NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
558691 |
2lxy   |
18703 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lxy
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 939
_Distance_constraint_stats_list.Viol_count 2454
_Distance_constraint_stats_list.Viol_total 1172.514
_Distance_constraint_stats_list.Viol_max 0.694
_Distance_constraint_stats_list.Viol_rms 0.0090
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0012
_Distance_constraint_stats_list.Viol_average_violations_only 0.0149
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 3 ARG 0.008 0.003 11 0 "[ . 1 . 2 . 3 ]"
1 4 VAL 0.304 0.015 7 0 "[ . 1 . 2 . 3 ]"
1 5 LYS 0.036 0.036 1 0 "[ . 1 . 2 . 3 ]"
1 6 ALA 0.337 0.019 15 0 "[ . 1 . 2 . 3 ]"
1 7 LEU 0.631 0.015 4 0 "[ . 1 . 2 . 3 ]"
1 8 GLU 0.174 0.008 11 0 "[ . 1 . 2 . 3 ]"
1 9 GLU 0.296 0.019 15 0 "[ . 1 . 2 . 3 ]"
1 10 LYS 0.414 0.019 4 0 "[ . 1 . 2 . 3 ]"
1 11 VAL 2.574 0.070 2 0 "[ . 1 . 2 . 3 ]"
1 12 LYS 3.245 0.069 31 0 "[ . 1 . 2 . 3 ]"
1 13 ALA 1.586 0.070 2 0 "[ . 1 . 2 . 3 ]"
1 14 LEU 4.263 0.069 31 0 "[ . 1 . 2 . 3 ]"
1 15 GLU 0.746 0.029 16 0 "[ . 1 . 2 . 3 ]"
1 16 GLU 0.108 0.012 7 0 "[ . 1 . 2 . 3 ]"
1 17 LYS 0.029 0.005 18 0 "[ . 1 . 2 . 3 ]"
1 18 VAL 0.948 0.029 26 0 "[ . 1 . 2 . 3 ]"
1 19 LYS 0.413 0.027 10 0 "[ . 1 . 2 . 3 ]"
1 20 ALA 0.442 0.038 9 0 "[ . 1 . 2 . 3 ]"
1 21 LEU 5.380 0.694 21 3 "[ *- . 1 . 2+ . 3 ]"
1 22 GLY 3.696 0.694 21 3 "[ *- . 1 . 2+ . 3 ]"
1 23 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 24 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 25 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 26 ARG 1.519 0.037 6 0 "[ . 1 . 2 . 3 ]"
1 27 ILE 0.702 0.037 6 0 "[ . 1 . 2 . 3 ]"
1 28 GLU 0.315 0.017 10 0 "[ . 1 . 2 . 3 ]"
1 29 GLU 0.772 0.031 20 0 "[ . 1 . 2 . 3 ]"
1 30 LEU 0.296 0.029 27 0 "[ . 1 . 2 . 3 ]"
1 31 LYS 1.492 0.039 1 0 "[ . 1 . 2 . 3 ]"
1 32 LYS 0.521 0.031 12 0 "[ . 1 . 2 . 3 ]"
1 33 LYS 0.288 0.031 12 0 "[ . 1 . 2 . 3 ]"
1 34 CYS 3.576 0.061 26 0 "[ . 1 . 2 . 3 ]"
1 35 GLU 3.672 0.061 26 0 "[ . 1 . 2 . 3 ]"
1 36 GLU 1.291 0.041 4 0 "[ . 1 . 2 . 3 ]"
1 37 LEU 1.312 0.030 23 0 "[ . 1 . 2 . 3 ]"
1 38 LYS 0.257 0.015 25 0 "[ . 1 . 2 . 3 ]"
1 39 LYS 0.399 0.038 21 0 "[ . 1 . 2 . 3 ]"
1 40 LYS 0.846 0.034 2 0 "[ . 1 . 2 . 3 ]"
1 41 ILE 0.964 0.024 24 0 "[ . 1 . 2 . 3 ]"
1 42 GLU 0.001 0.001 17 0 "[ . 1 . 2 . 3 ]"
1 43 GLU 1.605 0.039 29 0 "[ . 1 . 2 . 3 ]"
1 44 LEU 1.347 0.039 29 0 "[ . 1 . 2 . 3 ]"
1 45 GLY 0.020 0.005 24 0 "[ . 1 . 2 . 3 ]"
1 46 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 47 GLY 0.001 0.001 17 0 "[ . 1 . 2 . 3 ]"
1 48 GLY 0.001 0.001 17 0 "[ . 1 . 2 . 3 ]"
1 49 GLU 0.214 0.030 10 0 "[ . 1 . 2 . 3 ]"
1 50 VAL 0.237 0.019 5 0 "[ . 1 . 2 . 3 ]"
1 51 LYS 0.155 0.019 5 0 "[ . 1 . 2 . 3 ]"
1 52 LYS 0.660 0.030 10 0 "[ . 1 . 2 . 3 ]"
1 53 VAL 0.855 0.026 24 0 "[ . 1 . 2 . 3 ]"
1 54 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 55 GLU 0.218 0.010 32 0 "[ . 1 . 2 . 3 ]"
1 56 GLU 0.494 0.023 16 0 "[ . 1 . 2 . 3 ]"
1 57 VAL 0.904 0.032 7 0 "[ . 1 . 2 . 3 ]"
1 58 LYS 1.065 0.032 7 0 "[ . 1 . 2 . 3 ]"
1 59 LYS 1.321 0.031 20 0 "[ . 1 . 2 . 3 ]"
1 60 LEU 3.690 0.045 11 0 "[ . 1 . 2 . 3 ]"
1 61 GLU 2.344 0.033 19 0 "[ . 1 . 2 . 3 ]"
1 62 GLU 1.466 0.027 23 0 "[ . 1 . 2 . 3 ]"
1 63 GLU 1.506 0.045 11 0 "[ . 1 . 2 . 3 ]"
1 64 ILE 2.606 0.037 10 0 "[ . 1 . 2 . 3 ]"
1 65 LYS 0.318 0.028 31 0 "[ . 1 . 2 . 3 ]"
1 66 LYS 0.072 0.008 31 0 "[ . 1 . 2 . 3 ]"
1 67 LEU 1.729 0.060 26 0 "[ . 1 . 2 . 3 ]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 ARG H 1 3 ARG HA 2.350 . 3.000 2.897 2.785 2.947 . 0 0 "[ . 1 . 2 . 3 ]" 1
2 1 3 ARG H 1 4 VAL H 2.350 . 3.000 2.321 1.993 2.965 . 0 0 "[ . 1 . 2 . 3 ]" 1
3 1 3 ARG HA 1 3 ARG HB2 2.850 . 4.000 2.692 2.453 2.991 . 0 0 "[ . 1 . 2 . 3 ]" 1
4 1 3 ARG HA 1 3 ARG HB3 2.850 . 4.000 2.924 2.630 3.024 . 0 0 "[ . 1 . 2 . 3 ]" 1
5 1 3 ARG HA 1 3 ARG HG2 2.600 . 3.500 2.368 2.085 3.159 . 0 0 "[ . 1 . 2 . 3 ]" 1
6 1 3 ARG HA 1 3 ARG HG3 3.100 . 4.500 3.133 2.308 3.561 . 0 0 "[ . 1 . 2 . 3 ]" 1
7 1 3 ARG HA 1 4 VAL H 2.850 . 4.000 3.556 3.494 3.572 . 0 0 "[ . 1 . 2 . 3 ]" 1
8 1 3 ARG HA 1 6 ALA MB 2.850 . 4.000 3.453 3.025 3.934 . 0 0 "[ . 1 . 2 . 3 ]" 1
9 1 3 ARG HB2 1 3 ARG HG2 2.600 . 3.500 2.830 2.560 3.011 . 0 0 "[ . 1 . 2 . 3 ]" 1
10 1 3 ARG HB2 1 3 ARG HG3 2.850 . 4.000 2.288 2.212 2.573 . 0 0 "[ . 1 . 2 . 3 ]" 1
11 1 3 ARG HB3 1 3 ARG HD2 2.850 . 4.000 2.358 1.976 3.793 . 0 0 "[ . 1 . 2 . 3 ]" 1
12 1 3 ARG HB3 1 3 ARG HG2 2.850 . 4.000 2.770 2.330 2.997 . 0 0 "[ . 1 . 2 . 3 ]" 1
13 1 3 ARG HB3 1 3 ARG HG3 2.600 . 3.500 2.824 2.550 3.012 . 0 0 "[ . 1 . 2 . 3 ]" 1
14 1 3 ARG HB3 1 4 VAL H 2.350 . 3.000 2.436 1.970 3.001 0.001 30 0 "[ . 1 . 2 . 3 ]" 1
15 1 3 ARG HB3 1 50 VAL MG1 3.600 . 5.500 4.547 3.340 5.419 . 0 0 "[ . 1 . 2 . 3 ]" 1
16 1 3 ARG HD2 1 3 ARG HG2 2.600 . 3.500 2.850 2.449 3.015 . 0 0 "[ . 1 . 2 . 3 ]" 1
17 1 3 ARG HD2 1 3 ARG HG3 2.850 . 4.000 2.680 2.220 3.017 . 0 0 "[ . 1 . 2 . 3 ]" 1
18 1 3 ARG HD2 1 50 VAL MG2 3.600 . 5.500 4.873 2.974 5.503 0.003 11 0 "[ . 1 . 2 . 3 ]" 1
19 1 3 ARG HD3 1 3 ARG HG3 2.850 . 4.000 2.852 2.453 3.018 . 0 0 "[ . 1 . 2 . 3 ]" 1
20 1 3 ARG HG2 1 4 VAL H 3.350 . 5.000 4.425 3.661 4.939 . 0 0 "[ . 1 . 2 . 3 ]" 1
21 1 4 VAL H 1 4 VAL HA 2.350 . 3.000 2.855 2.798 2.891 . 0 0 "[ . 1 . 2 . 3 ]" 1
22 1 4 VAL H 1 4 VAL HB 2.350 . 3.000 2.632 2.545 2.696 . 0 0 "[ . 1 . 2 . 3 ]" 1
23 1 4 VAL H 1 4 VAL MG2 3.100 . 4.500 2.451 1.973 3.792 . 0 0 "[ . 1 . 2 . 3 ]" 1
24 1 4 VAL H 1 5 LYS H 2.350 . 3.000 2.519 2.359 2.702 . 0 0 "[ . 1 . 2 . 3 ]" 1
25 1 4 VAL HA 1 4 VAL HB 2.850 . 4.000 2.913 2.450 3.021 . 0 0 "[ . 1 . 2 . 3 ]" 1
26 1 4 VAL HA 1 4 VAL MG1 3.100 . 4.500 2.468 2.201 3.206 . 0 0 "[ . 1 . 2 . 3 ]" 1
27 1 4 VAL HA 1 4 VAL MG2 3.350 . 5.000 2.398 2.247 2.506 . 0 0 "[ . 1 . 2 . 3 ]" 1
28 1 4 VAL HA 1 5 LYS H 2.850 . 4.000 3.513 3.455 3.566 . 0 0 "[ . 1 . 2 . 3 ]" 1
29 1 4 VAL HA 1 6 ALA H 2.850 . 4.000 3.980 3.854 4.008 0.008 24 0 "[ . 1 . 2 . 3 ]" 1
30 1 4 VAL HA 1 7 LEU HB2 2.850 . 4.000 2.363 2.179 2.506 . 0 0 "[ . 1 . 2 . 3 ]" 1
31 1 4 VAL HA 1 7 LEU HB3 2.850 . 4.000 3.392 3.068 3.726 . 0 0 "[ . 1 . 2 . 3 ]" 1
32 1 4 VAL HA 1 7 LEU HG 3.100 . 4.500 4.507 4.476 4.515 0.015 7 0 "[ . 1 . 2 . 3 ]" 1
33 1 4 VAL HB 1 5 LYS H 3.350 . 5.000 2.964 2.368 4.129 . 0 0 "[ . 1 . 2 . 3 ]" 1
34 1 4 VAL MG1 1 5 LYS H 3.600 . 5.500 3.425 1.961 3.879 . 0 0 "[ . 1 . 2 . 3 ]" 1
35 1 4 VAL MG1 1 5 LYS HA 3.350 . 5.000 3.702 3.103 3.965 . 0 0 "[ . 1 . 2 . 3 ]" 1
36 1 4 VAL MG1 1 44 LEU HB2 3.600 . 5.500 4.145 2.780 5.279 . 0 0 "[ . 1 . 2 . 3 ]" 1
37 1 4 VAL MG1 1 44 LEU HB3 3.350 . 5.000 3.748 2.493 4.666 . 0 0 "[ . 1 . 2 . 3 ]" 1
38 1 5 LYS H 1 5 LYS HA 2.350 . 3.000 2.786 2.764 2.838 . 0 0 "[ . 1 . 2 . 3 ]" 1
39 1 5 LYS H 1 5 LYS QB 2.350 . 3.000 2.219 2.038 2.564 . 0 0 "[ . 1 . 2 . 3 ]" 1
40 1 5 LYS H 1 5 LYS QD 3.350 . 5.000 3.830 2.007 4.655 . 0 0 "[ . 1 . 2 . 3 ]" 1
41 1 5 LYS H 1 5 LYS QG 2.850 . 4.000 3.191 1.971 4.036 0.036 1 0 "[ . 1 . 2 . 3 ]" 1
42 1 5 LYS H 1 6 ALA H 2.350 . 3.000 2.699 2.538 2.772 . 0 0 "[ . 1 . 2 . 3 ]" 1
43 1 5 LYS HA 1 6 ALA H 2.850 . 4.000 3.497 3.468 3.526 . 0 0 "[ . 1 . 2 . 3 ]" 1
44 1 5 LYS QB 1 6 ALA H 2.850 . 4.000 2.856 2.680 3.502 . 0 0 "[ . 1 . 2 . 3 ]" 1
45 1 6 ALA H 1 6 ALA HA 2.350 . 3.000 2.876 2.842 2.892 . 0 0 "[ . 1 . 2 . 3 ]" 1
46 1 6 ALA H 1 6 ALA MB 2.600 . 3.500 2.161 2.090 2.278 . 0 0 "[ . 1 . 2 . 3 ]" 1
47 1 6 ALA H 1 7 LEU H 2.350 . 3.000 2.406 2.348 2.532 . 0 0 "[ . 1 . 2 . 3 ]" 1
48 1 6 ALA HA 1 7 LEU H 2.850 . 4.000 3.464 3.460 3.470 . 0 0 "[ . 1 . 2 . 3 ]" 1
49 1 6 ALA HA 1 9 GLU H 3.350 . 5.000 3.344 3.259 3.543 . 0 0 "[ . 1 . 2 . 3 ]" 1
50 1 6 ALA HA 1 9 GLU QB 2.600 . 3.500 3.509 3.501 3.519 0.019 15 0 "[ . 1 . 2 . 3 ]" 1
51 1 7 LEU H 1 7 LEU HA 2.350 . 3.000 2.827 2.802 2.846 . 0 0 "[ . 1 . 2 . 3 ]" 1
52 1 7 LEU H 1 8 GLU H 2.350 . 3.000 2.599 2.541 2.765 . 0 0 "[ . 1 . 2 . 3 ]" 1
53 1 7 LEU HA 1 7 LEU HB3 2.850 . 4.000 2.950 2.908 2.973 . 0 0 "[ . 1 . 2 . 3 ]" 1
54 1 7 LEU HA 1 7 LEU MD2 2.600 . 3.500 2.395 2.100 2.776 . 0 0 "[ . 1 . 2 . 3 ]" 1
55 1 7 LEU HA 1 7 LEU HG 2.850 . 4.000 2.489 2.307 2.561 . 0 0 "[ . 1 . 2 . 3 ]" 1
56 1 7 LEU HA 1 8 GLU H 2.850 . 4.000 3.497 3.473 3.559 . 0 0 "[ . 1 . 2 . 3 ]" 1
57 1 7 LEU HA 1 10 LYS HB2 2.850 . 4.000 2.691 2.517 2.860 . 0 0 "[ . 1 . 2 . 3 ]" 1
58 1 7 LEU HA 1 10 LYS HB3 2.850 . 4.000 4.007 4.000 4.015 0.015 4 0 "[ . 1 . 2 . 3 ]" 1
59 1 7 LEU HA 1 10 LYS QG 3.350 . 5.000 4.080 3.308 4.694 . 0 0 "[ . 1 . 2 . 3 ]" 1
60 1 7 LEU HA 1 11 VAL MG2 3.600 . 5.500 4.390 4.007 4.669 . 0 0 "[ . 1 . 2 . 3 ]" 1
61 1 7 LEU HA 1 41 ILE MD 3.600 . 5.500 4.490 4.063 4.904 . 0 0 "[ . 1 . 2 . 3 ]" 1
62 1 7 LEU HA 1 57 VAL MG1 3.600 . 5.500 4.793 4.186 5.178 . 0 0 "[ . 1 . 2 . 3 ]" 1
63 1 7 LEU HB2 1 7 LEU MD2 3.100 . 4.500 3.187 3.167 3.196 . 0 0 "[ . 1 . 2 . 3 ]" 1
64 1 7 LEU HB2 1 7 LEU HG 2.850 . 4.000 2.449 2.407 2.562 . 0 0 "[ . 1 . 2 . 3 ]" 1
65 1 7 LEU HB2 1 41 ILE MD 3.350 . 5.000 4.427 3.900 4.993 . 0 0 "[ . 1 . 2 . 3 ]" 1
66 1 7 LEU HB2 1 41 ILE MG 3.600 . 5.500 4.027 3.330 4.664 . 0 0 "[ . 1 . 2 . 3 ]" 1
67 1 7 LEU HB3 1 7 LEU HG 2.850 . 4.000 3.016 3.006 3.020 . 0 0 "[ . 1 . 2 . 3 ]" 1
68 1 7 LEU HB3 1 8 GLU H 2.350 . 3.000 2.927 2.486 3.007 0.007 3 0 "[ . 1 . 2 . 3 ]" 1
69 1 7 LEU HB3 1 41 ILE MD 3.600 . 5.500 2.919 2.303 3.563 . 0 0 "[ . 1 . 2 . 3 ]" 1
70 1 7 LEU HB3 1 41 ILE MG 3.600 . 5.500 2.736 2.057 3.360 . 0 0 "[ . 1 . 2 . 3 ]" 1
71 1 7 LEU QD 1 41 ILE MD 3.600 . 5.500 2.102 1.811 2.499 . 0 0 "[ . 1 . 2 . 3 ]" 1
72 1 7 LEU MD2 1 8 GLU HA 2.850 . 4.000 3.704 3.472 3.974 . 0 0 "[ . 1 . 2 . 3 ]" 1
73 1 7 LEU MD2 1 8 GLU HG2 3.350 . 5.000 4.988 4.749 5.008 0.008 11 0 "[ . 1 . 2 . 3 ]" 1
74 1 7 LEU MD2 1 8 GLU HG3 3.100 . 4.500 4.487 4.272 4.506 0.006 7 0 "[ . 1 . 2 . 3 ]" 1
75 1 7 LEU MD2 1 41 ILE MD 3.850 . 6.000 2.135 1.823 2.542 . 0 0 "[ . 1 . 2 . 3 ]" 1
76 1 7 LEU HG 1 41 ILE MD 3.600 . 5.500 4.579 4.220 5.007 . 0 0 "[ . 1 . 2 . 3 ]" 1
77 1 8 GLU H 1 8 GLU HA 2.350 . 3.000 2.860 2.799 2.888 . 0 0 "[ . 1 . 2 . 3 ]" 1
78 1 8 GLU H 1 8 GLU HG3 2.350 . 3.000 2.430 2.003 2.906 . 0 0 "[ . 1 . 2 . 3 ]" 1
79 1 8 GLU H 1 9 GLU H 2.350 . 3.000 2.502 2.383 2.710 . 0 0 "[ . 1 . 2 . 3 ]" 1
80 1 8 GLU HA 1 8 GLU HB2 2.600 . 3.500 3.014 2.982 3.024 . 0 0 "[ . 1 . 2 . 3 ]" 1
81 1 8 GLU HA 1 8 GLU HG3 2.600 . 3.500 2.869 2.760 2.956 . 0 0 "[ . 1 . 2 . 3 ]" 1
82 1 8 GLU HA 1 9 GLU H 2.850 . 4.000 3.514 3.496 3.546 . 0 0 "[ . 1 . 2 . 3 ]" 1
83 1 8 GLU HA 1 11 VAL HB 2.850 . 4.000 3.828 3.606 4.003 0.003 31 0 "[ . 1 . 2 . 3 ]" 1
84 1 8 GLU HA 1 11 VAL MG2 2.850 . 4.000 3.480 3.133 3.955 . 0 0 "[ . 1 . 2 . 3 ]" 1
85 1 8 GLU HA 1 41 ILE MD 3.350 . 5.000 2.426 2.055 3.052 . 0 0 "[ . 1 . 2 . 3 ]" 1
86 1 8 GLU HA 1 41 ILE MG 3.350 . 5.000 3.372 2.798 4.037 . 0 0 "[ . 1 . 2 . 3 ]" 1
87 1 8 GLU HB2 1 8 GLU HG2 2.850 . 4.000 3.000 2.978 3.010 . 0 0 "[ . 1 . 2 . 3 ]" 1
88 1 8 GLU HB3 1 8 GLU HG2 2.600 . 3.500 2.367 2.299 2.437 . 0 0 "[ . 1 . 2 . 3 ]" 1
89 1 8 GLU HB3 1 8 GLU HG3 2.600 . 3.500 3.001 2.980 3.010 . 0 0 "[ . 1 . 2 . 3 ]" 1
90 1 9 GLU H 1 9 GLU HA 2.350 . 3.000 2.861 2.827 2.870 . 0 0 "[ . 1 . 2 . 3 ]" 1
91 1 9 GLU H 1 9 GLU QB 2.350 . 3.000 2.464 2.374 2.521 . 0 0 "[ . 1 . 2 . 3 ]" 1
92 1 9 GLU H 1 9 GLU HG3 2.350 . 3.000 2.716 2.201 3.007 0.007 9 0 "[ . 1 . 2 . 3 ]" 1
93 1 9 GLU H 1 10 LYS H 2.350 . 3.000 2.489 2.437 2.607 . 0 0 "[ . 1 . 2 . 3 ]" 1
94 1 9 GLU HA 1 10 LYS H 2.850 . 4.000 3.431 3.416 3.456 . 0 0 "[ . 1 . 2 . 3 ]" 1
95 1 9 GLU HA 1 12 LYS H 2.850 . 4.000 3.508 3.362 3.752 . 0 0 "[ . 1 . 2 . 3 ]" 1
96 1 9 GLU HA 1 12 LYS QB 2.850 . 4.000 2.584 2.243 3.586 . 0 0 "[ . 1 . 2 . 3 ]" 1
97 1 9 GLU HG3 1 10 LYS H 2.350 . 3.000 2.422 2.213 2.580 . 0 0 "[ . 1 . 2 . 3 ]" 1
98 1 10 LYS H 1 10 LYS HA 2.350 . 3.000 2.849 2.829 2.875 . 0 0 "[ . 1 . 2 . 3 ]" 1
99 1 10 LYS H 1 10 LYS HB2 2.350 . 3.000 2.076 2.056 2.108 . 0 0 "[ . 1 . 2 . 3 ]" 1
100 1 10 LYS H 1 10 LYS HB3 3.350 . 5.000 3.262 3.183 3.382 . 0 0 "[ . 1 . 2 . 3 ]" 1
101 1 10 LYS H 1 10 LYS QG 2.850 . 4.000 3.472 3.273 3.820 . 0 0 "[ . 1 . 2 . 3 ]" 1
102 1 10 LYS H 1 11 VAL H 2.350 . 3.000 2.635 2.486 2.760 . 0 0 "[ . 1 . 2 . 3 ]" 1
103 1 10 LYS H 1 11 VAL MG2 3.600 . 5.500 4.053 3.917 4.186 . 0 0 "[ . 1 . 2 . 3 ]" 1
104 1 10 LYS HA 1 11 VAL H 2.850 . 4.000 3.556 3.537 3.566 . 0 0 "[ . 1 . 2 . 3 ]" 1
105 1 10 LYS HA 1 13 ALA MB 3.100 . 4.500 3.441 3.232 3.693 . 0 0 "[ . 1 . 2 . 3 ]" 1
106 1 10 LYS HB2 1 11 VAL H 2.350 . 3.000 3.005 2.968 3.019 0.019 4 0 "[ . 1 . 2 . 3 ]" 1
107 1 10 LYS HB2 1 57 VAL MG1 3.350 . 5.000 4.163 3.648 4.572 . 0 0 "[ . 1 . 2 . 3 ]" 1
108 1 10 LYS HB3 1 57 VAL MG1 3.350 . 5.000 3.133 2.527 3.668 . 0 0 "[ . 1 . 2 . 3 ]" 1
109 1 10 LYS QD 1 57 VAL MG1 3.350 . 5.000 3.864 3.004 5.002 0.002 24 0 "[ . 1 . 2 . 3 ]" 1
110 1 11 VAL H 1 11 VAL HA 2.350 . 3.000 2.839 2.799 2.872 . 0 0 "[ . 1 . 2 . 3 ]" 1
111 1 11 VAL H 1 11 VAL HB 2.350 . 3.000 2.645 2.601 2.712 . 0 0 "[ . 1 . 2 . 3 ]" 1
112 1 11 VAL H 1 11 VAL MG1 3.100 . 4.500 3.777 3.760 3.793 . 0 0 "[ . 1 . 2 . 3 ]" 1
113 1 11 VAL H 1 11 VAL MG2 3.100 . 4.500 2.113 1.952 2.272 . 0 0 "[ . 1 . 2 . 3 ]" 1
114 1 11 VAL H 1 12 LYS H 2.350 . 3.000 2.544 2.422 2.673 . 0 0 "[ . 1 . 2 . 3 ]" 1
115 1 11 VAL H 1 13 ALA MB 3.600 . 5.500 5.201 5.000 5.393 . 0 0 "[ . 1 . 2 . 3 ]" 1
116 1 11 VAL H 1 14 LEU MD1 3.600 . 5.500 4.622 4.559 4.708 . 0 0 "[ . 1 . 2 . 3 ]" 1
117 1 11 VAL HA 1 11 VAL HB 2.850 . 4.000 3.017 3.014 3.020 . 0 0 "[ . 1 . 2 . 3 ]" 1
118 1 11 VAL HA 1 11 VAL MG1 3.350 . 5.000 2.302 2.188 2.400 . 0 0 "[ . 1 . 2 . 3 ]" 1
119 1 11 VAL HA 1 11 VAL MG2 3.100 . 4.500 2.443 2.369 2.520 . 0 0 "[ . 1 . 2 . 3 ]" 1
120 1 11 VAL HA 1 12 LYS H 2.850 . 4.000 3.463 3.453 3.472 . 0 0 "[ . 1 . 2 . 3 ]" 1
121 1 11 VAL HA 1 13 ALA H 2.850 . 4.000 4.049 4.038 4.070 0.070 2 0 "[ . 1 . 2 . 3 ]" 1
122 1 11 VAL HA 1 14 LEU H 2.350 . 3.000 3.006 2.994 3.019 0.019 32 0 "[ . 1 . 2 . 3 ]" 1
123 1 11 VAL HA 1 14 LEU HB2 2.850 . 4.000 2.027 1.961 2.109 . 0 0 "[ . 1 . 2 . 3 ]" 1
124 1 11 VAL HA 1 14 LEU HB3 2.850 . 4.000 2.543 2.438 2.622 . 0 0 "[ . 1 . 2 . 3 ]" 1
125 1 11 VAL HA 1 14 LEU MD1 3.600 . 5.500 2.540 2.420 2.701 . 0 0 "[ . 1 . 2 . 3 ]" 1
126 1 11 VAL HA 1 14 LEU MD2 3.600 . 5.500 3.843 3.535 4.285 . 0 0 "[ . 1 . 2 . 3 ]" 1
127 1 11 VAL HA 1 57 VAL MG1 3.600 . 5.500 3.399 3.081 3.733 . 0 0 "[ . 1 . 2 . 3 ]" 1
128 1 11 VAL HB 1 12 LYS H 2.850 . 4.000 2.901 2.886 2.923 . 0 0 "[ . 1 . 2 . 3 ]" 1
129 1 11 VAL HB 1 14 LEU MD1 3.350 . 5.000 4.895 4.519 5.018 0.018 1 0 "[ . 1 . 2 . 3 ]" 1
130 1 11 VAL HB 1 37 LEU MD1 3.600 . 5.500 5.355 3.810 5.505 0.005 7 0 "[ . 1 . 2 . 3 ]" 1
131 1 11 VAL HB 1 37 LEU MD2 3.600 . 5.500 4.558 4.270 5.505 0.005 16 0 "[ . 1 . 2 . 3 ]" 1
132 1 11 VAL HB 1 41 ILE MD 3.350 . 5.000 3.419 3.040 3.799 . 0 0 "[ . 1 . 2 . 3 ]" 1
133 1 11 VAL MG1 1 12 LYS H 3.600 . 5.500 3.826 3.784 3.875 . 0 0 "[ . 1 . 2 . 3 ]" 1
134 1 11 VAL MG1 1 12 LYS HA 3.600 . 5.500 3.906 3.799 3.983 . 0 0 "[ . 1 . 2 . 3 ]" 1
135 1 11 VAL MG1 1 12 LYS QB 3.600 . 5.500 4.814 4.717 5.008 . 0 0 "[ . 1 . 2 . 3 ]" 1
136 1 11 VAL MG1 1 14 LEU HB3 3.600 . 5.500 2.499 2.297 2.798 . 0 0 "[ . 1 . 2 . 3 ]" 1
137 1 11 VAL MG1 1 35 GLU HA 3.100 . 4.500 4.510 4.492 4.521 0.021 27 0 "[ . 1 . 2 . 3 ]" 1
138 1 11 VAL MG1 1 37 LEU HB3 3.600 . 5.500 3.306 3.042 3.506 . 0 0 "[ . 1 . 2 . 3 ]" 1
139 1 11 VAL MG1 1 38 LYS H 3.600 . 5.500 3.718 3.267 3.921 . 0 0 "[ . 1 . 2 . 3 ]" 1
140 1 11 VAL MG1 1 38 LYS HA 3.100 . 4.500 3.735 3.413 4.028 . 0 0 "[ . 1 . 2 . 3 ]" 1
141 1 11 VAL MG1 1 38 LYS QB 3.600 . 5.500 3.610 2.905 4.038 . 0 0 "[ . 1 . 2 . 3 ]" 1
142 1 11 VAL MG1 1 38 LYS HD2 3.600 . 5.500 3.696 1.914 5.128 . 0 0 "[ . 1 . 2 . 3 ]" 1
143 1 11 VAL MG1 1 38 LYS HD3 3.600 . 5.500 3.710 2.127 5.087 . 0 0 "[ . 1 . 2 . 3 ]" 1
144 1 11 VAL MG1 1 38 LYS QE 3.100 . 4.500 3.167 1.920 4.032 . 0 0 "[ . 1 . 2 . 3 ]" 1
145 1 11 VAL MG1 1 41 ILE MD 3.600 . 5.500 3.709 3.265 3.964 . 0 0 "[ . 1 . 2 . 3 ]" 1
146 1 11 VAL MG2 1 13 ALA H 3.600 . 5.500 5.282 5.245 5.340 . 0 0 "[ . 1 . 2 . 3 ]" 1
147 1 11 VAL MG2 1 14 LEU H 3.600 . 5.500 4.931 4.899 4.958 . 0 0 "[ . 1 . 2 . 3 ]" 1
148 1 11 VAL MG2 1 14 LEU HB3 3.350 . 5.000 4.264 4.196 4.367 . 0 0 "[ . 1 . 2 . 3 ]" 1
149 1 11 VAL MG2 1 38 LYS HA 3.350 . 5.000 3.969 3.760 4.204 . 0 0 "[ . 1 . 2 . 3 ]" 1
150 1 11 VAL MG2 1 38 LYS QB 3.600 . 5.500 4.958 4.479 5.203 . 0 0 "[ . 1 . 2 . 3 ]" 1
151 1 11 VAL MG2 1 41 ILE HB 3.600 . 5.500 5.417 5.029 5.509 0.009 32 0 "[ . 1 . 2 . 3 ]" 1
152 1 11 VAL MG2 1 41 ILE MD 3.350 . 5.000 2.331 2.105 2.539 . 0 0 "[ . 1 . 2 . 3 ]" 1
153 1 11 VAL MG2 1 57 VAL HA 3.350 . 5.000 3.784 3.509 4.087 . 0 0 "[ . 1 . 2 . 3 ]" 1
154 1 11 VAL MG2 1 57 VAL MG1 3.100 . 4.500 1.745 1.692 1.849 0.008 16 0 "[ . 1 . 2 . 3 ]" 1
155 1 12 LYS H 1 12 LYS HA 2.350 . 3.000 2.804 2.780 2.829 . 0 0 "[ . 1 . 2 . 3 ]" 1
156 1 12 LYS H 1 12 LYS QB 2.350 . 3.000 2.206 2.048 2.589 . 0 0 "[ . 1 . 2 . 3 ]" 1
157 1 12 LYS H 1 13 ALA H 2.350 . 3.000 2.648 2.549 2.745 . 0 0 "[ . 1 . 2 . 3 ]" 1
158 1 12 LYS H 1 14 LEU H 2.850 . 4.000 3.749 3.685 3.860 . 0 0 "[ . 1 . 2 . 3 ]" 1
159 1 12 LYS H 1 14 LEU HB3 3.350 . 5.000 5.058 5.049 5.069 0.069 31 0 "[ . 1 . 2 . 3 ]" 1
160 1 12 LYS H 1 14 LEU MD1 3.600 . 5.500 5.523 5.504 5.535 0.035 8 0 "[ . 1 . 2 . 3 ]" 1
161 1 12 LYS HA 1 13 ALA H 2.850 . 4.000 3.510 3.495 3.525 . 0 0 "[ . 1 . 2 . 3 ]" 1
162 1 12 LYS HA 1 15 GLU HB2 2.850 . 4.000 3.984 3.810 4.006 0.006 7 0 "[ . 1 . 2 . 3 ]" 1
163 1 12 LYS HA 1 15 GLU HB3 2.600 . 3.500 3.518 3.511 3.529 0.029 16 0 "[ . 1 . 2 . 3 ]" 1
164 1 12 LYS QB 1 13 ALA H 2.850 . 4.000 2.762 2.650 3.482 . 0 0 "[ . 1 . 2 . 3 ]" 1
165 1 12 LYS QB 1 13 ALA HA 3.100 . 4.500 4.090 3.877 4.501 0.001 8 0 "[ . 1 . 2 . 3 ]" 1
166 1 12 LYS QB 1 13 ALA MB 3.600 . 5.500 3.800 3.621 4.513 . 0 0 "[ . 1 . 2 . 3 ]" 1
167 1 12 LYS QE 1 13 ALA MB 3.600 . 5.500 4.755 3.227 5.456 . 0 0 "[ . 1 . 2 . 3 ]" 1
168 1 13 ALA H 1 13 ALA HA 2.350 . 3.000 2.896 2.889 2.901 . 0 0 "[ . 1 . 2 . 3 ]" 1
169 1 13 ALA H 1 13 ALA MB 2.600 . 3.500 2.181 2.093 2.289 . 0 0 "[ . 1 . 2 . 3 ]" 1
170 1 13 ALA H 1 14 LEU H 2.350 . 3.000 2.251 2.233 2.285 . 0 0 "[ . 1 . 2 . 3 ]" 1
171 1 13 ALA HA 1 14 LEU H 2.850 . 4.000 3.418 3.411 3.442 . 0 0 "[ . 1 . 2 . 3 ]" 1
172 1 13 ALA HA 1 15 GLU H 2.850 . 4.000 3.758 3.701 3.809 . 0 0 "[ . 1 . 2 . 3 ]" 1
173 1 13 ALA HA 1 16 GLU H 2.850 . 4.000 3.382 3.245 3.532 . 0 0 "[ . 1 . 2 . 3 ]" 1
174 1 13 ALA HA 1 16 GLU QB 2.850 . 4.000 3.480 3.064 3.930 . 0 0 "[ . 1 . 2 . 3 ]" 1
175 1 13 ALA HA 1 16 GLU HG2 3.100 . 4.500 3.291 1.983 4.432 . 0 0 "[ . 1 . 2 . 3 ]" 1
176 1 13 ALA HA 1 16 GLU HG3 3.100 . 4.500 2.996 2.252 4.502 0.002 6 0 "[ . 1 . 2 . 3 ]" 1
177 1 13 ALA MB 1 14 LEU H 3.100 . 4.500 2.887 2.784 2.940 . 0 0 "[ . 1 . 2 . 3 ]" 1
178 1 13 ALA MB 1 14 LEU HA 3.350 . 5.000 3.889 3.810 3.934 . 0 0 "[ . 1 . 2 . 3 ]" 1
179 1 13 ALA MB 1 14 LEU MD1 3.850 . 6.000 5.021 4.762 5.418 . 0 0 "[ . 1 . 2 . 3 ]" 1
180 1 13 ALA MB 1 14 LEU MD2 3.850 . 6.000 5.721 5.507 5.836 . 0 0 "[ . 1 . 2 . 3 ]" 1
181 1 14 LEU H 1 14 LEU HA 2.350 . 3.000 2.815 2.792 2.823 . 0 0 "[ . 1 . 2 . 3 ]" 1
182 1 14 LEU H 1 14 LEU HB3 2.350 . 3.000 2.753 2.728 2.780 . 0 0 "[ . 1 . 2 . 3 ]" 1
183 1 14 LEU H 1 14 LEU MD1 3.100 . 4.500 3.924 3.830 4.079 . 0 0 "[ . 1 . 2 . 3 ]" 1
184 1 14 LEU H 1 15 GLU H 2.350 . 3.000 2.567 2.550 2.636 . 0 0 "[ . 1 . 2 . 3 ]" 1
185 1 14 LEU HA 1 14 LEU HB3 2.850 . 4.000 2.996 2.991 3.001 . 0 0 "[ . 1 . 2 . 3 ]" 1
186 1 14 LEU HA 1 14 LEU MD1 2.850 . 4.000 3.482 3.225 3.773 . 0 0 "[ . 1 . 2 . 3 ]" 1
187 1 14 LEU HA 1 14 LEU MD2 3.600 . 5.500 3.180 2.688 3.486 . 0 0 "[ . 1 . 2 . 3 ]" 1
188 1 14 LEU HA 1 14 LEU HG 2.350 . 3.000 2.293 2.239 2.459 . 0 0 "[ . 1 . 2 . 3 ]" 1
189 1 14 LEU HA 1 15 GLU H 2.850 . 4.000 3.461 3.455 3.466 . 0 0 "[ . 1 . 2 . 3 ]" 1
190 1 14 LEU HA 1 17 LYS HB2 2.850 . 4.000 3.537 3.113 3.966 . 0 0 "[ . 1 . 2 . 3 ]" 1
191 1 14 LEU HA 1 17 LYS HB3 2.850 . 4.000 3.815 3.307 4.005 0.005 18 0 "[ . 1 . 2 . 3 ]" 1
192 1 14 LEU HA 1 18 VAL MG2 3.600 . 5.500 4.293 4.041 4.497 . 0 0 "[ . 1 . 2 . 3 ]" 1
193 1 14 LEU HA 1 64 ILE MD 3.600 . 5.500 4.048 3.902 4.173 . 0 0 "[ . 1 . 2 . 3 ]" 1
194 1 14 LEU HB2 1 14 LEU MD1 3.100 . 4.500 2.070 1.976 2.301 . 0 0 "[ . 1 . 2 . 3 ]" 1
195 1 14 LEU HB2 1 14 LEU MD2 3.350 . 5.000 3.093 2.978 3.187 . 0 0 "[ . 1 . 2 . 3 ]" 1
196 1 14 LEU HB2 1 15 GLU H 2.850 . 4.000 3.795 3.779 3.822 . 0 0 "[ . 1 . 2 . 3 ]" 1
197 1 14 LEU HB2 1 18 VAL MG2 3.600 . 5.500 5.443 5.155 5.524 0.024 13 0 "[ . 1 . 2 . 3 ]" 1
198 1 14 LEU HB2 1 60 LEU MD2 3.350 . 5.000 4.910 4.733 5.013 0.013 23 0 "[ . 1 . 2 . 3 ]" 1
199 1 14 LEU HB2 1 64 ILE MD 3.350 . 5.000 5.011 4.963 5.025 0.025 21 0 "[ . 1 . 2 . 3 ]" 1
200 1 14 LEU HB3 1 14 LEU MD1 3.100 . 4.500 2.665 2.326 2.827 . 0 0 "[ . 1 . 2 . 3 ]" 1
201 1 14 LEU HB3 1 14 LEU HG 2.850 . 4.000 2.964 2.897 3.023 . 0 0 "[ . 1 . 2 . 3 ]" 1
202 1 14 LEU HB3 1 15 GLU H 2.850 . 4.000 2.984 2.966 3.001 . 0 0 "[ . 1 . 2 . 3 ]" 1
203 1 14 LEU HB3 1 64 ILE MD 3.600 . 5.500 4.564 4.440 4.627 . 0 0 "[ . 1 . 2 . 3 ]" 1
204 1 14 LEU MD1 1 60 LEU HB2 3.350 . 5.000 4.663 3.873 5.011 0.011 12 0 "[ . 1 . 2 . 3 ]" 1
205 1 14 LEU MD1 1 60 LEU HB3 3.350 . 5.000 3.165 2.348 3.522 . 0 0 "[ . 1 . 2 . 3 ]" 1
206 1 14 LEU MD1 1 60 LEU HG 3.600 . 5.500 5.002 4.467 5.281 . 0 0 "[ . 1 . 2 . 3 ]" 1
207 1 14 LEU MD1 1 61 GLU HA 3.350 . 5.000 2.497 2.211 2.907 . 0 0 "[ . 1 . 2 . 3 ]" 1
208 1 14 LEU MD1 1 61 GLU HB2 3.350 . 5.000 2.838 2.450 3.078 . 0 0 "[ . 1 . 2 . 3 ]" 1
209 1 14 LEU MD1 1 61 GLU HB3 3.350 . 5.000 3.882 3.592 4.120 . 0 0 "[ . 1 . 2 . 3 ]" 1
210 1 14 LEU MD1 1 61 GLU HG2 3.350 . 5.000 2.661 2.105 3.287 . 0 0 "[ . 1 . 2 . 3 ]" 1
211 1 14 LEU MD1 1 61 GLU HG3 3.350 . 5.000 1.897 1.820 2.189 . 0 0 "[ . 1 . 2 . 3 ]" 1
212 1 14 LEU MD1 1 64 ILE MD 3.350 . 5.000 3.501 3.391 3.663 . 0 0 "[ . 1 . 2 . 3 ]" 1
213 1 14 LEU MD2 1 33 LYS QE 3.600 . 5.500 5.475 5.098 5.519 0.019 3 0 "[ . 1 . 2 . 3 ]" 1
214 1 14 LEU MD2 1 60 LEU HG 3.600 . 5.500 3.887 3.756 4.031 . 0 0 "[ . 1 . 2 . 3 ]" 1
215 1 14 LEU MD2 1 61 GLU H 3.100 . 4.500 4.402 4.197 4.513 0.013 28 0 "[ . 1 . 2 . 3 ]" 1
216 1 14 LEU MD2 1 61 GLU HA 3.350 . 5.000 3.235 3.117 3.387 . 0 0 "[ . 1 . 2 . 3 ]" 1
217 1 14 LEU MD2 1 61 GLU HB2 3.600 . 5.500 4.620 4.483 4.735 . 0 0 "[ . 1 . 2 . 3 ]" 1
218 1 14 LEU MD2 1 61 GLU HB3 3.600 . 5.500 5.515 5.503 5.529 0.029 18 0 "[ . 1 . 2 . 3 ]" 1
219 1 14 LEU MD2 1 61 GLU HG2 3.600 . 5.500 4.289 4.051 4.556 . 0 0 "[ . 1 . 2 . 3 ]" 1
220 1 14 LEU MD2 1 61 GLU HG3 3.350 . 5.000 4.089 3.835 4.339 . 0 0 "[ . 1 . 2 . 3 ]" 1
221 1 14 LEU MD2 1 64 ILE HB 3.600 . 5.500 4.486 4.074 4.900 . 0 0 "[ . 1 . 2 . 3 ]" 1
222 1 14 LEU HG 1 60 LEU MD2 3.100 . 4.500 3.781 3.605 3.943 . 0 0 "[ . 1 . 2 . 3 ]" 1
223 1 15 GLU H 1 15 GLU HA 2.350 . 3.000 2.859 2.836 2.870 . 0 0 "[ . 1 . 2 . 3 ]" 1
224 1 15 GLU H 1 15 GLU HB2 2.350 . 3.000 2.767 2.711 2.790 . 0 0 "[ . 1 . 2 . 3 ]" 1
225 1 15 GLU H 1 15 GLU HB3 2.350 . 3.000 2.311 2.271 2.358 . 0 0 "[ . 1 . 2 . 3 ]" 1
226 1 15 GLU H 1 16 GLU H 2.350 . 3.000 2.567 2.487 2.670 . 0 0 "[ . 1 . 2 . 3 ]" 1
227 1 15 GLU HA 1 15 GLU HB2 2.850 . 4.000 2.378 2.357 2.400 . 0 0 "[ . 1 . 2 . 3 ]" 1
228 1 15 GLU HA 1 15 GLU HB3 2.850 . 4.000 3.016 3.011 3.020 . 0 0 "[ . 1 . 2 . 3 ]" 1
229 1 15 GLU HA 1 15 GLU HG2 2.850 . 4.000 3.265 2.596 3.519 . 0 0 "[ . 1 . 2 . 3 ]" 1
230 1 15 GLU HA 1 15 GLU HG3 2.850 . 4.000 2.746 2.617 3.515 . 0 0 "[ . 1 . 2 . 3 ]" 1
231 1 15 GLU HA 1 16 GLU H 2.850 . 4.000 3.556 3.534 3.575 . 0 0 "[ . 1 . 2 . 3 ]" 1
232 1 15 GLU HA 1 18 VAL HB 2.850 . 4.000 3.200 2.863 3.475 . 0 0 "[ . 1 . 2 . 3 ]" 1
233 1 15 GLU HA 1 18 VAL MG2 3.350 . 5.000 2.769 2.356 3.099 . 0 0 "[ . 1 . 2 . 3 ]" 1
234 1 15 GLU HB2 1 15 GLU HG2 2.850 . 4.000 2.989 2.722 3.010 . 0 0 "[ . 1 . 2 . 3 ]" 1
235 1 15 GLU HB2 1 15 GLU HG3 2.850 . 4.000 2.441 2.214 2.570 . 0 0 "[ . 1 . 2 . 3 ]" 1
236 1 15 GLU HB2 1 16 GLU H 2.850 . 4.000 3.918 3.807 4.008 0.008 30 0 "[ . 1 . 2 . 3 ]" 1
237 1 15 GLU HB3 1 15 GLU HG2 2.850 . 4.000 2.461 2.329 2.926 . 0 0 "[ . 1 . 2 . 3 ]" 1
238 1 15 GLU HB3 1 15 GLU HG3 2.850 . 4.000 2.991 2.714 3.012 . 0 0 "[ . 1 . 2 . 3 ]" 1
239 1 15 GLU HG2 1 16 GLU H 2.850 . 4.000 3.350 3.034 3.811 . 0 0 "[ . 1 . 2 . 3 ]" 1
240 1 15 GLU HG2 1 19 LYS QE 3.350 . 5.000 3.856 2.479 5.006 0.006 13 0 "[ . 1 . 2 . 3 ]" 1
241 1 15 GLU HG3 1 16 GLU H 3.100 . 4.500 4.436 4.190 4.512 0.012 7 0 "[ . 1 . 2 . 3 ]" 1
242 1 15 GLU HG3 1 19 LYS HG2 3.100 . 4.500 3.181 2.359 3.767 . 0 0 "[ . 1 . 2 . 3 ]" 1
243 1 16 GLU H 1 16 GLU HA 2.350 . 3.000 2.756 2.730 2.784 . 0 0 "[ . 1 . 2 . 3 ]" 1
244 1 16 GLU H 1 16 GLU QB 2.350 . 3.000 2.498 2.341 2.642 . 0 0 "[ . 1 . 2 . 3 ]" 1
245 1 16 GLU H 1 16 GLU HG2 2.350 . 3.000 2.416 2.003 3.000 . 19 0 "[ . 1 . 2 . 3 ]" 1
246 1 16 GLU H 1 16 GLU HG3 2.850 . 4.000 2.896 2.016 4.012 0.012 6 0 "[ . 1 . 2 . 3 ]" 1
247 1 16 GLU H 1 17 LYS H 2.350 . 3.000 2.779 2.710 2.852 . 0 0 "[ . 1 . 2 . 3 ]" 1
248 1 16 GLU HA 1 16 GLU QB 2.600 . 3.500 2.303 2.173 2.426 . 0 0 "[ . 1 . 2 . 3 ]" 1
249 1 16 GLU HA 1 16 GLU HG2 2.850 . 4.000 2.964 2.250 3.947 . 0 0 "[ . 1 . 2 . 3 ]" 1
250 1 16 GLU HA 1 16 GLU HG3 2.850 . 4.000 3.651 3.402 3.984 . 0 0 "[ . 1 . 2 . 3 ]" 1
251 1 16 GLU HA 1 17 LYS H 2.850 . 4.000 3.477 3.465 3.491 . 0 0 "[ . 1 . 2 . 3 ]" 1
252 1 16 GLU HA 1 19 LYS HB2 2.850 . 4.000 2.843 2.654 3.050 . 0 0 "[ . 1 . 2 . 3 ]" 1
253 1 16 GLU QB 1 16 GLU HG3 2.600 . 3.500 2.245 2.128 2.484 . 0 0 "[ . 1 . 2 . 3 ]" 1
254 1 16 GLU HG3 1 17 LYS H 3.350 . 5.000 3.893 2.172 5.002 0.002 11 0 "[ . 1 . 2 . 3 ]" 1
255 1 17 LYS H 1 17 LYS HA 2.350 . 3.000 2.865 2.862 2.867 . 0 0 "[ . 1 . 2 . 3 ]" 1
256 1 17 LYS H 1 18 VAL H 2.350 . 3.000 2.538 2.466 2.638 . 0 0 "[ . 1 . 2 . 3 ]" 1
257 1 17 LYS HA 1 17 LYS HG3 2.600 . 3.500 2.563 2.104 3.361 . 0 0 "[ . 1 . 2 . 3 ]" 1
258 1 17 LYS HA 1 18 VAL H 2.850 . 4.000 3.546 3.519 3.570 . 0 0 "[ . 1 . 2 . 3 ]" 1
259 1 17 LYS HA 1 20 ALA MB 2.850 . 4.000 3.225 2.926 3.567 . 0 0 "[ . 1 . 2 . 3 ]" 1
260 1 17 LYS HB2 1 18 VAL H 2.850 . 4.000 3.603 3.350 3.917 . 0 0 "[ . 1 . 2 . 3 ]" 1
261 1 17 LYS HB2 1 18 VAL MG2 3.600 . 5.500 4.191 3.836 4.441 . 0 0 "[ . 1 . 2 . 3 ]" 1
262 1 17 LYS HB2 1 64 ILE MD 3.350 . 5.000 4.295 3.750 4.856 . 0 0 "[ . 1 . 2 . 3 ]" 1
263 1 17 LYS HB3 1 18 VAL H 2.850 . 4.000 2.568 2.324 2.780 . 0 0 "[ . 1 . 2 . 3 ]" 1
264 1 17 LYS HB3 1 18 VAL MG2 3.600 . 5.500 2.862 2.754 2.976 . 0 0 "[ . 1 . 2 . 3 ]" 1
265 1 17 LYS HB3 1 64 ILE MD 3.600 . 5.500 3.003 2.419 3.515 . 0 0 "[ . 1 . 2 . 3 ]" 1
266 1 17 LYS QD 1 18 VAL MG2 3.600 . 5.500 4.569 3.079 5.312 . 0 0 "[ . 1 . 2 . 3 ]" 1
267 1 17 LYS QD 1 64 ILE MD 3.600 . 5.500 3.845 2.472 5.114 . 0 0 "[ . 1 . 2 . 3 ]" 1
268 1 17 LYS QD 1 64 ILE MG 3.350 . 5.000 3.142 1.872 4.391 . 0 0 "[ . 1 . 2 . 3 ]" 1
269 1 18 VAL H 1 18 VAL HA 2.350 . 3.000 2.856 2.819 2.872 . 0 0 "[ . 1 . 2 . 3 ]" 1
270 1 18 VAL H 1 18 VAL HB 2.350 . 3.000 2.706 2.589 2.818 . 0 0 "[ . 1 . 2 . 3 ]" 1
271 1 18 VAL H 1 18 VAL MG2 3.100 . 4.500 1.987 1.913 2.183 . 0 0 "[ . 1 . 2 . 3 ]" 1
272 1 18 VAL H 1 19 LYS H 2.350 . 3.000 2.644 2.521 2.768 . 0 0 "[ . 1 . 2 . 3 ]" 1
273 1 18 VAL H 1 20 ALA H 2.850 . 4.000 3.903 3.691 4.029 0.029 26 0 "[ . 1 . 2 . 3 ]" 1
274 1 18 VAL H 1 64 ILE MG 3.600 . 5.500 4.632 4.267 4.978 . 0 0 "[ . 1 . 2 . 3 ]" 1
275 1 18 VAL HA 1 18 VAL HB 2.850 . 5.000 2.997 2.986 3.006 . 0 0 "[ . 1 . 2 . 3 ]" 1
276 1 18 VAL HA 1 18 VAL MG1 3.100 . 4.500 2.313 2.179 2.392 . 0 0 "[ . 1 . 2 . 3 ]" 1
277 1 18 VAL HA 1 18 VAL MG2 3.100 . 4.500 2.511 2.432 2.551 . 0 0 "[ . 1 . 2 . 3 ]" 1
278 1 18 VAL HA 1 19 LYS H 2.850 . 4.000 3.563 3.551 3.572 . 0 0 "[ . 1 . 2 . 3 ]" 1
279 1 18 VAL HA 1 20 ALA H 2.850 . 4.000 3.949 3.790 4.015 0.015 26 0 "[ . 1 . 2 . 3 ]" 1
280 1 18 VAL HA 1 21 LEU H 2.850 . 4.000 3.163 2.898 3.566 . 0 0 "[ . 1 . 2 . 3 ]" 1
281 1 18 VAL HA 1 21 LEU HB2 2.850 . 5.000 2.800 1.926 4.664 . 0 0 "[ . 1 . 2 . 3 ]" 1
282 1 18 VAL HA 1 21 LEU HB3 2.600 . 3.500 3.314 2.209 3.519 0.019 10 0 "[ . 1 . 2 . 3 ]" 1
283 1 18 VAL HA 1 21 LEU MD1 3.100 . 4.500 2.982 2.001 4.518 0.018 28 0 "[ . 1 . 2 . 3 ]" 1
284 1 18 VAL HA 1 21 LEU HG 3.100 . 4.000 3.594 1.981 4.028 0.028 26 0 "[ . 1 . 2 . 3 ]" 1
285 1 18 VAL HA 1 27 ILE MG 3.600 . 5.500 3.797 3.041 4.351 . 0 0 "[ . 1 . 2 . 3 ]" 1
286 1 18 VAL HA 1 64 ILE MD 3.600 . 5.500 3.788 3.556 4.029 . 0 0 "[ . 1 . 2 . 3 ]" 1
287 1 18 VAL HA 1 64 ILE MG 3.600 . 5.500 3.875 3.591 4.146 . 0 0 "[ . 1 . 2 . 3 ]" 1
288 1 18 VAL HB 1 19 LYS H 2.350 . 3.000 2.321 2.128 2.571 . 0 0 "[ . 1 . 2 . 3 ]" 1
289 1 18 VAL MG1 1 19 LYS H 3.600 . 5.500 3.522 3.334 3.781 . 0 0 "[ . 1 . 2 . 3 ]" 1
290 1 18 VAL MG1 1 19 LYS HA 3.600 . 5.500 3.737 3.474 4.022 . 0 0 "[ . 1 . 2 . 3 ]" 1
291 1 18 VAL MG1 1 20 ALA H 3.600 . 5.500 4.739 4.577 4.904 . 0 0 "[ . 1 . 2 . 3 ]" 1
292 1 18 VAL MG1 1 27 ILE MD 3.850 . 6.000 4.430 4.157 4.831 . 0 0 "[ . 1 . 2 . 3 ]" 1
293 1 18 VAL MG1 1 27 ILE MG 3.600 . 5.500 2.186 1.757 2.551 . 0 0 "[ . 1 . 2 . 3 ]" 1
294 1 18 VAL MG1 1 30 LEU HB3 3.600 . 5.500 3.588 2.970 4.045 . 0 0 "[ . 1 . 2 . 3 ]" 1
295 1 18 VAL MG1 1 31 LYS HA 3.350 . 5.000 3.231 2.773 3.479 . 0 0 "[ . 1 . 2 . 3 ]" 1
296 1 18 VAL MG1 1 31 LYS HB2 3.350 . 5.000 3.351 2.960 3.631 . 0 0 "[ . 1 . 2 . 3 ]" 1
297 1 18 VAL MG1 1 31 LYS HB3 3.350 . 5.000 4.773 4.377 5.004 0.004 20 0 "[ . 1 . 2 . 3 ]" 1
298 1 18 VAL MG1 1 31 LYS QD 3.600 . 5.500 3.539 2.828 4.314 . 0 0 "[ . 1 . 2 . 3 ]" 1
299 1 18 VAL MG1 1 34 CYS HB2 3.600 . 5.500 4.364 4.120 4.519 . 0 0 "[ . 1 . 2 . 3 ]" 1
300 1 18 VAL MG1 1 34 CYS HB3 3.350 . 5.000 4.971 4.763 5.011 0.011 9 0 "[ . 1 . 2 . 3 ]" 1
301 1 18 VAL MG1 1 60 LEU MD2 3.600 . 5.500 4.144 3.858 4.391 . 0 0 "[ . 1 . 2 . 3 ]" 1
302 1 18 VAL MG1 1 64 ILE MD 3.850 . 6.000 3.365 3.113 3.573 . 0 0 "[ . 1 . 2 . 3 ]" 1
303 1 18 VAL MG2 1 27 ILE MD 3.850 . 6.000 5.969 5.790 6.011 0.011 19 0 "[ . 1 . 2 . 3 ]" 1
304 1 18 VAL MG2 1 27 ILE MG 3.600 . 5.500 3.966 3.340 4.421 . 0 0 "[ . 1 . 2 . 3 ]" 1
305 1 18 VAL MG2 1 30 LEU HB2 3.600 . 5.500 4.121 3.595 4.513 . 0 0 "[ . 1 . 2 . 3 ]" 1
306 1 18 VAL MG2 1 30 LEU HB3 3.600 . 5.500 3.428 2.953 3.796 . 0 0 "[ . 1 . 2 . 3 ]" 1
307 1 18 VAL MG2 1 30 LEU MD1 3.850 . 6.000 3.834 3.461 4.396 . 0 0 "[ . 1 . 2 . 3 ]" 1
308 1 18 VAL MG2 1 30 LEU MD2 3.600 . 5.500 4.239 3.391 4.883 . 0 0 "[ . 1 . 2 . 3 ]" 1
309 1 18 VAL MG2 1 31 LYS HA 3.600 . 5.500 4.316 3.814 4.726 . 0 0 "[ . 1 . 2 . 3 ]" 1
310 1 18 VAL MG2 1 34 CYS HA 3.600 . 5.500 5.424 5.181 5.512 0.012 2 0 "[ . 1 . 2 . 3 ]" 1
311 1 18 VAL MG2 1 34 CYS HB2 3.350 . 5.000 4.232 3.831 4.463 . 0 0 "[ . 1 . 2 . 3 ]" 1
312 1 18 VAL MG2 1 34 CYS HB3 3.600 . 5.500 4.580 4.274 4.719 . 0 0 "[ . 1 . 2 . 3 ]" 1
313 1 18 VAL MG2 1 64 ILE MD 3.100 . 4.500 1.789 1.697 1.957 0.003 25 0 "[ . 1 . 2 . 3 ]" 1
314 1 18 VAL MG2 1 64 ILE QG 3.600 . 5.500 3.105 2.842 3.370 . 0 0 "[ . 1 . 2 . 3 ]" 1
315 1 18 VAL MG2 1 64 ILE MG 3.600 . 5.500 3.011 2.833 3.266 . 0 0 "[ . 1 . 2 . 3 ]" 1
316 1 18 VAL MG2 1 67 LEU MD1 3.100 . 4.500 4.477 4.337 4.516 0.016 22 0 "[ . 1 . 2 . 3 ]" 1
317 1 19 LYS H 1 19 LYS HA 2.350 . 3.000 2.749 2.737 2.771 . 0 0 "[ . 1 . 2 . 3 ]" 1
318 1 19 LYS H 1 19 LYS HG2 2.350 . 3.000 2.928 2.201 3.015 0.015 13 0 "[ . 1 . 2 . 3 ]" 1
319 1 19 LYS H 1 19 LYS HG3 2.350 . 3.000 2.830 2.376 3.011 0.011 11 0 "[ . 1 . 2 . 3 ]" 1
320 1 19 LYS H 1 20 ALA H 2.350 . 3.000 2.794 2.732 2.833 . 0 0 "[ . 1 . 2 . 3 ]" 1
321 1 19 LYS HA 1 19 LYS QD 2.850 . 4.000 3.546 3.106 4.001 0.001 9 0 "[ . 1 . 2 . 3 ]" 1
322 1 19 LYS HA 1 19 LYS HG2 2.850 . 4.000 2.254 2.177 2.536 . 0 0 "[ . 1 . 2 . 3 ]" 1
323 1 19 LYS HA 1 19 LYS HG3 2.850 . 4.000 3.456 3.325 3.721 . 0 0 "[ . 1 . 2 . 3 ]" 1
324 1 19 LYS HA 1 20 ALA H 2.850 . 4.000 3.480 3.433 3.508 . 0 0 "[ . 1 . 2 . 3 ]" 1
325 1 19 LYS HA 1 21 LEU H 2.850 . 4.000 3.975 3.625 4.027 0.027 10 0 "[ . 1 . 2 . 3 ]" 1
326 1 19 LYS QB 1 19 LYS QD 2.600 . 3.500 2.050 1.921 2.233 . 0 0 "[ . 1 . 2 . 3 ]" 1
327 1 19 LYS HB2 1 20 ALA H 2.850 . 4.000 2.986 2.716 3.195 . 0 0 "[ . 1 . 2 . 3 ]" 1
328 1 19 LYS HB3 1 19 LYS HG3 2.600 . 3.500 2.882 2.783 2.972 . 0 0 "[ . 1 . 2 . 3 ]" 1
329 1 19 LYS HB3 1 20 ALA H 2.850 . 4.000 3.735 3.585 3.919 . 0 0 "[ . 1 . 2 . 3 ]" 1
330 1 19 LYS QD 1 19 LYS HG2 2.600 . 3.500 2.406 2.144 2.533 . 0 0 "[ . 1 . 2 . 3 ]" 1
331 1 19 LYS QD 1 19 LYS HG3 2.600 . 3.500 2.252 2.144 2.515 . 0 0 "[ . 1 . 2 . 3 ]" 1
332 1 19 LYS QE 1 19 LYS HG2 3.350 . 5.000 2.395 1.940 3.346 . 0 0 "[ . 1 . 2 . 3 ]" 1
333 1 19 LYS QE 1 19 LYS HG3 3.350 . 5.000 2.804 1.971 3.481 . 0 0 "[ . 1 . 2 . 3 ]" 1
334 1 20 ALA H 1 20 ALA HA 2.350 . 3.000 2.908 2.848 2.923 . 0 0 "[ . 1 . 2 . 3 ]" 1
335 1 20 ALA H 1 20 ALA MB 2.600 . 3.500 2.246 2.125 2.313 . 0 0 "[ . 1 . 2 . 3 ]" 1
336 1 20 ALA H 1 21 LEU H 2.350 . 3.000 2.320 2.231 2.578 . 0 0 "[ . 1 . 2 . 3 ]" 1
337 1 20 ALA H 1 21 LEU MD1 3.600 . 5.500 5.369 3.753 5.538 0.038 9 0 "[ . 1 . 2 . 3 ]" 1
338 1 20 ALA HA 1 21 LEU H 2.850 . 4.000 3.382 3.344 3.427 . 0 0 "[ . 1 . 2 . 3 ]" 1
339 1 20 ALA MB 1 21 LEU H 3.600 . 5.500 3.113 2.971 3.174 . 0 0 "[ . 1 . 2 . 3 ]" 1
340 1 20 ALA MB 1 21 LEU HA 3.600 . 5.500 3.957 3.872 4.033 . 0 0 "[ . 1 . 2 . 3 ]" 1
341 1 20 ALA MB 1 21 LEU MD2 3.850 . 6.000 5.168 4.006 5.835 . 0 0 "[ . 1 . 2 . 3 ]" 1
342 1 21 LEU H 1 21 LEU HA 2.350 . 3.000 2.854 2.803 2.935 . 0 0 "[ . 1 . 2 . 3 ]" 1
343 1 21 LEU H 1 21 LEU HB2 2.850 . 4.000 2.549 2.009 3.715 . 0 0 "[ . 1 . 2 . 3 ]" 1
344 1 21 LEU H 1 21 LEU HB3 2.350 . 3.000 2.865 2.236 3.080 0.080 30 0 "[ . 1 . 2 . 3 ]" 1
345 1 21 LEU H 1 21 LEU QD 3.850 . 6.000 3.425 1.892 3.699 . 0 0 "[ . 1 . 2 . 3 ]" 1
346 1 21 LEU HA 1 21 LEU HB2 2.850 . 4.000 2.614 2.290 2.801 . 0 0 "[ . 1 . 2 . 3 ]" 1
347 1 21 LEU HA 1 21 LEU HB3 2.850 . 4.000 2.829 2.564 3.011 . 0 0 "[ . 1 . 2 . 3 ]" 1
348 1 21 LEU HA 1 21 LEU MD1 3.600 . 5.500 3.516 1.827 3.774 . 0 0 "[ . 1 . 2 . 3 ]" 1
349 1 21 LEU HA 1 21 LEU MD2 3.100 . 4.500 2.884 1.942 4.131 . 0 0 "[ . 1 . 2 . 3 ]" 1
350 1 21 LEU HA 1 21 LEU HG 3.350 . 5.000 2.930 2.221 4.270 . 0 0 "[ . 1 . 2 . 3 ]" 1
351 1 21 LEU HA 1 22 GLY H 2.850 . 4.000 3.013 2.258 3.573 . 0 0 "[ . 1 . 2 . 3 ]" 1
352 1 21 LEU HB2 1 21 LEU MD1 3.100 . 4.500 2.312 2.018 3.178 . 0 0 "[ . 1 . 2 . 3 ]" 1
353 1 21 LEU HB2 1 21 LEU MD2 3.100 . 4.500 2.894 2.025 3.195 . 0 0 "[ . 1 . 2 . 3 ]" 1
354 1 21 LEU HB2 1 21 LEU HG 2.850 . 4.000 2.628 2.355 2.998 . 0 0 "[ . 1 . 2 . 3 ]" 1
355 1 21 LEU HB2 1 22 GLY H 2.850 . 4.000 3.183 2.394 4.025 0.025 19 0 "[ . 1 . 2 . 3 ]" 1
356 1 21 LEU HB2 1 27 ILE MD 3.350 . 5.000 4.190 2.198 5.000 0.000 9 0 "[ . 1 . 2 . 3 ]" 1
357 1 21 LEU HB2 1 27 ILE MG 3.600 . 5.500 3.855 2.565 5.050 . 0 0 "[ . 1 . 2 . 3 ]" 1
358 1 21 LEU HB3 1 21 LEU MD1 3.350 . 5.000 2.631 2.147 3.171 . 0 0 "[ . 1 . 2 . 3 ]" 1
359 1 21 LEU HB3 1 22 GLY H 2.850 . 4.000 2.730 1.944 4.029 0.029 9 0 "[ . 1 . 2 . 3 ]" 1
360 1 21 LEU HB3 1 27 ILE MD 3.600 . 5.500 3.528 2.301 5.405 . 0 0 "[ . 1 . 2 . 3 ]" 1
361 1 21 LEU HB3 1 27 ILE MG 3.600 . 5.500 3.201 2.148 5.485 . 0 0 "[ . 1 . 2 . 3 ]" 1
362 1 21 LEU MD1 1 22 GLY HA3 3.600 . 5.500 4.916 2.880 6.194 0.694 21 3 "[ *- . 1 . 2+ . 3 ]" 1
363 1 22 GLY H 1 22 GLY HA2 2.350 . 3.000 2.727 2.312 2.956 . 0 0 "[ . 1 . 2 . 3 ]" 1
364 1 22 GLY H 1 22 GLY HA3 2.350 . 3.000 2.755 2.295 2.957 . 0 0 "[ . 1 . 2 . 3 ]" 1
365 1 22 GLY H 1 23 GLY H 3.350 . 5.000 3.917 1.973 4.509 . 0 0 "[ . 1 . 2 . 3 ]" 1
366 1 23 GLY H 1 23 GLY HA3 2.850 . 4.000 2.828 2.538 2.955 . 0 0 "[ . 1 . 2 . 3 ]" 1
367 1 23 GLY H 1 24 GLY H 3.350 . 5.000 4.091 2.982 4.555 . 0 0 "[ . 1 . 2 . 3 ]" 1
368 1 24 GLY H 1 24 GLY HA2 2.850 . 4.000 2.732 2.375 2.946 . 0 0 "[ . 1 . 2 . 3 ]" 1
369 1 24 GLY H 1 24 GLY HA3 2.850 . 4.000 2.814 2.371 2.956 . 0 0 "[ . 1 . 2 . 3 ]" 1
370 1 25 GLY HA2 1 26 ARG H 2.850 . 4.000 3.423 3.090 3.569 . 0 0 "[ . 1 . 2 . 3 ]" 1
371 1 25 GLY HA3 1 26 ARG H 2.350 . 3.000 2.341 2.137 2.978 . 0 0 "[ . 1 . 2 . 3 ]" 1
372 1 26 ARG H 1 26 ARG HA 2.350 . 3.000 2.786 2.741 2.838 . 0 0 "[ . 1 . 2 . 3 ]" 1
373 1 26 ARG H 1 26 ARG QB 2.850 . 4.000 2.220 2.044 2.353 . 0 0 "[ . 1 . 2 . 3 ]" 1
374 1 26 ARG H 1 26 ARG HG2 2.850 . 4.000 3.742 3.551 4.011 0.011 2 0 "[ . 1 . 2 . 3 ]" 1
375 1 26 ARG H 1 27 ILE H 2.350 . 3.000 2.755 2.544 3.000 . 9 0 "[ . 1 . 2 . 3 ]" 1
376 1 26 ARG HA 1 26 ARG HD2 3.100 . 4.500 3.974 3.613 4.500 0.000 7 0 "[ . 1 . 2 . 3 ]" 1
377 1 26 ARG HA 1 26 ARG HD3 2.850 . 4.000 3.430 2.162 4.032 0.032 11 0 "[ . 1 . 2 . 3 ]" 1
378 1 26 ARG HA 1 26 ARG HG2 3.100 . 4.500 3.290 2.538 4.199 . 0 0 "[ . 1 . 2 . 3 ]" 1
379 1 26 ARG HA 1 27 ILE H 2.850 . 4.000 3.500 3.468 3.565 . 0 0 "[ . 1 . 2 . 3 ]" 1
380 1 26 ARG HA 1 29 GLU QB 3.100 . 4.500 3.551 3.260 3.927 . 0 0 "[ . 1 . 2 . 3 ]" 1
381 1 26 ARG QB 1 26 ARG HD2 2.850 . 4.000 2.694 2.264 3.442 . 0 0 "[ . 1 . 2 . 3 ]" 1
382 1 26 ARG QB 1 26 ARG HD3 3.100 . 4.500 2.854 2.395 3.126 . 0 0 "[ . 1 . 2 . 3 ]" 1
383 1 26 ARG QB 1 26 ARG HG2 2.600 . 3.500 2.329 2.143 2.389 . 0 0 "[ . 1 . 2 . 3 ]" 1
384 1 26 ARG HD2 1 26 ARG HG2 2.850 . 4.000 2.886 2.618 3.010 . 0 0 "[ . 1 . 2 . 3 ]" 1
385 1 26 ARG HD2 1 67 LEU MD2 3.600 . 5.500 3.300 1.924 4.309 . 0 0 "[ . 1 . 2 . 3 ]" 1
386 1 26 ARG HD3 1 26 ARG HG2 2.850 . 4.000 2.564 2.289 2.984 . 0 0 "[ . 1 . 2 . 3 ]" 1
387 1 26 ARG HD3 1 27 ILE HA 2.850 . 4.000 3.951 3.453 4.037 0.037 6 0 "[ . 1 . 2 . 3 ]" 1
388 1 26 ARG HG3 1 64 ILE HA 3.350 . 5.000 5.017 5.000 5.037 0.037 10 0 "[ . 1 . 2 . 3 ]" 1
389 1 26 ARG HG3 1 67 LEU HA 3.100 . 4.500 3.792 1.801 4.511 0.011 26 0 "[ . 1 . 2 . 3 ]" 1
390 1 26 ARG HG3 1 67 LEU HB2 2.850 . 4.000 3.760 3.059 4.036 0.036 6 0 "[ . 1 . 2 . 3 ]" 1
391 1 26 ARG HG3 1 67 LEU HB3 2.600 . 3.500 2.339 1.957 3.507 0.007 6 0 "[ . 1 . 2 . 3 ]" 1
392 1 26 ARG HG3 1 67 LEU MD1 3.100 . 4.500 3.787 2.333 4.528 0.028 22 0 "[ . 1 . 2 . 3 ]" 1
393 1 26 ARG HG3 1 67 LEU MD2 3.100 . 4.500 2.155 1.792 3.441 . 0 0 "[ . 1 . 2 . 3 ]" 1
394 1 27 ILE H 1 27 ILE HA 2.350 . 3.000 2.815 2.748 2.857 . 0 0 "[ . 1 . 2 . 3 ]" 1
395 1 27 ILE H 1 27 ILE HB 2.350 . 3.000 2.609 2.529 2.712 . 0 0 "[ . 1 . 2 . 3 ]" 1
396 1 27 ILE H 1 27 ILE MD 3.600 . 5.500 3.127 1.953 3.595 . 0 0 "[ . 1 . 2 . 3 ]" 1
397 1 27 ILE H 1 27 ILE HG12 2.850 . 4.000 3.473 3.087 3.738 . 0 0 "[ . 1 . 2 . 3 ]" 1
398 1 27 ILE H 1 27 ILE HG13 2.350 . 3.000 2.044 1.921 2.683 . 0 0 "[ . 1 . 2 . 3 ]" 1
399 1 27 ILE H 1 27 ILE MG 3.600 . 5.500 3.766 3.746 3.775 . 0 0 "[ . 1 . 2 . 3 ]" 1
400 1 27 ILE H 1 28 GLU H 2.350 . 3.000 2.615 2.461 2.826 . 0 0 "[ . 1 . 2 . 3 ]" 1
401 1 27 ILE HA 1 27 ILE MD 3.350 . 5.000 3.867 3.486 3.925 . 0 0 "[ . 1 . 2 . 3 ]" 1
402 1 27 ILE HA 1 27 ILE HG12 2.850 . 4.000 2.830 2.539 3.465 . 0 0 "[ . 1 . 2 . 3 ]" 1
403 1 27 ILE HA 1 27 ILE HG13 2.850 . 4.000 2.824 2.356 3.185 . 0 0 "[ . 1 . 2 . 3 ]" 1
404 1 27 ILE HA 1 27 ILE MG 3.100 . 4.500 2.319 2.207 2.388 . 0 0 "[ . 1 . 2 . 3 ]" 1
405 1 27 ILE HA 1 28 GLU H 2.850 . 4.000 3.490 3.484 3.497 . 0 0 "[ . 1 . 2 . 3 ]" 1
406 1 27 ILE HA 1 30 LEU H 2.850 . 4.000 3.559 3.326 3.914 . 0 0 "[ . 1 . 2 . 3 ]" 1
407 1 27 ILE HA 1 30 LEU HB2 3.100 . 4.500 2.572 2.318 2.849 . 0 0 "[ . 1 . 2 . 3 ]" 1
408 1 27 ILE HA 1 30 LEU HB3 3.100 . 4.500 4.129 3.794 4.489 . 0 0 "[ . 1 . 2 . 3 ]" 1
409 1 27 ILE HA 1 30 LEU MD1 3.350 . 5.000 2.322 1.816 2.931 . 0 0 "[ . 1 . 2 . 3 ]" 1
410 1 27 ILE HA 1 30 LEU MD2 3.600 . 5.500 4.638 4.214 5.104 . 0 0 "[ . 1 . 2 . 3 ]" 1
411 1 27 ILE HA 1 30 LEU HG 2.850 . 4.000 3.832 3.362 4.015 0.015 31 0 "[ . 1 . 2 . 3 ]" 1
412 1 27 ILE HB 1 27 ILE MD 3.350 . 5.000 2.228 2.012 2.520 . 0 0 "[ . 1 . 2 . 3 ]" 1
413 1 27 ILE HB 1 27 ILE HG12 2.850 . 4.000 2.977 2.710 3.027 . 0 0 "[ . 1 . 2 . 3 ]" 1
414 1 27 ILE HB 1 27 ILE HG13 2.850 . 4.000 2.630 2.437 2.959 . 0 0 "[ . 1 . 2 . 3 ]" 1
415 1 27 ILE MD 1 27 ILE MG 3.600 . 5.500 2.325 1.839 3.095 . 0 0 "[ . 1 . 2 . 3 ]" 1
416 1 27 ILE HG12 1 27 ILE MG 3.350 . 5.000 2.211 1.969 2.387 . 0 0 "[ . 1 . 2 . 3 ]" 1
417 1 27 ILE HG12 1 67 LEU MD2 3.600 . 5.500 3.417 1.933 5.102 . 0 0 "[ . 1 . 2 . 3 ]" 1
418 1 27 ILE HG13 1 27 ILE MG 3.350 . 5.000 3.126 2.775 3.197 . 0 0 "[ . 1 . 2 . 3 ]" 1
419 1 27 ILE MG 1 28 GLU H 3.600 . 5.500 3.766 3.718 3.828 . 0 0 "[ . 1 . 2 . 3 ]" 1
420 1 28 GLU H 1 28 GLU HA 2.350 . 3.000 2.807 2.768 2.838 . 0 0 "[ . 1 . 2 . 3 ]" 1
421 1 28 GLU H 1 29 GLU H 2.350 . 3.000 2.852 2.658 2.972 . 0 0 "[ . 1 . 2 . 3 ]" 1
422 1 28 GLU HA 1 29 GLU H 2.850 . 4.000 3.576 3.555 3.581 . 0 0 "[ . 1 . 2 . 3 ]" 1
423 1 28 GLU HA 1 31 LYS HB2 2.600 . 3.500 3.441 3.189 3.509 0.009 21 0 "[ . 1 . 2 . 3 ]" 1
424 1 28 GLU HA 1 31 LYS HB3 2.600 . 3.500 3.200 3.029 3.387 . 0 0 "[ . 1 . 2 . 3 ]" 1
425 1 28 GLU HA 1 31 LYS QD 2.850 . 4.000 4.007 3.988 4.017 0.017 10 0 "[ . 1 . 2 . 3 ]" 1
426 1 28 GLU QB 1 29 GLU H 2.350 . 3.000 2.338 2.217 2.653 . 0 0 "[ . 1 . 2 . 3 ]" 1
427 1 29 GLU H 1 29 GLU HA 2.350 . 3.000 2.798 2.779 2.844 . 0 0 "[ . 1 . 2 . 3 ]" 1
428 1 29 GLU H 1 30 LEU H 2.350 . 3.000 2.695 2.527 2.868 . 0 0 "[ . 1 . 2 . 3 ]" 1
429 1 29 GLU HA 1 29 GLU QG 3.100 . 4.500 2.653 2.431 3.089 . 0 0 "[ . 1 . 2 . 3 ]" 1
430 1 29 GLU HA 1 30 LEU H 2.850 . 4.000 3.496 3.464 3.552 . 0 0 "[ . 1 . 2 . 3 ]" 1
431 1 29 GLU HA 1 32 LYS QB 2.600 . 3.500 3.465 3.285 3.516 0.016 20 0 "[ . 1 . 2 . 3 ]" 1
432 1 29 GLU QG 1 59 LYS QD 3.100 . 4.500 4.520 4.509 4.531 0.031 20 0 "[ . 1 . 2 . 3 ]" 1
433 1 30 LEU H 1 30 LEU HA 2.350 . 3.000 2.837 2.746 2.877 . 0 0 "[ . 1 . 2 . 3 ]" 1
434 1 30 LEU H 1 30 LEU HB2 2.850 . 4.000 2.398 2.215 2.599 . 0 0 "[ . 1 . 2 . 3 ]" 1
435 1 30 LEU H 1 30 LEU MD1 3.600 . 5.500 3.377 2.848 3.649 . 0 0 "[ . 1 . 2 . 3 ]" 1
436 1 30 LEU H 1 30 LEU MD2 3.600 . 5.500 3.723 3.249 4.198 . 0 0 "[ . 1 . 2 . 3 ]" 1
437 1 30 LEU H 1 31 LYS H 2.350 . 3.000 2.560 2.412 2.823 . 0 0 "[ . 1 . 2 . 3 ]" 1
438 1 30 LEU HA 1 30 LEU HB2 2.850 . 4.000 3.010 2.990 3.016 . 0 0 "[ . 1 . 2 . 3 ]" 1
439 1 30 LEU HA 1 30 LEU HB3 2.850 . 4.000 2.515 2.416 2.626 . 0 0 "[ . 1 . 2 . 3 ]" 1
440 1 30 LEU HA 1 30 LEU MD2 3.100 . 4.500 2.238 1.849 2.874 . 0 0 "[ . 1 . 2 . 3 ]" 1
441 1 30 LEU HA 1 30 LEU HG 2.350 . 3.000 2.817 2.400 3.029 0.029 27 0 "[ . 1 . 2 . 3 ]" 1
442 1 30 LEU HA 1 31 LYS H 2.850 . 4.000 3.443 3.437 3.454 . 0 0 "[ . 1 . 2 . 3 ]" 1
443 1 30 LEU HA 1 33 LYS QB 2.850 . 4.000 3.344 3.048 3.717 . 0 0 "[ . 1 . 2 . 3 ]" 1
444 1 30 LEU HA 1 60 LEU MD1 3.100 . 4.500 1.968 1.868 2.247 . 0 0 "[ . 1 . 2 . 3 ]" 1
445 1 30 LEU HA 1 60 LEU MD2 3.350 . 5.000 3.448 2.973 3.802 . 0 0 "[ . 1 . 2 . 3 ]" 1
446 1 30 LEU HA 1 60 LEU HG 2.850 . 4.000 2.873 2.627 3.104 . 0 0 "[ . 1 . 2 . 3 ]" 1
447 1 30 LEU HB2 1 30 LEU MD2 3.350 . 5.000 3.148 3.035 3.193 . 0 0 "[ . 1 . 2 . 3 ]" 1
448 1 30 LEU HB2 1 30 LEU HG 2.600 . 3.500 2.584 2.477 2.761 . 0 0 "[ . 1 . 2 . 3 ]" 1
449 1 30 LEU HB2 1 31 LYS H 2.850 . 4.000 3.100 3.081 3.121 . 0 0 "[ . 1 . 2 . 3 ]" 1
450 1 30 LEU HB2 1 60 LEU MD2 3.350 . 5.000 4.098 3.600 4.653 . 0 0 "[ . 1 . 2 . 3 ]" 1
451 1 30 LEU HB3 1 30 LEU MD2 3.350 . 5.000 2.216 1.932 2.415 . 0 0 "[ . 1 . 2 . 3 ]" 1
452 1 30 LEU HB3 1 30 LEU HG 2.850 . 4.000 2.993 2.921 3.019 . 0 0 "[ . 1 . 2 . 3 ]" 1
453 1 30 LEU HB3 1 60 LEU MD2 3.100 . 4.500 2.607 2.280 3.109 . 0 0 "[ . 1 . 2 . 3 ]" 1
454 1 30 LEU MD1 1 60 LEU MD1 3.350 . 5.000 4.501 4.195 4.777 . 0 0 "[ . 1 . 2 . 3 ]" 1
455 1 30 LEU MD1 1 63 GLU HB2 2.850 . 4.000 3.824 3.299 4.015 0.015 5 0 "[ . 1 . 2 . 3 ]" 1
456 1 30 LEU MD1 1 63 GLU HB3 2.850 . 4.000 2.461 1.987 2.920 . 0 0 "[ . 1 . 2 . 3 ]" 1
457 1 30 LEU MD1 1 64 ILE HG12 3.350 . 5.000 2.083 1.826 2.710 . 0 0 "[ . 1 . 2 . 3 ]" 1
458 1 30 LEU MD1 1 64 ILE HG13 3.600 . 5.500 2.995 2.351 3.629 . 0 0 "[ . 1 . 2 . 3 ]" 1
459 1 30 LEU MD2 1 60 LEU HA 2.850 . 4.000 2.491 2.327 2.640 . 0 0 "[ . 1 . 2 . 3 ]" 1
460 1 30 LEU MD2 1 60 LEU MD1 3.600 . 5.500 2.618 2.227 3.031 . 0 0 "[ . 1 . 2 . 3 ]" 1
461 1 30 LEU MD2 1 60 LEU HG 3.600 . 5.500 1.799 1.740 1.851 . 0 0 "[ . 1 . 2 . 3 ]" 1
462 1 30 LEU MD2 1 63 GLU HB2 3.100 . 4.500 2.303 1.868 2.591 . 0 0 "[ . 1 . 2 . 3 ]" 1
463 1 30 LEU MD2 1 63 GLU HB3 3.100 . 4.500 1.831 1.790 1.895 . 0 0 "[ . 1 . 2 . 3 ]" 1
464 1 30 LEU MD2 1 64 ILE HA 3.600 . 5.500 3.637 2.722 4.426 . 0 0 "[ . 1 . 2 . 3 ]" 1
465 1 30 LEU MD2 1 64 ILE HG12 3.600 . 5.500 2.707 1.858 3.570 . 0 0 "[ . 1 . 2 . 3 ]" 1
466 1 30 LEU MD2 1 64 ILE HG13 3.600 . 5.500 2.509 1.854 3.207 . 0 0 "[ . 1 . 2 . 3 ]" 1
467 1 30 LEU HG 1 60 LEU MD2 3.350 . 5.000 4.701 4.242 5.010 0.010 30 0 "[ . 1 . 2 . 3 ]" 1
468 1 31 LYS H 1 31 LYS HA 2.350 . 3.000 2.866 2.855 2.873 . 0 0 "[ . 1 . 2 . 3 ]" 1
469 1 31 LYS H 1 31 LYS HB2 2.850 . 4.000 2.607 2.489 2.662 . 0 0 "[ . 1 . 2 . 3 ]" 1
470 1 31 LYS H 1 31 LYS HB3 2.850 . 4.000 2.476 2.422 2.586 . 0 0 "[ . 1 . 2 . 3 ]" 1
471 1 31 LYS H 1 31 LYS QG 3.350 . 5.000 3.973 3.955 4.002 . 0 0 "[ . 1 . 2 . 3 ]" 1
472 1 31 LYS H 1 32 LYS H 2.350 . 3.000 2.720 2.685 2.767 . 0 0 "[ . 1 . 2 . 3 ]" 1
473 1 31 LYS HA 1 31 LYS HB2 2.850 . 4.000 2.455 2.428 2.510 . 0 0 "[ . 1 . 2 . 3 ]" 1
474 1 31 LYS HA 1 31 LYS HB3 2.850 . 4.000 3.022 3.018 3.025 . 0 0 "[ . 1 . 2 . 3 ]" 1
475 1 31 LYS HA 1 31 LYS QG 2.850 . 4.000 2.389 2.347 2.440 . 0 0 "[ . 1 . 2 . 3 ]" 1
476 1 31 LYS HA 1 32 LYS H 2.850 . 4.000 3.574 3.570 3.580 . 0 0 "[ . 1 . 2 . 3 ]" 1
477 1 31 LYS HA 1 34 CYS H 3.100 . 4.500 3.476 3.341 3.664 . 0 0 "[ . 1 . 2 . 3 ]" 1
478 1 31 LYS HA 1 34 CYS HB2 2.600 . 3.500 2.398 2.331 2.460 . 0 0 "[ . 1 . 2 . 3 ]" 1
479 1 31 LYS HA 1 34 CYS HB3 2.600 . 3.500 3.523 3.503 3.539 0.039 1 0 "[ . 1 . 2 . 3 ]" 1
480 1 31 LYS HB2 1 31 LYS QD 3.350 . 5.000 2.107 1.972 2.241 . 0 0 "[ . 1 . 2 . 3 ]" 1
481 1 31 LYS HB2 1 32 LYS H 2.850 . 4.000 3.678 3.593 3.772 . 0 0 "[ . 1 . 2 . 3 ]" 1
482 1 31 LYS QE 1 31 LYS QG 2.850 . 4.000 2.091 1.930 2.309 . 0 0 "[ . 1 . 2 . 3 ]" 1
483 1 31 LYS QG 1 34 CYS HB2 2.850 . 4.000 3.990 3.942 4.012 0.012 31 0 "[ . 1 . 2 . 3 ]" 1
484 1 31 LYS QG 1 35 GLU HG3 3.350 . 5.000 4.851 4.622 5.007 0.007 13 0 "[ . 1 . 2 . 3 ]" 1
485 1 31 LYS HG3 1 32 LYS H 2.850 . 4.000 4.007 3.924 4.019 0.019 30 0 "[ . 1 . 2 . 3 ]" 1
486 1 32 LYS H 1 32 LYS HA 2.350 . 3.000 2.754 2.739 2.768 . 0 0 "[ . 1 . 2 . 3 ]" 1
487 1 32 LYS H 1 32 LYS QB 2.350 . 3.000 2.127 2.036 2.435 . 0 0 "[ . 1 . 2 . 3 ]" 1
488 1 32 LYS H 1 33 LYS H 2.350 . 3.000 2.897 2.775 3.031 0.031 12 0 "[ . 1 . 2 . 3 ]" 1
489 1 32 LYS HA 1 33 LYS H 2.850 . 4.000 3.541 3.502 3.565 . 0 0 "[ . 1 . 2 . 3 ]" 1
490 1 32 LYS HG2 1 33 LYS H 3.350 . 5.000 4.670 3.334 5.006 0.006 8 0 "[ . 1 . 2 . 3 ]" 1
491 1 33 LYS H 1 33 LYS HA 2.350 . 3.000 2.845 2.796 2.882 . 0 0 "[ . 1 . 2 . 3 ]" 1
492 1 33 LYS H 1 33 LYS QB 2.350 . 3.000 2.142 2.038 2.281 . 0 0 "[ . 1 . 2 . 3 ]" 1
493 1 33 LYS H 1 33 LYS QG 2.850 . 4.000 3.743 3.405 3.988 . 0 0 "[ . 1 . 2 . 3 ]" 1
494 1 33 LYS H 1 34 CYS H 2.350 . 3.000 2.543 2.404 2.695 . 0 0 "[ . 1 . 2 . 3 ]" 1
495 1 33 LYS HA 1 34 CYS H 2.850 . 4.000 3.463 3.457 3.467 . 0 0 "[ . 1 . 2 . 3 ]" 1
496 1 33 LYS HA 1 36 GLU HB3 2.850 . 4.000 3.033 2.654 4.004 0.004 13 0 "[ . 1 . 2 . 3 ]" 1
497 1 33 LYS QB 1 34 CYS H 2.600 . 3.500 2.977 2.929 3.029 . 0 0 "[ . 1 . 2 . 3 ]" 1
498 1 33 LYS QB 1 60 LEU MD1 3.350 . 5.000 1.834 1.783 1.925 . 0 0 "[ . 1 . 2 . 3 ]" 1
499 1 33 LYS QB 1 60 LEU MD2 3.350 . 5.000 4.121 3.896 4.292 . 0 0 "[ . 1 . 2 . 3 ]" 1
500 1 33 LYS QD 1 60 LEU MD1 3.600 . 5.500 3.056 1.842 3.706 . 0 0 "[ . 1 . 2 . 3 ]" 1
501 1 33 LYS QE 1 37 LEU MD2 3.600 . 5.500 3.259 2.571 4.378 . 0 0 "[ . 1 . 2 . 3 ]" 1
502 1 34 CYS H 1 34 CYS HA 2.350 . 3.000 2.805 2.793 2.819 . 0 0 "[ . 1 . 2 . 3 ]" 1
503 1 34 CYS H 1 34 CYS HB2 2.350 . 3.000 2.049 2.041 2.059 . 0 0 "[ . 1 . 2 . 3 ]" 1
504 1 34 CYS H 1 34 CYS HB3 2.600 . 3.500 3.195 3.128 3.251 . 0 0 "[ . 1 . 2 . 3 ]" 1
505 1 34 CYS H 1 35 GLU H 2.350 . 3.000 2.904 2.857 2.945 . 0 0 "[ . 1 . 2 . 3 ]" 1
506 1 34 CYS H 1 60 LEU MD1 3.350 . 5.000 2.638 2.479 2.849 . 0 0 "[ . 1 . 2 . 3 ]" 1
507 1 34 CYS HA 1 34 CYS HB2 2.600 . 3.500 2.808 2.777 2.832 . 0 0 "[ . 1 . 2 . 3 ]" 1
508 1 34 CYS HA 1 34 CYS HB3 2.850 . 4.000 2.892 2.870 2.920 . 0 0 "[ . 1 . 2 . 3 ]" 1
509 1 34 CYS HA 1 35 GLU H 2.850 . 4.000 3.577 3.563 3.587 . 0 0 "[ . 1 . 2 . 3 ]" 1
510 1 34 CYS HA 1 37 LEU HB2 2.850 . 4.000 3.982 3.489 4.017 0.017 20 0 "[ . 1 . 2 . 3 ]" 1
511 1 34 CYS HA 1 37 LEU HB3 2.600 . 3.500 3.183 3.106 3.521 0.021 16 0 "[ . 1 . 2 . 3 ]" 1
512 1 34 CYS HA 1 37 LEU HG 3.350 . 5.000 5.020 5.002 5.030 0.030 23 0 "[ . 1 . 2 . 3 ]" 1
513 1 34 CYS HA 1 60 LEU HB3 3.100 . 4.500 4.527 4.513 4.538 0.038 8 0 "[ . 1 . 2 . 3 ]" 1
514 1 34 CYS HA 1 60 LEU MD1 3.600 . 5.500 2.480 2.150 2.946 . 0 0 "[ . 1 . 2 . 3 ]" 1
515 1 34 CYS HA 1 60 LEU MD2 3.100 . 4.500 2.956 2.833 3.181 . 0 0 "[ . 1 . 2 . 3 ]" 1
516 1 34 CYS HB2 1 35 GLU H 2.350 . 3.000 3.028 2.996 3.061 0.061 26 0 "[ . 1 . 2 . 3 ]" 1
517 1 34 CYS HB2 1 60 LEU MD1 3.600 . 5.500 2.975 2.637 3.372 . 0 0 "[ . 1 . 2 . 3 ]" 1
518 1 34 CYS HB2 1 60 LEU MD2 3.100 . 4.500 3.318 2.941 3.616 . 0 0 "[ . 1 . 2 . 3 ]" 1
519 1 34 CYS HB2 1 64 ILE MD 3.600 . 5.500 5.371 5.172 5.505 0.005 31 0 "[ . 1 . 2 . 3 ]" 1
520 1 34 CYS HB3 1 35 GLU H 2.600 . 3.500 2.394 2.304 2.467 . 0 0 "[ . 1 . 2 . 3 ]" 1
521 1 34 CYS HB3 1 60 LEU MD2 3.350 . 5.000 4.099 3.937 4.226 . 0 0 "[ . 1 . 2 . 3 ]" 1
522 1 35 GLU H 1 35 GLU HA 2.350 . 3.000 2.820 2.808 2.830 . 0 0 "[ . 1 . 2 . 3 ]" 1
523 1 35 GLU H 1 35 GLU HB2 2.850 . 4.000 3.582 3.576 3.590 . 0 0 "[ . 1 . 2 . 3 ]" 1
524 1 35 GLU H 1 35 GLU HB3 2.350 . 3.000 2.754 2.690 2.802 . 0 0 "[ . 1 . 2 . 3 ]" 1
525 1 35 GLU H 1 36 GLU H 2.350 . 3.000 2.754 2.639 2.850 . 0 0 "[ . 1 . 2 . 3 ]" 1
526 1 35 GLU HA 1 35 GLU HB2 2.850 . 4.000 2.531 2.511 2.549 . 0 0 "[ . 1 . 2 . 3 ]" 1
527 1 35 GLU HA 1 35 GLU HB3 2.850 . 4.000 2.356 2.340 2.372 . 0 0 "[ . 1 . 2 . 3 ]" 1
528 1 35 GLU HA 1 35 GLU HG2 2.850 . 4.000 3.965 3.911 4.008 0.008 16 0 "[ . 1 . 2 . 3 ]" 1
529 1 35 GLU HA 1 35 GLU HG3 2.600 . 3.500 3.545 3.541 3.551 0.051 2 0 "[ . 1 . 2 . 3 ]" 1
530 1 35 GLU HA 1 36 GLU H 2.850 . 4.000 3.561 3.531 3.575 . 0 0 "[ . 1 . 2 . 3 ]" 1
531 1 35 GLU HA 1 38 LYS QB 3.100 . 4.500 2.877 2.559 3.142 . 0 0 "[ . 1 . 2 . 3 ]" 1
532 1 35 GLU HA 1 38 LYS QE 3.350 . 5.000 4.243 2.810 5.000 . 20 0 "[ . 1 . 2 . 3 ]" 1
533 1 35 GLU HB2 1 35 GLU HG2 2.850 . 4.000 2.872 2.847 2.900 . 0 0 "[ . 1 . 2 . 3 ]" 1
534 1 35 GLU HB2 1 35 GLU HG3 2.850 . 4.000 2.780 2.744 2.812 . 0 0 "[ . 1 . 2 . 3 ]" 1
535 1 35 GLU HB2 1 36 GLU H 2.850 . 4.000 3.383 3.221 3.608 . 0 0 "[ . 1 . 2 . 3 ]" 1
536 1 35 GLU HB3 1 35 GLU HG2 2.850 . 4.000 2.211 2.203 2.220 . 0 0 "[ . 1 . 2 . 3 ]" 1
537 1 35 GLU HB3 1 36 GLU H 2.850 . 4.000 3.933 3.863 4.017 0.017 16 0 "[ . 1 . 2 . 3 ]" 1
538 1 35 GLU HG3 1 36 GLU HA 2.850 . 4.000 4.027 4.011 4.041 0.041 4 0 "[ . 1 . 2 . 3 ]" 1
539 1 36 GLU H 1 36 GLU HA 2.350 . 3.000 2.756 2.726 2.807 . 0 0 "[ . 1 . 2 . 3 ]" 1
540 1 36 GLU H 1 36 GLU HB3 2.350 . 3.000 2.767 2.412 3.001 0.001 4 0 "[ . 1 . 2 . 3 ]" 1
541 1 36 GLU H 1 36 GLU QG 2.850 . 4.000 3.755 2.320 4.005 0.005 16 0 "[ . 1 . 2 . 3 ]" 1
542 1 36 GLU H 1 37 LEU H 2.350 . 3.000 2.732 2.622 2.807 . 0 0 "[ . 1 . 2 . 3 ]" 1
543 1 36 GLU HA 1 37 LEU H 2.850 . 4.000 3.459 3.450 3.467 . 0 0 "[ . 1 . 2 . 3 ]" 1
544 1 36 GLU HA 1 39 LYS QB 2.850 . 4.000 4.003 3.758 4.038 0.038 21 0 "[ . 1 . 2 . 3 ]" 1
545 1 36 GLU QG 1 37 LEU H 3.350 . 5.000 4.044 2.099 4.576 . 0 0 "[ . 1 . 2 . 3 ]" 1
546 1 37 LEU H 1 37 LEU HA 2.350 . 3.000 2.836 2.825 2.857 . 0 0 "[ . 1 . 2 . 3 ]" 1
547 1 37 LEU H 1 37 LEU HB2 2.850 . 4.000 2.720 2.327 2.785 . 0 0 "[ . 1 . 2 . 3 ]" 1
548 1 37 LEU H 1 37 LEU HB3 2.850 . 4.000 2.285 2.230 2.659 . 0 0 "[ . 1 . 2 . 3 ]" 1
549 1 37 LEU H 1 37 LEU HG 3.100 . 4.500 4.303 4.246 4.433 . 0 0 "[ . 1 . 2 . 3 ]" 1
550 1 37 LEU H 1 38 LYS H 2.350 . 3.000 2.605 2.499 2.750 . 0 0 "[ . 1 . 2 . 3 ]" 1
551 1 37 LEU HA 1 37 LEU HB2 2.350 . 3.000 2.365 2.332 2.553 . 0 0 "[ . 1 . 2 . 3 ]" 1
552 1 37 LEU HA 1 37 LEU HB3 2.350 . 3.000 3.003 2.993 3.008 0.008 16 0 "[ . 1 . 2 . 3 ]" 1
553 1 37 LEU HA 1 37 LEU MD2 2.850 . 4.000 3.759 1.840 3.868 . 0 0 "[ . 1 . 2 . 3 ]" 1
554 1 37 LEU HA 1 37 LEU HG 3.100 . 4.500 3.488 3.219 3.553 . 0 0 "[ . 1 . 2 . 3 ]" 1
555 1 37 LEU HA 1 38 LYS H 2.850 . 4.000 3.541 3.526 3.572 . 0 0 "[ . 1 . 2 . 3 ]" 1
556 1 37 LEU HA 1 40 LYS HB3 2.600 . 3.500 3.178 2.899 3.501 0.001 26 0 "[ . 1 . 2 . 3 ]" 1
557 1 37 LEU HB2 1 37 LEU MD2 3.350 . 5.000 2.288 2.108 2.992 . 0 0 "[ . 1 . 2 . 3 ]" 1
558 1 37 LEU HB2 1 38 LYS H 2.850 . 4.000 3.990 3.561 4.015 0.015 25 0 "[ . 1 . 2 . 3 ]" 1
559 1 37 LEU HB3 1 37 LEU MD1 2.850 . 4.000 3.143 1.937 3.191 . 0 0 "[ . 1 . 2 . 3 ]" 1
560 1 37 LEU HB3 1 37 LEU MD2 3.350 . 5.000 2.398 2.318 2.954 . 0 0 "[ . 1 . 2 . 3 ]" 1
561 1 37 LEU MD1 1 38 LYS H 3.600 . 5.500 4.029 3.481 4.133 . 0 0 "[ . 1 . 2 . 3 ]" 1
562 1 37 LEU MD1 1 40 LYS H 3.600 . 5.500 4.218 3.881 5.511 0.011 16 0 "[ . 1 . 2 . 3 ]" 1
563 1 37 LEU MD1 1 56 GLU H 3.350 . 5.000 4.222 4.050 5.023 0.023 16 0 "[ . 1 . 2 . 3 ]" 1
564 1 37 LEU MD1 1 56 GLU HB2 3.600 . 5.500 2.611 2.334 3.982 . 0 0 "[ . 1 . 2 . 3 ]" 1
565 1 37 LEU MD1 1 56 GLU HB3 3.600 . 5.500 2.610 2.186 3.643 . 0 0 "[ . 1 . 2 . 3 ]" 1
566 1 37 LEU MD1 1 57 VAL H 2.600 . 3.500 3.456 3.324 3.512 0.012 30 0 "[ . 1 . 2 . 3 ]" 1
567 1 37 LEU MD1 1 57 VAL HA 3.100 . 4.500 3.589 1.906 3.829 . 0 0 "[ . 1 . 2 . 3 ]" 1
568 1 37 LEU MD1 1 57 VAL MG2 3.100 . 4.500 1.842 1.710 1.919 . 0 0 "[ . 1 . 2 . 3 ]" 1
569 1 37 LEU MD2 1 38 LYS H 3.600 . 5.500 4.421 3.725 4.617 . 0 0 "[ . 1 . 2 . 3 ]" 1
570 1 37 LEU MD2 1 56 GLU HB2 3.350 . 5.000 3.462 2.456 3.772 . 0 0 "[ . 1 . 2 . 3 ]" 1
571 1 37 LEU MD2 1 56 GLU HB3 3.350 . 5.000 2.903 2.473 3.305 . 0 0 "[ . 1 . 2 . 3 ]" 1
572 1 37 LEU MD2 1 56 GLU HG2 3.600 . 5.500 5.089 4.579 5.493 . 0 0 "[ . 1 . 2 . 3 ]" 1
573 1 37 LEU MD2 1 56 GLU HG3 3.600 . 5.500 5.287 3.984 5.505 0.005 14 0 "[ . 1 . 2 . 3 ]" 1
574 1 37 LEU MD2 1 57 VAL HA 2.850 . 4.000 1.973 1.844 4.012 0.012 16 0 "[ . 1 . 2 . 3 ]" 1
575 1 38 LYS H 1 38 LYS HA 2.350 . 3.000 2.801 2.751 2.827 . 0 0 "[ . 1 . 2 . 3 ]" 1
576 1 38 LYS H 1 38 LYS QB 2.350 . 3.000 2.097 2.036 2.333 . 0 0 "[ . 1 . 2 . 3 ]" 1
577 1 38 LYS H 1 38 LYS HG3 2.850 . 4.000 3.454 2.611 4.001 0.001 19 0 "[ . 1 . 2 . 3 ]" 1
578 1 38 LYS H 1 39 LYS H 2.350 . 3.000 2.882 2.683 3.009 0.009 16 0 "[ . 1 . 2 . 3 ]" 1
579 1 38 LYS HA 1 38 LYS HD2 3.100 . 4.500 4.041 3.198 4.502 0.002 31 0 "[ . 1 . 2 . 3 ]" 1
580 1 38 LYS HA 1 38 LYS HG2 2.600 . 3.500 2.525 2.018 3.350 . 0 0 "[ . 1 . 2 . 3 ]" 1
581 1 38 LYS HA 1 38 LYS HG3 2.600 . 3.500 2.707 2.024 3.503 0.003 9 0 "[ . 1 . 2 . 3 ]" 1
582 1 38 LYS HA 1 39 LYS H 2.850 . 4.000 3.566 3.494 3.573 . 0 0 "[ . 1 . 2 . 3 ]" 1
583 1 38 LYS HA 1 41 ILE H 2.850 . 4.000 3.487 3.400 3.783 . 0 0 "[ . 1 . 2 . 3 ]" 1
584 1 38 LYS HA 1 41 ILE HB 2.850 . 4.000 3.697 3.553 3.946 . 0 0 "[ . 1 . 2 . 3 ]" 1
585 1 38 LYS HA 1 41 ILE MD 3.350 . 5.000 2.497 2.217 2.850 . 0 0 "[ . 1 . 2 . 3 ]" 1
586 1 38 LYS HA 1 41 ILE MG 3.350 . 5.000 4.651 4.520 4.843 . 0 0 "[ . 1 . 2 . 3 ]" 1
587 1 38 LYS QB 1 38 LYS HD2 3.350 . 5.000 2.401 1.962 3.281 . 0 0 "[ . 1 . 2 . 3 ]" 1
588 1 38 LYS QB 1 38 LYS HD3 3.350 . 5.000 2.703 1.940 3.271 . 0 0 "[ . 1 . 2 . 3 ]" 1
589 1 38 LYS QB 1 38 LYS QE 3.350 . 5.000 2.984 2.234 3.699 . 0 0 "[ . 1 . 2 . 3 ]" 1
590 1 38 LYS HD2 1 38 LYS QE 2.600 . 3.500 2.324 2.138 2.528 . 0 0 "[ . 1 . 2 . 3 ]" 1
591 1 38 LYS HD3 1 38 LYS QE 2.600 . 3.500 2.308 2.141 2.519 . 0 0 "[ . 1 . 2 . 3 ]" 1
592 1 38 LYS QE 1 38 LYS HG2 3.100 . 4.500 2.816 2.006 3.434 . 0 0 "[ . 1 . 2 . 3 ]" 1
593 1 39 LYS H 1 39 LYS HA 2.350 . 3.000 2.761 2.735 2.873 . 0 0 "[ . 1 . 2 . 3 ]" 1
594 1 39 LYS H 1 39 LYS QB 2.350 . 3.000 2.421 2.315 2.612 . 0 0 "[ . 1 . 2 . 3 ]" 1
595 1 39 LYS H 1 39 LYS QD 2.850 . 4.000 3.472 3.071 3.958 . 0 0 "[ . 1 . 2 . 3 ]" 1
596 1 39 LYS H 1 39 LYS HG2 2.850 . 4.000 2.265 1.958 2.580 . 0 0 "[ . 1 . 2 . 3 ]" 1
597 1 39 LYS H 1 40 LYS H 2.350 . 3.000 2.758 2.413 2.848 . 0 0 "[ . 1 . 2 . 3 ]" 1
598 1 39 LYS HA 1 40 LYS H 2.850 . 4.000 3.481 3.471 3.507 . 0 0 "[ . 1 . 2 . 3 ]" 1
599 1 39 LYS HA 1 42 GLU QB 2.850 . 4.000 3.013 2.592 3.802 . 0 0 "[ . 1 . 2 . 3 ]" 1
600 1 39 LYS HG2 1 41 ILE H 3.350 . 5.000 4.900 4.624 5.012 0.012 32 0 "[ . 1 . 2 . 3 ]" 1
601 1 39 LYS HG3 1 40 LYS H 2.850 . 4.000 2.916 2.518 3.507 . 0 0 "[ . 1 . 2 . 3 ]" 1
602 1 40 LYS H 1 40 LYS HA 2.350 . 3.000 2.841 2.815 2.859 . 0 0 "[ . 1 . 2 . 3 ]" 1
603 1 40 LYS H 1 40 LYS QB 2.850 . 4.000 2.219 2.133 2.261 . 0 0 "[ . 1 . 2 . 3 ]" 1
604 1 40 LYS H 1 40 LYS QD 3.350 . 5.000 4.249 3.818 4.560 . 0 0 "[ . 1 . 2 . 3 ]" 1
605 1 40 LYS H 1 40 LYS QG 3.350 . 5.000 3.967 3.803 4.059 . 0 0 "[ . 1 . 2 . 3 ]" 1
606 1 40 LYS H 1 41 ILE H 2.350 . 3.000 2.550 2.502 2.620 . 0 0 "[ . 1 . 2 . 3 ]" 1
607 1 40 LYS HA 1 40 LYS HG2 2.850 . 4.000 3.308 2.180 3.790 . 0 0 "[ . 1 . 2 . 3 ]" 1
608 1 40 LYS HA 1 40 LYS HG3 2.850 . 4.000 2.415 2.103 3.079 . 0 0 "[ . 1 . 2 . 3 ]" 1
609 1 40 LYS HA 1 41 ILE H 2.850 . 4.000 3.478 3.466 3.521 . 0 0 "[ . 1 . 2 . 3 ]" 1
610 1 40 LYS HA 1 43 GLU HB3 2.600 . 3.500 3.526 3.515 3.534 0.034 2 0 "[ . 1 . 2 . 3 ]" 1
611 1 40 LYS HB2 1 53 VAL MG1 3.600 . 5.500 3.904 3.480 4.365 . 0 0 "[ . 1 . 2 . 3 ]" 1
612 1 40 LYS HB2 1 53 VAL MG2 3.600 . 5.500 4.363 3.970 4.724 . 0 0 "[ . 1 . 2 . 3 ]" 1
613 1 40 LYS HB3 1 53 VAL MG1 3.600 . 5.500 2.523 2.115 3.007 . 0 0 "[ . 1 . 2 . 3 ]" 1
614 1 40 LYS HB3 1 53 VAL MG2 3.600 . 5.500 3.317 2.724 3.835 . 0 0 "[ . 1 . 2 . 3 ]" 1
615 1 40 LYS QG 1 41 ILE H 3.350 . 5.000 4.154 3.861 4.475 . 0 0 "[ . 1 . 2 . 3 ]" 1
616 1 40 LYS QG 1 43 GLU H 3.350 . 5.000 4.795 4.569 5.003 0.003 29 0 "[ . 1 . 2 . 3 ]" 1
617 1 41 ILE H 1 41 ILE HA 2.350 . 3.000 2.868 2.837 2.881 . 0 0 "[ . 1 . 2 . 3 ]" 1
618 1 41 ILE H 1 41 ILE HB 2.350 . 3.000 2.707 2.669 2.728 . 0 0 "[ . 1 . 2 . 3 ]" 1
619 1 41 ILE H 1 41 ILE MD 3.600 . 5.500 3.633 3.603 3.694 . 0 0 "[ . 1 . 2 . 3 ]" 1
620 1 41 ILE H 1 41 ILE HG12 2.350 . 3.000 3.008 3.003 3.014 0.014 30 0 "[ . 1 . 2 . 3 ]" 1
621 1 41 ILE H 1 41 ILE HG13 2.350 . 3.000 1.975 1.942 2.049 . 0 0 "[ . 1 . 2 . 3 ]" 1
622 1 41 ILE H 1 42 GLU H 2.350 . 3.000 2.470 2.413 2.786 . 0 0 "[ . 1 . 2 . 3 ]" 1
623 1 41 ILE HA 1 41 ILE HB 2.850 . 4.000 3.012 3.009 3.016 . 0 0 "[ . 1 . 2 . 3 ]" 1
624 1 41 ILE HA 1 41 ILE MD 3.350 . 5.000 3.837 3.782 3.864 . 0 0 "[ . 1 . 2 . 3 ]" 1
625 1 41 ILE HA 1 41 ILE HG12 2.850 . 4.000 2.624 2.557 2.657 . 0 0 "[ . 1 . 2 . 3 ]" 1
626 1 41 ILE HA 1 41 ILE HG13 2.850 . 4.000 3.308 3.266 3.328 . 0 0 "[ . 1 . 2 . 3 ]" 1
627 1 41 ILE HA 1 41 ILE MG 3.350 . 5.000 2.243 2.129 2.325 . 0 0 "[ . 1 . 2 . 3 ]" 1
628 1 41 ILE HA 1 42 GLU H 2.850 . 4.000 3.507 3.487 3.579 . 0 0 "[ . 1 . 2 . 3 ]" 1
629 1 41 ILE HA 1 43 GLU H 3.350 . 5.000 4.134 3.924 4.457 . 0 0 "[ . 1 . 2 . 3 ]" 1
630 1 41 ILE HA 1 44 LEU H 2.850 . 4.000 3.285 3.194 3.405 . 0 0 "[ . 1 . 2 . 3 ]" 1
631 1 41 ILE HA 1 44 LEU HB2 2.850 . 4.000 2.476 2.443 2.524 . 0 0 "[ . 1 . 2 . 3 ]" 1
632 1 41 ILE HA 1 44 LEU HB3 2.850 . 4.000 4.016 4.010 4.024 0.024 24 0 "[ . 1 . 2 . 3 ]" 1
633 1 41 ILE HA 1 44 LEU MD1 2.600 . 3.500 2.319 1.940 2.687 . 0 0 "[ . 1 . 2 . 3 ]" 1
634 1 41 ILE HA 1 44 LEU MD2 3.600 . 5.500 4.598 4.282 4.753 . 0 0 "[ . 1 . 2 . 3 ]" 1
635 1 41 ILE HA 1 44 LEU HG 2.600 . 3.500 3.447 2.884 3.509 0.009 20 0 "[ . 1 . 2 . 3 ]" 1
636 1 41 ILE HA 1 53 VAL MG1 3.600 . 5.500 3.192 2.989 3.567 . 0 0 "[ . 1 . 2 . 3 ]" 1
637 1 41 ILE HB 1 41 ILE MD 3.100 . 4.500 2.487 2.400 2.536 . 0 0 "[ . 1 . 2 . 3 ]" 1
638 1 41 ILE HB 1 41 ILE HG12 2.850 . 4.000 3.026 3.021 3.029 . 0 0 "[ . 1 . 2 . 3 ]" 1
639 1 41 ILE HB 1 41 ILE HG13 2.850 . 4.000 2.422 2.396 2.435 . 0 0 "[ . 1 . 2 . 3 ]" 1
640 1 41 ILE MD 1 41 ILE MG 3.350 . 5.000 1.850 1.698 1.992 0.002 26 0 "[ . 1 . 2 . 3 ]" 1
641 1 41 ILE MD 1 53 VAL HB 3.350 . 5.000 4.906 4.566 5.005 0.005 20 0 "[ . 1 . 2 . 3 ]" 1
642 1 41 ILE MD 1 53 VAL MG1 3.600 . 5.500 3.125 2.821 3.350 . 0 0 "[ . 1 . 2 . 3 ]" 1
643 1 41 ILE MD 1 53 VAL MG2 3.600 . 5.500 5.009 4.751 5.288 . 0 0 "[ . 1 . 2 . 3 ]" 1
644 1 41 ILE MD 1 57 VAL MG1 3.600 . 5.500 3.957 3.431 4.219 . 0 0 "[ . 1 . 2 . 3 ]" 1
645 1 41 ILE HG12 1 41 ILE MG 3.350 . 5.000 2.455 2.372 2.498 . 0 0 "[ . 1 . 2 . 3 ]" 1
646 1 41 ILE HG12 1 53 VAL MG1 3.350 . 5.000 2.138 1.937 2.450 . 0 0 "[ . 1 . 2 . 3 ]" 1
647 1 41 ILE HG13 1 41 ILE MG 3.100 . 4.500 3.197 3.187 3.203 . 0 0 "[ . 1 . 2 . 3 ]" 1
648 1 41 ILE HG13 1 53 VAL MG1 3.350 . 5.000 3.223 3.017 3.420 . 0 0 "[ . 1 . 2 . 3 ]" 1
649 1 41 ILE HG13 1 53 VAL MG2 3.600 . 5.500 4.973 4.728 5.278 . 0 0 "[ . 1 . 2 . 3 ]" 1
650 1 41 ILE MG 1 42 GLU H 3.100 . 4.500 3.822 3.353 3.940 . 0 0 "[ . 1 . 2 . 3 ]" 1
651 1 42 GLU H 1 42 GLU HA 2.350 . 3.000 2.833 2.801 2.844 . 0 0 "[ . 1 . 2 . 3 ]" 1
652 1 42 GLU H 1 42 GLU HG3 2.850 . 4.000 3.044 2.003 4.001 0.001 17 0 "[ . 1 . 2 . 3 ]" 1
653 1 42 GLU H 1 43 GLU H 2.350 . 3.000 2.552 2.504 2.668 . 0 0 "[ . 1 . 2 . 3 ]" 1
654 1 42 GLU H 1 44 LEU H 3.350 . 5.000 3.951 3.886 4.034 . 0 0 "[ . 1 . 2 . 3 ]" 1
655 1 42 GLU HA 1 43 GLU H 2.850 . 4.000 3.495 3.438 3.547 . 0 0 "[ . 1 . 2 . 3 ]" 1
656 1 42 GLU HA 1 44 LEU H 3.350 . 5.000 4.152 3.810 4.377 . 0 0 "[ . 1 . 2 . 3 ]" 1
657 1 43 GLU H 1 43 GLU HA 2.350 . 3.000 2.861 2.810 2.895 . 0 0 "[ . 1 . 2 . 3 ]" 1
658 1 43 GLU H 1 43 GLU HB3 3.350 . 5.000 2.525 2.213 3.493 . 0 0 "[ . 1 . 2 . 3 ]" 1
659 1 43 GLU H 1 43 GLU HG2 2.350 . 3.000 2.736 2.474 3.014 0.014 17 0 "[ . 1 . 2 . 3 ]" 1
660 1 43 GLU H 1 43 GLU HG3 3.350 . 5.000 3.099 2.686 4.054 . 0 0 "[ . 1 . 2 . 3 ]" 1
661 1 43 GLU H 1 44 LEU H 2.350 . 3.000 2.431 2.357 2.626 . 0 0 "[ . 1 . 2 . 3 ]" 1
662 1 43 GLU H 1 44 LEU MD1 3.600 . 5.500 5.286 4.841 5.506 0.006 17 0 "[ . 1 . 2 . 3 ]" 1
663 1 43 GLU HA 1 43 GLU HB2 2.850 . 4.000 2.406 2.294 2.987 . 0 0 "[ . 1 . 2 . 3 ]" 1
664 1 43 GLU HA 1 43 GLU HB3 2.600 . 3.500 2.548 2.515 2.650 . 0 0 "[ . 1 . 2 . 3 ]" 1
665 1 43 GLU HA 1 44 LEU H 2.850 . 4.000 3.466 3.385 3.509 . 0 0 "[ . 1 . 2 . 3 ]" 1
666 1 43 GLU HB2 1 44 LEU H 2.850 . 4.000 3.983 3.362 4.039 0.039 29 0 "[ . 1 . 2 . 3 ]" 1
667 1 43 GLU HG2 1 44 LEU H 3.350 . 5.000 3.251 1.968 4.889 . 0 0 "[ . 1 . 2 . 3 ]" 1
668 1 44 LEU H 1 44 LEU HA 2.350 . 3.000 2.793 2.753 2.868 . 0 0 "[ . 1 . 2 . 3 ]" 1
669 1 44 LEU H 1 44 LEU HB2 2.850 . 4.000 2.138 2.063 2.256 . 0 0 "[ . 1 . 2 . 3 ]" 1
670 1 44 LEU H 1 44 LEU HB3 2.850 . 4.000 3.442 3.290 3.521 . 0 0 "[ . 1 . 2 . 3 ]" 1
671 1 44 LEU H 1 44 LEU MD1 3.600 . 5.500 3.777 3.521 4.061 . 0 0 "[ . 1 . 2 . 3 ]" 1
672 1 44 LEU H 1 44 LEU MD2 3.600 . 5.500 3.933 3.645 4.084 . 0 0 "[ . 1 . 2 . 3 ]" 1
673 1 44 LEU HA 1 44 LEU HB2 2.850 . 4.000 2.947 2.879 2.994 . 0 0 "[ . 1 . 2 . 3 ]" 1
674 1 44 LEU HA 1 44 LEU HB3 2.850 . 4.000 2.715 2.611 2.818 . 0 0 "[ . 1 . 2 . 3 ]" 1
675 1 44 LEU HA 1 44 LEU MD1 3.600 . 5.500 3.786 3.759 3.822 . 0 0 "[ . 1 . 2 . 3 ]" 1
676 1 44 LEU HA 1 44 LEU MD2 3.100 . 4.500 2.059 1.934 2.254 . 0 0 "[ . 1 . 2 . 3 ]" 1
677 1 44 LEU HA 1 44 LEU HG 3.100 . 4.500 2.682 2.563 2.897 . 0 0 "[ . 1 . 2 . 3 ]" 1
678 1 44 LEU HA 1 45 GLY H 2.350 . 3.000 2.471 2.313 2.654 . 0 0 "[ . 1 . 2 . 3 ]" 1
679 1 44 LEU HB2 1 44 LEU MD1 3.350 . 5.000 2.338 2.192 2.445 . 0 0 "[ . 1 . 2 . 3 ]" 1
680 1 44 LEU HB2 1 44 LEU MD2 3.350 . 5.000 3.187 3.173 3.195 . 0 0 "[ . 1 . 2 . 3 ]" 1
681 1 44 LEU HB2 1 45 GLY H 2.850 . 4.000 3.827 3.539 4.005 0.005 24 0 "[ . 1 . 2 . 3 ]" 1
682 1 44 LEU HB3 1 44 LEU MD1 3.350 . 5.000 2.353 2.235 2.471 . 0 0 "[ . 1 . 2 . 3 ]" 1
683 1 44 LEU HB3 1 44 LEU MD2 3.350 . 5.000 2.311 2.192 2.392 . 0 0 "[ . 1 . 2 . 3 ]" 1
684 1 44 LEU HB3 1 44 LEU HG 2.850 . 4.000 3.016 3.006 3.019 . 0 0 "[ . 1 . 2 . 3 ]" 1
685 1 44 LEU HB3 1 45 GLY H 2.850 . 4.000 2.429 2.012 2.721 . 0 0 "[ . 1 . 2 . 3 ]" 1
686 1 44 LEU MD1 1 50 VAL HA 3.100 . 4.500 1.981 1.821 2.603 . 0 0 "[ . 1 . 2 . 3 ]" 1
687 1 44 LEU MD2 1 45 GLY HA2 3.600 . 5.500 4.791 4.414 5.200 . 0 0 "[ . 1 . 2 . 3 ]" 1
688 1 45 GLY H 1 45 GLY HA2 2.350 . 3.000 2.939 2.912 2.957 . 0 0 "[ . 1 . 2 . 3 ]" 1
689 1 45 GLY H 1 45 GLY HA3 2.350 . 3.000 2.559 2.394 2.660 . 0 0 "[ . 1 . 2 . 3 ]" 1
690 1 46 GLY HA2 1 47 GLY H 2.850 . 4.000 2.748 2.144 3.561 . 0 0 "[ . 1 . 2 . 3 ]" 1
691 1 46 GLY HA3 1 47 GLY H 2.850 . 4.000 2.972 2.147 3.571 . 0 0 "[ . 1 . 2 . 3 ]" 1
692 1 47 GLY HA3 1 48 GLY H 2.350 . 3.000 2.565 2.140 3.001 0.001 17 0 "[ . 1 . 2 . 3 ]" 1
693 1 48 GLY H 1 48 GLY HA2 2.350 . 3.000 2.576 2.297 2.957 . 0 0 "[ . 1 . 2 . 3 ]" 1
694 1 48 GLY HA2 1 49 GLU H 2.850 . 4.000 3.438 2.986 3.567 . 0 0 "[ . 1 . 2 . 3 ]" 1
695 1 48 GLY HA3 1 49 GLU H 2.850 . 4.000 2.682 2.165 3.482 . 0 0 "[ . 1 . 2 . 3 ]" 1
696 1 49 GLU H 1 49 GLU HA 2.350 . 3.000 2.864 2.784 2.922 . 0 0 "[ . 1 . 2 . 3 ]" 1
697 1 49 GLU H 1 49 GLU HB2 2.850 . 4.000 2.515 2.255 2.807 . 0 0 "[ . 1 . 2 . 3 ]" 1
698 1 49 GLU H 1 49 GLU HB3 2.850 . 4.000 2.653 2.482 2.983 . 0 0 "[ . 1 . 2 . 3 ]" 1
699 1 49 GLU H 1 49 GLU QG 2.850 . 4.000 3.975 3.872 4.021 0.021 15 0 "[ . 1 . 2 . 3 ]" 1
700 1 49 GLU H 1 50 VAL H 2.350 . 3.000 2.423 2.176 2.707 . 0 0 "[ . 1 . 2 . 3 ]" 1
701 1 49 GLU H 1 50 VAL MG2 3.600 . 5.500 4.336 3.344 5.511 0.011 6 0 "[ . 1 . 2 . 3 ]" 1
702 1 49 GLU HA 1 49 GLU HB2 2.850 . 4.000 2.533 2.448 2.721 . 0 0 "[ . 1 . 2 . 3 ]" 1
703 1 49 GLU HA 1 49 GLU HB3 2.600 . 3.500 3.012 2.950 3.024 . 0 0 "[ . 1 . 2 . 3 ]" 1
704 1 49 GLU HA 1 49 GLU QG 2.850 . 4.000 2.354 2.177 2.523 . 0 0 "[ . 1 . 2 . 3 ]" 1
705 1 49 GLU HA 1 50 VAL H 2.850 . 4.000 3.444 3.398 3.479 . 0 0 "[ . 1 . 2 . 3 ]" 1
706 1 49 GLU HA 1 51 LYS H 3.350 . 5.000 3.593 3.391 3.733 . 0 0 "[ . 1 . 2 . 3 ]" 1
707 1 49 GLU HA 1 52 LYS H 3.350 . 5.000 3.314 3.153 3.530 . 0 0 "[ . 1 . 2 . 3 ]" 1
708 1 49 GLU HA 1 52 LYS QB 3.100 . 4.500 3.330 3.025 4.509 0.009 10 0 "[ . 1 . 2 . 3 ]" 1
709 1 49 GLU QG 1 51 LYS H 3.350 . 5.000 4.776 4.570 5.003 0.003 5 0 "[ . 1 . 2 . 3 ]" 1
710 1 49 GLU QG 1 52 LYS H 2.850 . 4.000 3.795 3.508 4.030 0.030 10 0 "[ . 1 . 2 . 3 ]" 1
711 1 50 VAL H 1 50 VAL HA 2.350 . 3.000 2.771 2.740 2.835 . 0 0 "[ . 1 . 2 . 3 ]" 1
712 1 50 VAL H 1 50 VAL HB 2.350 . 3.000 2.600 2.411 2.734 . 0 0 "[ . 1 . 2 . 3 ]" 1
713 1 50 VAL H 1 50 VAL MG1 3.100 . 4.500 3.181 2.139 3.766 . 0 0 "[ . 1 . 2 . 3 ]" 1
714 1 50 VAL H 1 50 VAL MG2 3.100 . 4.500 2.644 1.929 3.753 . 0 0 "[ . 1 . 2 . 3 ]" 1
715 1 50 VAL H 1 51 LYS H 2.350 . 3.000 2.743 2.581 2.814 . 0 0 "[ . 1 . 2 . 3 ]" 1
716 1 50 VAL HA 1 50 VAL HB 2.850 . 4.000 2.812 2.462 3.020 . 0 0 "[ . 1 . 2 . 3 ]" 1
717 1 50 VAL HA 1 50 VAL MG1 3.350 . 5.000 2.626 2.208 3.207 . 0 0 "[ . 1 . 2 . 3 ]" 1
718 1 50 VAL HA 1 50 VAL MG2 3.350 . 5.000 2.358 2.211 2.479 . 0 0 "[ . 1 . 2 . 3 ]" 1
719 1 50 VAL HA 1 51 LYS H 2.850 . 4.000 3.464 3.400 3.490 . 0 0 "[ . 1 . 2 . 3 ]" 1
720 1 50 VAL HA 1 52 LYS H 3.350 . 5.000 4.108 3.832 4.735 . 0 0 "[ . 1 . 2 . 3 ]" 1
721 1 50 VAL HA 1 53 VAL HB 2.850 . 4.000 3.448 3.046 3.726 . 0 0 "[ . 1 . 2 . 3 ]" 1
722 1 50 VAL HA 1 53 VAL MG1 3.600 . 5.500 4.781 4.422 5.047 . 0 0 "[ . 1 . 2 . 3 ]" 1
723 1 50 VAL HB 1 51 LYS H 2.850 . 4.000 3.418 2.920 4.019 0.019 5 0 "[ . 1 . 2 . 3 ]" 1
724 1 50 VAL MG1 1 51 LYS H 3.100 . 4.500 3.260 2.069 3.999 . 0 0 "[ . 1 . 2 . 3 ]" 1
725 1 50 VAL MG1 1 51 LYS HA 3.600 . 5.500 3.630 3.120 3.994 . 0 0 "[ . 1 . 2 . 3 ]" 1
726 1 50 VAL MG2 1 51 LYS H 3.600 . 5.500 3.852 3.761 3.954 . 0 0 "[ . 1 . 2 . 3 ]" 1
727 1 51 LYS H 1 51 LYS HA 2.350 . 3.000 2.844 2.802 2.868 . 0 0 "[ . 1 . 2 . 3 ]" 1
728 1 51 LYS H 1 51 LYS QB 2.350 . 3.000 2.236 2.064 2.598 . 0 0 "[ . 1 . 2 . 3 ]" 1
729 1 51 LYS H 1 51 LYS QG 2.850 . 4.000 3.232 1.985 3.993 . 0 0 "[ . 1 . 2 . 3 ]" 1
730 1 51 LYS H 1 52 LYS H 2.350 . 3.000 2.543 2.440 2.718 . 0 0 "[ . 1 . 2 . 3 ]" 1
731 1 51 LYS HA 1 52 LYS H 2.850 . 4.000 3.499 3.470 3.589 . 0 0 "[ . 1 . 2 . 3 ]" 1
732 1 51 LYS QG 1 52 LYS H 3.350 . 5.000 4.055 2.076 4.612 . 0 0 "[ . 1 . 2 . 3 ]" 1
733 1 52 LYS H 1 52 LYS HA 2.350 . 3.000 2.834 2.774 2.880 . 0 0 "[ . 1 . 2 . 3 ]" 1
734 1 52 LYS H 1 52 LYS QB 2.350 . 3.000 2.258 2.214 2.887 . 0 0 "[ . 1 . 2 . 3 ]" 1
735 1 52 LYS H 1 52 LYS QG 3.350 . 5.000 3.823 1.905 3.990 . 0 0 "[ . 1 . 2 . 3 ]" 1
736 1 52 LYS H 1 53 VAL H 2.350 . 3.000 2.773 2.622 2.972 . 0 0 "[ . 1 . 2 . 3 ]" 1
737 1 52 LYS H 1 53 VAL MG2 3.600 . 5.500 4.054 3.888 4.213 . 0 0 "[ . 1 . 2 . 3 ]" 1
738 1 52 LYS HA 1 53 VAL H 2.850 . 4.000 3.570 3.562 3.573 . 0 0 "[ . 1 . 2 . 3 ]" 1
739 1 52 LYS HA 1 55 GLU HB2 2.850 . 4.000 3.990 3.820 4.005 0.005 17 0 "[ . 1 . 2 . 3 ]" 1
740 1 52 LYS HA 1 55 GLU HB3 2.600 . 3.500 3.504 3.497 3.510 0.010 32 0 "[ . 1 . 2 . 3 ]" 1
741 1 52 LYS QB 1 53 VAL H 2.350 . 3.000 2.328 2.297 3.025 0.025 10 0 "[ . 1 . 2 . 3 ]" 1
742 1 52 LYS QB 1 53 VAL HA 3.350 . 5.000 4.210 3.655 4.268 . 0 0 "[ . 1 . 2 . 3 ]" 1
743 1 52 LYS QB 1 53 VAL MG2 3.600 . 5.500 3.096 2.937 3.641 . 0 0 "[ . 1 . 2 . 3 ]" 1
744 1 52 LYS QG 1 53 VAL H 2.350 . 3.000 2.977 1.904 3.026 0.026 24 0 "[ . 1 . 2 . 3 ]" 1
745 1 53 VAL H 1 53 VAL HA 2.350 . 3.000 2.784 2.750 2.813 . 0 0 "[ . 1 . 2 . 3 ]" 1
746 1 53 VAL H 1 53 VAL MG1 3.600 . 5.500 3.757 3.748 3.768 . 0 0 "[ . 1 . 2 . 3 ]" 1
747 1 53 VAL H 1 53 VAL MG2 3.100 . 4.500 1.976 1.926 2.071 . 0 0 "[ . 1 . 2 . 3 ]" 1
748 1 53 VAL H 1 54 GLU H 2.350 . 3.000 2.713 2.638 2.797 . 0 0 "[ . 1 . 2 . 3 ]" 1
749 1 53 VAL HA 1 53 VAL HB 2.850 . 4.000 3.020 3.015 3.024 . 0 0 "[ . 1 . 2 . 3 ]" 1
750 1 53 VAL HA 1 53 VAL MG1 3.350 . 5.000 2.294 2.192 2.386 . 0 0 "[ . 1 . 2 . 3 ]" 1
751 1 53 VAL HA 1 53 VAL MG2 3.100 . 4.500 2.415 2.373 2.480 . 0 0 "[ . 1 . 2 . 3 ]" 1
752 1 53 VAL HA 1 54 GLU H 2.850 . 4.000 3.478 3.470 3.504 . 0 0 "[ . 1 . 2 . 3 ]" 1
753 1 53 VAL HA 1 56 GLU H 3.350 . 5.000 3.179 3.081 3.248 . 0 0 "[ . 1 . 2 . 3 ]" 1
754 1 53 VAL HA 1 56 GLU HB2 2.850 . 4.000 2.439 2.405 2.591 . 0 0 "[ . 1 . 2 . 3 ]" 1
755 1 53 VAL HA 1 56 GLU HB3 2.850 . 4.000 4.011 4.003 4.017 0.017 14 0 "[ . 1 . 2 . 3 ]" 1
756 1 53 VAL HA 1 56 GLU HG2 3.100 . 4.500 4.413 3.535 4.512 0.012 30 0 "[ . 1 . 2 . 3 ]" 1
757 1 53 VAL HA 1 56 GLU HG3 3.100 . 4.500 3.042 2.083 4.020 . 0 0 "[ . 1 . 2 . 3 ]" 1
758 1 53 VAL MG1 1 54 GLU H 3.600 . 5.500 3.848 3.775 3.910 . 0 0 "[ . 1 . 2 . 3 ]" 1
759 1 54 GLU H 1 54 GLU HA 2.350 . 3.000 2.820 2.797 2.832 . 0 0 "[ . 1 . 2 . 3 ]" 1
760 1 54 GLU H 1 54 GLU QB 2.850 . 4.000 2.174 2.042 2.479 . 0 0 "[ . 1 . 2 . 3 ]" 1
761 1 54 GLU H 1 55 GLU H 2.350 . 3.000 2.604 2.563 2.689 . 0 0 "[ . 1 . 2 . 3 ]" 1
762 1 54 GLU H 1 56 GLU H 2.850 . 4.000 3.935 3.897 3.996 . 0 0 "[ . 1 . 2 . 3 ]" 1
763 1 54 GLU HA 1 54 GLU HG3 2.850 . 4.000 2.894 2.191 3.594 . 0 0 "[ . 1 . 2 . 3 ]" 1
764 1 54 GLU HA 1 55 GLU H 2.850 . 4.000 3.509 3.486 3.529 . 0 0 "[ . 1 . 2 . 3 ]" 1
765 1 54 GLU HA 1 57 VAL H 2.850 . 4.000 3.599 3.518 3.733 . 0 0 "[ . 1 . 2 . 3 ]" 1
766 1 54 GLU HA 1 57 VAL HB 2.850 . 4.000 3.536 3.416 3.724 . 0 0 "[ . 1 . 2 . 3 ]" 1
767 1 54 GLU HA 1 57 VAL MG2 3.600 . 5.500 2.751 2.379 2.998 . 0 0 "[ . 1 . 2 . 3 ]" 1
768 1 54 GLU HA 1 58 LYS H 3.350 . 5.000 4.749 4.647 4.948 . 0 0 "[ . 1 . 2 . 3 ]" 1
769 1 54 GLU QB 1 55 GLU H 2.350 . 3.000 2.708 2.552 2.855 . 0 0 "[ . 1 . 2 . 3 ]" 1
770 1 55 GLU H 1 55 GLU HA 2.350 . 3.000 2.860 2.838 2.883 . 0 0 "[ . 1 . 2 . 3 ]" 1
771 1 55 GLU H 1 56 GLU H 2.350 . 3.000 2.456 2.370 2.529 . 0 0 "[ . 1 . 2 . 3 ]" 1
772 1 55 GLU HA 1 56 GLU H 2.850 . 4.000 3.472 3.468 3.476 . 0 0 "[ . 1 . 2 . 3 ]" 1
773 1 55 GLU HA 1 58 LYS QB 2.850 . 4.000 2.389 2.295 2.532 . 0 0 "[ . 1 . 2 . 3 ]" 1
774 1 55 GLU QB 1 56 GLU H 2.350 . 3.000 2.860 2.840 2.872 . 0 0 "[ . 1 . 2 . 3 ]" 1
775 1 56 GLU H 1 56 GLU HA 2.350 . 3.000 2.838 2.827 2.846 . 0 0 "[ . 1 . 2 . 3 ]" 1
776 1 56 GLU H 1 56 GLU HG3 2.350 . 3.000 2.895 2.466 3.006 0.006 16 0 "[ . 1 . 2 . 3 ]" 1
777 1 56 GLU H 1 57 VAL H 2.350 . 3.000 2.537 2.515 2.570 . 0 0 "[ . 1 . 2 . 3 ]" 1
778 1 56 GLU HA 1 57 VAL H 2.850 . 4.000 3.480 3.472 3.489 . 0 0 "[ . 1 . 2 . 3 ]" 1
779 1 56 GLU HA 1 59 LYS QB 2.850 . 4.000 3.228 3.118 3.307 . 0 0 "[ . 1 . 2 . 3 ]" 1
780 1 56 GLU HB3 1 56 GLU HG3 2.850 . 4.000 2.953 2.811 3.009 . 0 0 "[ . 1 . 2 . 3 ]" 1
781 1 57 VAL H 1 57 VAL HA 2.350 . 3.000 2.890 2.885 2.893 . 0 0 "[ . 1 . 2 . 3 ]" 1
782 1 57 VAL H 1 57 VAL HB 2.350 . 3.000 2.640 2.588 2.779 . 0 0 "[ . 1 . 2 . 3 ]" 1
783 1 57 VAL H 1 57 VAL MG2 3.100 . 4.500 2.187 2.057 2.258 . 0 0 "[ . 1 . 2 . 3 ]" 1
784 1 57 VAL H 1 58 LYS H 2.350 . 3.000 2.336 2.326 2.356 . 0 0 "[ . 1 . 2 . 3 ]" 1
785 1 57 VAL H 1 58 LYS QB 2.850 . 4.000 4.018 4.005 4.032 0.032 7 0 "[ . 1 . 2 . 3 ]" 1
786 1 57 VAL H 1 59 LYS H 2.850 . 4.000 3.998 3.958 4.011 0.011 30 0 "[ . 1 . 2 . 3 ]" 1
787 1 57 VAL HA 1 57 VAL HB 2.850 . 4.000 3.017 3.001 3.021 . 0 0 "[ . 1 . 2 . 3 ]" 1
788 1 57 VAL HA 1 57 VAL MG1 3.350 . 5.000 2.298 2.202 2.375 . 0 0 "[ . 1 . 2 . 3 ]" 1
789 1 57 VAL HA 1 57 VAL MG2 3.350 . 5.000 2.494 2.454 2.570 . 0 0 "[ . 1 . 2 . 3 ]" 1
790 1 57 VAL HA 1 58 LYS H 2.850 . 4.000 3.458 3.453 3.468 . 0 0 "[ . 1 . 2 . 3 ]" 1
791 1 57 VAL HA 1 60 LEU H 2.850 . 4.000 3.590 3.516 3.651 . 0 0 "[ . 1 . 2 . 3 ]" 1
792 1 57 VAL HA 1 60 LEU HB2 2.850 . 4.000 3.992 3.895 4.011 0.011 28 0 "[ . 1 . 2 . 3 ]" 1
793 1 57 VAL HA 1 60 LEU HB3 2.850 . 4.000 3.658 3.383 3.877 . 0 0 "[ . 1 . 2 . 3 ]" 1
794 1 57 VAL HA 1 61 GLU H 3.350 . 5.000 4.362 4.287 4.437 . 0 0 "[ . 1 . 2 . 3 ]" 1
795 1 57 VAL HB 1 58 LYS H 2.850 . 4.000 2.967 2.917 3.000 . 0 0 "[ . 1 . 2 . 3 ]" 1
796 1 57 VAL MG1 1 58 LYS HA 3.350 . 5.000 3.869 3.775 4.118 . 0 0 "[ . 1 . 2 . 3 ]" 1
797 1 57 VAL MG1 1 61 GLU HG2 3.600 . 5.500 5.011 4.786 5.412 . 0 0 "[ . 1 . 2 . 3 ]" 1
798 1 57 VAL MG1 1 61 GLU HG3 3.350 . 5.000 3.567 3.334 3.992 . 0 0 "[ . 1 . 2 . 3 ]" 1
799 1 57 VAL MG2 1 58 LYS H 3.100 . 4.500 3.804 3.666 3.842 . 0 0 "[ . 1 . 2 . 3 ]" 1
800 1 58 LYS H 1 58 LYS HA 2.350 . 3.000 2.856 2.848 2.859 . 0 0 "[ . 1 . 2 . 3 ]" 1
801 1 58 LYS H 1 58 LYS QB 2.350 . 3.000 2.065 2.057 2.076 . 0 0 "[ . 1 . 2 . 3 ]" 1
802 1 58 LYS H 1 59 LYS H 2.350 . 3.000 2.496 2.478 2.513 . 0 0 "[ . 1 . 2 . 3 ]" 1
803 1 58 LYS HA 1 59 LYS H 2.850 . 4.000 3.485 3.483 3.490 . 0 0 "[ . 1 . 2 . 3 ]" 1
804 1 58 LYS HA 1 61 GLU HB3 2.600 . 3.500 3.455 3.352 3.502 0.002 7 0 "[ . 1 . 2 . 3 ]" 1
805 1 58 LYS HA 1 61 GLU HG3 3.350 . 5.000 4.785 4.525 5.003 0.003 18 0 "[ . 1 . 2 . 3 ]" 1
806 1 58 LYS HA 1 62 GLU H 3.350 . 5.000 4.123 4.012 4.202 . 0 0 "[ . 1 . 2 . 3 ]" 1
807 1 58 LYS QB 1 62 GLU H 3.350 . 5.000 5.015 5.002 5.027 0.027 23 0 "[ . 1 . 2 . 3 ]" 1
808 1 58 LYS QG 1 59 LYS H 3.350 . 5.000 4.568 4.523 4.679 . 0 0 "[ . 1 . 2 . 3 ]" 1
809 1 59 LYS H 1 59 LYS HA 2.350 . 3.000 2.861 2.853 2.866 . 0 0 "[ . 1 . 2 . 3 ]" 1
810 1 59 LYS H 1 59 LYS QB 2.350 . 3.000 2.261 2.240 2.278 . 0 0 "[ . 1 . 2 . 3 ]" 1
811 1 59 LYS H 1 59 LYS QD 3.350 . 5.000 4.254 4.088 4.495 . 0 0 "[ . 1 . 2 . 3 ]" 1
812 1 59 LYS H 1 59 LYS QG 3.350 . 5.000 4.021 3.953 4.047 . 0 0 "[ . 1 . 2 . 3 ]" 1
813 1 59 LYS H 1 60 LEU H 2.350 . 3.000 2.565 2.527 2.600 . 0 0 "[ . 1 . 2 . 3 ]" 1
814 1 59 LYS HA 1 60 LEU H 2.850 . 4.000 3.547 3.535 3.560 . 0 0 "[ . 1 . 2 . 3 ]" 1
815 1 59 LYS HA 1 62 GLU H 3.350 . 5.000 3.948 3.819 4.001 . 0 0 "[ . 1 . 2 . 3 ]" 1
816 1 59 LYS HA 1 62 GLU HB2 2.850 . 4.000 3.969 3.735 4.011 0.011 10 0 "[ . 1 . 2 . 3 ]" 1
817 1 59 LYS HA 1 62 GLU HB3 2.850 . 4.000 4.015 4.007 4.021 0.021 27 0 "[ . 1 . 2 . 3 ]" 1
818 1 59 LYS QB 1 60 LEU H 2.350 . 3.000 2.628 2.516 2.704 . 0 0 "[ . 1 . 2 . 3 ]" 1
819 1 60 LEU H 1 60 LEU HA 2.350 . 3.000 2.867 2.853 2.874 . 0 0 "[ . 1 . 2 . 3 ]" 1
820 1 60 LEU H 1 60 LEU HB2 2.350 . 3.000 2.377 2.288 2.520 . 0 0 "[ . 1 . 2 . 3 ]" 1
821 1 60 LEU H 1 60 LEU MD1 3.600 . 5.500 4.046 3.903 4.196 . 0 0 "[ . 1 . 2 . 3 ]" 1
822 1 60 LEU H 1 60 LEU HG 3.350 . 5.000 4.384 4.343 4.442 . 0 0 "[ . 1 . 2 . 3 ]" 1
823 1 60 LEU H 1 61 GLU H 2.350 . 3.000 2.486 2.457 2.537 . 0 0 "[ . 1 . 2 . 3 ]" 1
824 1 60 LEU H 1 62 GLU H 3.350 . 5.000 4.470 4.219 4.598 . 0 0 "[ . 1 . 2 . 3 ]" 1
825 1 60 LEU HA 1 60 LEU HB2 2.850 . 4.000 2.588 2.509 2.647 . 0 0 "[ . 1 . 2 . 3 ]" 1
826 1 60 LEU HA 1 60 LEU HB3 2.850 . 4.000 2.994 2.972 3.018 . 0 0 "[ . 1 . 2 . 3 ]" 1
827 1 60 LEU HA 1 60 LEU MD1 3.350 . 5.000 3.264 3.117 3.375 . 0 0 "[ . 1 . 2 . 3 ]" 1
828 1 60 LEU HA 1 60 LEU MD2 3.350 . 5.000 3.409 3.299 3.457 . 0 0 "[ . 1 . 2 . 3 ]" 1
829 1 60 LEU HA 1 61 GLU H 2.850 . 4.000 3.464 3.457 3.483 . 0 0 "[ . 1 . 2 . 3 ]" 1
830 1 60 LEU HA 1 63 GLU H 2.850 . 4.000 3.420 3.316 3.490 . 0 0 "[ . 1 . 2 . 3 ]" 1
831 1 60 LEU HA 1 63 GLU HB2 3.350 . 5.000 2.228 2.126 2.339 . 0 0 "[ . 1 . 2 . 3 ]" 1
832 1 60 LEU HA 1 63 GLU HB3 2.600 . 3.500 3.442 3.229 3.529 0.029 5 0 "[ . 1 . 2 . 3 ]" 1
833 1 60 LEU HA 1 63 GLU HG3 2.600 . 3.500 3.247 2.347 3.515 0.015 20 0 "[ . 1 . 2 . 3 ]" 1
834 1 60 LEU HB2 1 60 LEU MD1 3.350 . 5.000 2.009 1.921 2.138 . 0 0 "[ . 1 . 2 . 3 ]" 1
835 1 60 LEU HB2 1 60 LEU HG 2.850 . 4.000 2.778 2.739 2.828 . 0 0 "[ . 1 . 2 . 3 ]" 1
836 1 60 LEU HB2 1 61 GLU H 3.350 . 5.000 3.895 3.786 4.000 . 0 0 "[ . 1 . 2 . 3 ]" 1
837 1 60 LEU HB3 1 60 LEU MD1 3.350 . 5.000 2.826 2.754 2.904 . 0 0 "[ . 1 . 2 . 3 ]" 1
838 1 60 LEU HB3 1 60 LEU MD2 3.350 . 5.000 2.121 2.027 2.165 . 0 0 "[ . 1 . 2 . 3 ]" 1
839 1 60 LEU HB3 1 60 LEU HG 2.850 . 4.000 2.905 2.869 2.933 . 0 0 "[ . 1 . 2 . 3 ]" 1
840 1 60 LEU HB3 1 61 GLU H 2.350 . 3.000 3.015 2.932 3.033 0.033 19 0 "[ . 1 . 2 . 3 ]" 1
841 1 60 LEU MD1 1 63 GLU HB2 3.350 . 5.000 4.757 4.562 5.000 0.000 29 0 "[ . 1 . 2 . 3 ]" 1
842 1 60 LEU MD1 1 63 GLU HB3 3.350 . 5.000 5.026 5.009 5.045 0.045 11 0 "[ . 1 . 2 . 3 ]" 1
843 1 60 LEU MD1 1 64 ILE MD 3.600 . 5.500 4.368 4.230 4.483 . 0 0 "[ . 1 . 2 . 3 ]" 1
844 1 60 LEU MD1 1 64 ILE HG13 3.350 . 5.000 5.016 4.986 5.036 0.036 22 0 "[ . 1 . 2 . 3 ]" 1
845 1 60 LEU MD2 1 64 ILE HA 3.600 . 5.500 5.497 5.318 5.522 0.022 11 0 "[ . 1 . 2 . 3 ]" 1
846 1 60 LEU MD2 1 64 ILE MD 3.600 . 5.500 2.279 2.124 2.410 . 0 0 "[ . 1 . 2 . 3 ]" 1
847 1 60 LEU MD2 1 64 ILE HG12 3.350 . 5.000 3.541 3.403 3.618 . 0 0 "[ . 1 . 2 . 3 ]" 1
848 1 60 LEU HG 1 61 GLU H 3.350 . 5.000 4.785 4.646 4.848 . 0 0 "[ . 1 . 2 . 3 ]" 1
849 1 60 LEU HG 1 64 ILE MD 3.350 . 5.000 3.945 3.866 4.082 . 0 0 "[ . 1 . 2 . 3 ]" 1
850 1 61 GLU H 1 61 GLU HA 2.350 . 3.000 2.839 2.825 2.846 . 0 0 "[ . 1 . 2 . 3 ]" 1
851 1 61 GLU H 1 61 GLU HB2 2.850 . 4.000 2.131 2.101 2.155 . 0 0 "[ . 1 . 2 . 3 ]" 1
852 1 61 GLU H 1 61 GLU HB3 2.350 . 3.000 3.017 3.002 3.027 0.027 17 0 "[ . 1 . 2 . 3 ]" 1
853 1 61 GLU H 1 61 GLU HG3 2.850 . 4.000 4.016 4.008 4.027 0.027 26 0 "[ . 1 . 2 . 3 ]" 1
854 1 61 GLU H 1 62 GLU H 2.350 . 3.000 2.669 2.537 2.756 . 0 0 "[ . 1 . 2 . 3 ]" 1
855 1 61 GLU HA 1 61 GLU HB3 2.850 . 4.000 2.939 2.932 2.952 . 0 0 "[ . 1 . 2 . 3 ]" 1
856 1 61 GLU HA 1 61 GLU HG3 2.850 . 4.000 2.862 2.580 3.076 . 0 0 "[ . 1 . 2 . 3 ]" 1
857 1 61 GLU HA 1 62 GLU H 2.850 . 4.000 3.553 3.522 3.562 . 0 0 "[ . 1 . 2 . 3 ]" 1
858 1 61 GLU HA 1 63 GLU H 3.350 . 5.000 4.140 4.061 4.226 . 0 0 "[ . 1 . 2 . 3 ]" 1
859 1 61 GLU HA 1 64 ILE H 3.350 . 5.000 3.921 3.680 4.108 . 0 0 "[ . 1 . 2 . 3 ]" 1
860 1 61 GLU HA 1 64 ILE HB 2.850 . 4.000 3.974 3.813 4.012 0.012 12 0 "[ . 1 . 2 . 3 ]" 1
861 1 61 GLU HA 1 64 ILE MD 3.350 . 5.000 3.301 2.993 3.577 . 0 0 "[ . 1 . 2 . 3 ]" 1
862 1 61 GLU HB3 1 62 GLU H 2.850 . 4.000 2.415 2.314 2.749 . 0 0 "[ . 1 . 2 . 3 ]" 1
863 1 62 GLU H 1 62 GLU HA 2.350 . 3.000 2.818 2.794 2.863 . 0 0 "[ . 1 . 2 . 3 ]" 1
864 1 62 GLU H 1 62 GLU HB3 2.350 . 3.000 2.974 2.955 3.002 0.002 25 0 "[ . 1 . 2 . 3 ]" 1
865 1 62 GLU H 1 62 GLU HG3 2.850 . 4.000 4.013 4.003 4.024 0.024 26 0 "[ . 1 . 2 . 3 ]" 1
866 1 62 GLU H 1 63 GLU H 2.350 . 3.000 2.583 2.448 2.653 . 0 0 "[ . 1 . 2 . 3 ]" 1
867 1 62 GLU HA 1 62 GLU HB2 2.350 . 3.000 2.704 2.686 2.736 . 0 0 "[ . 1 . 2 . 3 ]" 1
868 1 62 GLU HA 1 63 GLU H 2.850 . 4.000 3.468 3.458 3.473 . 0 0 "[ . 1 . 2 . 3 ]" 1
869 1 62 GLU HA 1 65 LYS QB 2.850 . 4.000 2.459 2.068 3.208 . 0 0 "[ . 1 . 2 . 3 ]" 1
870 1 62 GLU HA 1 65 LYS QD 2.850 . 4.000 2.772 1.945 3.874 . 0 0 "[ . 1 . 2 . 3 ]" 1
871 1 62 GLU HB2 1 63 GLU H 2.850 . 4.000 3.670 3.614 3.701 . 0 0 "[ . 1 . 2 . 3 ]" 1
872 1 63 GLU H 1 63 GLU HA 2.350 . 3.000 2.803 2.789 2.814 . 0 0 "[ . 1 . 2 . 3 ]" 1
873 1 63 GLU H 1 63 GLU QB 2.850 . 4.000 2.061 2.023 2.187 . 0 0 "[ . 1 . 2 . 3 ]" 1
874 1 63 GLU H 1 64 ILE H 2.350 . 3.000 2.825 2.723 2.880 . 0 0 "[ . 1 . 2 . 3 ]" 1
875 1 63 GLU HA 1 64 ILE H 2.850 . 4.000 3.561 3.546 3.566 . 0 0 "[ . 1 . 2 . 3 ]" 1
876 1 63 GLU HA 1 65 LYS H 2.850 . 4.000 4.000 3.937 4.028 0.028 31 0 "[ . 1 . 2 . 3 ]" 1
877 1 63 GLU HA 1 66 LYS H 3.350 . 5.000 3.709 3.474 3.984 . 0 0 "[ . 1 . 2 . 3 ]" 1
878 1 64 ILE H 1 64 ILE HA 2.350 . 3.000 2.784 2.743 2.836 . 0 0 "[ . 1 . 2 . 3 ]" 1
879 1 64 ILE H 1 64 ILE HB 2.350 . 3.000 2.678 2.645 2.717 . 0 0 "[ . 1 . 2 . 3 ]" 1
880 1 64 ILE H 1 64 ILE HG12 2.350 . 3.000 3.016 3.005 3.029 0.029 32 0 "[ . 1 . 2 . 3 ]" 1
881 1 64 ILE H 1 64 ILE HG13 2.350 . 3.000 1.905 1.839 1.962 . 0 0 "[ . 1 . 2 . 3 ]" 1
882 1 64 ILE H 1 65 LYS H 2.350 . 3.000 2.690 2.529 2.823 . 0 0 "[ . 1 . 2 . 3 ]" 1
883 1 64 ILE H 1 66 LYS H 3.350 . 5.000 4.371 4.241 4.596 . 0 0 "[ . 1 . 2 . 3 ]" 1
884 1 64 ILE HA 1 64 ILE HB 2.850 . 4.000 3.020 3.015 3.024 . 0 0 "[ . 1 . 2 . 3 ]" 1
885 1 64 ILE HA 1 64 ILE MD 3.350 . 5.000 3.833 3.796 3.862 . 0 0 "[ . 1 . 2 . 3 ]" 1
886 1 64 ILE HA 1 64 ILE HG12 2.850 . 4.000 2.575 2.516 2.641 . 0 0 "[ . 1 . 2 . 3 ]" 1
887 1 64 ILE HA 1 64 ILE HG13 2.850 . 4.000 3.196 3.151 3.260 . 0 0 "[ . 1 . 2 . 3 ]" 1
888 1 64 ILE HA 1 64 ILE MG 3.350 . 5.000 2.318 2.214 2.388 . 0 0 "[ . 1 . 2 . 3 ]" 1
889 1 64 ILE HA 1 65 LYS H 2.850 . 4.000 3.470 3.447 3.489 . 0 0 "[ . 1 . 2 . 3 ]" 1
890 1 64 ILE HA 1 66 LYS H 2.850 . 4.000 3.958 3.769 4.008 0.008 31 0 "[ . 1 . 2 . 3 ]" 1
891 1 64 ILE HA 1 67 LEU H 2.850 . 4.000 3.563 3.226 4.007 0.007 8 0 "[ . 1 . 2 . 3 ]" 1
892 1 64 ILE HA 1 67 LEU HB2 3.350 . 5.000 4.675 3.515 5.016 0.016 28 0 "[ . 1 . 2 . 3 ]" 1
893 1 64 ILE HA 1 67 LEU HB3 3.350 . 5.000 4.625 3.980 5.015 0.015 6 0 "[ . 1 . 2 . 3 ]" 1
894 1 64 ILE HA 1 67 LEU MD1 3.350 . 5.000 2.557 1.813 3.558 . 0 0 "[ . 1 . 2 . 3 ]" 1
895 1 64 ILE HA 1 67 LEU MD2 3.600 . 5.500 2.223 1.788 4.465 . 0 0 "[ . 1 . 2 . 3 ]" 1
896 1 64 ILE HA 1 67 LEU HG 2.850 . 4.000 2.350 1.894 4.001 0.001 6 0 "[ . 1 . 2 . 3 ]" 1
897 1 64 ILE HB 1 64 ILE MD 3.350 . 5.000 2.504 2.409 2.545 . 0 0 "[ . 1 . 2 . 3 ]" 1
898 1 64 ILE HB 1 64 ILE HG12 2.850 . 4.000 3.027 3.023 3.029 . 0 0 "[ . 1 . 2 . 3 ]" 1
899 1 64 ILE HB 1 64 ILE HG13 2.850 . 4.000 2.444 2.420 2.470 . 0 0 "[ . 1 . 2 . 3 ]" 1
900 1 64 ILE HB 1 65 LYS H 2.350 . 3.000 2.977 2.912 3.023 0.023 31 0 "[ . 1 . 2 . 3 ]" 1
901 1 64 ILE HG12 1 64 ILE MG 3.350 . 5.000 2.403 2.318 2.464 . 0 0 "[ . 1 . 2 . 3 ]" 1
902 1 64 ILE HG12 1 67 LEU MD1 3.600 . 5.500 3.428 2.714 4.224 . 0 0 "[ . 1 . 2 . 3 ]" 1
903 1 64 ILE HG13 1 64 ILE MG 3.350 . 5.000 3.198 3.189 3.204 . 0 0 "[ . 1 . 2 . 3 ]" 1
904 1 64 ILE HG13 1 67 LEU MD1 3.600 . 5.500 4.655 4.003 5.503 0.003 11 0 "[ . 1 . 2 . 3 ]" 1
905 1 64 ILE MG 1 65 LYS H 3.100 . 4.500 3.855 3.776 3.935 . 0 0 "[ . 1 . 2 . 3 ]" 1
906 1 64 ILE MG 1 65 LYS HA 3.350 . 5.000 3.875 3.719 4.024 . 0 0 "[ . 1 . 2 . 3 ]" 1
907 1 64 ILE MG 1 65 LYS QB 3.600 . 5.500 4.983 4.872 5.200 . 0 0 "[ . 1 . 2 . 3 ]" 1
908 1 64 ILE MG 1 65 LYS QE 3.600 . 5.500 4.679 3.702 5.402 . 0 0 "[ . 1 . 2 . 3 ]" 1
909 1 64 ILE MG 1 67 LEU HB3 3.600 . 5.500 5.080 4.650 5.446 . 0 0 "[ . 1 . 2 . 3 ]" 1
910 1 65 LYS H 1 65 LYS HA 2.350 . 3.000 2.804 2.763 2.832 . 0 0 "[ . 1 . 2 . 3 ]" 1
911 1 65 LYS H 1 65 LYS QB 2.350 . 3.000 2.091 2.032 2.556 . 0 0 "[ . 1 . 2 . 3 ]" 1
912 1 65 LYS H 1 65 LYS QD 2.350 . 3.000 2.807 2.422 3.009 0.009 11 0 "[ . 1 . 2 . 3 ]" 1
913 1 65 LYS H 1 65 LYS QG 2.850 . 4.000 3.626 2.020 3.925 . 0 0 "[ . 1 . 2 . 3 ]" 1
914 1 65 LYS H 1 66 LYS H 2.350 . 3.000 2.660 2.565 2.816 . 0 0 "[ . 1 . 2 . 3 ]" 1
915 1 65 LYS HA 1 66 LYS H 2.850 . 4.000 3.501 3.473 3.530 . 0 0 "[ . 1 . 2 . 3 ]" 1
916 1 65 LYS QB 1 66 LYS H 3.350 . 5.000 2.852 2.619 2.968 . 0 0 "[ . 1 . 2 . 3 ]" 1
917 1 66 LYS H 1 66 LYS HA 2.350 . 3.000 2.848 2.806 2.941 . 0 0 "[ . 1 . 2 . 3 ]" 1
918 1 66 LYS H 1 66 LYS HB2 2.350 . 3.000 2.359 2.096 2.618 . 0 0 "[ . 1 . 2 . 3 ]" 1
919 1 66 LYS H 1 66 LYS HB3 2.850 . 4.000 3.548 3.335 3.703 . 0 0 "[ . 1 . 2 . 3 ]" 1
920 1 66 LYS H 1 66 LYS HG2 2.850 . 4.000 3.133 2.015 3.956 . 0 0 "[ . 1 . 2 . 3 ]" 1
921 1 66 LYS H 1 66 LYS HG3 2.850 . 4.000 3.094 2.036 3.993 . 0 0 "[ . 1 . 2 . 3 ]" 1
922 1 66 LYS H 1 67 LEU H 2.350 . 3.000 2.723 2.469 2.938 . 0 0 "[ . 1 . 2 . 3 ]" 1
923 1 66 LYS HA 1 66 LYS HG2 2.850 . 4.000 2.434 2.041 3.158 . 0 0 "[ . 1 . 2 . 3 ]" 1
924 1 66 LYS HA 1 66 LYS HG3 2.850 . 4.000 3.432 2.804 3.821 . 0 0 "[ . 1 . 2 . 3 ]" 1
925 1 66 LYS HA 1 67 LEU H 2.850 . 4.000 3.561 3.493 3.573 . 0 0 "[ . 1 . 2 . 3 ]" 1
926 1 66 LYS HB2 1 67 LEU H 2.350 . 3.000 2.407 1.993 3.001 0.001 29 0 "[ . 1 . 2 . 3 ]" 1
927 1 66 LYS HB3 1 67 LEU H 2.850 . 4.000 3.136 2.644 3.746 . 0 0 "[ . 1 . 2 . 3 ]" 1
928 1 67 LEU H 1 67 LEU HA 2.350 . 3.000 2.740 2.267 2.925 . 0 0 "[ . 1 . 2 . 3 ]" 1
929 1 67 LEU H 1 67 LEU HB2 2.600 . 3.500 3.504 3.087 3.560 0.060 26 0 "[ . 1 . 2 . 3 ]" 1
930 1 67 LEU HA 1 67 LEU HB2 2.850 . 4.000 2.596 2.338 3.016 . 0 0 "[ . 1 . 2 . 3 ]" 1
931 1 67 LEU HA 1 67 LEU HB3 2.850 . 4.000 2.402 2.285 2.914 . 0 0 "[ . 1 . 2 . 3 ]" 1
932 1 67 LEU HA 1 67 LEU MD1 3.600 . 5.500 3.854 2.787 4.115 . 0 0 "[ . 1 . 2 . 3 ]" 1
933 1 67 LEU HA 1 67 LEU MD2 3.350 . 5.000 3.575 1.964 4.076 . 0 0 "[ . 1 . 2 . 3 ]" 1
934 1 67 LEU HA 1 67 LEU HG 2.850 . 4.000 3.447 2.087 3.675 . 0 0 "[ . 1 . 2 . 3 ]" 1
935 1 67 LEU HB2 1 67 LEU MD2 3.350 . 5.000 2.910 2.463 3.194 . 0 0 "[ . 1 . 2 . 3 ]" 1
936 1 67 LEU HB2 1 67 LEU HG 2.850 . 4.000 2.813 2.486 3.004 . 0 0 "[ . 1 . 2 . 3 ]" 1
937 1 67 LEU HB3 1 67 LEU MD1 3.350 . 5.000 2.873 2.327 3.167 . 0 0 "[ . 1 . 2 . 3 ]" 1
938 1 67 LEU HB3 1 67 LEU MD2 3.350 . 5.000 2.099 1.907 2.359 . 0 0 "[ . 1 . 2 . 3 ]" 1
939 1 67 LEU HB3 1 67 LEU HG 2.850 . 4.000 2.838 2.576 3.017 . 0 0 "[ . 1 . 2 . 3 ]" 1
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