[ . 1 . 2]" 1
699 1 50 TYR QB 1 76 LEU MD2 1.800 . 5.000 2.412 1.798 3.096 0.002 9 0 "[ . 1 . 2]" 1
700 1 50 TYR HB3 1 51 LYS H 1.800 . 5.470 4.271 4.087 4.402 . 0 0 "[ . 1 . 2]" 1
701 1 50 TYR HB3 1 52 ILE MD 1.800 . 4.100 2.880 2.328 3.449 . 0 0 "[ . 1 . 2]" 1
702 1 50 TYR HB3 1 52 ILE QG 1.800 . 4.480 3.356 2.513 3.701 . 0 0 "[ . 1 . 2]" 1
703 1 50 TYR HB3 1 52 ILE MG 1.800 . 5.080 2.327 2.132 2.767 . 0 0 "[ . 1 . 2]" 1
704 1 50 TYR HB3 1 52 ILE H 1.800 . 5.150 4.197 3.758 4.711 . 0 0 "[ . 1 . 2]" 1
705 1 50 TYR HB2 1 51 LYS H 1.800 . 5.470 3.499 3.288 3.672 . 0 0 "[ . 1 . 2]" 1
706 1 50 TYR HB2 1 52 ILE MD 1.800 . 4.100 2.423 2.263 2.668 . 0 0 "[ . 1 . 2]" 1
707 1 50 TYR HB2 1 52 ILE QG 1.800 . 4.480 2.111 1.864 2.388 . 0 0 "[ . 1 . 2]" 1
708 1 50 TYR HB2 1 52 ILE MG 1.800 . 5.080 2.615 2.216 3.523 . 0 0 "[ . 1 . 2]" 1
709 1 50 TYR HB2 1 52 ILE H 1.800 . 5.150 3.213 2.924 3.716 . 0 0 "[ . 1 . 2]" 1
710 1 50 TYR QD 1 51 LYS H 1.800 . 5.130 4.536 4.270 4.743 . 0 0 "[ . 1 . 2]" 1
711 1 50 TYR QD 1 52 ILE MD 1.800 . 5.130 3.144 2.420 3.520 . 0 0 "[ . 1 . 2]" 1
712 1 50 TYR QD 1 52 ILE MG 1.800 . 6.050 3.942 3.737 4.350 . 0 0 "[ . 1 . 2]" 1
713 1 50 TYR QD 1 72 VAL MG1 1.800 . 5.000 3.446 3.028 3.944 . 0 0 "[ . 1 . 2]" 1
714 1 50 TYR QD 1 76 LEU MD1 1.800 . 4.150 3.092 1.780 3.915 0.020 19 0 "[ . 1 . 2]" 1
715 1 50 TYR QD 1 76 LEU MD2 1.800 . 3.940 2.350 1.908 2.990 . 0 0 "[ . 1 . 2]" 1
716 1 50 TYR QE 1 72 VAL MG1 1.800 . 5.060 3.491 2.875 4.244 . 0 0 "[ . 1 . 2]" 1
717 1 50 TYR QE 1 76 LEU MD1 1.800 . 4.060 3.392 2.777 4.083 0.023 7 0 "[ . 1 . 2]" 1
718 1 50 TYR QE 1 76 LEU MD2 1.800 . 5.050 3.956 3.296 4.585 . 0 0 "[ . 1 . 2]" 1
719 1 50 TYR H 1 50 TYR HB3 1.800 . 4.130 3.670 3.637 3.703 . 0 0 "[ . 1 . 2]" 1
720 1 50 TYR H 1 50 TYR HB2 1.800 . 4.130 2.510 2.429 2.607 . 0 0 "[ . 1 . 2]" 1
721 1 50 TYR H 1 50 TYR QD 1.800 . 4.170 2.471 2.133 2.981 . 0 0 "[ . 1 . 2]" 1
722 1 50 TYR H 1 51 LYS H 1.800 . 3.620 2.422 2.322 2.540 . 0 0 "[ . 1 . 2]" 1
723 1 50 TYR H 1 52 ILE MD 1.800 . 6.580 4.305 4.077 4.698 . 0 0 "[ . 1 . 2]" 1
724 1 50 TYR H 1 52 ILE H 1.800 . 4.980 3.843 3.666 4.196 . 0 0 "[ . 1 . 2]" 1
725 1 51 LYS HA 1 51 LYS QD 1.800 . 5.040 3.098 2.389 4.058 . 0 0 "[ . 1 . 2]" 1
726 1 51 LYS HA 1 51 LYS QG 1.800 . 3.940 2.568 2.415 3.431 . 0 0 "[ . 1 . 2]" 1
727 1 51 LYS HA 1 52 ILE H 1.800 . 3.430 2.775 2.346 2.961 . 0 0 "[ . 1 . 2]" 1
728 1 51 LYS QB 1 51 LYS QD 1.800 . 3.540 2.422 2.183 2.799 . 0 0 "[ . 1 . 2]" 1
729 1 51 LYS QB 1 52 ILE H 1.800 . 4.610 3.916 3.849 4.034 . 0 0 "[ . 1 . 2]" 1
730 1 51 LYS QD 1 52 ILE H 1.800 . 6.000 4.637 4.239 5.972 . 0 0 "[ . 1 . 2]" 1
731 1 51 LYS QG 1 52 ILE H 1.800 . 6.120 4.894 4.514 5.080 . 0 0 "[ . 1 . 2]" 1
732 1 51 LYS H 1 52 ILE MG 1.800 . 4.980 4.093 3.848 4.379 . 0 0 "[ . 1 . 2]" 1
733 1 51 LYS H 1 52 ILE H 1.800 . 3.640 2.728 2.575 3.106 . 0 0 "[ . 1 . 2]" 1
734 1 52 ILE HA 1 52 ILE MD 1.800 . 5.280 4.264 4.237 4.277 . 0 0 "[ . 1 . 2]" 1
735 1 52 ILE HA 1 52 ILE MG 1.800 . 3.740 2.360 2.340 2.404 . 0 0 "[ . 1 . 2]" 1
736 1 52 ILE HA 1 53 LYS H 1.800 . 3.340 2.591 2.188 2.789 . 0 0 "[ . 1 . 2]" 1
737 1 52 ILE HB 1 52 ILE MD 1.800 . 3.710 2.520 2.476 2.574 . 0 0 "[ . 1 . 2]" 1
738 1 52 ILE HB 1 53 LYS H 1.800 . 3.320 2.203 1.946 3.014 . 0 0 "[ . 1 . 2]" 1
739 1 52 ILE HB 1 54 PHE QD 1.800 . 5.950 5.084 3.624 5.453 . 0 0 "[ . 1 . 2]" 1
740 1 52 ILE HB 1 75 LYS QE 1.800 . 5.870 4.185 3.425 5.002 . 0 0 "[ . 1 . 2]" 1
741 1 52 ILE MD 1 53 LYS H 1.800 . 5.030 4.076 3.798 4.955 . 0 0 "[ . 1 . 2]" 1
742 1 52 ILE MD 1 54 PHE QE 1.800 . 4.530 2.408 1.998 2.902 . 0 0 "[ . 1 . 2]" 1
743 1 52 ILE MD 1 54 PHE HZ 1.800 . 4.350 2.704 2.238 3.652 . 0 0 "[ . 1 . 2]" 1
744 1 52 ILE MD 1 72 VAL HA 1.800 . 4.200 2.715 2.032 3.251 . 0 0 "[ . 1 . 2]" 1
745 1 52 ILE MD 1 72 VAL MG1 1.800 . 4.310 2.321 2.045 2.929 . 0 0 "[ . 1 . 2]" 1
746 1 52 ILE MD 1 72 VAL MG2 1.800 . 4.530 2.604 1.966 3.251 . 0 0 "[ . 1 . 2]" 1
747 1 52 ILE MD 1 75 LYS HB3 1.800 . 4.470 3.289 2.612 4.313 . 0 0 "[ . 1 . 2]" 1
748 1 52 ILE MD 1 75 LYS HB2 1.800 . 4.470 2.835 2.168 3.493 . 0 0 "[ . 1 . 2]" 1
749 1 52 ILE MD 1 75 LYS QD 1.800 . 4.420 3.485 2.138 4.533 0.113 1 0 "[ . 1 . 2]" 1
750 1 52 ILE MD 1 75 LYS QE 1.800 . 5.380 4.013 3.442 4.766 . 0 0 "[ . 1 . 2]" 1
751 1 52 ILE MD 1 75 LYS QG 1.800 . 4.760 2.841 1.970 4.502 . 0 0 "[ . 1 . 2]" 1
752 1 52 ILE MD 1 75 LYS H 1.800 . 7.980 4.661 4.140 5.113 . 0 0 "[ . 1 . 2]" 1
753 1 52 ILE MD 1 76 LEU MD2 1.800 . 4.570 3.487 2.757 4.326 . 0 0 "[ . 1 . 2]" 1
754 1 52 ILE MD 1 76 LEU H 1.800 . 6.430 4.633 4.027 5.181 . 0 0 "[ . 1 . 2]" 1
755 1 54 PHE HB2 1 59 LEU MD1 1.800 . 4.480 4.325 3.202 4.755 0.275 20 0 "[ . 1 . 2]" 1
756 1 52 ILE HG13 1 53 LYS H 1.800 . 5.360 3.386 3.004 4.291 . 0 0 "[ . 1 . 2]" 1
757 1 52 ILE HG12 1 53 LYS H 1.800 . 5.360 4.458 4.199 5.038 . 0 0 "[ . 1 . 2]" 1
758 1 52 ILE MD 1 52 ILE MG 1.800 . 3.290 1.998 1.967 2.028 . 0 0 "[ . 1 . 2]" 1
759 1 52 ILE QG 1 52 ILE MG 1.800 . 4.070 2.431 2.402 2.458 . 0 0 "[ . 1 . 2]" 1
760 1 52 ILE MG 1 53 LYS H 1.800 . 4.130 3.642 3.550 3.803 . 0 0 "[ . 1 . 2]" 1
761 1 52 ILE MG 1 72 VAL MG1 1.800 . 6.770 3.523 2.940 4.263 . 0 0 "[ . 1 . 2]" 1
762 1 52 ILE MG 1 75 LYS QB 1.800 . 5.010 2.129 1.814 2.393 . 0 0 "[ . 1 . 2]" 1
763 1 52 ILE MG 1 75 LYS QG 1.800 . 5.510 3.573 2.893 4.153 . 0 0 "[ . 1 . 2]" 1
764 1 52 ILE MG 1 76 LEU HA 1.800 . 5.060 3.633 2.708 4.454 . 0 0 "[ . 1 . 2]" 1
765 1 52 ILE MG 1 76 LEU MD2 1.800 . 4.670 2.599 1.989 3.505 . 0 0 "[ . 1 . 2]" 1
766 1 52 ILE MG 1 79 LYS QD 1.800 . 4.970 3.564 2.065 4.754 . 0 0 "[ . 1 . 2]" 1
767 1 52 ILE MG 1 79 LYS QE 1.800 . 4.080 2.657 1.915 4.212 0.132 4 0 "[ . 1 . 2]" 1
768 1 52 ILE MG 1 79 LYS QG 1.800 . 5.870 2.563 1.868 3.318 . 0 0 "[ . 1 . 2]" 1
769 1 52 ILE H 1 52 ILE MD 1.800 . 4.440 3.771 3.684 3.985 . 0 0 "[ . 1 . 2]" 1
770 1 52 ILE H 1 52 ILE HG13 1.800 . 4.250 3.087 2.987 3.218 . 0 0 "[ . 1 . 2]" 1
771 1 52 ILE H 1 52 ILE HG12 1.800 . 4.250 2.106 1.992 2.339 . 0 0 "[ . 1 . 2]" 1
772 1 52 ILE H 1 52 ILE MG 1.800 . 4.680 2.799 2.613 3.178 . 0 0 "[ . 1 . 2]" 1
773 1 52 ILE H 1 53 LYS H 1.800 . 5.060 4.468 4.368 4.572 . 0 0 "[ . 1 . 2]" 1
774 1 53 LYS HA 1 53 LYS QD 1.800 . 4.970 3.530 2.285 4.154 . 0 0 "[ . 1 . 2]" 1
775 1 53 LYS HA 1 54 PHE H 1.800 . 3.610 2.197 2.146 2.225 . 0 0 "[ . 1 . 2]" 1
776 1 53 LYS QB 1 53 LYS QE 1.800 . 4.370 3.218 2.005 3.926 . 0 0 "[ . 1 . 2]" 1
777 1 53 LYS HB3 1 54 PHE H 1.800 . 5.090 4.355 3.518 4.555 . 0 0 "[ . 1 . 2]" 1
778 1 53 LYS HB2 1 54 PHE H 1.800 . 5.090 4.477 4.290 4.632 . 0 0 "[ . 1 . 2]" 1
779 1 53 LYS QD 1 54 PHE H 1.800 . 6.050 3.978 2.650 5.508 . 0 0 "[ . 1 . 2]" 1
780 1 53 LYS QG 1 54 PHE H 1.800 . 5.080 3.506 2.925 4.706 . 0 0 "[ . 1 . 2]" 1
781 1 53 LYS QE 1 53 LYS HG3 1.800 . 4.580 2.675 2.425 3.153 . 0 0 "[ . 1 . 2]" 1
782 1 53 LYS QE 1 53 LYS HG2 1.800 . 4.580 2.777 2.379 3.572 . 0 0 "[ . 1 . 2]" 1
783 1 53 LYS H 1 53 LYS QB 1.800 . 3.600 2.621 2.299 2.844 . 0 0 "[ . 1 . 2]" 1
784 1 53 LYS H 1 53 LYS QG 1.800 . 4.690 4.217 2.905 4.461 . 0 0 "[ . 1 . 2]" 1
785 1 53 LYS H 1 54 PHE H 1.800 . 4.980 4.047 3.808 4.415 . 0 0 "[ . 1 . 2]" 1
786 1 54 PHE HA 1 54 PHE QD 1.800 . 4.470 2.935 2.339 3.788 . 0 0 "[ . 1 . 2]" 1
787 1 54 PHE HA 1 55 ALA H 1.800 . 3.400 2.185 2.129 2.286 . 0 0 "[ . 1 . 2]" 1
788 1 54 PHE HA 1 75 LYS QE 1.800 . 4.630 2.750 2.057 3.406 . 0 0 "[ . 1 . 2]" 1
789 1 54 PHE QB 1 55 ALA H 1.800 . 4.500 3.002 2.501 3.449 . 0 0 "[ . 1 . 2]" 1
790 1 54 PHE QB 1 59 LEU H 1.800 . 6.500 4.352 3.733 5.028 . 0 0 "[ . 1 . 2]" 1
791 1 54 PHE QB 1 59 LEU MD1 1.800 . 4.480 3.724 2.767 4.419 . 0 0 "[ . 1 . 2]" 1
792 1 54 PHE QB 1 59 LEU HG 1.800 . 5.060 4.028 2.725 5.067 0.007 6 0 "[ . 1 . 2]" 1
793 1 54 PHE QB 1 59 LEU MD2 1.800 . 4.740 2.080 1.808 2.527 . 0 0 "[ . 1 . 2]" 1
794 1 54 PHE QD 1 55 ALA H 1.800 . 5.410 4.112 3.784 4.420 . 0 0 "[ . 1 . 2]" 1
795 1 54 PHE QD 1 59 LEU MD1 1.800 . 5.100 4.401 3.486 4.963 . 0 0 "[ . 1 . 2]" 1
796 1 54 PHE QD 1 59 LEU MD2 1.800 . 4.270 3.029 1.762 3.661 0.038 6 0 "[ . 1 . 2]" 1
797 1 54 PHE QD 1 62 LEU MD1 1.800 . 5.730 3.335 2.553 4.641 . 0 0 "[ . 1 . 2]" 1
798 1 54 PHE QD 1 71 LEU MD2 1.800 . 4.380 4.390 3.218 4.593 0.213 5 0 "[ . 1 . 2]" 1
799 1 54 PHE QD 1 71 LEU HG 1.800 . 5.850 3.588 3.074 4.566 . 0 0 "[ . 1 . 2]" 1
800 1 54 PHE QD 1 75 LYS QD 1.800 . 5.370 4.465 3.137 5.414 0.044 15 0 "[ . 1 . 2]" 1
801 1 54 PHE QD 1 75 LYS QE 1.800 . 3.960 2.948 2.215 3.719 . 0 0 "[ . 1 . 2]" 1
802 1 54 PHE QD 1 75 LYS HE3 1.800 . 4.530 3.071 2.232 3.944 . 0 0 "[ . 1 . 2]" 1
803 1 54 PHE QD 1 75 LYS HE2 1.800 . 4.530 3.876 3.229 4.595 0.065 3 0 "[ . 1 . 2]" 1
804 1 54 PHE QE 1 71 LEU MD2 1.800 . 4.660 4.360 3.496 4.832 0.172 6 0 "[ . 1 . 2]" 1
805 1 54 PHE QE 1 71 LEU HG 1.800 . 5.180 3.700 2.497 5.318 0.138 19 0 "[ . 1 . 2]" 1
806 1 54 PHE QE 1 72 VAL MG2 1.800 . 4.600 2.825 2.419 3.270 . 0 0 "[ . 1 . 2]" 1
807 1 54 PHE QE 1 75 LYS QD 1.800 . 5.560 4.539 3.303 5.587 0.027 19 0 "[ . 1 . 2]" 1
808 1 54 PHE QE 1 75 LYS QE 1.800 . 6.000 3.595 2.999 5.162 . 0 0 "[ . 1 . 2]" 1
809 1 54 PHE H 1 54 PHE QD 1.800 . 4.360 2.814 2.442 3.251 . 0 0 "[ . 1 . 2]" 1
810 1 54 PHE HZ 1 68 LEU MD1 1.800 . 5.460 3.094 2.416 4.358 . 0 0 "[ . 1 . 2]" 1
811 1 54 PHE HZ 1 72 VAL MG2 1.800 . 3.940 2.047 1.721 4.162 0.222 19 0 "[ . 1 . 2]" 1
812 1 55 ALA MB 1 57 GLY H 1.800 . 4.970 2.758 2.542 3.049 . 0 0 "[ . 1 . 2]" 1
813 1 55 ALA MB 1 58 GLU QB 1.800 . 4.200 3.299 3.036 3.715 . 0 0 "[ . 1 . 2]" 1
814 1 55 ALA MB 1 58 GLU QG 1.800 . 3.720 2.103 1.804 2.527 . 0 0 "[ . 1 . 2]" 1
815 1 55 ALA H 1 55 ALA MB 1.800 . 3.580 2.330 2.282 2.371 . 0 0 "[ . 1 . 2]" 1
816 1 55 ALA H 1 58 GLU QB 1.800 . 5.000 2.677 1.992 3.322 . 0 0 "[ . 1 . 2]" 1
817 1 55 ALA H 1 58 GLU QG 1.800 . 5.000 2.921 1.860 3.637 . 0 0 "[ . 1 . 2]" 1
818 1 55 ALA H 1 75 LYS QE 1.800 . 5.870 4.240 3.603 4.867 . 0 0 "[ . 1 . 2]" 1
819 1 56 LEU HA 1 56 LEU MD1 1.800 . 4.120 3.132 2.663 3.866 . 0 0 "[ . 1 . 2]" 1
820 1 56 LEU HA 1 56 LEU MD2 1.800 . 4.320 2.076 1.986 2.363 . 0 0 "[ . 1 . 2]" 1
821 1 56 LEU HA 1 59 LEU QB 1.800 . 4.550 2.205 1.903 2.646 . 0 0 "[ . 1 . 2]" 1
822 1 56 LEU HA 1 59 LEU MD1 1.800 . 4.050 3.780 2.182 4.399 0.349 3 0 "[ . 1 . 2]" 1
823 1 56 LEU MD2 1 60 GLN QE 1.800 . 5.000 3.980 1.889 5.069 0.069 4 0 "[ . 1 . 2]" 1
824 1 56 LEU HG 1 57 GLY H 1.800 . 5.860 5.309 5.160 5.430 . 0 0 "[ . 1 . 2]" 1
825 1 56 LEU H 1 56 LEU HG 1.800 . 5.850 4.536 3.998 4.634 . 0 0 "[ . 1 . 2]" 1
826 1 57 GLY QA 1 60 GLN QB 1.800 . 4.510 3.148 2.920 3.639 . 0 0 "[ . 1 . 2]" 1
827 1 57 GLY QA 1 60 GLN QG 1.800 . 4.850 2.760 2.211 3.456 . 0 0 "[ . 1 . 2]" 1
828 1 57 GLY QA 1 60 GLN H 1.800 . 4.970 3.487 3.291 3.786 . 0 0 "[ . 1 . 2]" 1
829 1 57 GLY H 1 58 GLU H 1.800 . 4.840 2.755 2.649 2.850 . 0 0 "[ . 1 . 2]" 1
830 1 58 GLU HA 1 58 GLU QG 1.800 . 3.970 2.576 2.445 3.040 . 0 0 "[ . 1 . 2]" 1
831 1 58 GLU QB 1 59 LEU H 1.800 . 3.840 2.748 2.497 3.023 . 0 0 "[ . 1 . 2]" 1
832 1 58 GLU QB 1 71 LEU MD1 1.800 . 4.550 3.007 1.902 4.331 . 0 0 "[ . 1 . 2]" 1
833 1 58 GLU QB 1 71 LEU MD2 1.800 . 4.520 3.146 2.356 4.112 . 0 0 "[ . 1 . 2]" 1
834 1 58 GLU QG 1 59 LEU H 1.800 . 4.990 4.076 3.817 4.217 . 0 0 "[ . 1 . 2]" 1
835 1 58 GLU H 1 58 GLU QB 1.800 . 3.650 2.525 2.460 2.584 . 0 0 "[ . 1 . 2]" 1
836 1 58 GLU H 1 58 GLU QG 1.800 . 3.690 2.219 2.048 2.378 . 0 0 "[ . 1 . 2]" 1
837 1 58 GLU H 1 59 LEU H 1.800 . 3.700 2.565 2.418 2.701 . 0 0 "[ . 1 . 2]" 1
838 1 58 GLU H 1 60 GLN H 1.800 . 5.350 4.197 4.016 4.451 . 0 0 "[ . 1 . 2]" 1
839 1 59 LEU HA 1 59 LEU MD1 1.800 . 4.880 2.639 1.909 3.915 . 0 0 "[ . 1 . 2]" 1
840 1 59 LEU HA 1 59 LEU MD2 1.800 . 3.650 2.352 1.927 2.730 . 0 0 "[ . 1 . 2]" 1
841 1 59 LEU HA 1 62 LEU MD1 1.800 . 3.840 2.210 1.864 2.559 . 0 0 "[ . 1 . 2]" 1
842 1 59 LEU HA 1 62 LEU HG 1.800 . 5.110 2.320 1.966 2.805 . 0 0 "[ . 1 . 2]" 1
843 1 59 LEU HA 1 62 LEU H 1.800 . 6.020 3.305 2.973 3.570 . 0 0 "[ . 1 . 2]" 1
844 1 59 LEU HA 1 68 LEU MD1 1.800 . 5.820 4.960 4.483 5.314 . 0 0 "[ . 1 . 2]" 1
845 1 59 LEU QB 1 59 LEU MD1 1.800 . 3.410 2.252 2.147 2.353 . 0 0 "[ . 1 . 2]" 1
846 1 59 LEU QB 1 59 LEU MD2 1.800 . 3.670 2.421 2.337 2.530 . 0 0 "[ . 1 . 2]" 1
847 1 59 LEU QB 1 62 LEU MD1 1.800 . 5.120 3.701 3.115 4.068 . 0 0 "[ . 1 . 2]" 1
848 1 59 LEU MD2 1 62 LEU MD1 1.800 . 3.480 2.395 1.779 3.140 0.021 20 0 "[ . 1 . 2]" 1
849 1 59 LEU MD2 1 62 LEU H 1.800 . 7.050 5.111 4.484 5.474 . 0 0 "[ . 1 . 2]" 1
850 1 59 LEU MD2 1 68 LEU MD1 1.800 . 4.280 4.073 3.109 4.498 0.218 9 0 "[ . 1 . 2]" 1
851 1 59 LEU HG 1 60 GLN H 1.800 . 5.590 4.985 4.218 5.352 . 0 0 "[ . 1 . 2]" 1
852 1 59 LEU H 1 59 LEU QB 1.800 . 3.830 2.296 2.049 2.574 . 0 0 "[ . 1 . 2]" 1
853 1 59 LEU H 1 59 LEU MD1 1.800 . 4.370 3.938 3.706 4.361 . 0 0 "[ . 1 . 2]" 1
854 1 59 LEU H 1 59 LEU MD2 1.800 . 4.430 2.619 2.122 3.761 . 0 0 "[ . 1 . 2]" 1
855 1 59 LEU H 1 59 LEU HG 1.800 . 4.080 3.604 2.267 4.367 0.287 20 0 "[ . 1 . 2]" 1
856 1 59 LEU H 1 60 GLN H 1.800 . 3.850 2.687 2.464 2.842 . 0 0 "[ . 1 . 2]" 1
857 1 59 LEU H 1 62 LEU MD1 1.800 . 5.930 4.244 3.800 4.688 . 0 0 "[ . 1 . 2]" 1
858 1 60 GLN HA 1 60 GLN QG 1.800 . 3.860 3.035 2.881 3.189 . 0 0 "[ . 1 . 2]" 1
859 1 60 GLN QB 1 61 LYS H 1.800 . 4.110 2.990 2.730 3.283 . 0 0 "[ . 1 . 2]" 1
860 1 60 GLN H 1 60 GLN QB 1.800 . 3.360 2.532 2.449 2.656 . 0 0 "[ . 1 . 2]" 1
861 1 60 GLN H 1 60 GLN QG 1.800 . 3.750 2.149 1.957 2.287 . 0 0 "[ . 1 . 2]" 1
862 1 60 GLN H 1 61 LYS QB 1.800 . 5.870 4.799 4.487 5.024 . 0 0 "[ . 1 . 2]" 1
863 1 60 GLN H 1 61 LYS H 1.800 . 4.080 2.684 2.523 2.841 . 0 0 "[ . 1 . 2]" 1
864 1 61 LYS HA 1 61 LYS QD 1.800 . 4.880 2.257 1.992 3.501 . 0 0 "[ . 1 . 2]" 1
865 1 61 LYS HA 1 61 LYS QG 1.800 . 3.750 3.025 2.812 3.238 . 0 0 "[ . 1 . 2]" 1
866 1 61 LYS QB 1 61 LYS QD 1.800 . 3.930 2.531 2.320 2.905 . 0 0 "[ . 1 . 2]" 1
867 1 61 LYS QB 1 61 LYS QE 1.800 . 4.850 3.287 2.016 3.951 . 0 0 "[ . 1 . 2]" 1
868 1 61 LYS QB 1 62 LEU H 1.800 . 4.550 3.309 3.026 3.517 . 0 0 "[ . 1 . 2]" 1
869 1 61 LYS QG 1 62 LEU H 1.800 . 5.170 4.419 4.090 4.695 . 0 0 "[ . 1 . 2]" 1
870 1 61 LYS H 1 61 LYS QB 1.800 . 3.440 2.486 2.295 2.656 . 0 0 "[ . 1 . 2]" 1
871 1 61 LYS H 1 61 LYS QG 1.800 . 4.300 2.498 2.100 2.839 . 0 0 "[ . 1 . 2]" 1
872 1 61 LYS H 1 62 LEU MD1 1.800 . 5.760 4.994 4.748 5.231 . 0 0 "[ . 1 . 2]" 1
873 1 61 LYS H 1 62 LEU MD2 1.800 . 5.740 4.505 4.133 4.927 . 0 0 "[ . 1 . 2]" 1
874 1 61 LYS H 1 62 LEU HG 1.800 . 4.790 3.760 3.534 3.965 . 0 0 "[ . 1 . 2]" 1
875 1 61 LYS H 1 62 LEU H 1.800 . 4.010 2.414 2.259 2.559 . 0 0 "[ . 1 . 2]" 1
876 1 62 LEU HA 1 62 LEU MD1 1.800 . 4.820 3.929 3.828 3.990 . 0 0 "[ . 1 . 2]" 1
877 1 62 LEU HA 1 62 LEU MD2 1.800 . 3.260 2.154 2.020 2.274 . 0 0 "[ . 1 . 2]" 1
878 1 62 LEU HA 1 63 LYS H 1.800 . 3.640 2.238 2.127 2.398 . 0 0 "[ . 1 . 2]" 1
879 1 62 LEU HA 1 64 ASN H 1.800 . 4.370 3.514 3.187 3.807 . 0 0 "[ . 1 . 2]" 1
880 1 62 LEU HA 1 67 ASP QB 1.800 . 4.210 2.118 1.954 2.550 . 0 0 "[ . 1 . 2]" 1
881 1 62 LEU HA 1 67 ASP H 1.800 . 6.050 4.938 4.577 5.261 . 0 0 "[ . 1 . 2]" 1
882 1 62 LEU HA 1 68 LEU H 1.800 . 5.650 4.743 4.118 5.666 0.016 11 0 "[ . 1 . 2]" 1
883 1 62 LEU QB 1 62 LEU MD2 1.800 . 3.620 2.429 2.375 2.512 . 0 0 "[ . 1 . 2]" 1
884 1 62 LEU QB 1 64 ASN H 1.800 . 4.360 3.903 3.364 4.381 0.021 13 0 "[ . 1 . 2]" 1
885 1 62 LEU QB 1 68 LEU H 1.800 . 5.080 4.111 3.198 4.555 . 0 0 "[ . 1 . 2]" 1
886 1 62 LEU HB3 1 62 LEU MD1 1.800 . 3.720 2.420 2.346 2.466 . 0 0 "[ . 1 . 2]" 1
887 1 62 LEU HB2 1 62 LEU MD1 1.800 . 3.720 2.405 2.348 2.501 . 0 0 "[ . 1 . 2]" 1
888 1 62 LEU MD1 1 67 ASP QB 1.800 . 5.100 4.005 3.087 4.675 . 0 0 "[ . 1 . 2]" 1
889 1 62 LEU MD1 1 68 LEU HA 1.800 . 4.130 3.320 1.826 4.161 0.031 9 0 "[ . 1 . 2]" 1
890 1 62 LEU MD1 1 68 LEU MD1 1.800 . 3.100 2.009 1.870 2.128 . 0 0 "[ . 1 . 2]" 1
891 1 62 LEU MD1 1 68 LEU HG 1.800 . 5.710 4.003 3.745 4.512 . 0 0 "[ . 1 . 2]" 1
892 1 62 LEU MD1 1 68 LEU H 1.800 . 5.140 4.441 3.676 4.999 . 0 0 "[ . 1 . 2]" 1
893 1 62 LEU MD2 1 63 LYS H 1.800 . 4.710 4.007 3.779 4.149 . 0 0 "[ . 1 . 2]" 1
894 1 62 LEU MD2 1 64 ASN H 1.800 . 5.390 4.630 4.312 4.882 . 0 0 "[ . 1 . 2]" 1
895 1 62 LEU MD2 1 67 ASP HA 1.800 . 4.850 3.815 3.477 4.267 . 0 0 "[ . 1 . 2]" 1
896 1 62 LEU MD2 1 67 ASP QB 1.800 . 3.500 2.047 1.732 2.514 0.068 11 0 "[ . 1 . 2]" 1
897 1 62 LEU MD2 1 67 ASP H 1.800 . 6.090 4.633 4.436 4.826 . 0 0 "[ . 1 . 2]" 1
898 1 62 LEU MD2 1 68 LEU HA 1.800 . 4.060 2.859 2.086 3.874 . 0 0 "[ . 1 . 2]" 1
899 1 62 LEU MD2 1 68 LEU H 1.800 . 4.330 3.404 3.022 4.108 . 0 0 "[ . 1 . 2]" 1
900 1 62 LEU MD2 1 71 LEU HB3 1.800 . 4.970 3.286 2.647 4.251 . 0 0 "[ . 1 . 2]" 1
901 1 62 LEU MD2 1 71 LEU HB2 1.800 . 4.970 2.558 1.961 3.467 . 0 0 "[ . 1 . 2]" 1
902 1 62 LEU MD2 1 71 LEU MD2 1.800 . 4.100 2.503 2.023 3.399 . 0 0 "[ . 1 . 2]" 1
903 1 62 LEU MD2 1 71 LEU H 1.800 . 6.000 4.003 3.586 4.333 . 0 0 "[ . 1 . 2]" 1
904 1 62 LEU H 1 62 LEU QB 1.800 . 3.790 2.529 2.439 2.642 . 0 0 "[ . 1 . 2]" 1
905 1 62 LEU H 1 62 LEU MD1 1.800 . 4.550 3.881 3.699 4.002 . 0 0 "[ . 1 . 2]" 1
906 1 62 LEU H 1 62 LEU MD2 1.800 . 3.900 3.352 2.903 3.615 . 0 0 "[ . 1 . 2]" 1
907 1 62 LEU H 1 62 LEU HG 1.800 . 3.260 2.563 2.353 2.813 . 0 0 "[ . 1 . 2]" 1
908 1 62 LEU H 1 63 LYS H 1.800 . 5.280 4.172 3.883 4.580 . 0 0 "[ . 1 . 2]" 1
909 1 63 LYS HA 1 63 LYS QD 1.800 . 4.760 3.524 3.049 4.328 . 0 0 "[ . 1 . 2]" 1
910 1 63 LYS HA 1 63 LYS QG 1.800 . 3.870 2.487 2.382 2.656 . 0 0 "[ . 1 . 2]" 1
911 1 63 LYS QB 1 63 LYS QE 1.800 . 5.520 3.315 1.929 3.939 . 0 0 "[ . 1 . 2]" 1
912 1 63 LYS QB 1 64 ASN H 1.800 . 4.590 2.898 2.716 3.185 . 0 0 "[ . 1 . 2]" 1
913 1 63 LYS QG 1 64 ASN H 1.800 . 5.200 4.434 3.822 4.759 . 0 0 "[ . 1 . 2]" 1
914 1 63 LYS H 1 63 LYS QB 1.800 . 3.890 2.319 2.205 2.438 . 0 0 "[ . 1 . 2]" 1
915 1 63 LYS H 1 63 LYS QG 1.800 . 4.130 4.108 4.000 4.243 0.113 15 0 "[ . 1 . 2]" 1
916 1 63 LYS H 1 64 ASN H 1.800 . 3.790 2.213 1.868 2.455 . 0 0 "[ . 1 . 2]" 1
917 1 63 LYS H 1 67 ASP QB 1.800 . 4.300 2.758 2.437 3.054 . 0 0 "[ . 1 . 2]" 1
918 1 64 ASN HA 1 65 VAL MG2 1.800 . 5.000 3.630 3.532 3.751 . 0 0 "[ . 1 . 2]" 1
919 1 64 ASN HA 1 65 VAL H 1.800 . 3.840 2.525 2.318 2.697 . 0 0 "[ . 1 . 2]" 1
920 1 64 ASN QB 1 65 VAL H 1.800 . 3.530 2.184 1.988 2.337 . 0 0 "[ . 1 . 2]" 1
921 1 64 ASN QB 1 66 GLY H 1.800 . 4.180 2.678 2.151 3.252 . 0 0 "[ . 1 . 2]" 1
922 1 64 ASN H 1 67 ASP QB 1.800 . 3.980 2.472 2.076 3.004 . 0 0 "[ . 1 . 2]" 1
923 1 64 ASN H 1 67 ASP H 1.800 . 4.380 3.301 3.116 3.459 . 0 0 "[ . 1 . 2]" 1
924 1 64 ASN H 1 68 LEU H 1.800 . 5.150 4.363 4.031 4.787 . 0 0 "[ . 1 . 2]" 1
925 1 65 VAL HA 1 65 VAL MG1 1.800 . 4.000 2.467 2.408 2.556 . 0 0 "[ . 1 . 2]" 1
926 1 65 VAL HA 1 65 VAL MG2 1.800 . 3.820 2.473 2.384 2.533 . 0 0 "[ . 1 . 2]" 1
927 1 65 VAL HA 1 68 LEU HB3 1.800 . 4.570 3.471 2.125 4.077 . 0 0 "[ . 1 . 2]" 1
928 1 65 VAL HA 1 68 LEU HB2 1.800 . 4.570 2.328 1.796 3.221 0.004 3 0 "[ . 1 . 2]" 1
929 1 65 VAL HA 1 68 LEU MD2 1.800 . 4.550 2.341 1.801 3.171 . 0 0 "[ . 1 . 2]" 1
930 1 65 VAL HA 1 68 LEU H 1.800 . 3.960 2.891 2.620 3.306 . 0 0 "[ . 1 . 2]" 1
931 1 65 VAL HB 1 66 GLY H 1.800 . 4.370 3.163 2.810 3.419 . 0 0 "[ . 1 . 2]" 1
932 1 65 VAL HB 1 67 ASP H 1.800 . 6.050 5.383 5.174 5.534 . 0 0 "[ . 1 . 2]" 1
933 1 65 VAL MG1 1 66 GLY QA 1.800 . 6.010 3.868 3.615 4.055 . 0 0 "[ . 1 . 2]" 1
934 1 65 VAL MG1 1 66 GLY H 1.800 . 4.710 3.917 3.694 4.054 . 0 0 "[ . 1 . 2]" 1
935 1 65 VAL MG1 1 68 LEU QB 1.800 . 4.810 2.763 2.403 3.276 . 0 0 "[ . 1 . 2]" 1
936 1 65 VAL MG1 1 68 LEU H 1.800 . 5.270 4.309 4.019 4.686 . 0 0 "[ . 1 . 2]" 1
937 1 65 VAL MG1 1 69 ALA MB 1.800 . 5.080 3.332 2.881 3.739 . 0 0 "[ . 1 . 2]" 1
938 1 65 VAL MG1 1 69 ALA H 1.800 . 4.150 3.782 3.539 3.923 . 0 0 "[ . 1 . 2]" 1
939 1 65 VAL MG2 1 66 GLY H 1.800 . 4.950 4.013 3.829 4.203 . 0 0 "[ . 1 . 2]" 1
940 1 65 VAL MG2 1 68 LEU H 1.800 . 5.750 4.872 4.586 5.189 . 0 0 "[ . 1 . 2]" 1
941 1 65 VAL H 1 65 VAL HB 1.800 . 3.750 2.587 2.487 2.701 . 0 0 "[ . 1 . 2]" 1
942 1 65 VAL H 1 65 VAL MG1 1.800 . 4.530 3.820 3.788 3.857 . 0 0 "[ . 1 . 2]" 1
943 1 65 VAL H 1 65 VAL MG2 1.800 . 3.650 2.072 1.974 2.266 . 0 0 "[ . 1 . 2]" 1
944 1 65 VAL H 1 66 GLY H 1.800 . 4.140 2.614 2.537 2.713 . 0 0 "[ . 1 . 2]" 1
945 1 66 GLY QA 1 69 ALA H 1.800 . 5.610 3.176 2.991 3.430 . 0 0 "[ . 1 . 2]" 1
946 1 66 GLY QA 1 70 ASP H 1.800 . 5.980 3.997 3.687 4.167 . 0 0 "[ . 1 . 2]" 1
947 1 66 GLY QA 1 69 ALA MB 1.800 . 5.070 2.405 2.203 2.615 . 0 0 "[ . 1 . 2]" 1
948 1 66 GLY H 1 67 ASP H 1.800 . 3.840 2.602 2.502 2.661 . 0 0 "[ . 1 . 2]" 1
949 1 66 GLY H 1 68 LEU H 1.800 . 5.820 3.981 3.789 4.182 . 0 0 "[ . 1 . 2]" 1
950 1 66 GLY H 1 69 ALA MB 1.800 . 5.580 4.526 4.327 4.716 . 0 0 "[ . 1 . 2]" 1
951 1 67 ASP QB 1 68 LEU H 1.800 . 3.830 2.606 2.405 2.821 . 0 0 "[ . 1 . 2]" 1
952 1 67 ASP H 1 67 ASP QB 1.800 . 3.610 2.453 2.357 2.503 . 0 0 "[ . 1 . 2]" 1
953 1 67 ASP H 1 68 LEU QB 1.800 . 5.360 4.487 4.216 4.607 . 0 0 "[ . 1 . 2]" 1
954 1 67 ASP H 1 68 LEU H 1.800 . 3.730 2.652 2.536 2.773 . 0 0 "[ . 1 . 2]" 1
955 1 67 ASP H 1 69 ALA MB 1.800 . 5.780 4.616 4.457 4.761 . 0 0 "[ . 1 . 2]" 1
956 1 67 ASP H 1 69 ALA H 1.800 . 4.940 3.932 3.778 4.075 . 0 0 "[ . 1 . 2]" 1
957 1 68 LEU HA 1 68 LEU MD1 1.800 . 3.670 2.032 1.923 2.293 . 0 0 "[ . 1 . 2]" 1
958 1 68 LEU HA 1 68 LEU MD2 1.800 . 4.930 3.066 2.662 3.989 . 0 0 "[ . 1 . 2]" 1
959 1 68 LEU HA 1 70 ASP H 1.800 . 5.390 4.549 4.320 4.901 . 0 0 "[ . 1 . 2]" 1
960 1 68 LEU HA 1 71 LEU QB 1.800 . 5.470 2.498 2.056 2.981 . 0 0 "[ . 1 . 2]" 1
961 1 68 LEU HA 1 71 LEU MD2 1.800 . 5.200 4.404 3.569 5.292 0.092 20 0 "[ . 1 . 2]" 1
962 1 68 LEU HA 1 71 LEU H 1.800 . 4.410 3.345 3.174 3.543 . 0 0 "[ . 1 . 2]" 1
963 1 68 LEU QB 1 68 LEU MD1 1.800 . 4.030 2.394 2.344 2.440 . 0 0 "[ . 1 . 2]" 1
964 1 68 LEU QB 1 70 ASP H 1.800 . 5.820 4.918 4.675 5.116 . 0 0 "[ . 1 . 2]" 1
965 1 68 LEU HB3 1 68 LEU MD2 1.800 . 4.020 3.057 2.350 3.247 . 0 0 "[ . 1 . 2]" 1
966 1 68 LEU HB3 1 69 ALA H 1.800 . 4.480 3.405 2.695 3.733 . 0 0 "[ . 1 . 2]" 1
967 1 68 LEU HB2 1 68 LEU MD2 1.800 . 4.020 2.372 2.309 2.449 . 0 0 "[ . 1 . 2]" 1
968 1 68 LEU HB2 1 69 ALA H 1.800 . 4.480 3.177 2.775 4.093 . 0 0 "[ . 1 . 2]" 1
969 1 68 LEU MD1 1 71 LEU H 1.800 . 5.730 4.661 4.337 4.978 . 0 0 "[ . 1 . 2]" 1
970 1 68 LEU HG 1 72 VAL MG2 1.800 . 3.930 3.868 2.500 4.235 0.305 9 0 "[ . 1 . 2]" 1
971 1 68 LEU H 1 68 LEU HB3 1.800 . 3.690 3.379 2.385 3.646 . 0 0 "[ . 1 . 2]" 1
972 1 68 LEU H 1 68 LEU HB2 1.800 . 3.690 2.398 2.304 2.559 . 0 0 "[ . 1 . 2]" 1
973 1 68 LEU H 1 68 LEU MD1 1.800 . 5.630 3.836 3.554 4.230 . 0 0 "[ . 1 . 2]" 1
974 1 68 LEU H 1 68 LEU MD2 1.800 . 5.800 2.701 2.212 4.305 . 0 0 "[ . 1 . 2]" 1
975 1 68 LEU H 1 68 LEU HG 1.800 . 5.350 4.231 4.108 4.538 . 0 0 "[ . 1 . 2]" 1
976 1 68 LEU H 1 69 ALA MB 1.800 . 5.750 4.366 4.263 4.489 . 0 0 "[ . 1 . 2]" 1
977 1 68 LEU H 1 69 ALA H 1.800 . 3.640 2.691 2.579 2.792 . 0 0 "[ . 1 . 2]" 1
978 1 69 ALA HA 1 71 LEU H 1.800 . 5.320 4.602 4.192 4.964 . 0 0 "[ . 1 . 2]" 1
979 1 69 ALA HA 1 72 VAL HB 1.800 . 4.260 3.415 2.867 4.009 . 0 0 "[ . 1 . 2]" 1
980 1 69 ALA HA 1 72 VAL MG1 1.800 . 5.550 4.663 4.211 5.266 . 0 0 "[ . 1 . 2]" 1
981 1 69 ALA HA 1 72 VAL MG2 1.800 . 4.360 3.930 2.696 4.497 0.137 15 0 "[ . 1 . 2]" 1
982 1 69 ALA HA 1 72 VAL H 1.800 . 4.570 4.170 3.314 4.429 . 0 0 "[ . 1 . 2]" 1
983 1 69 ALA HA 1 73 ASP H 1.800 . 5.650 4.205 3.953 4.479 . 0 0 "[ . 1 . 2]" 1
984 1 69 ALA MB 1 70 ASP H 1.800 . 3.410 2.390 2.123 2.654 . 0 0 "[ . 1 . 2]" 1
985 1 69 ALA MB 1 71 LEU H 1.800 . 5.270 4.533 4.302 4.872 . 0 0 "[ . 1 . 2]" 1
986 1 69 ALA MB 1 72 VAL MG2 1.800 . 5.840 4.923 3.992 5.330 . 0 0 "[ . 1 . 2]" 1
987 1 69 ALA MB 1 72 VAL H 1.800 . 6.050 5.162 4.525 5.332 . 0 0 "[ . 1 . 2]" 1
988 1 69 ALA H 1 69 ALA MB 1.800 . 3.300 2.254 2.207 2.287 . 0 0 "[ . 1 . 2]" 1
989 1 69 ALA H 1 71 LEU H 1.800 . 6.130 4.025 3.582 4.437 . 0 0 "[ . 1 . 2]" 1
990 1 70 ASP QB 1 71 LEU H 1.800 . 3.770 2.516 2.260 2.804 . 0 0 "[ . 1 . 2]" 1
991 1 70 ASP QB 1 72 VAL H 1.800 . 5.870 4.973 4.836 5.165 . 0 0 "[ . 1 . 2]" 1
992 1 70 ASP H 1 70 ASP QB 1.800 . 3.230 2.360 2.237 2.559 . 0 0 "[ . 1 . 2]" 1
993 1 70 ASP H 1 71 LEU QB 1.800 . 5.200 4.495 4.291 4.786 . 0 0 "[ . 1 . 2]" 1
994 1 70 ASP H 1 71 LEU H 1.800 . 3.640 2.733 2.613 2.847 . 0 0 "[ . 1 . 2]" 1
995 1 71 LEU HA 1 71 LEU MD1 1.800 . 3.700 2.566 1.908 3.573 . 0 0 "[ . 1 . 2]" 1
996 1 71 LEU HA 1 71 LEU MD2 1.800 . 5.050 2.367 2.008 2.952 . 0 0 "[ . 1 . 2]" 1
997 1 71 LEU HA 1 74 LYS QB 1.800 . 4.380 2.737 2.331 3.290 . 0 0 "[ . 1 . 2]" 1
998 1 71 LEU HA 1 74 LYS H 1.800 . 4.480 3.396 3.209 3.580 . 0 0 "[ . 1 . 2]" 1
999 1 71 LEU HA 1 75 LYS H 1.800 . 5.980 4.350 4.138 4.713 . 0 0 "[ . 1 . 2]" 1
1000 1 71 LEU QB 1 74 LYS H 1.800 . 6.050 4.875 4.706 4.977 . 0 0 "[ . 1 . 2]" 1
1001 1 71 LEU HB3 1 71 LEU MD1 1.800 . 4.160 2.413 2.267 2.535 . 0 0 "[ . 1 . 2]" 1
1002 1 71 LEU HB3 1 71 LEU MD2 1.800 . 4.070 3.243 3.227 3.267 . 0 0 "[ . 1 . 2]" 1
1003 1 71 LEU HB3 1 72 VAL H 1.800 . 4.850 2.734 2.362 3.326 . 0 0 "[ . 1 . 2]" 1
1004 1 71 LEU HB2 1 71 LEU MD1 1.800 . 4.160 3.237 3.180 3.260 . 0 0 "[ . 1 . 2]" 1
1005 1 71 LEU HB2 1 71 LEU MD2 1.800 . 4.070 2.438 2.325 2.649 . 0 0 "[ . 1 . 2]" 1
1006 1 71 LEU HB2 1 72 VAL H 1.800 . 4.850 3.292 2.726 3.923 . 0 0 "[ . 1 . 2]" 1
1007 1 71 LEU MD1 1 74 LYS H 1.800 . 5.360 4.687 4.377 4.965 . 0 0 "[ . 1 . 2]" 1
1008 1 71 LEU MD1 1 75 LYS QE 1.800 . 4.070 2.169 1.794 3.353 0.006 11 0 "[ . 1 . 2]" 1
1009 1 71 LEU MD1 1 75 LYS HE3 1.800 . 4.650 2.989 2.330 3.820 . 0 0 "[ . 1 . 2]" 1
1010 1 71 LEU MD1 1 75 LYS HE2 1.800 . 4.650 2.287 1.803 4.138 . 0 0 "[ . 1 . 2]" 1
1011 1 71 LEU MD1 1 75 LYS QG 1.800 . 4.580 2.919 2.342 4.000 . 0 0 "[ . 1 . 2]" 1
1012 1 71 LEU MD1 1 75 LYS H 1.800 . 4.970 4.366 3.885 4.903 . 0 0 "[ . 1 . 2]" 1
1013 1 71 LEU MD2 1 75 LYS QE 1.800 . 6.050 3.671 1.986 4.678 . 0 0 "[ . 1 . 2]" 1
1014 1 71 LEU H 1 71 LEU HB3 1.800 . 3.930 3.066 2.366 3.615 . 0 0 "[ . 1 . 2]" 1
1015 1 71 LEU H 1 71 LEU HB2 1.800 . 3.930 2.314 2.138 2.597 . 0 0 "[ . 1 . 2]" 1
1016 1 71 LEU H 1 71 LEU MD2 1.800 . 4.970 3.384 2.359 4.261 . 0 0 "[ . 1 . 2]" 1
1017 1 71 LEU H 1 72 VAL MG2 1.800 . 5.120 4.289 4.146 4.399 . 0 0 "[ . 1 . 2]" 1
1018 1 71 LEU H 1 72 VAL H 1.800 . 3.590 2.785 2.602 2.909 . 0 0 "[ . 1 . 2]" 1
1019 1 72 VAL HA 1 72 VAL MG1 1.800 . 3.610 2.506 2.458 2.549 . 0 0 "[ . 1 . 2]" 1
1020 1 72 VAL HA 1 72 VAL MG2 1.800 . 3.510 2.439 2.404 2.477 . 0 0 "[ . 1 . 2]" 1
1021 1 72 VAL HA 1 74 LYS H 1.800 . 6.020 4.332 4.051 4.494 . 0 0 "[ . 1 . 2]" 1
1022 1 72 VAL HA 1 75 LYS HB3 1.800 . 5.290 4.333 4.017 4.649 . 0 0 "[ . 1 . 2]" 1
1023 1 72 VAL HA 1 75 LYS HB2 1.800 . 5.290 2.773 2.521 3.174 . 0 0 "[ . 1 . 2]" 1
1024 1 72 VAL HA 1 75 LYS QG 1.800 . 4.490 3.013 2.172 3.975 . 0 0 "[ . 1 . 2]" 1
1025 1 72 VAL HA 1 75 LYS H 1.800 . 4.500 3.428 3.005 3.674 . 0 0 "[ . 1 . 2]" 1
1026 1 72 VAL HB 1 73 ASP H 1.800 . 4.170 2.776 2.585 3.058 . 0 0 "[ . 1 . 2]" 1
1027 1 72 VAL HB 1 74 LYS H 1.800 . 6.050 5.118 4.907 5.317 . 0 0 "[ . 1 . 2]" 1
1028 1 72 VAL HB 1 76 LEU MD1 1.800 . 5.190 4.274 4.002 4.615 . 0 0 "[ . 1 . 2]" 1
1029 1 72 VAL MG1 1 73 ASP HA 1.800 . 4.710 3.627 3.341 3.983 . 0 0 "[ . 1 . 2]" 1
1030 1 72 VAL MG1 1 73 ASP H 1.800 . 4.130 3.542 3.358 3.851 . 0 0 "[ . 1 . 2]" 1
1031 1 72 VAL MG1 1 76 LEU MD1 1.800 . 3.330 2.358 2.069 2.994 . 0 0 "[ . 1 . 2]" 1
1032 1 72 VAL MG1 1 76 LEU HG 1.800 . 4.000 2.578 2.201 2.897 . 0 0 "[ . 1 . 2]" 1
1033 1 72 VAL MG1 1 76 LEU H 1.800 . 5.640 4.059 3.847 4.221 . 0 0 "[ . 1 . 2]" 1
1034 1 72 VAL MG2 1 73 ASP H 1.800 . 5.540 3.979 3.888 4.037 . 0 0 "[ . 1 . 2]" 1
1035 1 72 VAL H 1 72 VAL HB 1.800 . 3.440 2.576 2.483 2.625 . 0 0 "[ . 1 . 2]" 1
1036 1 72 VAL H 1 72 VAL MG1 1.800 . 4.250 3.826 3.783 3.851 . 0 0 "[ . 1 . 2]" 1
1037 1 72 VAL H 1 72 VAL MG2 1.800 . 3.320 2.131 2.065 2.199 . 0 0 "[ . 1 . 2]" 1
1038 1 72 VAL H 1 73 ASP QB 1.800 . 5.870 4.567 4.276 4.817 . 0 0 "[ . 1 . 2]" 1
1039 1 72 VAL H 1 73 ASP H 1.800 . 3.640 2.788 2.670 2.966 . 0 0 "[ . 1 . 2]" 1
1040 1 72 VAL H 1 74 LYS H 1.800 . 5.060 4.166 3.991 4.317 . 0 0 "[ . 1 . 2]" 1
1041 1 73 ASP HA 1 75 LYS H 1.800 . 5.200 4.302 3.947 4.547 . 0 0 "[ . 1 . 2]" 1
1042 1 73 ASP HA 1 76 LEU HB3 1.800 . 5.590 4.190 3.671 4.659 . 0 0 "[ . 1 . 2]" 1
1043 1 73 ASP HA 1 76 LEU HB2 1.800 . 5.590 2.558 2.123 3.051 . 0 0 "[ . 1 . 2]" 1
1044 1 73 ASP HA 1 76 LEU MD1 1.800 . 4.060 2.694 1.770 3.258 0.030 17 0 "[ . 1 . 2]" 1
1045 1 73 ASP HA 1 76 LEU H 1.800 . 4.570 3.364 2.756 3.872 . 0 0 "[ . 1 . 2]" 1
1046 1 73 ASP HA 1 77 ALA H 1.800 . 4.980 4.078 3.837 4.305 . 0 0 "[ . 1 . 2]" 1
1047 1 73 ASP QB 1 74 LYS H 1.800 . 3.670 2.696 2.439 2.905 . 0 0 "[ . 1 . 2]" 1
1048 1 73 ASP H 1 73 ASP QB 1.800 . 3.250 2.278 2.148 2.518 . 0 0 "[ . 1 . 2]" 1
1049 1 73 ASP H 1 75 LYS H 1.800 . 4.980 4.096 3.912 4.280 . 0 0 "[ . 1 . 2]" 1
1050 1 74 LYS HA 1 74 LYS QD 1.800 . 5.200 2.075 1.947 2.294 . 0 0 "[ . 1 . 2]" 1
1051 1 74 LYS HA 1 77 ALA MB 1.800 . 3.600 2.534 2.082 2.941 . 0 0 "[ . 1 . 2]" 1
1052 1 74 LYS QB 1 74 LYS QD 1.800 . 4.590 2.613 2.393 2.923 . 0 0 "[ . 1 . 2]" 1
1053 1 74 LYS QB 1 75 LYS H 1.800 . 3.900 2.705 2.505 2.859 . 0 0 "[ . 1 . 2]" 1
1054 1 74 LYS QB 1 77 ALA MB 1.800 . 4.890 3.935 3.584 4.281 . 0 0 "[ . 1 . 2]" 1
1055 1 74 LYS H 1 74 LYS QB 1.800 . 3.590 2.526 2.401 2.651 . 0 0 "[ . 1 . 2]" 1
1056 1 74 LYS H 1 74 LYS QG 1.800 . 4.660 2.433 2.277 2.646 . 0 0 "[ . 1 . 2]" 1
1057 1 74 LYS H 1 75 LYS QB 1.800 . 5.270 4.611 4.533 4.817 . 0 0 "[ . 1 . 2]" 1
1058 1 74 LYS H 1 75 LYS H 1.800 . 3.720 2.581 2.501 2.714 . 0 0 "[ . 1 . 2]" 1
1059 1 74 LYS H 1 76 LEU H 1.800 . 5.300 4.023 3.770 4.194 . 0 0 "[ . 1 . 2]" 1
1060 1 75 LYS HA 1 75 LYS QD 1.800 . 5.030 2.703 1.985 4.116 . 0 0 "[ . 1 . 2]" 1
1061 1 75 LYS HA 1 75 LYS QG 1.800 . 3.810 2.866 2.401 3.210 . 0 0 "[ . 1 . 2]" 1
1062 1 75 LYS HA 1 77 ALA H 1.800 . 4.990 4.229 3.974 4.532 . 0 0 "[ . 1 . 2]" 1
1063 1 75 LYS HA 1 78 ARG QB 1.800 . 4.500 2.750 2.329 3.011 . 0 0 "[ . 1 . 2]" 1
1064 1 75 LYS HA 1 78 ARG QD 1.800 . 4.810 4.664 4.170 5.065 0.255 3 0 "[ . 1 . 2]" 1
1065 1 75 LYS HA 1 78 ARG QG 1.800 . 4.950 2.649 2.066 2.994 . 0 0 "[ . 1 . 2]" 1
1066 1 75 LYS HA 1 78 ARG H 1.800 . 4.280 3.244 2.731 3.519 . 0 0 "[ . 1 . 2]" 1
1067 1 75 LYS QB 1 76 LEU H 1.800 . 3.710 2.626 2.404 2.957 . 0 0 "[ . 1 . 2]" 1
1068 1 75 LYS QE 1 75 LYS QG 1.800 . 3.580 2.255 2.171 2.431 . 0 0 "[ . 1 . 2]" 1
1069 1 75 LYS H 1 75 LYS QG 1.800 . 3.640 2.266 2.119 2.434 . 0 0 "[ . 1 . 2]" 1
1070 1 75 LYS H 1 76 LEU H 1.800 . 3.760 2.527 2.403 2.668 . 0 0 "[ . 1 . 2]" 1
1071 1 75 LYS H 1 77 ALA H 1.800 . 4.680 3.857 3.698 4.132 . 0 0 "[ . 1 . 2]" 1
1072 1 76 LEU HA 1 76 LEU MD1 1.800 . 4.640 3.915 3.873 3.966 . 0 0 "[ . 1 . 2]" 1
1073 1 76 LEU HA 1 76 LEU MD2 1.800 . 3.360 2.061 1.976 2.167 . 0 0 "[ . 1 . 2]" 1
1074 1 76 LEU HA 1 79 LYS QB 1.800 . 4.910 2.301 1.890 2.726 . 0 0 "[ . 1 . 2]" 1
1075 1 76 LEU HA 1 79 LYS QD 1.800 . 5.420 4.516 2.962 5.066 . 0 0 "[ . 1 . 2]" 1
1076 1 76 LEU HA 1 79 LYS H 1.800 . 4.250 3.024 2.736 3.300 . 0 0 "[ . 1 . 2]" 1
1077 1 76 LEU HA 1 80 LEU H 1.800 . 5.140 4.210 3.051 5.051 . 0 0 "[ . 1 . 2]" 1
1078 1 76 LEU HB3 1 76 LEU MD1 1.800 . 3.960 2.435 2.382 2.561 . 0 0 "[ . 1 . 2]" 1
1079 1 76 LEU HB3 1 76 LEU MD2 1.800 . 4.440 2.489 2.379 2.560 . 0 0 "[ . 1 . 2]" 1
1080 1 76 LEU HB3 1 77 ALA H 1.800 . 5.130 3.835 3.619 4.032 . 0 0 "[ . 1 . 2]" 1
1081 1 76 LEU HB2 1 76 LEU MD1 1.800 . 3.960 2.398 2.321 2.462 . 0 0 "[ . 1 . 2]" 1
1082 1 76 LEU HB2 1 76 LEU MD2 1.800 . 4.440 3.259 3.246 3.269 . 0 0 "[ . 1 . 2]" 1
1083 1 76 LEU HB2 1 77 ALA H 1.800 . 5.130 2.903 2.628 3.099 . 0 0 "[ . 1 . 2]" 1
1084 1 76 LEU MD1 1 77 ALA H 1.800 . 5.260 4.830 4.550 4.990 . 0 0 "[ . 1 . 2]" 1
1085 1 76 LEU MD2 1 77 ALA H 1.800 . 5.620 4.740 4.664 4.823 . 0 0 "[ . 1 . 2]" 1
1086 1 76 LEU MD2 1 79 LYS QB 1.800 . 5.670 3.158 2.486 3.615 . 0 0 "[ . 1 . 2]" 1
1087 1 76 LEU MD2 1 79 LYS QD 1.800 . 5.000 4.409 2.635 5.118 0.118 11 0 "[ . 1 . 2]" 1
1088 1 76 LEU MD2 1 79 LYS QE 1.800 . 5.000 4.285 3.124 5.084 0.084 16 0 "[ . 1 . 2]" 1
1089 1 76 LEU MD2 1 79 LYS H 1.800 . 6.050 4.554 4.149 4.953 . 0 0 "[ . 1 . 2]" 1
1090 1 76 LEU HG 1 77 ALA H 1.800 . 5.640 4.539 4.427 4.700 . 0 0 "[ . 1 . 2]" 1
1091 1 76 LEU H 1 76 LEU MD1 1.800 . 4.890 3.770 3.514 3.934 . 0 0 "[ . 1 . 2]" 1
1092 1 76 LEU H 1 76 LEU MD2 1.800 . 4.350 3.396 3.224 3.724 . 0 0 "[ . 1 . 2]" 1
1093 1 76 LEU H 1 76 LEU HG 1.800 . 3.620 2.486 2.294 2.731 . 0 0 "[ . 1 . 2]" 1
1094 1 76 LEU H 1 77 ALA H 1.800 . 3.720 2.546 2.420 2.674 . 0 0 "[ . 1 . 2]" 1
1095 1 76 LEU H 1 78 ARG H 1.800 . 5.050 3.990 3.728 4.126 . 0 0 "[ . 1 . 2]" 1
1096 1 76 LEU H 1 79 LYS H 1.800 . 6.050 4.586 4.361 4.838 . 0 0 "[ . 1 . 2]" 1
1097 1 77 ALA HA 1 80 LEU MD1 1.800 . 6.050 4.939 3.537 6.094 0.044 9 0 "[ . 1 . 2]" 1
1098 1 77 ALA HA 1 80 LEU HG 1.800 . 5.910 4.250 2.635 5.762 . 0 0 "[ . 1 . 2]" 1
1099 1 77 ALA HA 1 80 LEU H 1.800 . 6.280 3.677 2.830 4.525 . 0 0 "[ . 1 . 2]" 1
1100 1 77 ALA MB 1 78 ARG H 1.800 . 4.000 2.653 2.431 2.931 . 0 0 "[ . 1 . 2]" 1
1101 1 77 ALA MB 1 80 LEU MD1 1.800 . 8.000 5.611 3.712 6.711 . 0 0 "[ . 1 . 2]" 1
1102 1 77 ALA H 1 77 ALA MB 1.800 . 3.120 2.268 2.243 2.292 . 0 0 "[ . 1 . 2]" 1
1103 1 77 ALA H 1 78 ARG H 1.800 . 3.590 2.614 2.338 2.778 . 0 0 "[ . 1 . 2]" 1
1104 1 78 ARG HA 1 78 ARG QD 1.800 . 4.650 2.139 1.920 2.270 . 0 0 "[ . 1 . 2]" 1
1105 1 78 ARG H 1 78 ARG QB 1.800 . 3.260 2.518 2.365 2.627 . 0 0 "[ . 1 . 2]" 1
1106 1 78 ARG H 1 78 ARG QD 1.800 . 5.030 3.342 2.958 3.741 . 0 0 "[ . 1 . 2]" 1
1107 1 79 LYS QB 1 79 LYS QD 1.800 . 4.000 2.464 2.145 2.876 . 0 0 "[ . 1 . 2]" 1
1108 1 79 LYS QB 1 79 LYS QE 1.800 . 4.030 3.552 2.000 3.946 . 0 0 "[ . 1 . 2]" 1
1109 1 79 LYS QB 1 80 LEU H 1.800 . 4.470 2.796 2.036 3.350 . 0 0 "[ . 1 . 2]" 1
1110 1 79 LYS QG 1 80 LEU H 1.800 . 5.870 4.290 3.863 4.677 . 0 0 "[ . 1 . 2]" 1
1111 1 79 LYS H 1 79 LYS QB 1.800 . 3.590 2.400 2.253 2.491 . 0 0 "[ . 1 . 2]" 1
1112 1 79 LYS H 1 79 LYS QD 1.800 . 5.310 3.739 3.302 4.199 . 0 0 "[ . 1 . 2]" 1
1113 1 79 LYS H 1 79 LYS QG 1.800 . 4.310 2.577 2.372 2.886 . 0 0 "[ . 1 . 2]" 1
1114 1 80 LEU HA 1 80 LEU MD1 1.800 . 4.260 2.462 1.964 3.948 . 0 0 "[ . 1 . 2]" 1
1115 1 80 LEU QB 1 80 LEU MD1 1.800 . 3.310 2.329 2.117 2.425 . 0 0 "[ . 1 . 2]" 1
1116 1 80 LEU QB 1 80 LEU MD2 1.800 . 3.580 2.363 2.293 2.452 . 0 0 "[ . 1 . 2]" 1
1117 1 80 LEU QB 1 81 GLU H 1.800 . 4.030 3.284 1.907 3.932 . 0 0 "[ . 1 . 2]" 1
1118 1 80 LEU MD1 1 81 GLU H 1.800 . 5.420 4.223 2.277 5.684 0.264 20 0 "[ . 1 . 2]" 1
1119 1 80 LEU H 1 80 LEU HB3 1.800 . 3.980 3.645 2.856 4.128 0.148 4 0 "[ . 1 . 2]" 1
1120 1 80 LEU H 1 80 LEU HB2 1.800 . 3.980 2.613 2.132 3.582 . 0 0 "[ . 1 . 2]" 1
1121 1 80 LEU H 1 80 LEU MD1 1.800 . 4.830 4.071 3.171 4.664 . 0 0 "[ . 1 . 2]" 1
1122 1 80 LEU H 1 80 LEU MD2 1.800 . 5.300 2.742 2.129 3.835 . 0 0 "[ . 1 . 2]" 1
1123 1 80 LEU H 1 80 LEU HG 1.800 . 5.000 4.151 2.823 5.148 0.148 13 0 "[ . 1 . 2]" 1
1124 1 81 GLU HA 1 81 GLU QG 1.800 . 3.860 2.745 2.370 3.187 . 0 0 "[ . 1 . 2]" 1
1125 1 81 GLU H 1 81 GLU QB 1.800 . 3.360 2.503 2.094 3.419 0.059 3 0 "[ . 1 . 2]" 1
1126 1 81 GLU H 1 81 GLU QG 1.800 . 4.260 3.182 1.961 4.436 0.176 14 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 54
_Distance_constraint_stats_list.Viol_count 129
_Distance_constraint_stats_list.Viol_total 161.459
_Distance_constraint_stats_list.Viol_max 0.271
_Distance_constraint_stats_list.Viol_rms 0.0297
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0075
_Distance_constraint_stats_list.Viol_average_violations_only 0.0626
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 7 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 PRO 0.115 0.030 17 0 "[ . 1 . 2]"
1 10 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 GLN 0.115 0.030 17 0 "[ . 1 . 2]"
1 14 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 TRP 1.979 0.271 19 0 "[ . 1 . 2]"
1 39 HIS 1.988 0.271 19 0 "[ . 1 . 2]"
1 40 MET 0.160 0.051 11 0 "[ . 1 . 2]"
1 41 ASN 0.917 0.108 8 0 "[ . 1 . 2]"
1 42 LEU 0.490 0.110 13 0 "[ . 1 . 2]"
1 43 ILE 0.010 0.010 9 0 "[ . 1 . 2]"
1 44 VAL 0.308 0.063 8 0 "[ . 1 . 2]"
1 45 SER 0.922 0.108 8 0 "[ . 1 . 2]"
1 46 LEU 0.646 0.110 13 0 "[ . 1 . 2]"
1 47 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 VAL 0.149 0.063 8 0 "[ . 1 . 2]"
1 49 HIS 0.005 0.004 10 0 "[ . 1 . 2]"
1 50 TYR 0.156 0.060 3 0 "[ . 1 . 2]"
1 55 ALA 0.402 0.216 19 0 "[ . 1 . 2]"
1 56 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 LEU 0.402 0.216 19 0 "[ . 1 . 2]"
1 60 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 VAL 0.034 0.034 6 0 "[ . 1 . 2]"
1 66 GLY 0.197 0.044 12 0 "[ . 1 . 2]"
1 67 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 ALA 2.148 0.180 1 0 "[ . 1 . 2]"
1 70 ASP 0.197 0.044 12 0 "[ . 1 . 2]"
1 71 LEU 0.076 0.076 12 0 "[ . 1 . 2]"
1 72 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 ASP 2.114 0.180 1 0 "[ . 1 . 2]"
1 74 LYS 0.694 0.147 12 0 "[ . 1 . 2]"
1 75 LYS 0.653 0.257 6 0 "[ . 1 . 2]"
1 76 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 ARG 0.694 0.147 12 0 "[ . 1 . 2]"
1 79 LYS 0.577 0.257 6 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 34 TRP HE1 1 39 HIS ND1 1.700 . 2.300 2.328 2.008 2.571 0.271 19 0 "[ . 1 . 2]" 2
2 1 34 TRP NE1 1 39 HIS ND1 2.700 2.700 3.300 3.054 2.834 3.294 . 0 0 "[ . 1 . 2]" 2
3 1 7 LEU O 1 11 PHE H 1.700 . 2.300 2.095 2.003 2.245 . 0 0 "[ . 1 . 2]" 2
4 1 7 LEU O 1 11 PHE N 2.700 2.700 3.300 3.030 2.944 3.166 . 0 0 "[ . 1 . 2]" 2
5 1 8 THR O 1 12 ARG H 1.700 . 2.300 2.078 1.962 2.255 . 0 0 "[ . 1 . 2]" 2
6 1 8 THR O 1 12 ARG N 2.700 2.700 3.300 3.032 2.914 3.226 . 0 0 "[ . 1 . 2]" 2
7 1 9 PRO O 1 13 GLN H 1.700 . 2.300 2.251 2.112 2.330 0.030 17 0 "[ . 1 . 2]" 2
8 1 9 PRO O 1 13 GLN N 2.700 2.700 3.300 3.035 2.858 3.175 . 0 0 "[ . 1 . 2]" 2
9 1 10 ILE O 1 14 VAL H 1.700 . 2.300 2.024 1.950 2.261 . 0 0 "[ . 1 . 2]" 2
10 1 10 ILE O 1 14 VAL N 2.700 2.700 3.300 2.993 2.919 3.211 . 0 0 "[ . 1 . 2]" 2
11 1 11 PHE O 1 15 PHE H 1.700 . 2.300 2.063 1.937 2.287 . 0 0 "[ . 1 . 2]" 2
12 1 11 PHE O 1 15 PHE N 2.700 2.700 3.300 3.011 2.890 3.230 . 0 0 "[ . 1 . 2]" 2
13 1 39 HIS O 1 43 ILE H 1.700 . 2.300 2.057 1.911 2.310 0.010 9 0 "[ . 1 . 2]" 2
14 1 39 HIS O 1 43 ILE N 2.700 2.700 3.300 2.996 2.853 3.250 . 0 0 "[ . 1 . 2]" 2
15 1 40 MET O 1 44 VAL H 1.700 . 2.300 2.204 2.035 2.351 0.051 11 0 "[ . 1 . 2]" 2
16 1 40 MET O 1 44 VAL N 2.700 2.700 3.300 3.167 2.988 3.325 0.025 11 0 "[ . 1 . 2]" 2
17 1 41 ASN O 1 45 SER H 1.700 . 2.300 2.332 2.193 2.408 0.108 8 0 "[ . 1 . 2]" 2
18 1 41 ASN O 1 45 SER N 2.700 2.700 3.300 3.209 3.074 3.326 0.026 8 0 "[ . 1 . 2]" 2
19 1 42 LEU O 1 46 LEU H 1.700 . 2.300 2.232 1.943 2.410 0.110 13 0 "[ . 1 . 2]" 2
20 1 42 LEU O 1 46 LEU N 2.700 2.700 3.300 3.122 2.816 3.320 0.020 20 0 "[ . 1 . 2]" 2
21 1 43 ILE O 1 47 GLU H 1.700 . 2.300 2.069 1.939 2.264 . 0 0 "[ . 1 . 2]" 2
22 1 43 ILE O 1 47 GLU N 2.700 2.700 3.300 2.958 2.801 3.156 . 0 0 "[ . 1 . 2]" 2
23 1 44 VAL O 1 48 VAL H 1.700 . 2.300 2.214 2.035 2.363 0.063 8 0 "[ . 1 . 2]" 2
24 1 44 VAL O 1 48 VAL N 2.700 2.700 3.300 3.165 2.980 3.316 0.016 8 0 "[ . 1 . 2]" 2
25 1 45 SER O 1 49 HIS H 1.700 . 2.300 2.121 2.009 2.304 0.004 10 0 "[ . 1 . 2]" 2
26 1 45 SER O 1 49 HIS N 2.700 2.700 3.300 3.059 2.957 3.250 . 0 0 "[ . 1 . 2]" 2
27 1 46 LEU O 1 50 TYR H 1.700 . 2.300 2.207 2.055 2.360 0.060 3 0 "[ . 1 . 2]" 2
28 1 46 LEU O 1 50 TYR N 2.700 2.700 3.300 3.120 2.973 3.263 . 0 0 "[ . 1 . 2]" 2
29 1 55 ALA O 1 59 LEU H 1.700 . 2.300 2.227 2.046 2.516 0.216 19 0 "[ . 1 . 2]" 2
30 1 55 ALA O 1 59 LEU N 2.700 2.700 3.300 3.086 2.838 3.399 0.099 19 0 "[ . 1 . 2]" 2
31 1 56 LEU O 1 60 GLN H 1.700 . 2.300 2.168 2.016 2.294 . 0 0 "[ . 1 . 2]" 2
32 1 56 LEU O 1 60 GLN N 2.700 2.700 3.300 3.066 2.936 3.217 . 0 0 "[ . 1 . 2]" 2
33 1 65 VAL O 1 69 ALA H 1.700 . 2.300 1.999 1.891 2.065 . 0 0 "[ . 1 . 2]" 2
34 1 65 VAL O 1 69 ALA N 2.700 2.700 3.300 2.789 2.666 2.881 0.034 6 0 "[ . 1 . 2]" 2
35 1 66 GLY O 1 70 ASP H 1.700 . 2.300 2.210 2.009 2.344 0.044 12 0 "[ . 1 . 2]" 2
36 1 66 GLY O 1 70 ASP N 2.700 2.700 3.300 3.140 2.935 3.311 0.011 5 0 "[ . 1 . 2]" 2
37 1 67 ASP O 1 71 LEU H 1.700 . 2.300 2.010 1.935 2.125 . 0 0 "[ . 1 . 2]" 2
38 1 67 ASP O 1 71 LEU N 2.700 2.700 3.300 2.899 2.806 3.062 . 0 0 "[ . 1 . 2]" 2
39 1 68 LEU O 1 72 VAL H 1.700 . 2.300 1.984 1.864 2.118 . 0 0 "[ . 1 . 2]" 2
40 1 68 LEU O 1 72 VAL N 2.700 2.700 3.300 2.906 2.789 3.019 . 0 0 "[ . 1 . 2]" 2
41 1 69 ALA O 1 73 ASP H 1.700 . 2.300 2.362 2.033 2.480 0.180 1 0 "[ . 1 . 2]" 2
42 1 69 ALA O 1 73 ASP N 2.700 2.700 3.300 3.235 2.924 3.363 0.063 1 0 "[ . 1 . 2]" 2
43 1 70 ASP O 1 74 LYS H 1.700 . 2.300 2.088 2.007 2.220 . 0 0 "[ . 1 . 2]" 2
44 1 70 ASP O 1 74 LYS N 2.700 2.700 3.300 2.922 2.799 3.099 . 0 0 "[ . 1 . 2]" 2
45 1 71 LEU O 1 75 LYS H 1.700 . 2.300 2.152 2.015 2.376 0.076 12 0 "[ . 1 . 2]" 2
46 1 71 LEU O 1 75 LYS N 2.700 2.700 3.300 3.022 2.901 3.244 . 0 0 "[ . 1 . 2]" 2
47 1 72 VAL O 1 76 LEU H 1.700 . 2.300 2.022 1.946 2.145 . 0 0 "[ . 1 . 2]" 2
48 1 72 VAL O 1 76 LEU N 2.700 2.700 3.300 2.910 2.792 3.076 . 0 0 "[ . 1 . 2]" 2
49 1 73 ASP O 1 77 ALA H 1.700 . 2.300 2.075 2.009 2.209 . 0 0 "[ . 1 . 2]" 2
50 1 73 ASP O 1 77 ALA N 2.700 2.700 3.300 2.902 2.764 3.119 . 0 0 "[ . 1 . 2]" 2
51 1 74 LYS O 1 78 ARG H 1.700 . 2.300 2.298 2.047 2.447 0.147 12 0 "[ . 1 . 2]" 2
52 1 74 LYS O 1 78 ARG N 2.700 2.700 3.300 3.127 2.851 3.289 . 0 0 "[ . 1 . 2]" 2
53 1 75 LYS O 1 79 LYS H 1.700 . 2.300 2.251 2.071 2.557 0.257 6 0 "[ . 1 . 2]" 2
54 1 75 LYS O 1 79 LYS N 2.700 2.700 3.300 2.975 2.782 3.266 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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