NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
610045 |
5k5g   |
30099 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5k5g
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 1376
_Distance_constraint_stats_list.Viol_count 1668
_Distance_constraint_stats_list.Viol_total 1134.651
_Distance_constraint_stats_list.Viol_max 0.868
_Distance_constraint_stats_list.Viol_rms 0.0346
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0082
_Distance_constraint_stats_list.Viol_average_violations_only 0.0680
_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 10 GLN 2.004 0.114 10 0 "[ . 1]"
1 11 ARG 1.994 0.121 4 0 "[ . 1]"
1 12 LEU 2.353 0.837 9 1 "[ . +1]"
1 13 ALA 1.405 0.110 7 0 "[ . 1]"
1 14 ASN 3.518 0.369 1 0 "[ . 1]"
1 15 PHE 1.500 0.369 1 0 "[ . 1]"
1 16 LEU 4.386 0.151 1 0 "[ . 1]"
1 17 VAL 6.715 0.194 7 0 "[ . 1]"
1 18 HIS 1.023 0.079 5 0 "[ . 1]"
1 19 SER 0.000 0.000 . 0 "[ . 1]"
1 22 ASN 0.000 0.000 . 0 "[ . 1]"
1 23 PHE 2.756 0.137 9 0 "[ . 1]"
1 24 GLY 1.229 0.072 10 0 "[ . 1]"
1 25 ALA 3.341 0.174 6 0 "[ . 1]"
1 26 ILE 4.467 0.460 6 0 "[ . 1]"
1 27 LEU 1.546 0.083 1 0 "[ . 1]"
1 28 SER 2.176 0.837 9 1 "[ . +1]"
1 29 SER 1.409 0.513 3 1 "[ + . 1]"
1 30 THR 0.561 0.226 3 0 "[ . 1]"
2 25 GLU 0.832 0.092 6 0 "[ . 1]"
2 26 ILE 1.525 0.169 5 0 "[ . 1]"
2 27 VAL 4.746 0.868 7 1 "[ . + 1]"
2 28 TYR 2.673 0.169 5 0 "[ . 1]"
2 29 LEU 3.071 0.253 6 0 "[ . 1]"
2 30 PRO 0.218 0.108 7 0 "[ . 1]"
2 31 ASN 0.635 0.369 7 0 "[ . 1]"
2 32 LEU 1.972 0.369 7 0 "[ . 1]"
2 33 ASN 3.422 0.448 6 0 "[ . 1]"
2 34 PRO 1.916 0.353 10 0 "[ . 1]"
2 35 ASP 0.918 0.256 9 0 "[ . 1]"
2 36 GLN 0.000 0.000 . 0 "[ . 1]"
2 37 LEU 3.519 0.116 3 0 "[ . 1]"
2 39 ALA 0.000 0.000 . 0 "[ . 1]"
2 40 PHE 0.729 0.083 1 0 "[ . 1]"
2 41 ILE 3.657 0.192 5 0 "[ . 1]"
2 42 HIS 0.777 0.087 4 0 "[ . 1]"
2 43 SER 0.026 0.026 2 0 "[ . 1]"
2 44 ILE 1.353 0.088 6 0 "[ . 1]"
2 45 HIS 0.601 0.088 6 0 "[ . 1]"
2 46 ASP 0.099 0.039 2 0 "[ . 1]"
2 47 ASP 1.486 0.325 7 0 "[ . 1]"
2 48 PRO 2.610 0.325 7 0 "[ . 1]"
2 49 SER 0.851 0.181 5 0 "[ . 1]"
2 50 GLN 0.506 0.068 1 0 "[ . 1]"
2 51 SER 0.381 0.068 5 0 "[ . 1]"
2 52 ALA 0.769 0.096 2 0 "[ . 1]"
2 53 ASN 1.292 0.096 2 0 "[ . 1]"
2 54 LEU 1.205 0.116 8 0 "[ . 1]"
2 55 LEU 0.975 0.076 1 0 "[ . 1]"
2 56 ALA 0.444 0.056 9 0 "[ . 1]"
2 57 GLU 3.838 0.169 2 0 "[ . 1]"
2 58 ALA 3.391 0.253 6 0 "[ . 1]"
2 59 LYS 4.244 0.868 7 1 "[ . + 1]"
2 60 LYS 0.427 0.095 10 0 "[ . 1]"
2 61 LEU 3.785 0.253 2 0 "[ . 1]"
2 62 ASN 1.403 0.353 10 0 "[ . 1]"
2 63 ASP 1.281 0.228 9 0 "[ . 1]"
2 64 ALA 1.196 0.228 9 0 "[ . 1]"
2 65 GLN 0.210 0.101 7 0 "[ . 1]"
2 66 ALA 1.479 0.132 7 0 "[ . 1]"
3 24 GLY 0.906 0.460 6 0 "[ . 1]"
3 25 GLU 2.455 0.122 1 0 "[ . 1]"
3 26 ILE 1.684 0.122 1 0 "[ . 1]"
3 27 VAL 5.305 0.290 4 0 "[ . 1]"
3 28 TYR 0.382 0.069 9 0 "[ . 1]"
3 29 LEU 2.547 0.186 2 0 "[ . 1]"
3 30 PRO 2.014 0.448 7 0 "[ . 1]"
3 31 ASN 3.006 0.448 7 0 "[ . 1]"
3 32 LEU 4.286 0.399 9 0 "[ . 1]"
3 33 ASN 4.652 0.538 9 2 "[ . +-]"
3 34 PRO 3.625 0.353 10 0 "[ . 1]"
3 35 ASP 0.126 0.031 5 0 "[ . 1]"
3 36 GLN 4.878 0.538 9 2 "[ . +-]"
3 37 LEU 5.815 0.222 4 0 "[ . 1]"
3 39 ALA 0.000 0.000 . 0 "[ . 1]"
3 40 PHE 0.137 0.076 1 0 "[ . 1]"
3 41 ILE 3.420 0.214 9 0 "[ . 1]"
3 42 HIS 0.277 0.038 4 0 "[ . 1]"
3 43 SER 0.000 0.000 . 0 "[ . 1]"
3 44 ILE 1.765 0.087 8 0 "[ . 1]"
3 45 HIS 0.707 0.068 3 0 "[ . 1]"
3 46 ASP 0.712 0.075 7 0 "[ . 1]"
3 47 ASP 2.984 0.193 3 0 "[ . 1]"
3 48 PRO 2.406 0.193 3 0 "[ . 1]"
3 49 SER 0.000 0.000 . 0 "[ . 1]"
3 50 GLN 1.885 0.136 9 0 "[ . 1]"
3 51 SER 0.308 0.044 10 0 "[ . 1]"
3 52 ALA 0.881 0.071 2 0 "[ . 1]"
3 53 ASN 1.832 0.099 8 0 "[ . 1]"
3 54 LEU 1.924 0.089 6 0 "[ . 1]"
3 55 LEU 6.474 0.626 5 2 "[- + 1]"
3 56 ALA 0.634 0.099 8 0 "[ . 1]"
3 57 GLU 1.714 0.169 2 0 "[ . 1]"
3 58 ALA 2.051 0.186 2 0 "[ . 1]"
3 59 LYS 1.702 0.167 7 0 "[ . 1]"
3 60 LYS 0.136 0.043 1 0 "[ . 1]"
3 61 LEU 3.719 0.335 9 0 "[ . 1]"
3 62 ASN 0.987 0.079 6 0 "[ . 1]"
3 63 ASP 1.963 0.228 9 0 "[ . 1]"
3 64 ALA 3.072 0.228 9 0 "[ . 1]"
3 65 GLN 0.005 0.005 7 0 "[ . 1]"
3 66 ALA 1.658 0.091 8 0 "[ . 1]"
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 10 GLN HA 1 10 GLN HB2 2.377 . 3.083 2.734 2.453 3.006 . 0 0 "[ . 1]" 1
2 1 10 GLN HA 1 10 GLN QB 2.434 . 3.174 2.305 2.164 2.452 . 0 0 "[ . 1]" 1
3 1 10 GLN HA 1 10 GLN HB3 2.421 . 3.154 2.493 2.387 2.600 . 0 0 "[ . 1]" 1
4 1 10 GLN HA 1 10 GLN QG 2.448 . 3.197 2.832 2.330 3.311 0.114 10 0 "[ . 1]" 1
5 1 10 GLN HA 1 11 ARG H 1.968 . 2.452 2.486 2.460 2.505 0.053 7 0 "[ . 1]" 1
6 1 10 GLN QB 1 12 LEU QD 2.835 . 3.840 2.738 1.788 3.516 0.042 4 0 "[ . 1]" 1
7 1 10 GLN HB2 1 10 GLN QG 2.090 . 2.444 2.340 2.281 2.400 . 0 0 "[ . 1]" 1
8 1 10 GLN HB2 1 11 ARG H 2.664 . 3.379 2.745 2.037 3.464 0.085 1 0 "[ . 1]" 1
9 1 10 GLN HB3 1 10 GLN QG 2.121 . 2.464 2.279 2.145 2.380 . 0 0 "[ . 1]" 1
10 1 10 GLN HB3 1 11 ARG H 2.671 . 3.406 2.748 1.985 3.487 0.081 5 0 "[ . 1]" 1
11 1 10 GLN HE21 1 10 GLN QG 2.229 . 2.850 2.187 2.153 2.215 . 0 0 "[ . 1]" 1
12 1 10 GLN HE22 1 10 GLN QG 2.489 . 3.263 3.253 3.212 3.292 0.029 4 0 "[ . 1]" 1
13 1 10 GLN QG 1 11 ARG H 2.874 . 3.289 3.312 3.274 3.371 0.082 6 0 "[ . 1]" 1
14 1 10 GLN QG 1 12 LEU QD 2.757 . 3.707 2.598 1.851 3.402 . 0 0 "[ . 1]" 1
15 1 11 ARG H 1 11 ARG HA 2.518 . 3.310 2.906 2.808 2.935 . 0 0 "[ . 1]" 1
16 1 11 ARG H 1 11 ARG QB 2.310 . 2.977 2.966 2.345 3.098 0.121 4 0 "[ . 1]" 1
17 1 11 ARG H 1 11 ARG QD 2.829 . 6.500 4.336 4.164 4.473 . 0 0 "[ . 1]" 1
18 1 11 ARG H 1 11 ARG QG 2.371 . 3.074 2.363 2.218 2.549 . 0 0 "[ . 1]" 1
19 1 11 ARG H 1 12 LEU QD 2.907 . 3.964 3.101 2.108 3.924 . 0 0 "[ . 1]" 1
20 1 11 ARG HA 1 11 ARG HB2 2.522 . 3.317 2.480 2.403 2.998 . 0 0 "[ . 1]" 1
21 1 11 ARG HA 1 11 ARG HB3 2.542 . 3.350 2.466 2.409 2.512 . 0 0 "[ . 1]" 1
22 1 11 ARG HA 1 11 ARG QG 2.573 . 3.521 3.170 2.104 3.311 . 0 0 "[ . 1]" 1
23 1 11 ARG HA 1 12 LEU H 2.260 . 2.898 2.308 1.991 2.724 . 0 0 "[ . 1]" 1
24 1 11 ARG QB 1 11 ARG HD3 2.155 . 2.735 2.329 2.217 2.392 . 0 0 "[ . 1]" 1
25 1 11 ARG QB 1 11 ARG HD2 2.550 . 3.363 3.104 2.357 3.294 . 0 0 "[ . 1]" 1
26 1 11 ARG QB 1 11 ARG HD3 2.504 . 3.288 2.372 2.323 2.423 . 0 0 "[ . 1]" 1
27 1 11 ARG QB 1 11 ARG QG 2.074 . 2.612 2.062 2.052 2.068 . 0 0 "[ . 1]" 1
28 1 11 ARG QB 1 12 LEU H 2.647 . 6.500 3.305 2.830 3.993 . 0 0 "[ . 1]" 1
29 1 11 ARG QB 1 27 LEU QD 2.659 . 3.543 2.929 2.404 3.220 . 0 0 "[ . 1]" 1
30 1 11 ARG QD 1 11 ARG QG 2.196 . 2.775 2.019 1.993 2.092 . 0 0 "[ . 1]" 1
31 1 11 ARG QD 1 27 LEU HB2 2.602 . 6.500 5.337 3.567 6.539 0.039 6 0 "[ . 1]" 1
32 1 11 ARG QD 1 27 LEU QD 2.699 . 3.609 2.535 1.777 3.189 0.025 10 0 "[ . 1]" 1
33 1 11 ARG HD2 1 11 ARG QG 2.513 . 3.303 2.216 2.177 2.395 . 0 0 "[ . 1]" 1
34 1 11 ARG HD3 1 11 ARG QG 2.479 . 3.247 2.331 2.305 2.370 . 0 0 "[ . 1]" 1
35 1 11 ARG QG 1 12 LEU H 2.860 . 3.883 3.804 3.750 3.893 0.010 7 0 "[ . 1]" 1
36 1 11 ARG QG 1 12 LEU H 2.413 . 6.500 3.348 2.179 3.724 . 0 0 "[ . 1]" 1
37 1 11 ARG QG 1 12 LEU QD 2.600 . 6.500 3.734 2.958 4.568 . 0 0 "[ . 1]" 1
38 1 11 ARG QG 1 12 LEU QD 2.592 . 6.500 2.989 2.349 3.340 . 0 0 "[ . 1]" 1
39 1 11 ARG QG 1 27 LEU QD 2.875 . 3.908 3.272 2.357 3.589 . 0 0 "[ . 1]" 1
40 1 12 LEU H 1 12 LEU HA 2.218 . 2.833 2.890 2.824 2.914 0.081 10 0 "[ . 1]" 1
41 1 12 LEU H 1 12 LEU QB 2.300 . 2.962 2.508 2.189 2.796 . 0 0 "[ . 1]" 1
42 1 12 LEU H 1 12 LEU QD 2.893 . 3.586 2.588 2.090 3.179 . 0 0 "[ . 1]" 1
43 1 12 LEU H 1 27 LEU QD 2.919 . 3.984 3.835 3.449 3.985 0.001 4 0 "[ . 1]" 1
44 1 12 LEU H 1 28 SER H 2.983 . 4.095 3.107 2.729 3.582 . 0 0 "[ . 1]" 1
45 1 12 LEU H 1 28 SER HB2 3.123 . 4.342 3.890 3.052 5.179 0.837 9 1 "[ . +1]" 1
46 1 12 LEU H 1 28 SER QB 3.006 . 4.136 3.496 3.005 4.111 . 0 0 "[ . 1]" 1
47 1 12 LEU H 1 29 SER HA 3.066 . 4.241 4.004 3.472 4.283 0.042 10 0 "[ . 1]" 1
48 1 12 LEU HA 1 12 LEU QB 2.559 . 3.378 2.394 2.296 2.467 . 0 0 "[ . 1]" 1
49 1 12 LEU HA 1 12 LEU QD 2.326 . 3.503 1.960 1.841 2.164 . 0 0 "[ . 1]" 1
50 1 12 LEU HA 1 13 ALA H 3.138 . 3.413 2.466 2.306 2.610 . 0 0 "[ . 1]" 1
51 1 12 LEU HA 1 13 ALA MB 2.851 . 3.867 3.882 3.784 3.922 0.055 5 0 "[ . 1]" 1
52 1 12 LEU HA 1 27 LEU HB3 2.617 . 6.500 5.904 5.588 6.194 . 0 0 "[ . 1]" 1
53 1 12 LEU HA 1 27 LEU QD 2.720 . 3.645 3.607 3.439 3.677 0.032 1 0 "[ . 1]" 1
54 1 12 LEU QB 1 28 SER HB2 2.965 . 4.064 3.347 2.444 4.116 0.052 2 0 "[ . 1]" 1
55 1 12 LEU QB 1 12 LEU QD 2.225 . 2.844 2.014 1.890 2.067 . 0 0 "[ . 1]" 1
56 1 12 LEU QB 1 13 ALA H 2.881 . 3.919 2.260 1.841 2.762 0.002 3 0 "[ . 1]" 1
57 1 12 LEU QD 1 12 LEU HG 2.012 . 2.292 1.887 1.880 1.893 . 0 0 "[ . 1]" 1
58 1 12 LEU QD 1 13 ALA H 2.990 . 4.108 3.273 3.041 3.798 . 0 0 "[ . 1]" 1
59 1 12 LEU QD 1 27 LEU HA 2.700 . 6.500 5.711 5.580 5.852 . 0 0 "[ . 1]" 1
60 1 12 LEU QD 1 28 SER QB 2.629 . 6.500 4.093 3.516 4.592 . 0 0 "[ . 1]" 1
61 1 12 LEU QD 3 48 PRO HB2 2.691 . 3.596 2.160 1.979 2.449 . 0 0 "[ . 1]" 1
62 1 12 LEU QD 3 48 PRO HB3 2.919 . 3.984 2.423 1.972 3.218 . 0 0 "[ . 1]" 1
63 1 13 ALA H 1 13 ALA MB 3.044 . 3.134 2.524 2.415 2.666 . 0 0 "[ . 1]" 1
64 1 13 ALA HA 1 13 ALA MB 2.476 . 3.242 2.114 2.109 2.117 . 0 0 "[ . 1]" 1
65 1 13 ALA HA 1 14 ASN H 2.663 . 3.549 2.090 2.027 2.136 . 0 0 "[ . 1]" 1
66 1 13 ALA HA 1 27 LEU QD 2.768 . 3.726 2.383 2.067 2.566 . 0 0 "[ . 1]" 1
67 1 13 ALA MB 1 14 ASN H 2.565 . 3.387 2.984 2.773 3.213 . 0 0 "[ . 1]" 1
68 1 13 ALA MB 1 14 ASN QB 3.244 . 4.560 4.605 4.458 4.670 0.110 7 0 "[ . 1]" 1
69 1 13 ALA MB 1 27 LEU H 3.175 . 4.435 4.489 4.469 4.518 0.083 1 0 "[ . 1]" 1
70 1 13 ALA MB 1 27 LEU HB3 2.935 . 6.500 4.686 4.556 4.799 . 0 0 "[ . 1]" 1
71 1 13 ALA MB 1 27 LEU QD 1.952 . 2.437 1.873 1.809 1.963 . 0 0 "[ . 1]" 1
72 1 13 ALA MB 1 27 LEU HG 2.737 . 3.673 3.609 3.375 3.697 0.024 10 0 "[ . 1]" 1
73 1 14 ASN H 1 14 ASN HB2 2.701 . 3.613 2.431 2.147 2.673 . 0 0 "[ . 1]" 1
74 1 14 ASN H 1 14 ASN QB 3.172 . 4.430 2.388 2.078 2.607 . 0 0 "[ . 1]" 1
75 1 14 ASN H 1 15 PHE H 3.386 . 4.819 4.543 4.479 4.588 . 0 0 "[ . 1]" 1
76 1 14 ASN H 1 27 LEU HA 3.032 . 4.181 3.390 2.902 3.666 . 0 0 "[ . 1]" 1
77 1 14 ASN HA 1 14 ASN HB2 2.746 . 3.689 2.989 2.671 3.032 . 0 0 "[ . 1]" 1
78 1 14 ASN HA 1 15 PHE H 3.017 . 3.230 2.322 2.270 2.344 . 0 0 "[ . 1]" 1
79 1 14 ASN QB 1 26 ILE MD 3.082 . 4.269 3.994 3.824 4.176 . 0 0 "[ . 1]" 1
80 1 14 ASN QB 1 26 ILE MG 2.381 . 3.090 1.808 1.706 1.880 . 0 0 "[ . 1]" 1
81 1 14 ASN QB 2 28 TYR QD 2.942 . 4.024 2.837 2.556 3.554 . 0 0 "[ . 1]" 1
82 1 14 ASN QB 2 28 TYR QE 3.019 . 4.158 4.088 3.052 4.225 0.067 7 0 "[ . 1]" 1
83 1 14 ASN HB2 1 14 ASN HD21 2.899 . 3.950 2.650 2.074 2.988 . 0 0 "[ . 1]" 1
84 1 14 ASN HB2 1 14 ASN HD22 2.627 . 3.490 3.656 3.348 3.810 0.320 9 0 "[ . 1]" 1
85 1 14 ASN HB2 1 15 PHE H 3.018 . 4.003 3.931 3.671 4.372 0.369 1 0 "[ . 1]" 1
86 1 14 ASN HB2 1 26 ILE MG 2.471 . 3.234 1.931 1.758 2.817 . 0 0 "[ . 1]" 1
87 1 14 ASN HD21 1 28 SER QB 2.964 . 4.062 3.669 3.147 4.314 0.252 2 0 "[ . 1]" 1
88 1 14 ASN HD22 1 28 SER QB 3.099 . 4.299 3.295 2.711 4.395 0.096 1 0 "[ . 1]" 1
89 1 15 PHE H 1 15 PHE HB2 3.002 . 3.773 2.746 2.689 2.842 . 0 0 "[ . 1]" 1
90 1 15 PHE H 1 15 PHE HB3 . . 3.350 2.730 2.620 2.792 . 0 0 "[ . 1]" 1
91 1 15 PHE H 1 15 PHE QD 3.250 . 4.570 4.295 4.270 4.313 . 0 0 "[ . 1]" 1
92 1 15 PHE H 1 16 LEU H 3.405 . 4.718 4.163 4.060 4.343 . 0 0 "[ . 1]" 1
93 1 15 PHE H 2 30 PRO HA 3.307 . 4.674 2.744 2.333 3.252 . 0 0 "[ . 1]" 1
94 1 15 PHE HA 1 15 PHE QD 2.834 . 3.838 2.888 2.788 3.068 . 0 0 "[ . 1]" 1
95 1 15 PHE HA 1 16 LEU H 2.564 . 3.386 2.151 2.117 2.191 . 0 0 "[ . 1]" 1
96 1 15 PHE HA 1 25 ALA MB 2.872 . 3.903 3.624 3.171 3.840 . 0 0 "[ . 1]" 1
97 1 15 PHE HA 1 26 ILE H 3.165 . 3.860 3.810 3.662 3.882 0.022 4 0 "[ . 1]" 1
98 1 15 PHE HB2 1 15 PHE QD 2.637 . 3.506 2.399 2.330 2.443 . 0 0 "[ . 1]" 1
99 1 15 PHE HB2 1 16 LEU H 3.118 . 6.500 4.505 4.358 4.571 . 0 0 "[ . 1]" 1
100 1 15 PHE HB2 2 29 LEU QD 3.052 . 6.500 5.039 4.779 5.141 . 0 0 "[ . 1]" 1
101 1 15 PHE HB2 2 37 LEU MD2 2.699 . 3.609 3.221 2.543 3.612 0.003 10 0 "[ . 1]" 1
102 1 15 PHE HB3 1 15 PHE QD 2.552 . 3.366 2.377 2.340 2.458 . 0 0 "[ . 1]" 1
103 1 15 PHE HB3 1 16 LEU H 3.090 . 4.284 4.262 4.095 4.325 0.041 4 0 "[ . 1]" 1
104 1 15 PHE HB3 2 29 LEU QD 2.744 . 3.685 3.678 3.538 3.735 0.050 3 0 "[ . 1]" 1
105 1 15 PHE QD 1 17 VAL MG1 2.809 . 3.795 3.682 3.495 3.813 0.018 6 0 "[ . 1]" 1
106 1 15 PHE QD 1 25 ALA MB 2.523 . 3.319 3.355 3.287 3.391 0.072 6 0 "[ . 1]" 1
107 1 15 PHE QD 2 37 LEU MD1 2.371 . 3.074 3.103 3.081 3.141 0.067 6 0 "[ . 1]" 1
108 1 15 PHE QD 2 37 LEU MD2 2.458 . 3.213 2.868 2.568 3.216 0.003 4 0 "[ . 1]" 1
109 1 15 PHE QD 2 41 ILE MD 3.237 . 4.547 3.973 3.779 4.267 . 0 0 "[ . 1]" 1
110 1 16 LEU H 1 16 LEU MD1 2.741 . 6.500 3.890 3.820 4.010 . 0 0 "[ . 1]" 1
111 1 16 LEU H 1 16 LEU MD2 2.810 . 3.797 1.809 1.796 1.823 0.027 1 0 "[ . 1]" 1
112 1 16 LEU H 1 16 LEU HG 2.733 . 3.666 3.697 3.678 3.727 0.061 9 0 "[ . 1]" 1
113 1 16 LEU H 1 24 GLY H 3.160 . 3.852 3.839 3.717 3.889 0.037 2 0 "[ . 1]" 1
114 1 16 LEU HB2 1 16 LEU MD1 2.538 . 3.343 2.395 2.360 2.419 . 0 0 "[ . 1]" 1
115 1 16 LEU HB2 1 16 LEU HG 2.968 . 4.069 2.413 2.401 2.442 . 0 0 "[ . 1]" 1
116 1 16 LEU HB2 1 17 VAL H 2.944 . 4.027 2.583 2.531 2.655 . 0 0 "[ . 1]" 1
117 1 16 LEU HB2 2 26 ILE MG 2.490 . 3.265 2.254 2.198 2.365 . 0 0 "[ . 1]" 1
118 1 16 LEU HB2 2 28 TYR QD 2.930 . 4.003 3.349 2.273 3.533 . 0 0 "[ . 1]" 1
119 1 16 LEU HB2 2 28 TYR QE 3.006 . 4.135 3.933 3.834 4.024 . 0 0 "[ . 1]" 1
120 1 16 LEU HB3 1 16 LEU MD1 2.521 . 3.315 2.293 2.267 2.362 . 0 0 "[ . 1]" 1
121 1 16 LEU HB3 1 16 LEU MD2 2.856 . 3.876 2.454 2.391 2.487 . 0 0 "[ . 1]" 1
122 1 16 LEU HB3 1 17 VAL H 3.245 . 4.262 3.939 3.907 3.988 . 0 0 "[ . 1]" 1
123 1 16 LEU HB3 2 26 ILE MG 2.674 . 3.568 3.588 3.483 3.626 0.058 6 0 "[ . 1]" 1
124 1 16 LEU HB3 2 28 TYR QD 3.196 . 4.473 2.447 2.291 2.575 . 0 0 "[ . 1]" 1
125 1 16 LEU QD 1 17 VAL H 2.755 . 3.704 3.206 3.092 3.272 . 0 0 "[ . 1]" 1
126 1 16 LEU QD 1 26 ILE MG 2.121 . 2.683 2.046 1.917 2.225 . 0 0 "[ . 1]" 1
127 1 16 LEU MD1 1 16 LEU HG 2.334 . 2.833 2.131 2.128 2.134 . 0 0 "[ . 1]" 1
128 1 16 LEU MD1 1 17 VAL H 3.027 . 4.172 4.172 4.106 4.223 0.051 1 0 "[ . 1]" 1
129 1 16 LEU MD1 1 17 VAL HA 2.924 . 6.500 4.954 4.836 5.040 . 0 0 "[ . 1]" 1
130 1 16 LEU MD1 1 24 GLY H 2.983 . 6.500 5.186 5.134 5.213 . 0 0 "[ . 1]" 1
131 1 16 LEU MD1 1 26 ILE HB 2.641 . 3.435 2.855 2.724 2.962 . 0 0 "[ . 1]" 1
132 1 16 LEU MD1 1 26 ILE MD 2.096 . 2.645 2.679 2.618 2.712 0.067 1 0 "[ . 1]" 1
133 1 16 LEU MD1 1 26 ILE HG12 2.824 . 6.500 4.693 4.573 4.824 . 0 0 "[ . 1]" 1
134 1 16 LEU MD1 1 26 ILE MG 2.058 . 2.587 2.443 2.284 2.586 . 0 0 "[ . 1]" 1
135 1 16 LEU MD1 2 26 ILE MG 2.002 . 2.503 1.937 1.827 2.030 . 0 0 "[ . 1]" 1
136 1 16 LEU MD1 2 28 TYR H 2.605 . 6.500 5.266 5.120 5.440 . 0 0 "[ . 1]" 1
137 1 16 LEU MD1 2 28 TYR QD 2.363 . 3.061 3.086 2.670 3.157 0.096 1 0 "[ . 1]" 1
138 1 16 LEU MD1 2 28 TYR QE 2.240 . 2.867 2.143 2.030 2.257 . 0 0 "[ . 1]" 1
139 1 16 LEU MD1 3 26 ILE MD 2.184 . 2.409 2.424 2.337 2.450 0.041 1 0 "[ . 1]" 1
140 1 16 LEU MD1 3 26 ILE MG 2.149 . 2.439 2.151 1.861 2.411 . 0 0 "[ . 1]" 1
141 1 16 LEU MD2 1 16 LEU HG 2.474 . 3.239 2.108 2.104 2.111 . 0 0 "[ . 1]" 1
142 1 16 LEU MD2 1 17 VAL H 2.847 . 3.860 3.984 3.945 4.011 0.151 1 0 "[ . 1]" 1
143 1 16 LEU MD2 1 24 GLY H 2.699 . 3.562 2.825 2.720 2.915 . 0 0 "[ . 1]" 1
144 1 16 LEU MD2 1 25 ALA H 2.785 . 3.755 2.756 2.661 2.929 . 0 0 "[ . 1]" 1
145 1 16 LEU MD2 2 26 ILE MG 2.170 . 6.500 3.593 3.452 3.670 . 0 0 "[ . 1]" 1
146 1 16 LEU MD2 2 28 TYR H 2.767 . 6.500 6.391 6.336 6.532 0.032 5 0 "[ . 1]" 1
147 1 16 LEU MD2 2 28 TYR QD 2.961 . 4.057 3.996 3.831 4.104 0.047 5 0 "[ . 1]" 1
148 1 16 LEU MD2 2 28 TYR QE 2.951 . 4.039 3.926 3.686 4.027 . 0 0 "[ . 1]" 1
149 1 16 LEU MD2 3 26 ILE MD 2.472 . 6.500 3.936 3.853 4.007 . 0 0 "[ . 1]" 1
150 1 16 LEU MD2 3 26 ILE MG 2.290 . 2.946 2.435 2.328 2.534 . 0 0 "[ . 1]" 1
151 1 16 LEU MD2 3 28 TYR QD 2.669 . 3.560 3.430 2.938 3.569 0.009 8 0 "[ . 1]" 1
152 1 16 LEU MD2 3 28 TYR QE 2.280 . 2.930 2.810 2.098 2.999 0.069 9 0 "[ . 1]" 1
153 1 16 LEU HG 1 24 GLY H 3.239 . 3.958 4.011 3.995 4.030 0.072 10 0 "[ . 1]" 1
154 1 17 VAL H 1 17 VAL HB 2.763 . 3.717 3.497 3.484 3.517 . 0 0 "[ . 1]" 1
155 1 17 VAL H 1 17 VAL MG1 2.731 . 3.405 2.286 2.262 2.319 . 0 0 "[ . 1]" 1
156 1 17 VAL H 1 17 VAL MG2 2.716 . 3.636 3.822 3.811 3.830 0.194 7 0 "[ . 1]" 1
157 1 17 VAL H 1 23 PHE HA 3.105 . 6.500 4.748 4.674 4.843 . 0 0 "[ . 1]" 1
158 1 17 VAL H 2 27 VAL H 2.957 . 4.050 2.830 2.776 2.884 . 0 0 "[ . 1]" 1
159 1 17 VAL H 2 28 TYR H 3.273 . 4.612 4.707 4.692 4.731 0.119 4 0 "[ . 1]" 1
160 1 17 VAL H 2 29 LEU H 3.332 . 4.720 4.673 4.491 4.773 0.053 1 0 "[ . 1]" 1
161 1 17 VAL HA 1 17 VAL MG1 2.668 . 3.558 3.179 3.172 3.184 . 0 0 "[ . 1]" 1
162 1 17 VAL HA 1 17 VAL MG2 2.564 . 3.386 2.498 2.489 2.509 . 0 0 "[ . 1]" 1
163 1 17 VAL HA 1 18 HIS H 2.576 . 3.406 2.099 2.076 2.121 . 0 0 "[ . 1]" 1
164 1 17 VAL HA 1 24 GLY H 3.132 . 4.359 2.583 2.421 2.711 . 0 0 "[ . 1]" 1
165 1 17 VAL HB 1 17 VAL MG1 2.144 . 2.719 2.106 2.102 2.112 . 0 0 "[ . 1]" 1
166 1 17 VAL HB 1 17 VAL MG2 2.072 . 2.609 2.120 2.118 2.121 . 0 0 "[ . 1]" 1
167 1 17 VAL HB 1 18 HIS H 2.924 . 3.993 4.030 4.017 4.044 0.051 1 0 "[ . 1]" 1
168 1 17 VAL HB 2 27 VAL H 2.978 . 6.500 5.322 5.225 5.400 . 0 0 "[ . 1]" 1
169 1 17 VAL HB 2 27 VAL HB 2.698 . 6.500 6.622 6.597 6.647 0.147 6 0 "[ . 1]" 1
170 1 17 VAL HB 2 44 ILE MD 2.889 . 6.500 6.211 5.833 6.502 0.002 2 0 "[ . 1]" 1
171 1 17 VAL MG1 1 18 HIS H 2.742 . 6.500 4.174 4.141 4.196 . 0 0 "[ . 1]" 1
172 1 17 VAL MG1 1 23 PHE QB 2.682 . 3.581 3.629 3.611 3.655 0.074 9 0 "[ . 1]" 1
173 1 17 VAL MG1 1 23 PHE QD 2.434 . 6.500 5.123 4.967 5.246 . 0 0 "[ . 1]" 1
174 1 17 VAL MG1 1 24 GLY H 3.166 . 4.419 4.449 4.396 4.480 0.061 9 0 "[ . 1]" 1
175 1 17 VAL MG1 2 27 VAL HB 2.752 . 3.699 3.665 3.643 3.690 . 0 0 "[ . 1]" 1
176 1 17 VAL MG1 2 29 LEU QD 1.918 . 2.378 2.126 1.986 2.385 0.007 5 0 "[ . 1]" 1
177 1 17 VAL MG2 1 18 HIS H 2.796 . 3.773 2.678 2.609 2.719 . 0 0 "[ . 1]" 1
178 1 17 VAL MG2 1 23 PHE H 3.309 . 4.678 3.393 3.250 3.553 . 0 0 "[ . 1]" 1
179 1 17 VAL MG2 1 23 PHE QB 2.403 . 3.125 2.463 2.282 2.603 . 0 0 "[ . 1]" 1
180 1 18 HIS H 1 18 HIS HB2 2.990 . 4.108 2.536 2.394 2.650 . 0 0 "[ . 1]" 1
181 1 18 HIS H 1 18 HIS HB3 3.041 . 4.197 2.597 2.493 2.728 . 0 0 "[ . 1]" 1
182 1 18 HIS H 1 22 ASN H 3.561 . 5.146 4.167 3.982 4.371 . 0 0 "[ . 1]" 1
183 1 18 HIS HA 1 19 SER H 2.844 . 3.540 2.137 2.120 2.183 . 0 0 "[ . 1]" 1
184 1 18 HIS HA 2 26 ILE MD 2.851 . 3.867 3.905 3.771 3.946 0.079 5 0 "[ . 1]" 1
185 1 18 HIS HA 2 26 ILE MG 3.051 . 4.215 3.173 2.928 3.659 . 0 0 "[ . 1]" 1
186 1 18 HIS HA 2 27 VAL H 3.119 . 4.335 3.915 3.758 4.264 . 0 0 "[ . 1]" 1
187 1 18 HIS HB2 1 18 HIS HD2 3.044 . 4.202 3.042 2.811 3.269 . 0 0 "[ . 1]" 1
188 1 18 HIS HB2 2 26 ILE MD 3.190 . 4.462 2.557 2.247 3.023 . 0 0 "[ . 1]" 1
189 1 18 HIS HB2 3 28 TYR QE 2.731 . 3.663 3.039 2.427 3.627 . 0 0 "[ . 1]" 1
190 1 18 HIS HB3 2 26 ILE MD 3.208 . 4.494 3.895 3.682 4.208 . 0 0 "[ . 1]" 1
191 1 18 HIS HB3 3 28 TYR QE 2.895 . 3.943 3.501 2.982 3.999 0.056 9 0 "[ . 1]" 1
192 1 18 HIS HD2 2 26 ILE MD 2.280 . 2.930 2.675 2.060 2.946 0.016 7 0 "[ . 1]" 1
193 1 18 HIS HD2 2 26 ILE HG12 2.584 . 3.419 2.223 1.980 2.638 . 0 0 "[ . 1]" 1
194 1 19 SER H 1 19 SER HA 2.732 . 3.603 2.675 2.609 2.747 . 0 0 "[ . 1]" 1
195 1 19 SER H 1 19 SER QB 3.062 . 3.593 2.406 2.162 2.645 . 0 0 "[ . 1]" 1
196 1 19 SER H 2 26 ILE MD 3.092 . 4.287 3.969 3.710 4.124 . 0 0 "[ . 1]" 1
197 1 19 SER QB 2 26 ILE HG12 2.938 . 4.017 3.248 2.481 3.887 . 0 0 "[ . 1]" 1
198 1 22 ASN H 1 22 ASN QB 3.212 . 4.501 2.525 2.323 2.982 . 0 0 "[ . 1]" 1
199 1 22 ASN H 1 23 PHE H 3.283 . 4.630 4.198 3.938 4.405 . 0 0 "[ . 1]" 1
200 1 22 ASN QB 1 23 PHE H 3.383 . 4.465 3.579 2.849 3.822 . 0 0 "[ . 1]" 1
201 1 23 PHE H 1 23 PHE HB2 3.048 . 3.399 3.513 3.482 3.536 0.137 9 0 "[ . 1]" 1
202 1 23 PHE H 1 23 PHE HB3 2.947 . 3.337 3.057 2.967 3.161 . 0 0 "[ . 1]" 1
203 1 23 PHE H 1 23 PHE QD 3.176 . 4.437 2.356 2.120 2.633 . 0 0 "[ . 1]" 1
204 1 23 PHE H 1 24 GLY H 3.180 . 6.500 4.563 4.541 4.581 . 0 0 "[ . 1]" 1
205 1 23 PHE H 3 30 PRO HA 3.134 . 4.362 3.732 3.453 4.372 0.010 2 0 "[ . 1]" 1
206 1 23 PHE HA 1 23 PHE HB2 2.590 . 3.429 2.601 2.565 2.649 . 0 0 "[ . 1]" 1
207 1 23 PHE HA 1 23 PHE HB3 2.669 . 3.559 2.325 2.306 2.341 . 0 0 "[ . 1]" 1
208 1 23 PHE HA 1 23 PHE QD 2.734 . 3.668 3.663 3.623 3.682 0.014 10 0 "[ . 1]" 1
209 1 23 PHE HA 1 24 GLY H 2.498 . 3.168 2.266 2.202 2.330 . 0 0 "[ . 1]" 1
210 1 23 PHE QB 1 24 GLY H 2.705 . 3.620 2.905 2.799 3.007 . 0 0 "[ . 1]" 1
211 1 23 PHE QB 2 41 ILE MD 2.987 . 4.102 3.816 3.688 3.977 . 0 0 "[ . 1]" 1
212 1 23 PHE QB 2 41 ILE HG12 3.158 . 4.404 3.593 3.430 3.758 . 0 0 "[ . 1]" 1
213 1 23 PHE HB2 1 23 PHE QD 2.437 . 3.179 2.374 2.339 2.414 . 0 0 "[ . 1]" 1
214 1 23 PHE HB3 1 24 GLY H 2.842 . 3.851 3.851 3.766 3.896 0.045 5 0 "[ . 1]" 1
215 1 23 PHE QD 2 41 ILE MD 2.840 . 3.849 3.419 3.278 3.582 . 0 0 "[ . 1]" 1
216 1 23 PHE QD 2 41 ILE MG 2.785 . 3.755 3.520 3.285 3.785 0.030 2 0 "[ . 1]" 1
217 1 23 PHE QD 3 37 LEU MD1 2.524 . 6.500 4.535 4.096 4.819 . 0 0 "[ . 1]" 1
218 1 23 PHE QD 3 37 LEU MD2 2.333 . 3.013 3.099 3.075 3.149 0.136 5 0 "[ . 1]" 1
219 1 24 GLY H 1 24 GLY HA2 2.991 . 4.109 2.939 2.906 2.953 . 0 0 "[ . 1]" 1
220 1 24 GLY H 1 24 GLY HA3 2.998 . 4.121 2.611 2.572 2.698 . 0 0 "[ . 1]" 1
221 1 24 GLY H 1 25 ALA H 2.833 . 6.500 4.254 4.159 4.312 . 0 0 "[ . 1]" 1
222 1 24 GLY HA2 1 25 ALA H 2.631 . 3.496 2.794 2.694 2.922 . 0 0 "[ . 1]" 1
223 1 24 GLY HA2 3 29 LEU H 3.192 . 4.466 2.091 1.887 2.464 0.031 7 0 "[ . 1]" 1
224 1 24 GLY HA2 3 29 LEU HB2 3.104 . 4.308 3.843 3.101 4.204 . 0 0 "[ . 1]" 1
225 1 24 GLY HA3 1 25 ALA H 2.777 . 3.513 2.303 2.196 2.362 . 0 0 "[ . 1]" 1
226 1 24 GLY HA3 3 29 LEU H 3.212 . 4.501 3.197 2.636 3.601 . 0 0 "[ . 1]" 1
227 1 25 ALA H 1 25 ALA HA 2.988 . 4.104 2.899 2.889 2.905 . 0 0 "[ . 1]" 1
228 1 25 ALA H 1 25 ALA HA 2.413 . 3.141 2.292 2.269 2.339 . 0 0 "[ . 1]" 1
229 1 25 ALA H 1 25 ALA MB 2.647 . 3.523 2.599 2.558 2.636 . 0 0 "[ . 1]" 1
230 1 25 ALA H 1 25 ALA MB 2.094 . 2.642 2.184 2.100 2.225 . 0 0 "[ . 1]" 1
231 1 25 ALA H 1 26 ILE HB 3.303 . 4.666 4.728 4.717 4.746 0.080 10 0 "[ . 1]" 1
232 1 25 ALA H 3 27 VAL MG1 2.229 . 6.500 3.777 3.640 3.875 . 0 0 "[ . 1]" 1
233 1 25 ALA H 3 26 ILE MD 2.848 . 6.500 6.215 6.105 6.440 . 0 0 "[ . 1]" 1
234 1 25 ALA H 3 26 ILE MG 2.925 . 3.995 3.638 3.484 3.796 . 0 0 "[ . 1]" 1
235 1 25 ALA H 3 27 VAL H 3.003 . 4.130 3.155 3.038 3.298 . 0 0 "[ . 1]" 1
236 1 25 ALA H 3 27 VAL HB 3.089 . 4.282 3.753 3.437 4.047 . 0 0 "[ . 1]" 1
237 1 25 ALA H 3 28 TYR HA 2.970 . 4.072 2.551 2.210 2.836 . 0 0 "[ . 1]" 1
238 1 25 ALA HA 1 26 ILE H 2.804 . 3.787 2.402 2.368 2.472 . 0 0 "[ . 1]" 1
239 1 25 ALA HA 3 27 VAL H 3.152 . 4.394 4.542 4.521 4.568 0.174 6 0 "[ . 1]" 1
240 1 25 ALA MB 1 26 ILE H 2.785 . 3.754 2.351 2.208 2.419 . 0 0 "[ . 1]" 1
241 1 25 ALA MB 1 27 LEU QD 2.346 . 6.500 4.221 4.001 4.541 . 0 0 "[ . 1]" 1
242 1 25 ALA MB 3 27 VAL H 2.769 . 3.727 3.556 3.477 3.723 . 0 0 "[ . 1]" 1
243 1 25 ALA MB 3 27 VAL HB 2.786 . 3.756 2.387 2.029 2.723 . 0 0 "[ . 1]" 1
244 1 25 ALA MB 3 27 VAL MG1 2.349 . 3.039 3.089 2.984 3.151 0.112 6 0 "[ . 1]" 1
245 1 25 ALA MB 3 29 LEU MD1 2.337 . 3.020 2.986 2.722 3.093 0.073 3 0 "[ . 1]" 1
246 1 25 ALA MB 3 41 ILE HG12 2.407 . 6.500 5.485 5.302 5.739 . 0 0 "[ . 1]" 1
247 1 26 ILE H 1 26 ILE HB 2.868 . 3.896 3.510 3.470 3.539 . 0 0 "[ . 1]" 1
248 1 26 ILE H 1 26 ILE MD 3.010 . 6.500 4.896 4.860 4.927 . 0 0 "[ . 1]" 1
249 1 26 ILE H 1 26 ILE HG12 3.291 . 4.645 4.488 4.448 4.513 . 0 0 "[ . 1]" 1
250 1 26 ILE H 1 26 ILE MG 2.251 . 2.884 2.465 2.390 2.491 . 0 0 "[ . 1]" 1
251 1 26 ILE H 1 27 LEU H 3.364 . 4.779 4.141 4.109 4.179 . 0 0 "[ . 1]" 1
252 1 26 ILE H 3 26 ILE MG 2.811 . 6.500 4.933 4.829 5.032 . 0 0 "[ . 1]" 1
253 1 26 ILE HA 1 26 ILE HB 2.785 . 3.755 2.381 2.361 2.393 . 0 0 "[ . 1]" 1
254 1 26 ILE HA 1 26 ILE MD 2.670 . 3.561 3.694 3.658 3.737 0.176 1 0 "[ . 1]" 1
255 1 26 ILE HA 1 26 ILE HG12 2.856 . 3.875 3.253 3.093 3.386 . 0 0 "[ . 1]" 1
256 1 26 ILE HA 1 26 ILE HG13 2.491 . 3.267 2.385 2.346 2.421 . 0 0 "[ . 1]" 1
257 1 26 ILE HA 1 27 LEU H 2.476 . 3.242 2.171 2.133 2.252 . 0 0 "[ . 1]" 1
258 1 26 ILE HA 3 27 VAL H 2.957 . 4.050 2.654 2.469 2.870 . 0 0 "[ . 1]" 1
259 1 26 ILE HB 1 26 ILE MD 2.407 . 3.087 2.249 2.216 2.318 . 0 0 "[ . 1]" 1
260 1 26 ILE HB 1 26 ILE HG12 2.669 . 3.559 3.021 3.013 3.025 . 0 0 "[ . 1]" 1
261 1 26 ILE HB 1 26 ILE HG13 2.753 . 3.701 2.530 2.450 2.580 . 0 0 "[ . 1]" 1
262 1 26 ILE HB 1 26 ILE HG13 2.233 . 2.856 2.021 2.003 2.031 . 0 0 "[ . 1]" 1
263 1 26 ILE HB 1 26 ILE MG 2.234 . 2.858 2.126 2.119 2.129 . 0 0 "[ . 1]" 1
264 1 26 ILE HB 1 27 LEU H 2.982 . 4.094 4.073 4.047 4.123 0.029 1 0 "[ . 1]" 1
265 1 26 ILE HB 2 28 TYR QE 2.885 . 3.926 3.687 3.392 3.933 0.007 8 0 "[ . 1]" 1
266 1 26 ILE HB 3 26 ILE MD 2.792 . 3.766 3.792 3.770 3.812 0.046 3 0 "[ . 1]" 1
267 1 26 ILE HB 3 26 ILE HG12 2.795 . 3.771 3.030 2.865 3.291 . 0 0 "[ . 1]" 1
268 1 26 ILE HB 3 26 ILE MG 3.098 . 4.298 2.366 2.228 2.512 . 0 0 "[ . 1]" 1
269 1 26 ILE MD 1 26 ILE HG12 2.157 . 2.723 2.096 2.084 2.110 . 0 0 "[ . 1]" 1
270 1 26 ILE MD 1 26 ILE HG13 1.766 . 2.156 1.873 1.839 1.889 . 0 0 "[ . 1]" 1
271 1 26 ILE MD 1 26 ILE MG 1.956 . 2.434 2.109 2.038 2.146 . 0 0 "[ . 1]" 1
272 1 26 ILE MD 1 27 LEU H 3.005 . 4.134 4.147 4.069 4.184 0.050 5 0 "[ . 1]" 1
273 1 26 ILE MD 1 27 LEU HG 2.495 . 6.500 6.511 6.391 6.575 0.075 7 0 "[ . 1]" 1
274 1 26 ILE MD 2 28 TYR QD 2.919 . 3.984 3.651 3.422 4.113 0.129 5 0 "[ . 1]" 1
275 1 26 ILE MD 2 28 TYR QE 2.436 . 3.178 2.047 1.906 2.308 . 0 0 "[ . 1]" 1
276 1 26 ILE MD 3 24 GLY HA2 2.865 . 6.500 4.056 3.581 4.470 . 0 0 "[ . 1]" 1
277 1 26 ILE MD 3 26 ILE HA 2.432 . 3.172 3.182 3.058 3.211 0.039 10 0 "[ . 1]" 1
278 1 26 ILE MD 3 26 ILE MG 2.644 . 3.291 2.893 2.662 3.119 . 0 0 "[ . 1]" 1
279 1 26 ILE HG12 1 26 ILE MG 2.427 . 3.164 2.309 2.262 2.384 . 0 0 "[ . 1]" 1
280 1 26 ILE HG12 1 27 LEU H 2.853 . 3.871 3.066 2.884 3.300 . 0 0 "[ . 1]" 1
281 1 26 ILE HG13 3 26 ILE MG 2.549 . 3.361 3.309 3.137 3.379 0.018 1 0 "[ . 1]" 1
282 1 26 ILE HG13 1 27 LEU H 2.988 . 4.104 2.606 2.492 2.736 . 0 0 "[ . 1]" 1
283 1 26 ILE HG13 3 24 GLY HA2 2.855 . 3.874 3.965 3.895 4.334 0.460 6 0 "[ . 1]" 1
284 1 26 ILE HG13 3 26 ILE HA 3.012 . 4.146 2.579 2.333 2.736 . 0 0 "[ . 1]" 1
285 1 26 ILE MG 1 27 LEU H 2.745 . 6.500 3.999 3.948 4.071 . 0 0 "[ . 1]" 1
286 1 26 ILE MG 2 28 TYR QD 2.609 . 3.460 2.443 2.070 3.512 0.052 5 0 "[ . 1]" 1
287 1 26 ILE MG 2 28 TYR QE 2.309 . 2.976 2.087 1.971 2.251 . 0 0 "[ . 1]" 1
288 1 26 ILE MG 3 26 ILE HA 2.603 . 6.500 4.097 4.009 4.151 . 0 0 "[ . 1]" 1
289 1 26 ILE MG 3 26 ILE MG 2.762 . 3.716 3.614 3.492 3.725 0.009 1 0 "[ . 1]" 1
290 1 27 LEU H 1 27 LEU HB2 2.779 . 3.745 2.330 2.293 2.374 . 0 0 "[ . 1]" 1
291 1 27 LEU H 1 27 LEU HB3 2.664 . 3.551 3.573 3.553 3.596 0.045 5 0 "[ . 1]" 1
292 1 27 LEU H 1 27 LEU HB3 2.777 . 3.741 2.773 2.671 2.834 . 0 0 "[ . 1]" 1
293 1 27 LEU H 1 27 LEU QD 2.668 . 3.773 3.373 3.291 3.437 . 0 0 "[ . 1]" 1
294 1 27 LEU H 1 27 LEU QD 2.762 . 3.716 3.243 3.192 3.296 . 0 0 "[ . 1]" 1
295 1 27 LEU H 1 27 LEU HG 2.640 . 3.511 2.891 2.757 2.979 . 0 0 "[ . 1]" 1
296 1 27 LEU H 1 28 SER H 3.270 . 4.607 4.529 4.517 4.541 . 0 0 "[ . 1]" 1
297 1 27 LEU H 1 28 SER H 3.002 . 4.129 4.029 3.952 4.121 . 0 0 "[ . 1]" 1
298 1 27 LEU H 3 25 GLU H 3.465 . 4.814 3.599 3.411 3.746 . 0 0 "[ . 1]" 1
299 1 27 LEU H 3 27 VAL H 3.577 . 5.176 4.520 4.364 4.742 . 0 0 "[ . 1]" 1
300 1 27 LEU HA 1 27 LEU HB2 2.731 . 3.663 2.993 2.983 3.006 . 0 0 "[ . 1]" 1
301 1 27 LEU HA 1 27 LEU HB3 2.720 . 3.645 2.552 2.522 2.580 . 0 0 "[ . 1]" 1
302 1 27 LEU HA 1 27 LEU QD 2.529 . 3.260 1.897 1.794 1.989 . 0 0 "[ . 1]" 1
303 1 27 LEU HA 1 27 LEU HG 2.865 . 3.891 3.008 2.894 3.100 . 0 0 "[ . 1]" 1
304 1 27 LEU HA 1 28 SER H 2.663 . 3.070 2.253 2.230 2.284 . 0 0 "[ . 1]" 1
305 1 27 LEU HB2 1 27 LEU QD 2.401 . 3.122 2.285 2.253 2.330 . 0 0 "[ . 1]" 1
306 1 27 LEU HB2 1 28 SER H 2.992 . 4.111 3.798 3.729 3.845 . 0 0 "[ . 1]" 1
307 1 27 LEU HB2 3 25 GLU HB2 3.098 . 6.500 5.232 5.003 5.432 . 0 0 "[ . 1]" 1
308 1 27 LEU HB3 1 27 LEU QD 2.251 . 2.497 2.081 2.055 2.127 . 0 0 "[ . 1]" 1
309 1 27 LEU HB3 1 28 SER H 2.896 . 3.904 2.499 2.453 2.535 . 0 0 "[ . 1]" 1
310 1 27 LEU MD1 1 27 LEU MD2 1.833 . 2.057 2.026 2.010 2.049 . 0 0 "[ . 1]" 1
311 1 27 LEU QD 1 27 LEU HG 2.094 . 2.465 1.890 1.887 1.894 . 0 0 "[ . 1]" 1
312 1 27 LEU QD 1 28 SER H 2.933 . 3.257 2.867 2.714 3.001 . 0 0 "[ . 1]" 1
313 1 27 LEU QD 1 28 SER QB 2.851 . 6.500 4.571 4.275 4.720 . 0 0 "[ . 1]" 1
314 1 27 LEU QD 3 24 GLY H 3.673 . 4.645 3.307 2.889 3.947 . 0 0 "[ . 1]" 1
315 1 27 LEU QD 3 25 GLU HG2 2.922 . 3.990 3.404 2.778 3.836 . 0 0 "[ . 1]" 1
316 1 27 LEU QD 3 52 ALA H 2.470 . 3.232 2.950 2.846 3.061 . 0 0 "[ . 1]" 1
317 1 27 LEU QD 3 52 ALA HA 2.138 . 2.709 1.795 1.731 1.836 0.014 9 0 "[ . 1]" 1
318 1 27 LEU QD 3 52 ALA MB 1.961 . 2.442 1.984 1.900 2.072 . 0 0 "[ . 1]" 1
319 1 27 LEU QD 3 55 LEU HB2 2.836 . 3.566 3.120 2.834 3.355 . 0 0 "[ . 1]" 1
320 1 27 LEU QD 3 55 LEU HG 2.710 . 3.628 3.308 2.927 3.660 0.032 1 0 "[ . 1]" 1
321 1 27 LEU HG 1 28 SER H 2.856 . 6.500 4.695 4.575 4.766 . 0 0 "[ . 1]" 1
322 1 28 SER H 1 28 SER HA 2.902 . 3.694 2.920 2.897 2.948 . 0 0 "[ . 1]" 1
323 1 28 SER H 1 28 SER HB2 2.957 . 4.050 2.879 2.713 3.152 . 0 0 "[ . 1]" 1
324 1 28 SER H 1 28 SER QB 2.442 . 3.188 2.732 2.653 2.818 . 0 0 "[ . 1]" 1
325 1 28 SER H 1 28 SER HB3 2.832 . 3.835 3.672 2.855 3.906 0.071 5 0 "[ . 1]" 1
326 1 28 SER H 1 29 SER H 3.145 . 4.382 4.206 4.021 4.365 . 0 0 "[ . 1]" 1
327 1 28 SER HA 1 29 SER H 2.387 . 3.064 2.177 2.109 2.273 . 0 0 "[ . 1]" 1
328 1 28 SER HA 3 25 GLU H 2.946 . 6.500 5.770 5.419 6.053 . 0 0 "[ . 1]" 1
329 1 28 SER QB 1 29 SER H 2.536 . 3.340 3.210 2.736 3.422 0.082 9 0 "[ . 1]" 1
330 1 28 SER HB2 1 29 SER H 2.431 . 6.500 4.145 3.935 4.303 . 0 0 "[ . 1]" 1
331 1 28 SER HB3 1 29 SER H 2.516 . 6.500 3.358 2.791 3.708 . 0 0 "[ . 1]" 1
332 1 29 SER H 1 29 SER HA 2.996 . 3.695 2.915 2.875 2.944 . 0 0 "[ . 1]" 1
333 1 29 SER H 1 29 SER HB2 2.419 . 3.151 2.768 2.429 3.664 0.513 3 1 "[ + . 1]" 1
334 1 29 SER H 1 29 SER QB 2.302 . 2.964 2.603 2.264 2.987 0.023 3 0 "[ . 1]" 1
335 1 29 SER H 1 30 THR H 2.673 . 3.566 2.330 2.034 2.558 . 0 0 "[ . 1]" 1
336 1 29 SER HA 1 30 THR H 2.427 . 6.500 3.543 3.516 3.575 . 0 0 "[ . 1]" 1
337 1 29 SER QB 1 30 THR H 2.442 . 3.187 2.236 2.035 2.650 . 0 0 "[ . 1]" 1
338 1 29 SER HB2 1 30 THR H 2.604 . 3.451 2.525 2.056 3.516 0.065 6 0 "[ . 1]" 1
339 1 29 SER HB3 1 30 THR H 2.507 . 3.293 3.114 2.221 3.519 0.226 3 0 "[ . 1]" 1
340 1 30 THR H 1 30 THR HA 2.343 . 3.029 2.785 2.251 2.940 . 0 0 "[ . 1]" 1
341 1 30 THR H 1 30 THR HB 2.519 . 6.500 3.729 3.528 4.054 . 0 0 "[ . 1]" 1
342 1 30 THR H 1 30 THR MG 2.404 . 3.112 2.783 2.415 3.119 0.007 5 0 "[ . 1]" 1
343 1 30 THR HA 1 30 THR MG 2.122 . 2.685 2.281 2.212 2.318 . 0 0 "[ . 1]" 1
344 1 30 THR HB 1 30 THR MG 1.904 . 2.357 2.134 2.130 2.136 . 0 0 "[ . 1]" 1
345 2 25 GLU H 2 25 GLU HA 2.680 . 3.578 2.918 2.884 2.948 . 0 0 "[ . 1]" 1
346 2 25 GLU H 2 25 GLU HB2 2.388 . 6.500 3.686 3.605 3.801 . 0 0 "[ . 1]" 1
347 2 25 GLU H 2 25 GLU HB3 2.360 . 3.056 2.825 2.619 3.084 0.028 5 0 "[ . 1]" 1
348 2 25 GLU H 2 25 GLU HG2 2.485 . 3.257 2.087 1.876 2.257 . 0 0 "[ . 1]" 1
349 2 25 GLU H 2 25 GLU HG3 2.451 . 3.202 3.225 3.144 3.290 0.088 6 0 "[ . 1]" 1
350 2 25 GLU HA 2 26 ILE H 2.131 . 2.699 2.353 2.245 2.563 . 0 0 "[ . 1]" 1
351 2 25 GLU HB2 2 25 GLU HG2 2.387 . 3.099 3.006 2.996 3.012 . 0 0 "[ . 1]" 1
352 2 25 GLU HB2 2 25 GLU HG3 2.302 . 2.965 2.413 2.346 2.481 . 0 0 "[ . 1]" 1
353 2 25 GLU HB2 2 26 ILE H 2.640 . 3.511 2.641 2.269 2.910 . 0 0 "[ . 1]" 1
354 2 25 GLU HB2 2 27 VAL MG1 3.621 . 5.260 3.718 3.358 4.052 . 0 0 "[ . 1]" 1
355 2 25 GLU HB3 2 26 ILE H 2.593 . 6.500 3.919 3.731 4.071 . 0 0 "[ . 1]" 1
356 2 25 GLU HG2 2 27 VAL MG1 2.669 . 3.559 3.549 3.193 3.651 0.092 6 0 "[ . 1]" 1
357 2 25 GLU HG3 2 26 ILE H 2.882 . 3.920 3.716 3.242 3.947 0.027 6 0 "[ . 1]" 1
358 2 25 GLU HG3 2 27 VAL MG1 2.473 . 3.237 2.194 2.003 2.405 . 0 0 "[ . 1]" 1
359 2 25 GLU HG3 2 27 VAL MG2 3.092 . 4.287 3.276 3.010 3.623 . 0 0 "[ . 1]" 1
360 2 26 ILE H 2 26 ILE HA 2.362 . 3.060 2.930 2.897 2.945 . 0 0 "[ . 1]" 1
361 2 26 ILE H 2 26 ILE HB 2.725 . 3.105 2.546 2.426 2.651 . 0 0 "[ . 1]" 1
362 2 26 ILE H 2 26 ILE MD 2.747 . 3.690 3.726 3.621 3.776 0.086 10 0 "[ . 1]" 1
363 2 26 ILE H 2 26 ILE HG12 2.847 . 3.860 3.765 3.552 3.875 0.015 5 0 "[ . 1]" 1
364 2 26 ILE H 2 26 ILE MG 2.738 . 6.500 3.808 3.764 3.853 . 0 0 "[ . 1]" 1
365 2 26 ILE H 2 27 VAL H 3.962 . 5.924 4.222 4.135 4.327 . 0 0 "[ . 1]" 1
366 2 26 ILE HA 2 26 ILE HG12 2.693 . 3.599 2.568 2.468 2.626 . 0 0 "[ . 1]" 1
367 2 26 ILE HA 2 26 ILE MG 2.844 . 3.855 2.381 2.328 2.488 . 0 0 "[ . 1]" 1
368 2 26 ILE HA 2 27 VAL H 2.847 . 3.307 2.152 2.128 2.174 . 0 0 "[ . 1]" 1
369 2 26 ILE HB 2 26 ILE MD 2.216 . 2.830 2.385 2.350 2.406 . 0 0 "[ . 1]" 1
370 2 26 ILE HB 2 26 ILE HG12 2.335 . 3.017 3.021 3.018 3.025 0.008 4 0 "[ . 1]" 1
371 2 26 ILE HB 2 26 ILE MG 2.264 . 2.905 2.132 2.128 2.137 . 0 0 "[ . 1]" 1
372 2 26 ILE MD 2 26 ILE MG 2.087 . 2.631 1.970 1.929 2.006 . 0 0 "[ . 1]" 1
373 2 26 ILE HG12 2 26 ILE MG . . 2.483 2.350 2.316 2.379 . 0 0 "[ . 1]" 1
374 2 26 ILE MG 2 27 VAL H 2.486 . 3.258 3.112 2.942 3.265 0.007 5 0 "[ . 1]" 1
375 2 26 ILE MG 2 28 TYR QE 2.880 . 3.917 3.563 3.251 4.086 0.169 5 0 "[ . 1]" 1
376 2 27 VAL H 2 27 VAL HB 2.752 . 3.699 3.612 3.574 3.645 . 0 0 "[ . 1]" 1
377 2 27 VAL H 2 27 VAL MG1 2.392 . 3.108 3.030 2.932 3.126 0.018 10 0 "[ . 1]" 1
378 2 27 VAL H 2 27 VAL MG2 2.840 . 3.848 1.840 1.806 1.903 0.026 1 0 "[ . 1]" 1
379 2 27 VAL HA 2 27 VAL MG1 2.400 . 2.908 2.148 2.120 2.192 . 0 0 "[ . 1]" 1
380 2 27 VAL HA 2 27 VAL MG2 2.448 . 3.197 3.167 3.149 3.179 . 0 0 "[ . 1]" 1
381 2 27 VAL HA 2 28 TYR H 2.579 . 2.892 2.050 1.939 2.081 . 0 0 "[ . 1]" 1
382 2 27 VAL HB 2 27 VAL MG1 2.095 . 2.644 2.134 2.130 2.136 . 0 0 "[ . 1]" 1
383 2 27 VAL HB 2 27 VAL MG2 2.202 . 2.621 2.114 2.108 2.119 . 0 0 "[ . 1]" 1
384 2 27 VAL MG1 2 27 VAL MG2 1.720 . 2.090 2.073 2.057 2.081 . 0 0 "[ . 1]" 1
385 2 27 VAL MG1 2 28 TYR H 2.638 . 3.508 3.516 3.413 3.557 0.049 7 0 "[ . 1]" 1
386 2 27 VAL MG1 2 29 LEU QD 3.180 . 4.444 3.446 3.252 3.652 . 0 0 "[ . 1]" 1
387 2 27 VAL MG1 2 59 LYS HD2 2.798 . 3.777 3.000 1.873 3.736 . 0 0 "[ . 1]" 1
388 2 27 VAL MG1 2 59 LYS HD3 . . 3.384 2.788 2.000 3.643 0.259 1 0 "[ . 1]" 1
389 2 27 VAL MG1 2 59 LYS QE 2.480 . 3.249 2.154 1.878 3.290 0.041 7 0 "[ . 1]" 1
390 2 27 VAL MG2 2 29 LEU QD 1.832 . 2.252 2.241 2.196 2.274 0.022 8 0 "[ . 1]" 1
391 2 27 VAL MG2 2 55 LEU HG 2.463 . 3.221 3.219 3.142 3.267 0.046 1 0 "[ . 1]" 1
392 2 27 VAL MG2 2 59 LYS HB2 2.875 . 6.500 5.160 4.900 5.369 . 0 0 "[ . 1]" 1
393 2 27 VAL MG2 2 59 LYS HD2 3.213 . 4.503 3.044 2.218 3.828 . 0 0 "[ . 1]" 1
394 2 27 VAL MG2 2 59 LYS HD3 2.978 . 4.087 4.092 3.009 4.955 0.868 7 1 "[ . + 1]" 1
395 2 27 VAL MG2 2 59 LYS HD3 2.714 . 3.635 3.387 2.617 3.802 0.167 7 0 "[ . 1]" 1
396 2 27 VAL MG2 2 59 LYS HG2 2.412 . 3.139 2.993 2.661 3.374 0.235 5 0 "[ . 1]" 1
397 2 27 VAL MG2 2 59 LYS HG3 2.546 . 3.356 3.192 2.964 3.406 0.050 3 0 "[ . 1]" 1
398 2 28 TYR H 2 28 TYR HB2 3.069 . 3.260 2.451 2.036 2.566 . 0 0 "[ . 1]" 1
399 2 28 TYR H 2 28 TYR HB3 3.159 . 3.891 3.564 2.939 3.649 . 0 0 "[ . 1]" 1
400 2 28 TYR H 2 28 TYR QD 3.070 . 4.248 2.292 1.994 3.749 . 0 0 "[ . 1]" 1
401 2 28 TYR HA 2 29 LEU H 2.821 . 3.816 2.202 2.165 2.319 . 0 0 "[ . 1]" 1
402 2 28 TYR HB2 2 28 TYR QD 2.655 . 3.536 2.499 2.458 2.622 . 0 0 "[ . 1]" 1
403 2 28 TYR HB3 2 28 TYR QD 2.787 . 3.758 2.326 2.253 2.350 . 0 0 "[ . 1]" 1
404 2 28 TYR QD 2 29 LEU H 3.877 . 5.756 4.676 4.514 4.811 . 0 0 "[ . 1]" 1
405 2 29 LEU H 2 29 LEU HB2 2.969 . 4.071 2.921 2.520 3.745 . 0 0 "[ . 1]" 1
406 2 29 LEU H 2 29 LEU HB3 2.902 . 3.955 3.622 3.404 3.741 . 0 0 "[ . 1]" 1
407 2 29 LEU H 2 29 LEU QD 2.955 . 4.046 2.146 1.958 2.516 . 0 0 "[ . 1]" 1
408 2 29 LEU H 2 29 LEU HG 2.957 . 4.050 3.530 2.025 4.143 0.093 7 0 "[ . 1]" 1
409 2 29 LEU HA 2 29 LEU HB2 2.691 . 3.596 2.894 2.611 3.012 . 0 0 "[ . 1]" 1
410 2 29 LEU HA 2 29 LEU HB3 2.855 . 3.874 2.397 2.297 2.462 . 0 0 "[ . 1]" 1
411 2 29 LEU QB 2 29 LEU QD 2.279 . 2.928 1.945 1.790 2.026 . 0 0 "[ . 1]" 1
412 2 29 LEU QB 2 32 LEU QD 2.255 . 2.890 2.165 1.899 2.671 . 0 0 "[ . 1]" 1
413 2 29 LEU HB2 2 29 LEU QD 2.275 . 2.480 2.136 1.966 2.241 . 0 0 "[ . 1]" 1
414 2 29 LEU HB2 2 58 ALA MB 2.645 . 3.519 3.701 3.587 3.772 0.253 6 0 "[ . 1]" 1
415 2 29 LEU HB3 2 29 LEU QD 2.230 . 2.851 2.238 2.060 2.346 . 0 0 "[ . 1]" 1
416 2 29 LEU HB3 2 32 LEU H 2.656 . 6.500 4.244 3.488 5.710 . 0 0 "[ . 1]" 1
417 2 29 LEU HB3 2 58 ALA MB 2.721 . 3.647 3.534 3.372 3.727 0.080 10 0 "[ . 1]" 1
418 2 29 LEU QD 2 31 ASN H 3.924 . 5.849 4.537 4.368 4.794 . 0 0 "[ . 1]" 1
419 2 29 LEU QD 2 32 LEU HA 3.311 . 6.500 5.390 5.058 5.562 . 0 0 "[ . 1]" 1
420 2 29 LEU QD 2 32 LEU QD 2.454 . 3.207 2.367 1.722 2.663 . 0 0 "[ . 1]" 1
421 2 29 LEU QD 2 32 LEU HG 2.519 . 3.312 3.059 2.470 3.290 . 0 0 "[ . 1]" 1
422 2 29 LEU QD 2 58 ALA HA 2.951 . 4.039 3.636 3.227 3.857 . 0 0 "[ . 1]" 1
423 2 29 LEU QD 2 58 ALA MB 2.103 . 2.656 2.162 1.588 2.461 . 0 0 "[ . 1]" 1
424 2 29 LEU QD 2 59 LYS HB2 3.447 . 4.933 4.358 3.750 4.947 0.014 10 0 "[ . 1]" 1
425 2 29 LEU QD 2 62 ASN H 2.715 . 3.636 3.410 3.124 3.684 0.048 1 0 "[ . 1]" 1
426 2 29 LEU QD 2 62 ASN HB2 3.376 . 4.801 3.434 2.023 4.470 . 0 0 "[ . 1]" 1
427 2 29 LEU QD 2 62 ASN HB3 2.848 . 3.862 2.746 2.149 3.885 0.023 10 0 "[ . 1]" 1
428 2 29 LEU HG 2 32 LEU QD 2.365 . 3.064 2.335 1.973 3.022 . 0 0 "[ . 1]" 1
429 2 30 PRO HA 2 31 ASN H 3.427 . 4.560 3.444 3.349 3.511 . 0 0 "[ . 1]" 1
430 2 30 PRO HB3 2 31 ASN H 3.540 . 4.809 4.319 4.224 4.388 . 0 0 "[ . 1]" 1
431 2 30 PRO HD2 2 30 PRO HG2 2.967 . 4.067 2.274 2.262 2.319 . 0 0 "[ . 1]" 1
432 2 30 PRO HD2 2 30 PRO HG3 2.909 . 3.967 2.818 2.770 2.989 . 0 0 "[ . 1]" 1
433 2 30 PRO HD2 2 31 ASN H 3.683 . 4.449 2.203 1.879 2.428 0.108 7 0 "[ . 1]" 1
434 2 30 PRO HD3 2 31 ASN H 3.375 . 4.298 3.593 3.366 3.765 . 0 0 "[ . 1]" 1
435 2 30 PRO HG2 2 31 ASN H 3.118 . 3.970 2.996 2.638 3.620 . 0 0 "[ . 1]" 1
436 2 30 PRO HG3 2 31 ASN H 3.083 . 4.271 4.186 3.973 4.306 0.035 1 0 "[ . 1]" 1
437 2 31 ASN H 2 31 ASN HB2 3.372 . 4.001 2.517 2.426 2.598 . 0 0 "[ . 1]" 1
438 2 31 ASN H 2 31 ASN HB3 3.247 . 4.565 3.593 2.814 3.703 . 0 0 "[ . 1]" 1
439 2 31 ASN H 2 32 LEU H 2.747 . 3.594 2.455 2.337 2.646 . 0 0 "[ . 1]" 1
440 2 31 ASN H 2 32 LEU HA 4.118 . 6.238 4.719 4.613 4.834 . 0 0 "[ . 1]" 1
441 2 31 ASN H 2 32 LEU QD 3.539 . 5.105 4.091 3.865 4.248 . 0 0 "[ . 1]" 1
442 2 31 ASN H 2 62 ASN HA 3.824 . 4.342 3.815 3.569 4.131 . 0 0 "[ . 1]" 1
443 2 31 ASN HA 2 31 ASN HB2 2.623 . 3.483 2.597 2.277 2.696 . 0 0 "[ . 1]" 1
444 2 31 ASN HA 2 31 ASN HB3 2.659 . 3.543 2.282 2.177 2.681 . 0 0 "[ . 1]" 1
445 2 31 ASN HA 2 32 LEU H 3.230 . 3.690 3.176 3.044 3.252 . 0 0 "[ . 1]" 1
446 2 31 ASN HB2 2 32 LEU H 2.879 . 3.915 3.780 3.588 4.284 0.369 7 0 "[ . 1]" 1
447 2 31 ASN HB2 2 62 ASN HA 2.947 . 4.033 2.499 1.951 3.791 . 0 0 "[ . 1]" 1
448 2 31 ASN HB3 2 32 LEU H 3.531 . 5.090 4.288 3.756 4.456 . 0 0 "[ . 1]" 1
449 2 31 ASN HB3 2 62 ASN HA 2.776 . 3.739 3.356 2.099 3.756 0.017 10 0 "[ . 1]" 1
450 2 32 LEU H 2 32 LEU QB 2.690 . 3.595 2.378 2.366 2.397 . 0 0 "[ . 1]" 1
451 2 32 LEU H 2 32 LEU HB3 2.616 . 3.471 2.548 2.489 2.646 . 0 0 "[ . 1]" 1
452 2 32 LEU H 2 32 LEU QD 3.099 . 3.437 3.130 2.967 3.244 . 0 0 "[ . 1]" 1
453 2 32 LEU H 2 32 LEU HG 2.617 . 3.473 2.607 2.538 2.721 . 0 0 "[ . 1]" 1
454 2 32 LEU H 2 62 ASN HA 3.068 . 4.244 4.071 3.827 4.258 0.014 4 0 "[ . 1]" 1
455 2 32 LEU HA 2 32 LEU QD 2.728 . 3.018 1.925 1.853 1.981 . 0 0 "[ . 1]" 1
456 2 32 LEU HA 2 33 ASN H 2.634 . 3.147 2.247 2.096 2.346 . 0 0 "[ . 1]" 1
457 2 32 LEU HA 2 37 LEU MD2 2.839 . 6.500 4.965 4.698 5.295 . 0 0 "[ . 1]" 1
458 2 32 LEU QB 2 33 ASN H 2.985 . 4.099 2.574 2.245 3.002 . 0 0 "[ . 1]" 1
459 2 32 LEU QD 2 32 LEU HG 2.163 . 2.688 1.884 1.879 1.887 . 0 0 "[ . 1]" 1
460 2 32 LEU QD 2 32 LEU HG 1.914 . 2.372 1.762 1.759 1.765 . 0 0 "[ . 1]" 1
461 2 32 LEU QD 2 33 ASN H 2.970 . 3.154 3.152 3.111 3.178 0.024 9 0 "[ . 1]" 1
462 2 32 LEU QD 2 37 LEU HG 2.211 . 6.500 3.143 2.637 3.548 . 0 0 "[ . 1]" 1
463 2 32 LEU QD 2 58 ALA HA 2.990 . 4.108 2.503 2.220 2.850 . 0 0 "[ . 1]" 1
464 2 32 LEU QD 2 58 ALA MB 2.499 . 3.280 1.979 1.797 2.353 . 0 0 "[ . 1]" 1
465 2 32 LEU QD 2 61 LEU HB3 2.467 . 3.228 1.815 1.617 1.960 0.089 8 0 "[ . 1]" 1
466 2 32 LEU QD 2 61 LEU MD2 1.801 . 2.206 2.171 1.992 2.257 0.051 2 0 "[ . 1]" 1
467 2 32 LEU QD 2 61 LEU HG 2.279 . 6.500 3.502 3.177 3.882 . 0 0 "[ . 1]" 1
468 2 32 LEU QD 2 62 ASN H 2.434 . 3.174 2.298 2.092 2.431 . 0 0 "[ . 1]" 1
469 2 32 LEU QD 2 62 ASN HA 2.620 . 3.478 2.564 2.327 2.802 . 0 0 "[ . 1]" 1
470 2 32 LEU QD 2 62 ASN HB3 2.753 . 3.461 2.843 2.373 3.814 0.353 10 0 "[ . 1]" 1
471 2 32 LEU MD1 2 32 LEU MD2 1.719 . 2.088 1.842 1.836 1.846 . 0 0 "[ . 1]" 1
472 2 32 LEU HG 2 37 LEU MD2 2.295 . 6.500 3.612 3.242 3.957 . 0 0 "[ . 1]" 1
473 2 32 LEU HG 2 62 ASN H 2.908 . 3.965 4.013 3.993 4.043 0.078 5 0 "[ . 1]" 1
474 2 33 ASN H 2 33 ASN HB2 2.984 . 4.097 2.557 2.450 2.726 . 0 0 "[ . 1]" 1
475 2 33 ASN H 2 33 ASN HB2 2.805 . 3.789 2.409 2.302 2.543 . 0 0 "[ . 1]" 1
476 2 33 ASN H 2 33 ASN HB3 3.360 . 3.998 3.516 2.384 3.689 . 0 0 "[ . 1]" 1
477 2 33 ASN HA 2 36 GLN H 2.559 . 6.500 4.430 4.205 4.721 . 0 0 "[ . 1]" 1
478 2 33 ASN HB2 2 33 ASN HD21 2.461 . 3.218 2.269 2.099 2.941 . 0 0 "[ . 1]" 1
479 2 33 ASN HB2 2 34 PRO HD3 2.612 . 3.465 3.065 2.373 3.818 0.353 10 0 "[ . 1]" 1
480 2 33 ASN HB3 2 33 ASN HD21 2.681 . 3.579 2.894 2.207 3.337 . 0 0 "[ . 1]" 1
481 2 33 ASN HB3 2 33 ASN HD22 2.652 . 3.531 3.768 3.471 3.979 0.448 6 0 "[ . 1]" 1
482 2 33 ASN HD21 2 36 GLN QG 3.008 . 3.626 2.605 2.450 2.845 . 0 0 "[ . 1]" 1
483 2 33 ASN HD22 2 36 GLN QG 2.955 . 4.046 3.904 3.683 4.018 . 0 0 "[ . 1]" 1
484 2 34 PRO HA 2 35 ASP H 2.945 . 4.029 3.549 3.516 3.586 . 0 0 "[ . 1]" 1
485 2 34 PRO HA 2 37 LEU H 3.562 . 4.089 3.652 3.540 3.762 . 0 0 "[ . 1]" 1
486 2 34 PRO HA 2 37 LEU HB2 2.901 . 3.953 3.153 2.897 3.446 . 0 0 "[ . 1]" 1
487 2 34 PRO HA 2 37 LEU MD1 2.721 . 3.646 2.584 2.088 2.964 . 0 0 "[ . 1]" 1
488 2 34 PRO HA 2 37 LEU HG 2.887 . 3.929 3.550 3.053 3.971 0.042 8 0 "[ . 1]" 1
489 2 34 PRO HA 3 41 ILE MD 2.924 . 3.993 3.785 3.611 3.998 0.005 7 0 "[ . 1]" 1
490 2 34 PRO HA 3 41 ILE MG 2.502 . 3.285 2.074 1.840 2.274 . 0 0 "[ . 1]" 1
491 2 34 PRO QB 2 36 GLN H 2.953 . 6.500 4.564 4.361 4.725 . 0 0 "[ . 1]" 1
492 2 34 PRO HB2 2 35 ASP H 2.719 . 3.461 2.331 2.208 2.454 . 0 0 "[ . 1]" 1
493 2 34 PRO HB2 3 42 HIS HA 2.966 . 4.066 3.875 3.339 4.091 0.025 3 0 "[ . 1]" 1
494 2 34 PRO HB3 2 35 ASP H 2.798 . 3.777 3.751 3.670 3.831 0.054 4 0 "[ . 1]" 1
495 2 34 PRO HB3 3 41 ILE MG 2.492 . 3.268 2.119 1.953 2.237 . 0 0 "[ . 1]" 1
496 2 34 PRO HD2 2 34 PRO HG3 3.035 . 4.187 2.528 2.511 2.540 . 0 0 "[ . 1]" 1
497 2 34 PRO HD3 2 35 ASP H 3.030 . 4.178 4.217 3.995 4.434 0.256 9 0 "[ . 1]" 1
498 2 34 PRO HG2 3 41 ILE MG 2.852 . 6.500 4.156 3.873 4.397 . 0 0 "[ . 1]" 1
499 2 34 PRO HG3 3 41 ILE MG 2.755 . 3.704 3.142 2.567 3.548 . 0 0 "[ . 1]" 1
500 2 35 ASP H 2 35 ASP HA 2.586 . 3.422 2.804 2.775 2.852 . 0 0 "[ . 1]" 1
501 2 35 ASP H 2 35 ASP HB2 2.147 . 2.723 2.161 2.071 2.348 . 0 0 "[ . 1]" 1
502 2 35 ASP H 2 36 GLN H 2.471 . 3.234 2.702 2.536 2.768 . 0 0 "[ . 1]" 1
503 2 35 ASP HA 2 35 ASP QB 2.264 . 2.904 2.098 2.059 2.152 . 0 0 "[ . 1]" 1
504 2 35 ASP HA 2 36 GLN H 3.195 . 4.471 3.525 3.460 3.565 . 0 0 "[ . 1]" 1
505 2 35 ASP HA 2 36 GLN H 2.845 . 3.857 3.137 3.095 3.169 . 0 0 "[ . 1]" 1
506 2 35 ASP HA 2 39 ALA H 4.440 . 6.904 4.374 3.969 5.387 . 0 0 "[ . 1]" 1
507 2 36 GLN H 2 36 GLN HA 2.570 . 3.395 2.840 2.777 2.884 . 0 0 "[ . 1]" 1
508 2 36 GLN H 2 36 GLN QG 2.682 . 3.581 2.566 2.267 3.335 . 0 0 "[ . 1]" 1
509 2 36 GLN H 2 37 LEU H 2.863 . 3.887 2.625 2.431 2.792 . 0 0 "[ . 1]" 1
510 2 36 GLN HB2 2 36 GLN QG 2.452 . 3.203 2.151 2.022 2.288 . 0 0 "[ . 1]" 1
511 2 36 GLN HB2 2 36 GLN QG 2.432 . 3.171 2.091 2.006 2.158 . 0 0 "[ . 1]" 1
512 2 36 GLN HB3 2 36 GLN QG 2.419 . 3.150 2.118 2.025 2.165 . 0 0 "[ . 1]" 1
513 2 36 GLN HB3 2 36 GLN QG 2.417 . 3.147 2.181 2.105 2.317 . 0 0 "[ . 1]" 1
514 2 36 GLN QG 2 39 ALA MB 2.998 . 4.122 3.969 3.918 4.028 . 0 0 "[ . 1]" 1
515 2 36 GLN QG 2 61 LEU MD2 2.938 . 3.986 2.831 2.436 3.243 . 0 0 "[ . 1]" 1
516 2 37 LEU H 2 37 LEU HB2 2.471 . 3.234 2.481 2.432 2.539 . 0 0 "[ . 1]" 1
517 2 37 LEU H 2 37 LEU HB3 2.940 . 4.021 3.609 3.594 3.621 . 0 0 "[ . 1]" 1
518 2 37 LEU H 2 37 LEU MD1 2.291 . 6.500 3.610 3.541 3.722 . 0 0 "[ . 1]" 1
519 2 37 LEU H 2 37 LEU MD2 2.581 . 3.414 3.461 3.438 3.487 0.073 9 0 "[ . 1]" 1
520 2 37 LEU H 2 37 LEU HG 2.647 . 3.523 2.391 2.295 2.519 . 0 0 "[ . 1]" 1
521 2 37 LEU HA 2 40 PHE H 2.534 . 3.337 3.354 3.304 3.396 0.059 2 0 "[ . 1]" 1
522 2 37 LEU HB2 2 37 LEU MD1 1.763 . 2.152 2.232 2.215 2.252 0.100 6 0 "[ . 1]" 1
523 2 37 LEU HB2 2 37 LEU HG 2.192 . 2.793 2.488 2.449 2.517 . 0 0 "[ . 1]" 1
524 2 37 LEU HB2 2 41 ILE MD 2.732 . 3.665 3.703 3.668 3.735 0.070 5 0 "[ . 1]" 1
525 2 37 LEU HB2 3 41 ILE MD 2.506 . 3.291 2.142 2.012 2.285 . 0 0 "[ . 1]" 1
526 2 37 LEU HB2 3 41 ILE MG 2.447 . 3.195 2.433 2.281 2.565 . 0 0 "[ . 1]" 1
527 2 37 LEU HB3 2 41 ILE MD 2.736 . 3.672 2.482 2.293 2.745 . 0 0 "[ . 1]" 1
528 2 37 LEU HB3 2 41 ILE MD 2.545 . 3.355 1.950 1.870 2.055 . 0 0 "[ . 1]" 1
529 2 37 LEU HB3 3 41 ILE MG 2.716 . 3.638 3.381 3.197 3.508 . 0 0 "[ . 1]" 1
530 2 37 LEU MD1 2 37 LEU HG 1.788 . 2.188 1.888 1.886 1.889 . 0 0 "[ . 1]" 1
531 2 37 LEU MD1 3 41 ILE MD 2.150 . 2.728 1.672 1.639 1.704 . 0 0 "[ . 1]" 1
532 2 37 LEU MD1 3 41 ILE MD 2.564 . 3.385 1.955 1.861 2.104 . 0 0 "[ . 1]" 1
533 2 37 LEU MD1 3 41 ILE MG 2.057 . 2.068 1.814 1.749 1.949 . 0 0 "[ . 1]" 1
534 2 37 LEU MD2 2 37 LEU HG 1.925 . 2.388 1.893 1.890 1.895 . 0 0 "[ . 1]" 1
535 2 37 LEU MD2 2 41 ILE MD 2.184 . 2.780 2.337 1.935 2.698 . 0 0 "[ . 1]" 1
536 2 37 LEU MD2 3 41 ILE MD 2.453 . 3.205 3.259 3.221 3.295 0.090 4 0 "[ . 1]" 1
537 2 37 LEU HG 3 41 ILE MD 2.532 . 3.334 3.413 3.375 3.450 0.116 3 0 "[ . 1]" 1
538 2 37 LEU HG 3 41 ILE MG 2.882 . 3.920 3.209 3.144 3.317 . 0 0 "[ . 1]" 1
539 2 37 LEU HG 3 41 ILE MD 3.068 . 3.845 3.722 3.697 3.758 . 0 0 "[ . 1]" 1
540 2 37 LEU HG 3 41 ILE MG 2.521 . 6.500 3.685 3.582 3.831 . 0 0 "[ . 1]" 1
541 2 39 ALA H 2 39 ALA HA 2.623 . 3.483 2.831 2.795 2.875 . 0 0 "[ . 1]" 1
542 2 39 ALA H 2 39 ALA HA 2.332 . 3.012 2.521 2.484 2.551 . 0 0 "[ . 1]" 1
543 2 39 ALA H 2 39 ALA MB 1.734 . 2.110 1.991 1.979 2.005 . 0 0 "[ . 1]" 1
544 2 39 ALA H 2 40 PHE H 2.641 . 3.506 2.671 2.513 2.791 . 0 0 "[ . 1]" 1
545 2 39 ALA HA 2 39 ALA MB 1.848 . 2.178 1.897 1.895 1.899 . 0 0 "[ . 1]" 1
546 2 39 ALA HA 2 40 PHE H 3.085 . 4.275 3.561 3.547 3.583 . 0 0 "[ . 1]" 1
547 2 39 ALA HA 2 42 HIS H 3.506 . 5.043 3.733 3.602 3.857 . 0 0 "[ . 1]" 1
548 2 39 ALA MB 2 40 PHE H 2.424 . 3.158 2.407 2.320 2.443 . 0 0 "[ . 1]" 1
549 2 39 ALA MB 2 42 HIS QB 3.030 . 4.178 3.991 3.770 4.107 . 0 0 "[ . 1]" 1
550 2 40 PHE H 2 40 PHE HA 2.795 . 3.554 2.815 2.790 2.852 . 0 0 "[ . 1]" 1
551 2 40 PHE H 2 40 PHE QB 2.350 . 2.974 2.155 2.069 2.385 . 0 0 "[ . 1]" 1
552 2 40 PHE H 2 40 PHE QD 2.838 . 3.845 3.618 2.385 3.928 0.083 1 0 "[ . 1]" 1
553 2 40 PHE H 2 41 ILE H 2.938 . 4.010 2.719 2.585 2.793 . 0 0 "[ . 1]" 1
554 2 40 PHE HA 2 40 PHE QD 2.607 . 3.456 2.714 2.060 2.917 . 0 0 "[ . 1]" 1
555 2 40 PHE HA 2 43 SER H 3.180 . 4.444 3.368 3.070 3.535 . 0 0 "[ . 1]" 1
556 2 40 PHE QB 2 40 PHE QD 2.505 . 3.290 2.119 2.105 2.161 . 0 0 "[ . 1]" 1
557 2 40 PHE QD 2 41 ILE H 3.099 . 4.299 3.364 2.870 4.344 0.045 5 0 "[ . 1]" 1
558 2 41 ILE H 2 41 ILE HA 2.864 . 3.875 2.817 2.784 2.829 . 0 0 "[ . 1]" 1
559 2 41 ILE H 2 41 ILE HB 2.679 . 3.576 2.483 2.449 2.520 . 0 0 "[ . 1]" 1
560 2 41 ILE H 2 41 ILE MD 3.121 . 3.422 3.388 3.270 3.438 0.016 4 0 "[ . 1]" 1
561 2 41 ILE H 2 41 ILE HG12 2.893 . 3.939 3.536 3.447 3.621 . 0 0 "[ . 1]" 1
562 2 41 ILE H 2 41 ILE HG13 2.622 . 3.481 2.141 1.996 2.197 . 0 0 "[ . 1]" 1
563 2 41 ILE H 2 41 ILE MG 2.473 . 6.500 3.756 3.748 3.765 . 0 0 "[ . 1]" 1
564 2 41 ILE H 2 42 HIS H 3.056 . 3.294 2.590 2.529 2.668 . 0 0 "[ . 1]" 1
565 2 41 ILE HA 2 41 ILE MD 2.826 . 3.824 3.842 3.834 3.863 0.039 2 0 "[ . 1]" 1
566 2 41 ILE HA 2 41 ILE HG12 2.844 . 3.855 2.593 2.573 2.643 . 0 0 "[ . 1]" 1
567 2 41 ILE HA 2 41 ILE MG 2.513 . 3.303 2.418 2.392 2.446 . 0 0 "[ . 1]" 1
568 2 41 ILE HA 2 42 HIS H 2.577 . 3.407 3.480 3.451 3.494 0.087 4 0 "[ . 1]" 1
569 2 41 ILE HA 2 44 ILE H 3.239 . 4.550 3.248 3.135 3.425 . 0 0 "[ . 1]" 1
570 2 41 ILE HB 2 41 ILE MD 2.685 . 3.586 2.374 2.351 2.393 . 0 0 "[ . 1]" 1
571 2 41 ILE HB 2 41 ILE MD 2.474 . 3.239 2.136 2.125 2.149 . 0 0 "[ . 1]" 1
572 2 41 ILE HB 2 42 HIS H 2.992 . 4.111 2.729 2.645 2.862 . 0 0 "[ . 1]" 1
573 2 41 ILE HB 2 45 HIS H 2.886 . 6.500 5.993 5.801 6.159 . 0 0 "[ . 1]" 1
574 2 41 ILE MD 2 41 ILE HG12 2.296 . 2.955 2.113 2.112 2.115 . 0 0 "[ . 1]" 1
575 2 41 ILE MD 2 41 ILE HG13 2.315 . 2.985 2.116 2.114 2.117 . 0 0 "[ . 1]" 1
576 2 41 ILE MD 2 41 ILE MG 1.822 . 2.237 1.769 1.731 1.799 . 0 0 "[ . 1]" 1
577 2 41 ILE MD 2 42 HIS H 3.335 . 4.726 4.567 4.524 4.628 . 0 0 "[ . 1]" 1
578 2 41 ILE MD 2 44 ILE MD 2.596 . 6.500 6.303 6.076 6.472 . 0 0 "[ . 1]" 1
579 2 41 ILE MD 3 34 PRO HA 2.926 . 3.996 3.946 3.800 4.038 0.042 5 0 "[ . 1]" 1
580 2 41 ILE MG 2 42 HIS H 3.128 . 3.675 3.479 3.406 3.652 . 0 0 "[ . 1]" 1
581 2 41 ILE MG 2 42 HIS HA 2.773 . 3.734 3.540 3.432 3.744 0.010 2 0 "[ . 1]" 1
582 2 41 ILE MG 3 34 PRO HA 2.442 . 3.187 2.503 2.171 2.829 . 0 0 "[ . 1]" 1
583 2 41 ILE MG 3 34 PRO HB3 2.480 . 3.249 2.845 2.230 3.264 0.015 9 0 "[ . 1]" 1
584 2 41 ILE MG 3 34 PRO HG2 2.750 . 3.696 3.799 3.495 3.888 0.192 5 0 "[ . 1]" 1
585 2 41 ILE MG 3 34 PRO HG3 2.852 . 3.869 2.287 1.959 2.502 . 0 0 "[ . 1]" 1
586 2 41 ILE MG 3 37 LEU MD2 1.887 . 2.332 1.931 1.773 2.319 . 0 0 "[ . 1]" 1
587 2 42 HIS H 2 42 HIS HA 2.982 . 3.812 2.822 2.806 2.845 . 0 0 "[ . 1]" 1
588 2 42 HIS H 2 43 SER H 2.737 . 3.674 2.603 2.492 2.708 . 0 0 "[ . 1]" 1
589 2 42 HIS H 2 45 HIS QB 2.393 . 6.500 5.389 4.884 6.232 . 0 0 "[ . 1]" 1
590 2 42 HIS HA 2 42 HIS QB 2.360 . 3.056 2.146 2.122 2.164 . 0 0 "[ . 1]" 1
591 2 42 HIS HA 2 43 SER H 2.316 . 6.500 3.518 3.489 3.563 . 0 0 "[ . 1]" 1
592 2 42 HIS HA 2 45 HIS H 3.312 . 4.394 3.607 3.357 3.994 . 0 0 "[ . 1]" 1
593 2 42 HIS HA 2 46 ASP H 3.168 . 4.422 4.143 3.982 4.461 0.039 2 0 "[ . 1]" 1
594 2 42 HIS HA 3 34 PRO HB3 2.966 . 4.066 2.789 2.092 3.772 . 0 0 "[ . 1]" 1
595 2 42 HIS QB 2 43 SER H 2.554 . 3.369 2.586 2.328 2.701 . 0 0 "[ . 1]" 1
596 2 42 HIS QB 2 45 HIS H 2.687 . 6.500 5.160 4.918 5.493 . 0 0 "[ . 1]" 1
597 2 43 SER H 2 43 SER HA 2.503 . 3.286 2.841 2.826 2.863 . 0 0 "[ . 1]" 1
598 2 43 SER H 2 44 ILE H 2.720 . 3.645 2.580 2.514 2.662 . 0 0 "[ . 1]" 1
599 2 43 SER H 2 44 ILE MG 2.823 . 6.500 5.886 5.809 5.969 . 0 0 "[ . 1]" 1
600 2 43 SER H 2 46 ASP QB 2.905 . 6.500 4.668 4.281 5.450 . 0 0 "[ . 1]" 1
601 2 43 SER HA 2 44 ILE H 3.538 . 5.102 3.496 3.461 3.533 . 0 0 "[ . 1]" 1
602 2 43 SER HA 2 46 ASP H 3.013 . 4.148 3.374 3.110 3.809 . 0 0 "[ . 1]" 1
603 2 43 SER HA 2 46 ASP QB 2.598 . 3.442 2.540 1.995 3.468 0.026 2 0 "[ . 1]" 1
604 2 43 SER HA 2 47 ASP H 3.022 . 4.164 3.384 3.072 3.885 . 0 0 "[ . 1]" 1
605 2 44 ILE H 2 44 ILE HB 2.414 . 3.142 2.542 2.511 2.573 . 0 0 "[ . 1]" 1
606 2 44 ILE H 2 44 ILE MD 2.641 . 3.513 3.306 3.231 3.390 . 0 0 "[ . 1]" 1
607 2 44 ILE H 2 44 ILE HG12 2.615 . 3.470 2.209 2.136 2.275 . 0 0 "[ . 1]" 1
608 2 44 ILE H 2 44 ILE HG13 2.740 . 3.678 3.656 3.594 3.700 0.022 5 0 "[ . 1]" 1
609 2 44 ILE H 2 44 ILE MG 2.337 . 6.500 3.787 3.777 3.799 . 0 0 "[ . 1]" 1
610 2 44 ILE H 2 45 HIS H 2.987 . 4.087 2.599 2.500 2.760 . 0 0 "[ . 1]" 1
611 2 44 ILE HA 2 44 ILE HB 2.563 . 3.384 3.027 3.025 3.028 . 0 0 "[ . 1]" 1
612 2 44 ILE HA 2 44 ILE MD 2.337 . 3.019 2.019 1.984 2.045 . 0 0 "[ . 1]" 1
613 2 44 ILE HA 2 44 ILE HG12 2.774 . 3.736 3.043 2.997 3.089 . 0 0 "[ . 1]" 1
614 2 44 ILE HA 2 44 ILE MG 2.279 . 2.928 2.414 2.401 2.444 . 0 0 "[ . 1]" 1
615 2 44 ILE HA 2 45 HIS H 2.820 . 3.814 3.525 3.490 3.560 . 0 0 "[ . 1]" 1
616 2 44 ILE HA 2 47 ASP H 3.147 . 4.385 3.743 3.627 3.925 . 0 0 "[ . 1]" 1
617 2 44 ILE HB 2 44 ILE MD 2.387 . 3.729 3.241 3.237 3.247 . 0 0 "[ . 1]" 1
618 2 44 ILE HB 2 44 ILE HG12 2.913 . 3.974 2.472 2.461 2.483 . 0 0 "[ . 1]" 1
619 2 44 ILE HB 2 44 ILE HG13 2.750 . 3.695 2.452 2.439 2.464 . 0 0 "[ . 1]" 1
620 2 44 ILE HB 2 44 ILE MG 2.238 . 2.864 2.133 2.131 2.136 . 0 0 "[ . 1]" 1
621 2 44 ILE HB 2 45 HIS H 2.823 . 3.819 2.493 2.213 2.683 . 0 0 "[ . 1]" 1
622 2 44 ILE HB 2 45 HIS QB 2.824 . 3.821 3.755 3.708 3.858 0.037 5 0 "[ . 1]" 1
623 2 44 ILE MD 2 44 ILE HG12 2.302 . 2.965 2.121 2.119 2.124 . 0 0 "[ . 1]" 1
624 2 44 ILE MD 2 44 ILE HG13 2.279 . 2.928 2.122 2.121 2.125 . 0 0 "[ . 1]" 1
625 2 44 ILE MD 2 44 ILE MG 1.665 . 2.011 1.953 1.932 1.974 . 0 0 "[ . 1]" 1
626 2 44 ILE MD 2 45 HIS H 3.246 . 4.563 4.614 4.567 4.651 0.088 6 0 "[ . 1]" 1
627 2 44 ILE MD 2 47 ASP H 2.920 . 6.500 5.143 4.999 5.304 . 0 0 "[ . 1]" 1
628 2 44 ILE MD 2 51 SER H 3.019 . 4.158 4.196 4.178 4.226 0.068 5 0 "[ . 1]" 1
629 2 44 ILE MD 2 51 SER HA 2.662 . 3.353 2.189 2.120 2.332 . 0 0 "[ . 1]" 1
630 2 44 ILE MD 2 51 SER QB 2.644 . 3.518 2.507 2.100 3.016 . 0 0 "[ . 1]" 1
631 2 44 ILE HG12 2 44 ILE MG 2.460 . 3.216 3.206 3.203 3.209 . 0 0 "[ . 1]" 1
632 2 44 ILE HG12 2 45 HIS H 3.031 . 4.180 4.163 4.122 4.189 0.009 3 0 "[ . 1]" 1
633 2 44 ILE HG12 2 51 SER QB 2.796 . 6.500 3.599 3.501 3.833 . 0 0 "[ . 1]" 1
634 2 44 ILE HG13 2 44 ILE MG 2.631 . 3.496 2.382 2.358 2.403 . 0 0 "[ . 1]" 1
635 2 44 ILE HG13 2 45 HIS QB 2.985 . 6.500 5.951 5.884 6.048 . 0 0 "[ . 1]" 1
636 2 44 ILE MG 2 45 HIS H 3.102 . 3.778 3.343 3.059 3.534 . 0 0 "[ . 1]" 1
637 2 44 ILE MG 2 45 HIS QB 3.052 . 6.500 3.936 3.762 4.087 . 0 0 "[ . 1]" 1
638 2 44 ILE MG 2 47 ASP H 2.923 . 3.991 3.939 3.901 4.026 0.035 2 0 "[ . 1]" 1
639 2 44 ILE MG 2 48 PRO HA 2.859 . 3.881 3.130 3.048 3.174 . 0 0 "[ . 1]" 1
640 2 44 ILE MG 2 48 PRO HB2 3.293 . 4.648 4.589 4.200 4.710 0.062 1 0 "[ . 1]" 1
641 2 44 ILE MG 2 48 PRO HB3 3.011 . 4.145 3.671 3.165 3.904 . 0 0 "[ . 1]" 1
642 2 44 ILE MG 2 51 SER QB 2.513 . 3.303 2.555 2.223 2.944 . 0 0 "[ . 1]" 1
643 2 45 HIS H 2 45 HIS HA 2.727 . 3.454 2.849 2.768 2.876 . 0 0 "[ . 1]" 1
644 2 45 HIS H 2 45 HIS QB 2.651 . 3.131 2.300 2.219 2.561 . 0 0 "[ . 1]" 1
645 2 45 HIS H 2 46 ASP H 2.699 . 3.609 2.459 2.340 2.733 . 0 0 "[ . 1]" 1
646 2 45 HIS H 2 46 ASP HA 2.885 . 6.500 5.119 5.018 5.328 . 0 0 "[ . 1]" 1
647 2 45 HIS H 2 46 ASP QB 3.027 . 6.500 4.250 4.108 4.509 . 0 0 "[ . 1]" 1
648 2 45 HIS HA 2 45 HIS QB 2.533 . 3.335 2.359 2.145 2.439 . 0 0 "[ . 1]" 1
649 2 45 HIS HA 2 46 ASP H 3.020 . 4.160 3.475 3.421 3.529 . 0 0 "[ . 1]" 1
650 2 45 HIS QB 2 46 ASP H 2.793 . 3.360 2.827 2.609 3.263 . 0 0 "[ . 1]" 1
651 2 45 HIS QB 2 46 ASP QB 2.935 . 4.012 3.879 3.730 4.046 0.034 5 0 "[ . 1]" 1
652 2 46 ASP H 2 46 ASP HA 2.732 . 3.265 2.876 2.848 2.892 . 0 0 "[ . 1]" 1
653 2 46 ASP H 2 46 ASP QB 2.434 . 3.046 2.264 2.210 2.294 . 0 0 "[ . 1]" 1
654 2 46 ASP H 2 47 ASP H 2.725 . 3.425 2.522 2.433 2.662 . 0 0 "[ . 1]" 1
655 2 46 ASP HA 2 47 ASP H 2.698 . 3.608 3.521 3.326 3.582 . 0 0 "[ . 1]" 1
656 2 46 ASP QB 2 47 ASP H 2.565 . 3.387 2.639 2.346 3.371 . 0 0 "[ . 1]" 1
657 2 47 ASP H 2 47 ASP HA 2.780 . 3.593 2.927 2.902 2.945 . 0 0 "[ . 1]" 1
658 2 47 ASP H 2 47 ASP QB 3.014 . 3.363 2.515 2.326 2.800 . 0 0 "[ . 1]" 1
659 2 47 ASP H 2 48 PRO HD2 3.012 . 4.146 4.218 3.827 4.471 0.325 7 0 "[ . 1]" 1
660 2 47 ASP H 2 48 PRO HD3 3.115 . 3.845 3.368 2.636 3.665 . 0 0 "[ . 1]" 1
661 2 47 ASP H 2 48 PRO QG 3.304 . 6.500 5.096 4.414 5.333 . 0 0 "[ . 1]" 1
662 2 47 ASP HA 2 47 ASP QB 2.603 . 3.125 2.460 2.430 2.496 . 0 0 "[ . 1]" 1
663 2 47 ASP HA 2 48 PRO HD2 2.315 . 2.985 2.205 2.061 2.428 . 0 0 "[ . 1]" 1
664 2 47 ASP HA 2 48 PRO HD3 2.461 . 3.218 2.785 2.549 3.078 . 0 0 "[ . 1]" 1
665 2 47 ASP HA 2 48 PRO QG 2.765 . 6.500 4.017 3.902 4.197 . 0 0 "[ . 1]" 1
666 2 47 ASP QB 2 50 GLN H 2.992 . 4.111 2.258 2.127 2.403 . 0 0 "[ . 1]" 1
667 2 47 ASP QB 2 50 GLN QG 2.881 . 3.919 2.904 2.184 3.701 . 0 0 "[ . 1]" 1
668 2 47 ASP QB 2 54 LEU QD 2.792 . 3.767 2.419 2.373 2.526 . 0 0 "[ . 1]" 1
669 2 47 ASP QB 2 54 LEU HG 2.852 . 3.868 3.762 3.632 3.855 . 0 0 "[ . 1]" 1
670 2 48 PRO HA 2 48 PRO HB3 2.355 . 3.048 2.301 2.290 2.312 . 0 0 "[ . 1]" 1
671 2 48 PRO HA 2 48 PRO QG 2.713 . 3.633 3.501 3.494 3.506 . 0 0 "[ . 1]" 1
672 2 48 PRO HA 2 49 SER H 3.195 . 4.471 3.435 3.375 3.506 . 0 0 "[ . 1]" 1
673 2 48 PRO HA 2 51 SER H 2.821 . 3.816 3.334 3.011 3.506 . 0 0 "[ . 1]" 1
674 2 48 PRO HB2 2 48 PRO HD2 2.760 . 3.712 3.511 3.498 3.522 . 0 0 "[ . 1]" 1
675 2 48 PRO HB2 2 48 PRO HD3 2.795 . 3.772 2.823 2.802 2.852 . 0 0 "[ . 1]" 1
676 2 48 PRO HB2 2 48 PRO QG 2.138 . 2.709 2.193 2.187 2.196 . 0 0 "[ . 1]" 1
677 2 48 PRO HB2 2 49 SER H 3.283 . 4.630 3.655 3.437 3.811 . 0 0 "[ . 1]" 1
678 2 48 PRO HB3 2 49 SER H 3.222 . 4.181 4.266 4.201 4.362 0.181 5 0 "[ . 1]" 1
679 2 48 PRO HD2 2 48 PRO QG 2.253 . 2.887 2.184 2.181 2.189 . 0 0 "[ . 1]" 1
680 2 48 PRO HD2 2 48 PRO HG2 2.215 . 2.828 1.999 1.994 2.005 . 0 0 "[ . 1]" 1
681 2 48 PRO HD2 2 49 SER H 3.460 . 3.962 2.580 2.461 2.767 . 0 0 "[ . 1]" 1
682 2 48 PRO HD3 2 48 PRO QG 2.319 . 2.992 2.230 2.220 2.245 . 0 0 "[ . 1]" 1
683 2 48 PRO HD3 2 48 PRO HG3 2.307 . 2.972 2.026 2.021 2.031 . 0 0 "[ . 1]" 1
684 2 48 PRO HD3 2 49 SER H 3.027 . 4.173 3.792 3.700 3.905 . 0 0 "[ . 1]" 1
685 2 48 PRO HG2 2 49 SER H 2.779 . 3.744 2.700 2.464 2.912 . 0 0 "[ . 1]" 1
686 2 49 SER H 2 49 SER HA 2.789 . 3.761 2.870 2.843 2.899 . 0 0 "[ . 1]" 1
687 2 49 SER H 2 49 SER QB 2.729 . 3.660 2.456 2.274 2.559 . 0 0 "[ . 1]" 1
688 2 49 SER H 2 50 GLN H 2.749 . 3.468 2.446 2.318 2.565 . 0 0 "[ . 1]" 1
689 2 49 SER HA 2 50 GLN H 2.889 . 3.932 3.518 3.477 3.561 . 0 0 "[ . 1]" 1
690 2 49 SER HA 2 51 SER H 3.319 . 4.696 3.739 3.638 3.825 . 0 0 "[ . 1]" 1
691 2 49 SER QB 2 50 GLN H 2.447 . 3.196 2.672 2.479 2.847 . 0 0 "[ . 1]" 1
692 2 50 GLN H 2 50 GLN HB2 2.456 . 3.210 2.517 2.441 2.594 . 0 0 "[ . 1]" 1
693 2 50 GLN H 2 50 GLN HB3 2.891 . 3.558 3.608 3.567 3.626 0.068 1 0 "[ . 1]" 1
694 2 50 GLN H 2 50 GLN QG 2.974 . 3.161 2.338 2.201 2.460 . 0 0 "[ . 1]" 1
695 2 50 GLN H 2 51 SER H 2.550 . 3.035 2.515 2.437 2.622 . 0 0 "[ . 1]" 1
696 2 50 GLN H 2 54 LEU QD 2.846 . 3.858 3.514 3.395 3.611 . 0 0 "[ . 1]" 1
697 2 50 GLN HA 2 50 GLN HB2 2.777 . 3.741 3.016 3.007 3.020 . 0 0 "[ . 1]" 1
698 2 50 GLN HA 2 50 GLN HB3 2.761 . 3.714 2.428 2.402 2.471 . 0 0 "[ . 1]" 1
699 2 50 GLN HA 2 50 GLN QG 2.623 . 3.483 2.425 2.289 2.633 . 0 0 "[ . 1]" 1
700 2 50 GLN HA 2 51 SER H 3.256 . 3.657 3.298 3.277 3.322 . 0 0 "[ . 1]" 1
701 2 50 GLN HA 2 53 ASN H 3.477 . 4.988 3.586 3.427 3.674 . 0 0 "[ . 1]" 1
702 2 50 GLN HB2 2 54 LEU QD 2.647 . 3.523 1.931 1.839 2.004 0.010 2 0 "[ . 1]" 1
703 2 50 GLN HB3 2 54 LEU QD 2.629 . 3.493 2.283 2.208 2.323 . 0 0 "[ . 1]" 1
704 2 50 GLN QG 2 54 LEU QD 2.966 . 4.066 3.423 3.301 3.463 . 0 0 "[ . 1]" 1
705 2 51 SER H 2 51 SER HA 2.473 . 3.238 2.680 2.671 2.699 . 0 0 "[ . 1]" 1
706 2 51 SER H 2 51 SER QB 2.336 . 3.018 2.402 2.231 2.553 . 0 0 "[ . 1]" 1
707 2 51 SER H 2 52 ALA H 2.953 . 4.043 3.060 2.975 3.133 . 0 0 "[ . 1]" 1
708 2 51 SER H 2 54 LEU QD 2.952 . 4.041 3.095 2.980 3.231 . 0 0 "[ . 1]" 1
709 2 51 SER HA 2 52 ALA H 2.931 . 3.909 3.550 3.521 3.573 . 0 0 "[ . 1]" 1
710 2 51 SER HA 2 54 LEU H 3.302 . 4.665 3.144 3.077 3.325 . 0 0 "[ . 1]" 1
711 2 51 SER HA 2 54 LEU QD 2.640 . 3.511 2.307 2.230 2.474 . 0 0 "[ . 1]" 1
712 2 51 SER HA 2 55 LEU H 3.566 . 5.156 3.885 3.774 4.057 . 0 0 "[ . 1]" 1
713 2 51 SER QB 2 52 ALA H 2.585 . 3.420 3.009 2.448 3.371 . 0 0 "[ . 1]" 1
714 2 52 ALA H 2 52 ALA HA 2.821 . 3.099 2.765 2.743 2.788 . 0 0 "[ . 1]" 1
715 2 52 ALA H 2 52 ALA MB . . 2.278 2.204 2.196 2.225 . 0 0 "[ . 1]" 1
716 2 52 ALA H 2 53 ASN H 2.727 . 3.656 2.784 2.692 2.875 . 0 0 "[ . 1]" 1
717 2 52 ALA H 2 53 ASN HA 2.905 . 6.500 5.397 5.335 5.450 . 0 0 "[ . 1]" 1
718 2 52 ALA H 2 53 ASN QB 2.681 . 6.500 4.597 4.486 4.744 . 0 0 "[ . 1]" 1
719 2 52 ALA H 2 54 LEU H 2.010 . 6.500 4.068 4.008 4.175 . 0 0 "[ . 1]" 1
720 2 52 ALA HA 2 52 ALA MB 1.910 . 2.366 2.126 2.123 2.129 . 0 0 "[ . 1]" 1
721 2 52 ALA HA 2 53 ASN H 2.945 . 3.566 3.506 3.477 3.535 . 0 0 "[ . 1]" 1
722 2 52 ALA HA 2 55 LEU MD1 3.097 . 4.296 4.235 4.128 4.303 0.007 8 0 "[ . 1]" 1
723 2 52 ALA HA 2 56 ALA H 5.595 . 9.507 4.492 4.364 4.625 . 0 0 "[ . 1]" 1
724 2 52 ALA MB 2 53 ASN H . . 2.413 2.483 2.453 2.509 0.096 2 0 "[ . 1]" 1
725 2 52 ALA MB 2 53 ASN QB 2.692 . 3.598 3.593 3.552 3.624 0.026 2 0 "[ . 1]" 1
726 2 52 ALA MB 2 54 LEU H 2.868 . 6.500 4.419 4.375 4.458 . 0 0 "[ . 1]" 1
727 2 52 ALA MB 2 55 LEU MD2 2.737 . 3.673 3.296 3.201 3.412 . 0 0 "[ . 1]" 1
728 2 53 ASN H 2 53 ASN HA 2.668 . 2.996 2.885 2.876 2.896 . 0 0 "[ . 1]" 1
729 2 53 ASN H 2 53 ASN QB 2.315 . 2.467 2.286 2.255 2.332 . 0 0 "[ . 1]" 1
730 2 53 ASN H 2 54 LEU H 2.810 . 3.249 2.400 2.359 2.425 . 0 0 "[ . 1]" 1
731 2 53 ASN H 2 54 LEU QD 2.935 . 4.012 3.473 3.394 3.569 . 0 0 "[ . 1]" 1
732 2 53 ASN H 2 55 LEU H 3.459 . 4.083 4.132 4.122 4.147 0.064 2 0 "[ . 1]" 1
733 2 53 ASN HA 2 54 LEU H 2.737 . 3.674 3.531 3.522 3.539 . 0 0 "[ . 1]" 1
734 2 53 ASN HA 2 56 ALA H 2.558 . 3.376 3.233 3.117 3.331 . 0 0 "[ . 1]" 1
735 2 53 ASN HA 2 56 ALA MB 2.172 . 2.762 1.949 1.882 1.992 . 0 0 "[ . 1]" 1
736 2 53 ASN QB 2 54 LEU H 2.251 . 2.884 2.699 2.640 2.719 . 0 0 "[ . 1]" 1
737 2 53 ASN QB 2 54 LEU QD 2.743 . 3.684 2.794 2.731 2.892 . 0 0 "[ . 1]" 1
738 2 53 ASN QB 2 54 LEU HG 2.509 . 6.500 5.654 5.615 5.741 . 0 0 "[ . 1]" 1
739 2 53 ASN QB 2 56 ALA MB 2.847 . 3.860 3.808 3.718 3.887 0.027 5 0 "[ . 1]" 1
740 2 54 LEU H 2 54 LEU HA 2.791 . 3.458 2.808 2.800 2.816 . 0 0 "[ . 1]" 1
741 2 54 LEU H 2 54 LEU HB2 2.854 . 3.872 2.329 2.311 2.353 . 0 0 "[ . 1]" 1
742 2 54 LEU H 2 54 LEU HB3 2.617 . 3.473 3.578 3.566 3.589 0.116 8 0 "[ . 1]" 1
743 2 54 LEU H 2 54 LEU QD 2.786 . 3.221 2.154 2.073 2.220 . 0 0 "[ . 1]" 1
744 2 54 LEU H 2 54 LEU HG 2.488 . 6.500 4.182 4.132 4.234 . 0 0 "[ . 1]" 1
745 2 54 LEU H 2 55 LEU H 2.905 . 3.960 2.767 2.746 2.809 . 0 0 "[ . 1]" 1
746 2 54 LEU HA 2 55 LEU H 3.254 . 4.578 3.569 3.560 3.575 . 0 0 "[ . 1]" 1
747 2 54 LEU HA 2 57 GLU H 2.726 . 3.655 3.573 3.496 3.647 . 0 0 "[ . 1]" 1
748 2 54 LEU HB2 2 54 LEU QD 2.542 . 3.350 2.184 2.168 2.197 . 0 0 "[ . 1]" 1
749 2 54 LEU HB2 2 54 LEU QD 2.467 . 3.170 2.114 2.091 2.150 . 0 0 "[ . 1]" 1
750 2 54 LEU HB2 2 54 LEU HG 2.482 . 3.252 2.423 2.353 2.457 . 0 0 "[ . 1]" 1
751 2 54 LEU HB3 2 54 LEU QD 2.556 . 3.373 2.483 2.467 2.500 . 0 0 "[ . 1]" 1
752 2 54 LEU HB3 2 54 LEU QD 2.598 . 2.993 2.369 2.303 2.403 . 0 0 "[ . 1]" 1
753 2 54 LEU HB3 2 54 LEU QD 2.315 . 2.985 2.315 2.257 2.400 . 0 0 "[ . 1]" 1
754 2 54 LEU MD1 2 54 LEU MD2 1.818 . 2.231 2.079 2.071 2.087 . 0 0 "[ . 1]" 1
755 2 54 LEU QD 2 54 LEU HG 2.032 . 2.548 1.764 1.760 1.766 . 0 0 "[ . 1]" 1
756 2 54 LEU QD 2 57 GLU QB 2.757 . 3.707 3.716 3.695 3.738 0.031 2 0 "[ . 1]" 1
757 2 54 LEU QD 2 57 GLU QG 2.809 . 3.795 3.265 2.809 3.683 . 0 0 "[ . 1]" 1
758 2 55 LEU H 2 55 LEU HA 2.977 . 3.645 2.908 2.901 2.916 . 0 0 "[ . 1]" 1
759 2 55 LEU H 2 55 LEU HB3 2.290 . 2.945 2.471 2.432 2.519 . 0 0 "[ . 1]" 1
760 2 55 LEU H 2 55 LEU MD1 3.426 . 4.893 4.211 4.169 4.258 . 0 0 "[ . 1]" 1
761 2 55 LEU H 2 55 LEU MD2 3.304 . 4.668 2.156 2.082 2.220 . 0 0 "[ . 1]" 1
762 2 55 LEU H 2 55 LEU HG 2.684 . 3.584 3.615 3.582 3.660 0.076 1 0 "[ . 1]" 1
763 2 55 LEU H 2 56 ALA H 2.993 . 3.709 2.287 2.259 2.306 . 0 0 "[ . 1]" 1
764 2 55 LEU HA 2 55 LEU HB3 2.357 . 3.051 2.632 2.614 2.647 . 0 0 "[ . 1]" 1
765 2 55 LEU HA 2 55 LEU MD2 2.499 . 6.500 3.756 3.722 3.803 . 0 0 "[ . 1]" 1
766 2 55 LEU HA 2 55 LEU HG 2.747 . 3.690 3.557 3.537 3.585 . 0 0 "[ . 1]" 1
767 2 55 LEU HA 2 58 ALA H 2.723 . 3.650 2.866 2.717 3.055 . 0 0 "[ . 1]" 1
768 2 55 LEU HA 2 58 ALA MB 2.502 . 3.284 2.363 2.112 2.533 . 0 0 "[ . 1]" 1
769 2 55 LEU HB2 2 55 LEU MD1 2.326 . 3.002 2.178 2.154 2.197 . 0 0 "[ . 1]" 1
770 2 55 LEU HB2 2 56 ALA H 2.559 . 6.500 4.335 4.298 4.353 . 0 0 "[ . 1]" 1
771 2 55 LEU HB3 2 55 LEU MD1 2.247 . 2.878 2.568 2.529 2.610 . 0 0 "[ . 1]" 1
772 2 55 LEU HB3 2 55 LEU MD2 2.469 . 3.231 2.218 2.195 2.241 . 0 0 "[ . 1]" 1
773 2 55 LEU HB3 2 55 LEU HG 2.271 . 6.500 2.992 2.982 3.000 . 0 0 "[ . 1]" 1
774 2 55 LEU HB3 2 56 ALA H 2.539 . 6.500 3.928 3.889 3.979 . 0 0 "[ . 1]" 1
775 2 55 LEU MD1 2 55 LEU HG 2.057 . 2.586 2.128 2.122 2.131 . 0 0 "[ . 1]" 1
776 2 55 LEU MD2 2 55 LEU HG 2.013 . 2.519 2.125 2.121 2.129 . 0 0 "[ . 1]" 1
777 2 55 LEU HG 2 56 ALA H 2.956 . 4.048 3.102 3.024 3.155 . 0 0 "[ . 1]" 1
778 2 56 ALA H 2 56 ALA HA 2.676 . 3.016 2.815 2.797 2.826 . 0 0 "[ . 1]" 1
779 2 56 ALA H 2 56 ALA MB . . 2.268 2.228 2.220 2.236 . 0 0 "[ . 1]" 1
780 2 56 ALA H 2 57 GLU H 2.560 . 3.379 2.597 2.544 2.661 . 0 0 "[ . 1]" 1
781 2 56 ALA H 2 58 ALA H 4.796 . 7.671 4.041 3.962 4.157 . 0 0 "[ . 1]" 1
782 2 56 ALA HA 2 56 ALA MB 1.727 . 2.100 1.902 1.900 1.903 . 0 0 "[ . 1]" 1
783 2 56 ALA HA 2 57 GLU H 2.626 . 3.488 3.503 3.488 3.509 0.021 1 0 "[ . 1]" 1
784 2 56 ALA HA 2 59 LYS H 2.893 . 3.939 3.520 3.421 3.597 . 0 0 "[ . 1]" 1
785 2 56 ALA HA 2 59 LYS H 2.537 . 3.341 3.103 3.054 3.221 . 0 0 "[ . 1]" 1
786 2 56 ALA MB 2 57 GLU H . . 2.455 2.341 2.272 2.448 . 0 0 "[ . 1]" 1
787 2 56 ALA MB 2 57 GLU HB2 2.498 . 6.500 3.629 3.563 3.658 . 0 0 "[ . 1]" 1
788 2 56 ALA MB 2 57 GLU QG 2.308 . 2.974 2.996 2.952 3.030 0.056 9 0 "[ . 1]" 1
789 2 57 GLU H 2 57 GLU HA 2.526 . 2.997 2.792 2.783 2.803 . 0 0 "[ . 1]" 1
790 2 57 GLU H 2 57 GLU QB 2.512 . 2.518 2.474 2.431 2.511 . 0 0 "[ . 1]" 1
791 2 57 GLU H 2 57 GLU QG . . 2.548 1.955 1.873 2.025 . 0 0 "[ . 1]" 1
792 2 57 GLU H 2 58 ALA H 2.650 . 3.381 2.704 2.661 2.761 . 0 0 "[ . 1]" 1
793 2 57 GLU H 2 58 ALA MB 3.140 . 4.372 4.327 4.286 4.367 . 0 0 "[ . 1]" 1
794 2 57 GLU HA 2 57 GLU HB3 1.987 . 2.480 2.147 2.138 2.164 . 0 0 "[ . 1]" 1
795 2 57 GLU HA 2 57 GLU QG 2.100 . 2.651 2.583 2.316 2.820 0.169 2 0 "[ . 1]" 1
796 2 57 GLU HA 2 58 ALA H 2.808 . 3.793 3.521 3.501 3.537 . 0 0 "[ . 1]" 1
797 2 57 GLU HA 2 60 LYS H 2.555 . 3.361 3.320 3.213 3.391 0.030 8 0 "[ . 1]" 1
798 2 57 GLU HB2 2 57 GLU HG2 1.632 . 1.965 1.886 1.832 1.941 . 0 0 "[ . 1]" 1
799 2 57 GLU QB 2 57 GLU QG 1.758 . 2.144 1.923 1.885 1.956 . 0 0 "[ . 1]" 1
800 2 57 GLU QB 2 58 ALA H 2.410 . 3.136 2.317 2.261 2.375 . 0 0 "[ . 1]" 1
801 2 57 GLU QB 2 58 ALA MB 2.724 . 3.652 3.703 3.671 3.750 0.098 5 0 "[ . 1]" 1
802 2 57 GLU QB 2 61 LEU MD1 2.766 . 3.722 2.297 2.153 2.470 . 0 0 "[ . 1]" 1
803 2 57 GLU HB2 2 57 GLU QG 1.814 . 2.225 2.037 1.985 2.097 . 0 0 "[ . 1]" 1
804 2 57 GLU QG 2 58 ALA H 2.760 . 3.712 3.798 3.754 3.854 0.142 10 0 "[ . 1]" 1
805 2 57 GLU QG 2 61 LEU MD1 2.861 . 3.885 3.993 3.942 4.030 0.145 2 0 "[ . 1]" 1
806 2 58 ALA H 2 58 ALA HA 2.599 . 3.394 2.764 2.754 2.788 . 0 0 "[ . 1]" 1
807 2 58 ALA H 2 58 ALA MB 2.406 . 2.632 2.217 2.179 2.247 . 0 0 "[ . 1]" 1
808 2 58 ALA H 2 59 LYS H 2.651 . 3.530 2.821 2.785 2.873 . 0 0 "[ . 1]" 1
809 2 58 ALA H 2 60 LYS H 3.684 . 5.381 4.208 4.083 4.311 . 0 0 "[ . 1]" 1
810 2 58 ALA HA 2 58 ALA MB 2.130 . 2.697 2.118 2.102 2.128 . 0 0 "[ . 1]" 1
811 2 58 ALA HA 2 60 LYS H 3.161 . 4.410 4.290 4.118 4.432 0.022 4 0 "[ . 1]" 1
812 2 58 ALA HA 2 61 LEU H 3.025 . 4.169 3.284 3.053 3.511 . 0 0 "[ . 1]" 1
813 2 58 ALA HA 2 62 ASN H 4.857 . 7.806 3.727 3.421 3.981 . 0 0 "[ . 1]" 1
814 2 58 ALA MB 2 59 LYS H 2.389 . 3.102 2.570 2.478 2.681 . 0 0 "[ . 1]" 1
815 2 59 LYS H 2 59 LYS HA 2.918 . 3.526 2.818 2.795 2.827 . 0 0 "[ . 1]" 1
816 2 59 LYS H 2 59 LYS HB2 2.735 . 2.913 2.486 2.211 2.630 . 0 0 "[ . 1]" 1
817 2 59 LYS H 2 59 LYS HB3 2.795 . 3.772 3.581 3.510 3.612 . 0 0 "[ . 1]" 1
818 2 59 LYS H 2 59 LYS HD2 2.996 . 6.500 4.280 3.844 5.334 . 0 0 "[ . 1]" 1
819 2 59 LYS H 2 59 LYS HG2 3.234 . 3.361 3.271 2.668 3.635 0.274 1 0 "[ . 1]" 1
820 2 59 LYS H 2 59 LYS HG3 2.711 . 3.630 2.432 2.037 3.644 0.014 3 0 "[ . 1]" 1
821 2 59 LYS H 2 60 LYS H 2.799 . 3.779 2.646 2.594 2.738 . 0 0 "[ . 1]" 1
822 2 59 LYS HA 2 59 LYS HB2 2.646 . 3.521 3.014 2.981 3.022 . 0 0 "[ . 1]" 1
823 2 59 LYS HA 2 59 LYS HB3 2.957 . 4.050 2.491 2.433 2.646 . 0 0 "[ . 1]" 1
824 2 59 LYS HA 2 59 LYS QG 2.636 . 3.504 2.503 2.422 2.559 . 0 0 "[ . 1]" 1
825 2 59 LYS HA 2 62 ASN H 3.180 . 3.884 3.886 3.831 3.907 0.023 9 0 "[ . 1]" 1
826 2 59 LYS HA 2 63 ASP H 3.530 . 5.088 4.420 4.113 4.618 . 0 0 "[ . 1]" 1
827 2 59 LYS HB2 2 59 LYS HG2 2.235 . 2.860 2.912 2.572 2.991 0.131 6 0 "[ . 1]" 1
828 2 59 LYS HB2 2 59 LYS HG3 2.274 . 2.921 2.437 2.259 2.513 . 0 0 "[ . 1]" 1
829 2 59 LYS HB2 2 60 LYS H 2.559 . 3.378 2.698 2.451 3.029 . 0 0 "[ . 1]" 1
830 2 59 LYS HB3 2 59 LYS HG2 2.471 . 3.234 2.512 2.358 2.994 . 0 0 "[ . 1]" 1
831 2 59 LYS QE 2 59 LYS QG 2.735 . 3.670 2.215 2.138 2.312 . 0 0 "[ . 1]" 1
832 2 60 LYS H 2 60 LYS HA 2.444 . 2.979 2.876 2.842 2.901 . 0 0 "[ . 1]" 1
833 2 60 LYS H 2 60 LYS QB 1.848 . 2.275 2.289 2.212 2.370 0.095 10 0 "[ . 1]" 1
834 2 60 LYS H 2 61 LEU H 2.733 . 3.631 2.356 2.198 2.557 . 0 0 "[ . 1]" 1
835 2 60 LYS HA 2 63 ASP H 2.899 . 3.950 3.462 3.323 3.863 . 0 0 "[ . 1]" 1
836 2 60 LYS QB 2 61 LEU H 2.197 . 2.801 2.659 2.484 2.824 0.023 7 0 "[ . 1]" 1
837 2 61 LEU H 2 61 LEU HA 2.592 . 3.056 2.790 2.771 2.809 . 0 0 "[ . 1]" 1
838 2 61 LEU H 2 61 LEU HB2 2.494 . 3.272 2.027 2.014 2.041 . 0 0 "[ . 1]" 1
839 2 61 LEU H 2 61 LEU HB3 2.461 . 3.101 3.334 3.311 3.354 0.253 2 0 "[ . 1]" 1
840 2 61 LEU H 2 61 LEU MD1 2.867 . 3.895 2.634 2.531 2.748 . 0 0 "[ . 1]" 1
841 2 61 LEU H 2 61 LEU MD2 2.738 . 6.500 3.960 3.772 4.121 . 0 0 "[ . 1]" 1
842 2 61 LEU H 2 61 LEU HG 3.043 . 4.200 4.112 3.939 4.197 . 0 0 "[ . 1]" 1
843 2 61 LEU H 2 62 ASN H 2.644 . 3.518 2.855 2.794 2.968 . 0 0 "[ . 1]" 1
844 2 61 LEU H 2 63 ASP H 3.227 . 4.529 3.887 3.693 4.105 . 0 0 "[ . 1]" 1
845 2 61 LEU HA 2 62 ASN H 2.746 . 3.689 3.594 3.563 3.630 . 0 0 "[ . 1]" 1
846 2 61 LEU HA 2 64 ALA H 2.854 . 3.872 3.463 3.308 3.623 . 0 0 "[ . 1]" 1
847 2 61 LEU HA 2 64 ALA MB 2.017 . 2.526 2.297 2.155 2.450 . 0 0 "[ . 1]" 1
848 2 61 LEU HA 2 65 GLN H 3.404 . 4.853 3.770 3.537 4.183 . 0 0 "[ . 1]" 1
849 2 61 LEU HB2 2 61 LEU HG 2.550 . 3.363 2.997 2.985 3.003 . 0 0 "[ . 1]" 1
850 2 61 LEU HB2 2 62 ASN H 2.755 . 3.704 2.722 2.560 2.837 . 0 0 "[ . 1]" 1
851 2 61 LEU HB3 2 61 LEU HG 2.302 . 2.965 2.479 2.416 2.587 . 0 0 "[ . 1]" 1
852 2 61 LEU HB3 2 62 ASN H 2.697 . 3.606 2.707 2.485 2.957 . 0 0 "[ . 1]" 1
853 2 61 LEU MD2 2 64 ALA H 2.808 . 6.500 6.392 6.172 6.521 0.021 4 0 "[ . 1]" 1
854 2 61 LEU HG 2 62 ASN H 2.992 . 6.500 4.819 4.690 4.959 . 0 0 "[ . 1]" 1
855 2 62 ASN H 2 62 ASN HA 2.985 . 3.765 2.803 2.730 2.847 . 0 0 "[ . 1]" 1
856 2 62 ASN H 2 62 ASN HB2 2.711 . 3.630 3.259 2.398 3.618 . 0 0 "[ . 1]" 1
857 2 62 ASN H 2 62 ASN HB3 2.676 . 3.571 2.427 2.293 2.644 . 0 0 "[ . 1]" 1
858 2 62 ASN H 2 63 ASP H 2.707 . 3.623 2.695 2.530 2.966 . 0 0 "[ . 1]" 1
859 2 62 ASN HA 2 62 ASN HB3 2.652 . 3.531 2.229 2.149 2.335 . 0 0 "[ . 1]" 1
860 2 62 ASN HA 2 63 ASP H 3.599 . 5.218 3.480 3.416 3.551 . 0 0 "[ . 1]" 1
861 2 62 ASN HA 2 65 GLN H 3.364 . 4.778 3.429 3.207 3.664 . 0 0 "[ . 1]" 1
862 2 62 ASN HB3 2 63 ASP H 2.997 . 4.120 3.523 2.417 4.067 . 0 0 "[ . 1]" 1
863 2 63 ASP H 2 63 ASP HA 2.733 . 3.384 2.851 2.816 2.889 . 0 0 "[ . 1]" 1
864 2 63 ASP H 2 63 ASP QB 2.478 . 2.997 2.254 2.216 2.286 . 0 0 "[ . 1]" 1
865 2 63 ASP H 2 64 ALA H 2.642 . 3.514 2.518 2.345 2.668 . 0 0 "[ . 1]" 1
866 2 63 ASP H 2 64 ALA MB 2.705 . 6.500 4.226 4.068 4.354 . 0 0 "[ . 1]" 1
867 2 63 ASP H 2 65 GLN H 3.318 . 4.694 3.882 3.689 4.031 . 0 0 "[ . 1]" 1
868 2 63 ASP HA 2 64 ALA H 3.299 . 4.659 3.514 3.475 3.544 . 0 0 "[ . 1]" 1
869 2 63 ASP HA 2 66 ALA H 2.931 . 3.800 3.720 3.518 3.819 0.019 1 0 "[ . 1]" 1
870 2 63 ASP HA 2 66 ALA MB 2.240 . 2.867 2.062 1.938 2.151 . 0 0 "[ . 1]" 1
871 2 63 ASP QB 2 64 ALA H 2.491 . 3.266 2.645 2.528 2.744 . 0 0 "[ . 1]" 1
872 2 63 ASP QB 2 64 ALA MB 2.704 . 3.618 3.721 3.501 3.846 0.228 9 0 "[ . 1]" 1
873 2 63 ASP HB3 2 66 ALA MB 2.802 . 3.784 3.728 3.542 3.842 0.058 10 0 "[ . 1]" 1
874 2 64 ALA H 2 64 ALA HA 2.588 . 2.993 2.852 2.838 2.874 . 0 0 "[ . 1]" 1
875 2 64 ALA H 2 64 ALA MB 2.166 . 2.263 2.243 2.237 2.251 . 0 0 "[ . 1]" 1
876 2 64 ALA H 2 65 GLN H 2.542 . 3.350 2.506 2.398 2.564 . 0 0 "[ . 1]" 1
877 2 64 ALA H 2 66 ALA H 3.027 . 4.172 4.026 3.931 4.188 0.016 9 0 "[ . 1]" 1
878 2 64 ALA HA 2 64 ALA MB 1.721 . 2.074 1.893 1.892 1.896 . 0 0 "[ . 1]" 1
879 2 64 ALA HA 2 65 GLN H 2.723 . 3.215 3.121 3.074 3.150 . 0 0 "[ . 1]" 1
880 2 64 ALA HA 2 66 ALA H 3.095 . 4.292 3.705 3.523 3.901 . 0 0 "[ . 1]" 1
881 2 64 ALA HA 2 66 ALA H 2.800 . 3.780 3.333 3.248 3.488 . 0 0 "[ . 1]" 1
882 2 64 ALA MB 2 65 GLN H 1.996 . 2.494 2.234 2.092 2.345 . 0 0 "[ . 1]" 1
883 2 64 ALA MB 2 66 ALA H 2.682 . 6.500 4.319 4.207 4.486 . 0 0 "[ . 1]" 1
884 2 65 GLN H 2 65 GLN HA 2.440 . 2.941 2.599 2.589 2.618 . 0 0 "[ . 1]" 1
885 2 65 GLN H 2 66 ALA H 2.622 . 3.481 2.519 2.259 2.732 . 0 0 "[ . 1]" 1
886 2 65 GLN H 2 66 ALA H 2.348 . 3.037 2.242 2.086 2.332 . 0 0 "[ . 1]" 1
887 2 65 GLN HA 2 66 ALA H 2.378 . 3.085 3.071 2.912 3.186 0.101 7 0 "[ . 1]" 1
888 2 66 ALA H 2 66 ALA HA 2.654 . 2.972 2.885 2.852 2.921 . 0 0 "[ . 1]" 1
889 2 66 ALA H 2 66 ALA MB . . 2.031 2.143 2.129 2.163 0.132 7 0 "[ . 1]" 1
890 2 66 ALA HA 2 66 ALA MB 1.894 . 2.342 1.892 1.890 1.893 . 0 0 "[ . 1]" 1
891 3 25 GLU H 3 25 GLU HB2 2.397 . 6.500 3.611 3.586 3.628 . 0 0 "[ . 1]" 1
892 3 25 GLU H 3 25 GLU HB3 2.196 . 2.799 2.831 2.794 2.865 0.066 7 0 "[ . 1]" 1
893 3 25 GLU H 3 25 GLU HG2 2.474 . 3.239 2.720 2.633 2.786 . 0 0 "[ . 1]" 1
894 3 25 GLU H 3 25 GLU HG3 2.502 . 6.500 3.650 3.596 3.687 . 0 0 "[ . 1]" 1
895 3 25 GLU HA 3 25 GLU HB2 2.194 . 2.796 2.494 2.476 2.513 . 0 0 "[ . 1]" 1
896 3 25 GLU HA 3 25 GLU HB3 2.417 . 3.148 2.381 2.361 2.420 . 0 0 "[ . 1]" 1
897 3 25 GLU HB2 3 25 GLU HG2 1.979 . 2.468 2.525 2.498 2.539 0.071 2 0 "[ . 1]" 1
898 3 25 GLU HB2 3 25 GLU HG3 2.298 . 2.452 2.299 2.285 2.338 . 0 0 "[ . 1]" 1
899 3 25 GLU HB2 3 26 ILE H 2.727 . 3.656 2.484 2.314 2.575 . 0 0 "[ . 1]" 1
900 3 25 GLU HB2 3 26 ILE HB 2.916 . 6.500 4.919 4.735 5.083 . 0 0 "[ . 1]" 1
901 3 25 GLU HB3 3 25 GLU HG2 2.266 . 2.908 2.970 2.965 2.980 0.072 5 0 "[ . 1]" 1
902 3 25 GLU HB3 3 25 GLU HG3 2.113 . 2.671 2.541 2.502 2.557 . 0 0 "[ . 1]" 1
903 3 25 GLU HB3 3 26 ILE H 2.686 . 3.588 3.682 3.651 3.710 0.122 1 0 "[ . 1]" 1
904 3 25 GLU HG2 3 27 VAL MG1 3.037 . 6.500 4.930 4.566 5.361 . 0 0 "[ . 1]" 1
905 3 25 GLU HG2 3 27 VAL MG2 2.458 . 3.213 2.519 2.342 2.847 . 0 0 "[ . 1]" 1
906 3 25 GLU HG3 3 27 VAL MG2 2.829 . 3.830 3.117 2.815 3.435 . 0 0 "[ . 1]" 1
907 3 26 ILE H 3 26 ILE HB 2.425 . 3.160 2.669 2.621 2.729 . 0 0 "[ . 1]" 1
908 3 26 ILE H 3 26 ILE MD 2.661 . 6.500 3.990 3.956 4.038 . 0 0 "[ . 1]" 1
909 3 26 ILE H 3 26 ILE HG12 2.948 . 4.035 3.329 3.126 3.415 . 0 0 "[ . 1]" 1
910 3 26 ILE H 3 26 ILE MG 2.742 . 6.500 3.847 3.834 3.861 . 0 0 "[ . 1]" 1
911 3 26 ILE HA 3 26 ILE HG12 3.307 . 4.674 2.508 2.447 2.563 . 0 0 "[ . 1]" 1
912 3 26 ILE HA 3 26 ILE MG 2.837 . 3.309 2.316 2.277 2.353 . 0 0 "[ . 1]" 1
913 3 26 ILE HA 3 27 VAL H 2.449 . 3.199 2.187 2.152 2.215 . 0 0 "[ . 1]" 1
914 3 26 ILE HB 3 26 ILE MD 2.369 . 3.028 2.572 2.555 2.607 . 0 0 "[ . 1]" 1
915 3 26 ILE HB 3 26 ILE HG12 2.857 . 3.787 3.013 3.010 3.015 . 0 0 "[ . 1]" 1
916 3 26 ILE HB 3 26 ILE MG 2.393 . 2.869 2.130 2.129 2.132 . 0 0 "[ . 1]" 1
917 3 26 ILE MD 3 26 ILE MG 2.005 . 2.508 1.881 1.872 1.895 . 0 0 "[ . 1]" 1
918 3 26 ILE MD 3 27 VAL H 2.955 . 6.500 4.936 4.887 4.986 . 0 0 "[ . 1]" 1
919 3 26 ILE HG12 3 26 ILE MG 2.624 . 3.372 2.531 2.502 2.562 . 0 0 "[ . 1]" 1
920 3 26 ILE HG12 3 27 VAL H 2.968 . 6.500 4.508 4.414 4.578 . 0 0 "[ . 1]" 1
921 3 26 ILE MG 3 27 VAL H 2.411 . 3.138 2.536 2.460 2.624 . 0 0 "[ . 1]" 1
922 3 26 ILE MG 3 28 TYR QD 2.976 . 4.083 2.328 1.869 3.402 . 0 0 "[ . 1]" 1
923 3 26 ILE MG 3 28 TYR QE 2.587 . 3.424 2.381 2.081 2.726 . 0 0 "[ . 1]" 1
924 3 27 VAL H 3 27 VAL HB 2.676 . 3.571 2.691 2.595 2.751 . 0 0 "[ . 1]" 1
925 3 27 VAL H 3 27 VAL MG1 2.512 . 6.500 3.876 3.853 3.898 . 0 0 "[ . 1]" 1
926 3 27 VAL H 3 27 VAL MG2 2.977 . 4.085 2.680 2.320 2.865 . 0 0 "[ . 1]" 1
927 3 27 VAL HA 3 27 VAL HB 2.247 . 6.500 3.025 3.019 3.032 . 0 0 "[ . 1]" 1
928 3 27 VAL HA 3 27 VAL MG1 2.397 . 3.115 2.375 2.243 2.506 . 0 0 "[ . 1]" 1
929 3 27 VAL HA 3 27 VAL MG2 2.554 . 3.192 2.426 2.346 2.557 . 0 0 "[ . 1]" 1
930 3 27 VAL HA 3 28 TYR H 2.436 . 2.853 2.263 2.224 2.293 . 0 0 "[ . 1]" 1
931 3 27 VAL HB 3 27 VAL MG1 2.128 . 2.489 2.109 2.092 2.120 . 0 0 "[ . 1]" 1
932 3 27 VAL HB 3 27 VAL MG2 1.666 . 2.013 2.106 2.103 2.108 0.095 9 0 "[ . 1]" 1
933 3 27 VAL MG1 3 27 VAL MG2 1.654 . 1.996 2.043 2.022 2.060 0.064 4 0 "[ . 1]" 1
934 3 27 VAL MG1 3 28 TYR H 2.528 . 6.500 3.538 3.386 3.651 . 0 0 "[ . 1]" 1
935 3 27 VAL MG1 3 29 LEU MD1 1.832 . 2.252 1.679 1.626 1.942 . 0 0 "[ . 1]" 1
936 3 27 VAL MG1 3 29 LEU HG 3.030 . 4.178 3.612 2.293 3.916 . 0 0 "[ . 1]" 1
937 3 27 VAL MG1 3 55 LEU HG 2.536 . 3.340 3.372 2.991 3.630 0.290 4 0 "[ . 1]" 1
938 3 27 VAL MG1 3 59 LYS HB2 2.751 . 3.628 3.697 3.665 3.726 0.098 2 0 "[ . 1]" 1
939 3 27 VAL MG1 3 59 LYS QE 2.478 . 3.245 2.352 1.955 3.265 0.020 1 0 "[ . 1]" 1
940 3 27 VAL MG1 3 59 LYS QG 2.242 . 2.870 2.127 1.877 2.373 . 0 0 "[ . 1]" 1
941 3 27 VAL MG2 3 29 LEU QD 3.152 . 4.394 3.843 3.780 3.921 . 0 0 "[ . 1]" 1
942 3 28 TYR H 3 28 TYR HB2 3.079 . 4.264 2.229 2.146 2.424 . 0 0 "[ . 1]" 1
943 3 28 TYR H 3 28 TYR HB2 2.690 . 3.595 2.222 2.142 2.410 . 0 0 "[ . 1]" 1
944 3 28 TYR H 3 28 TYR HB3 3.078 . 3.934 3.473 3.386 3.628 . 0 0 "[ . 1]" 1
945 3 28 TYR H 3 28 TYR QD 3.161 . 4.410 3.035 2.742 3.273 . 0 0 "[ . 1]" 1
946 3 28 TYR HA 3 29 LEU H 3.341 . 3.741 2.147 2.119 2.164 . 0 0 "[ . 1]" 1
947 3 28 TYR HB2 3 28 TYR QD 2.750 . 3.696 2.452 2.279 2.742 . 0 0 "[ . 1]" 1
948 3 28 TYR HB3 3 28 TYR QD 2.936 . 4.014 2.392 2.281 2.637 . 0 0 "[ . 1]" 1
949 3 28 TYR QD 3 29 LEU HA 3.018 . 6.500 5.474 5.118 5.860 . 0 0 "[ . 1]" 1
950 3 29 LEU H 3 29 LEU HB2 3.007 . 4.137 2.631 2.557 2.734 . 0 0 "[ . 1]" 1
951 3 29 LEU H 3 29 LEU MD2 3.211 . 4.500 4.411 4.255 4.541 0.041 4 0 "[ . 1]" 1
952 3 29 LEU H 3 29 LEU HG 3.147 . 4.385 4.135 3.346 4.398 0.013 9 0 "[ . 1]" 1
953 3 29 LEU HA 3 31 ASN H 3.507 . 5.044 3.154 2.950 3.335 . 0 0 "[ . 1]" 1
954 3 29 LEU HA 3 32 LEU H 3.536 . 5.099 4.200 3.951 4.484 . 0 0 "[ . 1]" 1
955 3 29 LEU QB 3 29 LEU MD1 2.359 . 3.055 2.062 2.002 2.089 . 0 0 "[ . 1]" 1
956 3 29 LEU QB 3 29 LEU MD1 2.346 . 3.034 2.226 2.078 2.319 . 0 0 "[ . 1]" 1
957 3 29 LEU QB 3 29 LEU MD2 2.521 . 3.316 2.067 2.018 2.162 . 0 0 "[ . 1]" 1
958 3 29 LEU QB 3 32 LEU MD2 2.227 . 6.500 3.496 3.412 3.622 . 0 0 "[ . 1]" 1
959 3 29 LEU QB 3 58 ALA MB 2.627 . 3.490 3.627 3.520 3.676 0.186 2 0 "[ . 1]" 1
960 3 29 LEU HB3 3 32 LEU H 2.666 . 3.555 3.314 3.141 3.593 0.038 10 0 "[ . 1]" 1
961 3 29 LEU QD 3 29 LEU HG 2.124 . 2.688 1.882 1.879 1.886 . 0 0 "[ . 1]" 1
962 3 29 LEU QD 3 31 ASN H 3.607 . 5.233 4.647 4.287 4.801 . 0 0 "[ . 1]" 1
963 3 29 LEU QD 3 59 LYS HB2 3.134 . 4.362 3.279 3.181 3.437 . 0 0 "[ . 1]" 1
964 3 29 LEU MD1 3 59 LYS QG 2.001 . 2.501 2.043 1.858 2.619 0.118 10 0 "[ . 1]" 1
965 3 29 LEU MD1 3 62 ASN HB3 2.964 . 4.062 4.031 3.824 4.135 0.073 1 0 "[ . 1]" 1
966 3 29 LEU MD2 3 32 LEU HA 3.300 . 6.500 5.050 4.959 5.152 . 0 0 "[ . 1]" 1
967 3 29 LEU MD2 3 32 LEU MD1 1.902 . 2.354 1.806 1.716 2.063 . 0 0 "[ . 1]" 1
968 3 29 LEU MD2 3 32 LEU MD2 2.137 . 2.708 2.712 2.616 2.767 0.059 1 0 "[ . 1]" 1
969 3 29 LEU MD2 3 32 LEU HG 2.519 . 3.312 2.501 2.365 2.681 . 0 0 "[ . 1]" 1
970 3 29 LEU MD2 3 58 ALA HA 2.872 . 3.903 3.541 3.464 3.910 0.007 10 0 "[ . 1]" 1
971 3 29 LEU MD2 3 58 ALA MB 1.995 . 2.492 1.958 1.861 2.516 0.024 10 0 "[ . 1]" 1
972 3 29 LEU MD2 3 59 LYS QG 2.143 . 2.717 2.558 2.033 2.737 0.020 4 0 "[ . 1]" 1
973 3 29 LEU MD2 3 62 ASN HB2 2.592 . 3.432 2.301 2.012 2.784 . 0 0 "[ . 1]" 1
974 3 30 PRO HA 3 31 ASN H 3.454 . 4.167 3.353 3.235 3.422 . 0 0 "[ . 1]" 1
975 3 30 PRO HB3 3 31 ASN H 3.538 . 4.428 4.415 4.352 4.513 0.085 7 0 "[ . 1]" 1
976 3 30 PRO HD2 3 30 PRO HG2 2.914 . 3.975 2.278 2.262 2.288 . 0 0 "[ . 1]" 1
977 3 30 PRO HD2 3 30 PRO HG3 2.868 . 3.896 2.773 2.733 2.829 . 0 0 "[ . 1]" 1
978 3 30 PRO HD2 3 31 ASN H 4.164 . 4.506 2.524 2.255 2.691 . 0 0 "[ . 1]" 1
979 3 30 PRO HD3 3 31 ASN H 3.320 . 4.351 3.764 3.595 3.894 . 0 0 "[ . 1]" 1
980 3 30 PRO HG2 3 31 ASN H 3.100 . 3.871 3.182 2.935 3.603 . 0 0 "[ . 1]" 1
981 3 30 PRO HG3 3 31 ASN H 3.044 . 4.203 4.391 4.265 4.651 0.448 7 0 "[ . 1]" 1
982 3 31 ASN H 3 31 ASN HB2 3.366 . 3.858 2.544 2.466 2.749 . 0 0 "[ . 1]" 1
983 3 31 ASN H 3 31 ASN HB3 3.256 . 4.581 3.344 2.476 3.687 . 0 0 "[ . 1]" 1
984 3 31 ASN H 3 32 LEU H 2.620 . 3.478 2.234 2.140 2.350 . 0 0 "[ . 1]" 1
985 3 31 ASN H 3 32 LEU HA 3.879 . 5.759 4.789 4.673 4.872 . 0 0 "[ . 1]" 1
986 3 31 ASN H 3 32 LEU MD1 3.573 . 5.169 5.045 4.797 5.178 0.009 1 0 "[ . 1]" 1
987 3 31 ASN H 3 32 LEU MD2 3.405 . 4.855 4.877 4.860 4.905 0.050 6 0 "[ . 1]" 1
988 3 31 ASN HA 3 32 LEU H 3.066 . 3.736 3.354 3.305 3.421 . 0 0 "[ . 1]" 1
989 3 31 ASN HB2 3 32 LEU H 2.829 . 3.830 3.564 3.253 4.229 0.399 9 0 "[ . 1]" 1
990 3 31 ASN HB2 3 62 ASN HA 2.919 . 3.984 2.775 2.067 3.762 . 0 0 "[ . 1]" 1
991 3 31 ASN HB3 3 32 LEU H 3.544 . 5.114 3.882 3.071 4.268 . 0 0 "[ . 1]" 1
992 3 31 ASN HB3 3 62 ASN HA 2.784 . 3.753 3.070 2.039 3.765 0.012 5 0 "[ . 1]" 1
993 3 32 LEU H 3 32 LEU HA 2.867 . 3.894 2.826 2.794 2.856 . 0 0 "[ . 1]" 1
994 3 32 LEU H 3 32 LEU QB 2.804 . 3.787 2.308 2.279 2.334 . 0 0 "[ . 1]" 1
995 3 32 LEU H 3 32 LEU HB3 2.584 . 3.419 2.557 2.429 2.610 . 0 0 "[ . 1]" 1
996 3 32 LEU H 3 32 LEU MD1 2.811 . 3.799 3.781 3.646 3.848 0.049 1 0 "[ . 1]" 1
997 3 32 LEU H 3 32 LEU MD2 3.023 . 3.461 3.493 3.464 3.522 0.061 5 0 "[ . 1]" 1
998 3 32 LEU H 3 32 LEU HG 2.542 . 3.350 2.622 2.473 2.684 . 0 0 "[ . 1]" 1
999 3 32 LEU H 3 62 ASN HA 2.946 . 4.031 3.955 3.710 4.059 0.028 1 0 "[ . 1]" 1
1000 3 32 LEU HA 3 32 LEU MD1 2.720 . 6.500 3.793 3.758 3.825 . 0 0 "[ . 1]" 1
1001 3 32 LEU HA 3 32 LEU MD2 2.312 . 2.980 1.964 1.891 2.049 . 0 0 "[ . 1]" 1
1002 3 32 LEU HA 3 33 ASN H 2.546 . 3.075 2.153 2.092 2.218 . 0 0 "[ . 1]" 1
1003 3 32 LEU HA 3 37 LEU MD2 2.850 . 3.865 3.935 3.893 3.955 0.090 2 0 "[ . 1]" 1
1004 3 32 LEU QB 3 33 ASN H 3.055 . 4.222 3.005 2.738 3.278 . 0 0 "[ . 1]" 1
1005 3 32 LEU MD1 3 32 LEU HG 2.163 . 2.748 2.123 2.120 2.128 . 0 0 "[ . 1]" 1
1006 3 32 LEU MD1 3 62 ASN HA 2.752 . 6.500 4.819 4.625 4.980 . 0 0 "[ . 1]" 1
1007 3 32 LEU MD1 3 62 ASN HB2 2.958 . 4.052 3.599 3.291 4.036 . 0 0 "[ . 1]" 1
1008 3 32 LEU MD2 3 32 LEU HG 2.124 . 2.688 2.118 2.112 2.122 . 0 0 "[ . 1]" 1
1009 3 32 LEU MD2 3 33 ASN H 2.894 . 3.207 3.221 3.088 3.279 0.072 10 0 "[ . 1]" 1
1010 3 32 LEU MD2 3 58 ALA HA 2.990 . 4.108 3.134 2.915 3.544 . 0 0 "[ . 1]" 1
1011 3 32 LEU MD2 3 58 ALA MB 2.246 . 2.877 2.883 2.758 2.929 0.052 7 0 "[ . 1]" 1
1012 3 32 LEU MD2 3 61 LEU HB3 2.746 . 3.689 2.053 1.759 2.742 0.044 6 0 "[ . 1]" 1
1013 3 32 LEU MD2 3 61 LEU MD1 1.831 . 2.250 2.302 2.283 2.326 0.076 2 0 "[ . 1]" 1
1014 3 32 LEU MD2 3 61 LEU MD2 2.309 . 2.975 2.629 2.039 3.046 0.071 4 0 "[ . 1]" 1
1015 3 32 LEU MD2 3 61 LEU HG 2.374 . 6.500 4.064 3.948 4.157 . 0 0 "[ . 1]" 1
1016 3 32 LEU MD2 3 62 ASN H 2.208 . 2.817 2.664 2.369 2.823 0.006 1 0 "[ . 1]" 1
1017 3 32 LEU MD2 3 62 ASN HA 2.520 . 3.314 3.044 2.501 3.320 0.006 3 0 "[ . 1]" 1
1018 3 32 LEU MD2 3 62 ASN HB2 2.604 . 3.452 3.174 2.626 3.466 0.014 4 0 "[ . 1]" 1
1019 3 32 LEU HG 3 37 LEU MD2 2.295 . 6.500 4.096 4.028 4.248 . 0 0 "[ . 1]" 1
1020 3 32 LEU HG 3 62 ASN H 2.779 . 3.744 3.802 3.784 3.823 0.079 6 0 "[ . 1]" 1
1021 3 33 ASN H 3 33 ASN HB2 2.940 . 4.021 3.168 2.558 3.729 . 0 0 "[ . 1]" 1
1022 3 33 ASN H 3 33 ASN HB3 3.234 . 4.542 3.219 2.694 3.645 . 0 0 "[ . 1]" 1
1023 3 33 ASN HA 3 36 GLN H 2.884 . 6.500 4.758 4.427 5.239 . 0 0 "[ . 1]" 1
1024 3 33 ASN HB2 3 33 ASN HD21 2.474 . 3.239 2.584 2.159 3.473 0.234 8 0 "[ . 1]" 1
1025 3 33 ASN HB3 3 33 ASN HD21 2.639 . 3.509 2.859 2.224 3.435 . 0 0 "[ . 1]" 1
1026 3 33 ASN HB3 3 34 PRO HD2 2.630 . 3.495 3.132 2.303 3.835 0.340 3 0 "[ . 1]" 1
1027 3 33 ASN HD21 3 36 GLN HG2 2.995 . 4.117 3.033 1.893 4.120 0.003 2 0 "[ . 1]" 1
1028 3 33 ASN HD22 3 36 GLN HG2 2.709 . 3.626 3.050 2.096 4.164 0.538 9 2 "[ . +-]" 1
1029 3 33 ASN HD22 3 36 GLN HG3 3.011 . 4.144 3.613 2.095 4.246 0.102 7 0 "[ . 1]" 1
1030 3 34 PRO HA 3 34 PRO HB2 2.555 . 3.371 2.996 2.989 3.003 . 0 0 "[ . 1]" 1
1031 3 34 PRO HA 3 35 ASP H 2.795 . 3.771 3.572 3.553 3.600 . 0 0 "[ . 1]" 1
1032 3 34 PRO HA 3 37 LEU H 3.200 . 4.480 3.888 3.756 4.025 . 0 0 "[ . 1]" 1
1033 3 34 PRO HA 3 37 LEU HB2 2.957 . 6.500 5.066 4.855 5.319 . 0 0 "[ . 1]" 1
1034 3 34 PRO HA 3 37 LEU MD1 2.746 . 3.689 2.229 2.053 2.607 . 0 0 "[ . 1]" 1
1035 3 34 PRO HA 3 37 LEU HG 2.875 . 3.908 2.443 2.176 2.641 . 0 0 "[ . 1]" 1
1036 3 34 PRO QB 3 36 GLN H 2.967 . 6.500 4.523 4.250 4.669 . 0 0 "[ . 1]" 1
1037 3 34 PRO HB2 3 35 ASP H 2.776 . 3.508 2.217 2.110 2.276 . 0 0 "[ . 1]" 1
1038 3 34 PRO HB3 3 35 ASP H 2.728 . 3.658 3.657 3.564 3.689 0.031 5 0 "[ . 1]" 1
1039 3 34 PRO HD2 3 35 ASP H 3.030 . 4.178 3.220 2.992 3.401 . 0 0 "[ . 1]" 1
1040 3 35 ASP H 3 35 ASP HA 2.597 . 3.147 2.797 2.770 2.846 . 0 0 "[ . 1]" 1
1041 3 35 ASP H 3 36 GLN H 2.514 . 3.304 2.743 2.586 2.854 . 0 0 "[ . 1]" 1
1042 3 35 ASP HA 3 36 GLN H 2.538 . 6.500 3.518 3.403 3.549 . 0 0 "[ . 1]" 1
1043 3 36 GLN H 3 36 GLN HA 2.552 . 3.366 2.841 2.741 2.897 . 0 0 "[ . 1]" 1
1044 3 36 GLN H 3 36 GLN HG2 2.738 . 6.500 3.320 2.308 4.453 . 0 0 "[ . 1]" 1
1045 3 36 GLN H 3 36 GLN HG3 2.768 . 3.726 3.825 3.714 3.907 0.181 5 0 "[ . 1]" 1
1046 3 36 GLN H 3 37 LEU H 2.716 . 3.638 2.647 2.289 2.959 . 0 0 "[ . 1]" 1
1047 3 36 GLN HG2 3 61 LEU MD1 2.923 . 3.991 3.800 3.259 4.326 0.335 9 0 "[ . 1]" 1
1048 3 36 GLN HG2 3 61 LEU MD2 2.704 . 3.618 3.385 2.092 3.937 0.319 6 0 "[ . 1]" 1
1049 3 36 GLN HG3 3 61 LEU QD 2.915 . 3.977 2.672 2.102 3.451 . 0 0 "[ . 1]" 1
1050 3 36 GLN HG3 3 61 LEU MD2 2.862 . 3.886 3.041 2.404 3.905 0.019 2 0 "[ . 1]" 1
1051 3 37 LEU H 3 37 LEU HA 2.573 . 3.400 2.841 2.823 2.866 . 0 0 "[ . 1]" 1
1052 3 37 LEU H 3 37 LEU HB2 2.608 . 3.458 3.623 3.599 3.649 0.191 2 0 "[ . 1]" 1
1053 3 37 LEU H 3 37 LEU MD1 2.459 . 6.500 3.223 3.171 3.356 . 0 0 "[ . 1]" 1
1054 3 37 LEU H 3 37 LEU MD2 2.640 . 3.511 3.369 3.308 3.504 . 0 0 "[ . 1]" 1
1055 3 37 LEU H 3 37 LEU HG 2.722 . 3.648 1.939 1.855 2.083 . 0 0 "[ . 1]" 1
1056 3 37 LEU HA 3 40 PHE H 2.641 . 3.513 3.119 2.899 3.343 . 0 0 "[ . 1]" 1
1057 3 37 LEU HB2 3 37 LEU MD2 1.913 . 2.370 2.552 2.490 2.592 0.222 4 0 "[ . 1]" 1
1058 3 37 LEU MD1 3 41 ILE HA 3.080 . 6.500 5.847 5.613 6.149 . 0 0 "[ . 1]" 1
1059 3 39 ALA H 3 40 PHE H 2.628 . 3.491 2.618 2.447 2.790 . 0 0 "[ . 1]" 1
1060 3 39 ALA HA 3 40 PHE H 3.061 . 4.232 3.537 3.513 3.584 . 0 0 "[ . 1]" 1
1061 3 39 ALA HA 3 42 HIS H 3.300 . 4.661 3.578 3.454 3.707 . 0 0 "[ . 1]" 1
1062 3 39 ALA MB 3 40 PHE H 2.399 . 3.119 2.556 2.377 2.666 . 0 0 "[ . 1]" 1
1063 3 39 ALA MB 3 42 HIS QB 3.030 . 4.178 3.982 3.814 4.163 . 0 0 "[ . 1]" 1
1064 3 40 PHE H 3 40 PHE HA 2.825 . 3.753 2.837 2.807 2.893 . 0 0 "[ . 1]" 1
1065 3 40 PHE H 3 40 PHE QB 2.315 . 2.985 2.335 2.059 2.505 . 0 0 "[ . 1]" 1
1066 3 40 PHE H 3 40 PHE QD 2.791 . 3.765 2.994 2.469 3.841 0.076 1 0 "[ . 1]" 1
1067 3 40 PHE H 3 41 ILE H 3.199 . 3.645 2.594 2.361 2.757 . 0 0 "[ . 1]" 1
1068 3 40 PHE HA 3 40 PHE QD 2.871 . 3.901 2.684 2.190 3.618 . 0 0 "[ . 1]" 1
1069 3 40 PHE HA 3 43 SER H 3.193 . 4.468 3.113 2.773 3.461 . 0 0 "[ . 1]" 1
1070 3 40 PHE QB 3 40 PHE QD 2.640 . 3.511 2.128 2.108 2.148 . 0 0 "[ . 1]" 1
1071 3 41 ILE H 3 41 ILE HA 2.798 . 3.777 2.807 2.786 2.825 . 0 0 "[ . 1]" 1
1072 3 41 ILE H 3 41 ILE HB 3.143 . 3.753 2.471 2.441 2.500 . 0 0 "[ . 1]" 1
1073 3 41 ILE H 3 41 ILE MD 2.882 . 3.921 3.632 3.528 3.691 . 0 0 "[ . 1]" 1
1074 3 41 ILE H 3 41 ILE HG12 2.811 . 3.799 3.469 3.409 3.549 . 0 0 "[ . 1]" 1
1075 3 41 ILE H 3 41 ILE MG 3.085 . 4.275 3.757 3.748 3.765 . 0 0 "[ . 1]" 1
1076 3 41 ILE H 3 42 HIS H 2.938 . 3.958 2.725 2.634 2.785 . 0 0 "[ . 1]" 1
1077 3 41 ILE HA 3 41 ILE MD 2.702 . 3.615 3.800 3.770 3.829 0.214 9 0 "[ . 1]" 1
1078 3 41 ILE HA 3 41 ILE HG12 2.953 . 3.748 2.467 2.413 2.522 . 0 0 "[ . 1]" 1
1079 3 41 ILE HA 3 41 ILE HG13 2.878 . 3.913 2.957 2.879 3.017 . 0 0 "[ . 1]" 1
1080 3 41 ILE HA 3 41 ILE MG 2.654 . 3.085 2.478 2.450 2.520 . 0 0 "[ . 1]" 1
1081 3 41 ILE HA 3 42 HIS H 2.474 . 6.500 3.546 3.532 3.557 . 0 0 "[ . 1]" 1
1082 3 41 ILE HA 3 44 ILE H 3.105 . 4.310 3.406 3.248 3.650 . 0 0 "[ . 1]" 1
1083 3 41 ILE HB 3 41 ILE MD 2.682 . 3.581 2.425 2.391 2.451 . 0 0 "[ . 1]" 1
1084 3 41 ILE HB 3 42 HIS H 2.698 . 3.608 2.491 2.435 2.546 . 0 0 "[ . 1]" 1
1085 3 41 ILE HB 3 45 HIS H 3.057 . 6.500 6.101 5.846 6.430 . 0 0 "[ . 1]" 1
1086 3 41 ILE MD 3 41 ILE HG12 2.173 . 2.763 2.119 2.117 2.123 . 0 0 "[ . 1]" 1
1087 3 41 ILE MD 3 41 ILE HG13 2.757 . 3.707 2.121 2.119 2.124 . 0 0 "[ . 1]" 1
1088 3 41 ILE MD 3 44 ILE MD 2.596 . 6.500 5.694 5.432 5.979 . 0 0 "[ . 1]" 1
1089 3 41 ILE MD 3 42 HIS H 3.212 . 4.502 4.523 4.505 4.540 0.038 4 0 "[ . 1]" 1
1090 3 41 ILE HG12 3 41 ILE MG 2.656 . 3.538 2.385 2.317 2.439 . 0 0 "[ . 1]" 1
1091 3 41 ILE HG13 3 41 ILE MG 3.077 . 4.261 3.207 3.202 3.211 . 0 0 "[ . 1]" 1
1092 3 41 ILE MG 3 42 HIS H 3.078 . 3.246 3.183 3.066 3.254 0.008 4 0 "[ . 1]" 1
1093 3 41 ILE MG 3 42 HIS HA 2.773 . 3.734 3.311 3.146 3.419 . 0 0 "[ . 1]" 1
1094 3 42 HIS H 3 42 HIS HA 2.966 . 3.600 2.811 2.782 2.827 . 0 0 "[ . 1]" 1
1095 3 42 HIS H 3 42 HIS QB 2.456 . 3.210 2.251 2.049 2.377 . 0 0 "[ . 1]" 1
1096 3 42 HIS H 3 43 SER H 2.653 . 3.533 2.640 2.532 2.735 . 0 0 "[ . 1]" 1
1097 3 42 HIS HA 3 43 SER H 2.316 . 6.500 3.500 3.477 3.526 . 0 0 "[ . 1]" 1
1098 3 42 HIS HA 3 45 HIS H 3.191 . 4.269 3.422 3.301 3.652 . 0 0 "[ . 1]" 1
1099 3 42 HIS HA 3 46 ASP H 3.275 . 4.616 4.285 4.089 4.507 . 0 0 "[ . 1]" 1
1100 3 42 HIS QB 3 43 SER H 2.497 . 3.276 2.738 2.591 2.959 . 0 0 "[ . 1]" 1
1101 3 43 SER H 3 43 SER HA 2.930 . 3.673 2.825 2.802 2.855 . 0 0 "[ . 1]" 1
1102 3 43 SER H 3 44 ILE H 2.612 . 3.465 2.640 2.542 2.706 . 0 0 "[ . 1]" 1
1103 3 43 SER H 3 44 ILE MG 2.730 . 6.500 5.923 5.839 5.995 . 0 0 "[ . 1]" 1
1104 3 43 SER HA 3 46 ASP H 3.096 . 4.294 3.207 3.071 3.397 . 0 0 "[ . 1]" 1
1105 3 43 SER HA 3 46 ASP QB 2.656 . 3.538 2.456 2.006 3.041 . 0 0 "[ . 1]" 1
1106 3 44 ILE H 3 44 ILE HB 2.497 . 3.276 2.593 2.539 2.663 . 0 0 "[ . 1]" 1
1107 3 44 ILE H 3 44 ILE MD 2.685 . 3.586 3.187 3.094 3.316 . 0 0 "[ . 1]" 1
1108 3 44 ILE H 3 44 ILE HG12 2.833 . 3.836 2.097 2.011 2.165 . 0 0 "[ . 1]" 1
1109 3 44 ILE H 3 44 ILE HG13 2.869 . 3.898 3.592 3.531 3.631 . 0 0 "[ . 1]" 1
1110 3 44 ILE H 3 44 ILE MG 2.396 . 6.500 3.789 3.783 3.800 . 0 0 "[ . 1]" 1
1111 3 44 ILE H 3 45 HIS H 3.241 . 3.993 2.575 2.515 2.663 . 0 0 "[ . 1]" 1
1112 3 44 ILE HA 3 44 ILE HB 2.795 . 3.534 3.026 3.024 3.029 . 0 0 "[ . 1]" 1
1113 3 44 ILE HA 3 44 ILE MD 2.368 . 3.069 2.042 2.005 2.091 . 0 0 "[ . 1]" 1
1114 3 44 ILE HA 3 44 ILE HG13 2.856 . 3.875 3.762 3.741 3.806 . 0 0 "[ . 1]" 1
1115 3 44 ILE HA 3 44 ILE MG 2.434 . 3.175 2.389 2.357 2.435 . 0 0 "[ . 1]" 1
1116 3 44 ILE HA 3 45 HIS H 2.927 . 3.876 3.498 3.475 3.515 . 0 0 "[ . 1]" 1
1117 3 44 ILE HA 3 47 ASP H 3.637 . 5.290 3.454 3.335 3.592 . 0 0 "[ . 1]" 1
1118 3 44 ILE HB 3 44 ILE MD 2.594 . 3.435 3.232 3.228 3.238 . 0 0 "[ . 1]" 1
1119 3 44 ILE HB 3 44 ILE HG12 2.905 . 3.960 2.465 2.445 2.489 . 0 0 "[ . 1]" 1
1120 3 44 ILE HB 3 44 ILE HG13 2.868 . 3.896 2.447 2.426 2.464 . 0 0 "[ . 1]" 1
1121 3 44 ILE HB 3 44 ILE MG 2.365 . 2.995 2.130 2.128 2.135 . 0 0 "[ . 1]" 1
1122 3 44 ILE HB 3 45 HIS H 2.905 . 3.960 2.626 2.462 2.715 . 0 0 "[ . 1]" 1
1123 3 44 ILE HB 3 54 LEU MD2 2.737 . 6.500 4.735 4.426 4.950 . 0 0 "[ . 1]" 1
1124 3 44 ILE MD 3 44 ILE HG12 2.497 . 3.276 2.115 2.109 2.118 . 0 0 "[ . 1]" 1
1125 3 44 ILE MD 3 44 ILE HG13 2.079 . 2.619 2.119 2.116 2.120 . 0 0 "[ . 1]" 1
1126 3 44 ILE MD 3 44 ILE MG 1.919 . 2.379 1.984 1.961 2.019 . 0 0 "[ . 1]" 1
1127 3 44 ILE MD 3 45 HIS H 3.245 . 4.561 4.602 4.567 4.629 0.068 3 0 "[ . 1]" 1
1128 3 44 ILE MD 3 47 ASP H 2.982 . 6.500 4.956 4.869 5.016 . 0 0 "[ . 1]" 1
1129 3 44 ILE MD 3 51 SER H 3.024 . 4.167 3.930 3.778 4.019 . 0 0 "[ . 1]" 1
1130 3 44 ILE MD 3 51 SER HA 2.778 . 3.271 1.863 1.796 2.004 0.017 8 0 "[ . 1]" 1
1131 3 44 ILE MD 3 51 SER QB 2.860 . 3.882 2.911 2.390 3.077 . 0 0 "[ . 1]" 1
1132 3 44 ILE MD 3 53 ASN H 2.851 . 6.500 5.107 5.006 5.234 . 0 0 "[ . 1]" 1
1133 3 44 ILE MD 3 54 LEU H 2.714 . 3.635 3.695 3.671 3.718 0.083 9 0 "[ . 1]" 1
1134 3 44 ILE HG12 3 44 ILE MG 2.550 . 3.363 3.208 3.204 3.212 . 0 0 "[ . 1]" 1
1135 3 44 ILE HG12 3 54 LEU MD2 2.762 . 3.716 3.559 3.215 3.750 0.034 3 0 "[ . 1]" 1
1136 3 44 ILE HG13 3 51 SER HB2 2.890 . 6.500 4.846 4.196 5.207 . 0 0 "[ . 1]" 1
1137 3 44 ILE HG13 3 44 ILE MG 2.545 . 2.706 2.379 2.355 2.426 . 0 0 "[ . 1]" 1
1138 3 44 ILE HG13 3 45 HIS H 2.926 . 6.500 4.895 4.774 5.002 . 0 0 "[ . 1]" 1
1139 3 44 ILE MG 3 45 HIS H 2.978 . 3.544 3.525 3.290 3.576 0.032 5 0 "[ . 1]" 1
1140 3 44 ILE MG 3 47 ASP H 3.025 . 4.169 3.727 3.551 3.955 . 0 0 "[ . 1]" 1
1141 3 44 ILE MG 3 48 PRO HA 2.925 . 3.995 2.694 2.531 2.770 . 0 0 "[ . 1]" 1
1142 3 44 ILE MG 3 48 PRO HB2 3.050 . 4.213 4.266 4.232 4.300 0.087 8 0 "[ . 1]" 1
1143 3 44 ILE MG 3 48 PRO HB3 2.961 . 4.057 3.223 3.166 3.313 . 0 0 "[ . 1]" 1
1144 3 44 ILE MG 3 51 SER H 3.404 . 4.852 4.419 3.983 4.712 . 0 0 "[ . 1]" 1
1145 3 44 ILE MG 3 51 SER HA 2.934 . 4.010 3.045 2.608 3.393 . 0 0 "[ . 1]" 1
1146 3 44 ILE MG 3 51 SER QB 2.991 . 4.109 2.785 2.253 3.313 . 0 0 "[ . 1]" 1
1147 3 45 HIS H 3 45 HIS HA 2.732 . 3.470 2.837 2.793 2.885 . 0 0 "[ . 1]" 1
1148 3 45 HIS H 3 45 HIS HB2 2.651 . 3.530 2.552 2.333 2.708 . 0 0 "[ . 1]" 1
1149 3 45 HIS H 3 45 HIS HB3 2.615 . 3.470 2.516 2.358 2.716 . 0 0 "[ . 1]" 1
1150 3 45 HIS H 3 46 ASP H 2.719 . 3.643 2.558 2.378 2.760 . 0 0 "[ . 1]" 1
1151 3 45 HIS H 3 46 ASP H 2.443 . 3.189 2.206 2.131 2.314 . 0 0 "[ . 1]" 1
1152 3 45 HIS H 3 46 ASP HA 2.566 . 6.500 5.185 5.044 5.340 . 0 0 "[ . 1]" 1
1153 3 45 HIS H 3 46 ASP QB 3.022 . 6.500 4.392 4.133 4.701 . 0 0 "[ . 1]" 1
1154 3 45 HIS HA 3 45 HIS HB2 2.588 . 3.425 2.470 2.386 2.589 . 0 0 "[ . 1]" 1
1155 3 45 HIS HA 3 45 HIS HB3 2.558 . 3.376 3.024 3.012 3.029 . 0 0 "[ . 1]" 1
1156 3 45 HIS HA 3 46 ASP H 3.194 . 4.469 3.498 3.426 3.561 . 0 0 "[ . 1]" 1
1157 3 45 HIS HA 3 48 PRO HD3 2.946 . 4.031 3.714 3.357 4.042 0.011 5 0 "[ . 1]" 1
1158 3 45 HIS QB 3 46 ASP H 2.799 . 3.778 2.669 2.384 2.913 . 0 0 "[ . 1]" 1
1159 3 45 HIS HB2 3 46 ASP H 2.870 . 3.899 3.907 3.830 3.956 0.057 9 0 "[ . 1]" 1
1160 3 45 HIS HB3 3 46 ASP H 2.869 . 3.898 2.721 2.408 3.009 . 0 0 "[ . 1]" 1
1161 3 46 ASP H 3 46 ASP HA 2.721 . 3.268 2.873 2.841 2.893 . 0 0 "[ . 1]" 1
1162 3 46 ASP H 3 46 ASP QB 2.468 . 2.972 2.250 2.169 2.299 . 0 0 "[ . 1]" 1
1163 3 46 ASP H 3 47 ASP H 2.628 . 3.491 2.425 2.328 2.536 . 0 0 "[ . 1]" 1
1164 3 46 ASP HA 3 47 ASP H 2.626 . 3.389 3.442 3.402 3.464 0.075 7 0 "[ . 1]" 1
1165 3 46 ASP QB 3 47 ASP H 2.554 . 3.136 2.942 2.809 3.142 0.006 6 0 "[ . 1]" 1
1166 3 47 ASP H 3 47 ASP HA 2.980 . 3.490 2.886 2.860 2.919 . 0 0 "[ . 1]" 1
1167 3 47 ASP H 3 47 ASP HB2 2.473 . 3.237 3.189 3.054 3.274 0.037 3 0 "[ . 1]" 1
1168 3 47 ASP H 3 47 ASP HB3 3.317 . 3.394 3.132 3.040 3.219 . 0 0 "[ . 1]" 1
1169 3 47 ASP H 3 48 PRO HD2 3.063 . 3.697 3.751 3.742 3.761 0.064 3 0 "[ . 1]" 1
1170 3 47 ASP H 3 48 PRO HD3 . . 3.593 3.058 2.967 3.151 . 0 0 "[ . 1]" 1
1171 3 47 ASP H 3 48 PRO QG 3.335 . 4.725 4.858 4.801 4.918 0.193 3 0 "[ . 1]" 1
1172 3 47 ASP HA 3 47 ASP HB2 2.390 . 3.104 2.598 2.568 2.626 . 0 0 "[ . 1]" 1
1173 3 47 ASP HA 3 47 ASP HB3 2.589 . 3.427 3.010 3.001 3.017 . 0 0 "[ . 1]" 1
1174 3 47 ASP HA 3 48 PRO HD2 2.309 . 2.976 1.994 1.933 2.051 . 0 0 "[ . 1]" 1
1175 3 47 ASP HA 3 48 PRO HD3 2.489 . 3.263 2.953 2.901 3.024 . 0 0 "[ . 1]" 1
1176 3 47 ASP HA 3 48 PRO QG 2.697 . 6.500 3.826 3.770 3.882 . 0 0 "[ . 1]" 1
1177 3 47 ASP HB3 3 50 GLN HG2 3.048 . 4.209 3.560 3.215 3.991 . 0 0 "[ . 1]" 1
1178 3 47 ASP HB3 3 54 LEU MD1 3.000 . 4.125 4.178 4.165 4.214 0.089 6 0 "[ . 1]" 1
1179 3 47 ASP HB3 3 54 LEU MD2 2.730 . 3.662 2.737 2.538 2.949 . 0 0 "[ . 1]" 1
1180 3 47 ASP HB3 3 54 LEU HG 2.863 . 6.500 5.175 4.724 5.488 . 0 0 "[ . 1]" 1
1181 3 48 PRO HA 3 48 PRO HB2 2.392 . 3.107 2.721 2.700 2.747 . 0 0 "[ . 1]" 1
1182 3 48 PRO HA 3 48 PRO HB3 2.336 . 3.018 2.290 2.275 2.303 . 0 0 "[ . 1]" 1
1183 3 48 PRO HA 3 48 PRO QG 2.682 . 3.581 3.492 3.483 3.496 . 0 0 "[ . 1]" 1
1184 3 48 PRO HA 3 51 SER H 3.141 . 4.374 3.357 3.223 3.548 . 0 0 "[ . 1]" 1
1185 3 48 PRO HB3 3 48 PRO QG 2.134 . 2.704 2.258 2.250 2.263 . 0 0 "[ . 1]" 1
1186 3 48 PRO HD2 3 48 PRO QG 2.114 . 2.673 2.194 2.193 2.197 . 0 0 "[ . 1]" 1
1187 3 48 PRO HD2 3 49 SER H 3.084 . 4.273 3.024 2.926 3.098 . 0 0 "[ . 1]" 1
1188 3 48 PRO HD3 3 48 PRO QG 2.273 . 2.919 2.247 2.239 2.253 . 0 0 "[ . 1]" 1
1189 3 48 PRO HD3 3 49 SER H 3.092 . 4.287 4.052 4.005 4.096 . 0 0 "[ . 1]" 1
1190 3 48 PRO QG 3 49 SER H 3.262 . 3.932 2.941 2.724 3.208 . 0 0 "[ . 1]" 1
1191 3 49 SER H 3 49 SER HA 2.947 . 3.898 2.863 2.822 2.896 . 0 0 "[ . 1]" 1
1192 3 49 SER H 3 49 SER QB 2.863 . 3.888 2.521 2.274 2.920 . 0 0 "[ . 1]" 1
1193 3 49 SER H 3 50 GLN H 2.865 . 3.891 2.464 2.361 2.591 . 0 0 "[ . 1]" 1
1194 3 49 SER HA 3 50 GLN H 2.868 . 3.896 3.525 3.468 3.561 . 0 0 "[ . 1]" 1
1195 3 49 SER HA 3 51 SER H 2.949 . 4.036 3.586 3.466 3.687 . 0 0 "[ . 1]" 1
1196 3 49 SER QB 3 50 GLN H 2.706 . 3.621 2.669 2.444 3.174 . 0 0 "[ . 1]" 1
1197 3 50 GLN H 3 50 GLN HB2 2.578 . 3.196 2.485 2.400 2.590 . 0 0 "[ . 1]" 1
1198 3 50 GLN H 3 50 GLN HB3 2.983 . 4.095 3.579 3.572 3.586 . 0 0 "[ . 1]" 1
1199 3 50 GLN H 3 50 GLN HG2 2.827 . 3.238 2.150 1.971 2.386 . 0 0 "[ . 1]" 1
1200 3 50 GLN H 3 50 GLN HG3 2.962 . 3.333 3.443 3.416 3.469 0.136 9 0 "[ . 1]" 1
1201 3 50 GLN H 3 51 SER H 2.044 . 2.566 2.593 2.574 2.610 0.044 10 0 "[ . 1]" 1
1202 3 50 GLN H 3 54 LEU MD2 3.086 . 4.276 3.569 3.518 3.715 . 0 0 "[ . 1]" 1
1203 3 50 GLN HA 3 50 GLN HB2 2.762 . 3.716 3.017 3.012 3.020 . 0 0 "[ . 1]" 1
1204 3 50 GLN HA 3 50 GLN HB3 2.729 . 3.660 2.431 2.381 2.473 . 0 0 "[ . 1]" 1
1205 3 50 GLN HA 3 50 GLN HG2 2.707 . 3.623 2.952 2.748 3.151 . 0 0 "[ . 1]" 1
1206 3 50 GLN HA 3 50 GLN HG3 2.692 . 6.500 3.791 3.760 3.832 . 0 0 "[ . 1]" 1
1207 3 50 GLN HA 3 53 ASN H 3.578 . 5.178 3.539 3.412 3.628 . 0 0 "[ . 1]" 1
1208 3 50 GLN HB2 3 54 LEU MD1 2.918 . 3.982 2.819 2.411 3.404 . 0 0 "[ . 1]" 1
1209 3 50 GLN HB2 3 54 LEU MD2 2.613 . 3.466 2.009 1.922 2.107 . 0 0 "[ . 1]" 1
1210 3 50 GLN HB3 3 54 LEU MD1 2.882 . 3.920 2.433 1.949 3.505 . 0 0 "[ . 1]" 1
1211 3 50 GLN HB3 3 54 LEU MD2 2.797 . 3.775 2.819 2.520 3.128 . 0 0 "[ . 1]" 1
1212 3 50 GLN HG2 3 54 LEU MD2 2.951 . 4.040 4.083 3.986 4.115 0.075 1 0 "[ . 1]" 1
1213 3 50 GLN HG3 3 54 LEU MD2 2.804 . 3.787 3.642 3.400 3.812 0.025 3 0 "[ . 1]" 1
1214 3 51 SER H 3 51 SER QB 3.027 . 4.172 2.334 2.236 2.549 . 0 0 "[ . 1]" 1
1215 3 51 SER H 3 52 ALA H 3.864 . 3.868 3.321 3.220 3.394 . 0 0 "[ . 1]" 1
1216 3 51 SER H 3 52 ALA HA 3.196 . 6.500 5.750 5.672 5.813 . 0 0 "[ . 1]" 1
1217 3 51 SER HA 3 54 LEU H 3.506 . 5.043 3.550 3.417 3.674 . 0 0 "[ . 1]" 1
1218 3 51 SER HA 3 54 LEU MD2 2.978 . 4.086 2.611 2.113 3.029 . 0 0 "[ . 1]" 1
1219 3 51 SER QB 3 52 ALA H 3.092 . 4.287 2.302 2.033 2.872 . 0 0 "[ . 1]" 1
1220 3 52 ALA H 3 52 ALA HA 2.723 . 3.229 2.744 2.717 2.769 . 0 0 "[ . 1]" 1
1221 3 52 ALA H 3 52 ALA MB 2.444 . 2.464 2.192 2.183 2.207 . 0 0 "[ . 1]" 1
1222 3 52 ALA H 3 53 ASN H 2.757 . 3.236 2.858 2.726 2.929 . 0 0 "[ . 1]" 1
1223 3 52 ALA H 3 53 ASN QB 2.762 . 6.500 4.622 4.455 4.703 . 0 0 "[ . 1]" 1
1224 3 52 ALA HA 3 52 ALA MB 2.094 . 2.575 2.121 2.118 2.126 . 0 0 "[ . 1]" 1
1225 3 52 ALA HA 3 53 ASN H 2.540 . 3.867 3.522 3.468 3.563 . 0 0 "[ . 1]" 1
1226 3 52 ALA HA 3 55 LEU H 3.075 . 3.828 3.421 3.327 3.554 . 0 0 "[ . 1]" 1
1227 3 52 ALA HA 3 56 ALA H 3.215 . 4.507 4.106 3.998 4.248 . 0 0 "[ . 1]" 1
1228 3 52 ALA MB 3 53 ASN H 2.426 . 2.457 2.497 2.461 2.528 0.071 2 0 "[ . 1]" 1
1229 3 52 ALA MB 3 53 ASN QB 2.708 . 3.625 3.671 3.638 3.693 0.068 5 0 "[ . 1]" 1
1230 3 53 ASN H 3 53 ASN HA 2.512 . 2.884 2.849 2.837 2.857 . 0 0 "[ . 1]" 1
1231 3 53 ASN H 3 53 ASN QB 2.278 . 2.372 2.247 2.220 2.261 . 0 0 "[ . 1]" 1
1232 3 53 ASN H 3 54 LEU H 2.495 . 3.273 2.551 2.469 2.604 . 0 0 "[ . 1]" 1
1233 3 53 ASN H 3 55 LEU H 2.819 . 3.812 3.786 3.678 3.887 0.075 2 0 "[ . 1]" 1
1234 3 53 ASN H 3 55 LEU MD1 2.810 . 6.500 5.426 4.717 6.512 0.012 2 0 "[ . 1]" 1
1235 3 53 ASN HA 3 54 LEU H 2.856 . 3.875 3.527 3.492 3.555 . 0 0 "[ . 1]" 1
1236 3 53 ASN HA 3 55 LEU H 2.944 . 4.028 3.977 3.789 4.080 0.052 4 0 "[ . 1]" 1
1237 3 53 ASN HA 3 56 ALA H 2.579 . 3.410 3.000 2.943 3.122 . 0 0 "[ . 1]" 1
1238 3 53 ASN QB 3 54 LEU H 2.338 . 3.021 2.757 2.690 2.807 . 0 0 "[ . 1]" 1
1239 3 53 ASN QB 3 54 LEU MD1 2.790 . 3.763 2.973 2.557 3.671 . 0 0 "[ . 1]" 1
1240 3 53 ASN QB 3 54 LEU HG 2.525 . 6.500 5.676 5.387 5.894 . 0 0 "[ . 1]" 1
1241 3 53 ASN QB 3 56 ALA MB 2.847 . 3.860 3.915 3.886 3.959 0.099 8 0 "[ . 1]" 1
1242 3 54 LEU H 3 54 LEU HB2 2.774 . 3.736 2.275 2.190 2.443 . 0 0 "[ . 1]" 1
1243 3 54 LEU H 3 54 LEU HB3 2.731 . 3.663 3.540 3.491 3.625 . 0 0 "[ . 1]" 1
1244 3 54 LEU H 3 54 LEU MD1 2.536 . 3.340 2.502 2.297 2.982 . 0 0 "[ . 1]" 1
1245 3 54 LEU H 3 54 LEU MD2 2.591 . 3.430 2.918 2.124 3.389 . 0 0 "[ . 1]" 1
1246 3 54 LEU H 3 54 LEU HG 2.584 . 6.500 4.232 4.148 4.292 . 0 0 "[ . 1]" 1
1247 3 54 LEU H 3 55 LEU H 2.940 . 4.021 2.457 2.374 2.559 . 0 0 "[ . 1]" 1
1248 3 54 LEU H 3 56 ALA H 3.410 . 4.863 3.958 3.851 4.018 . 0 0 "[ . 1]" 1
1249 3 54 LEU HA 3 55 LEU H 2.745 . 3.687 2.720 2.713 2.727 . 0 0 "[ . 1]" 1
1250 3 54 LEU HA 3 56 ALA H 4.094 . 6.189 4.358 4.151 4.434 . 0 0 "[ . 1]" 1
1251 3 54 LEU HA 3 57 GLU H 2.924 . 3.993 3.173 3.043 3.441 . 0 0 "[ . 1]" 1
1252 3 54 LEU HA 3 57 GLU QB 2.400 . 3.120 2.321 2.136 2.595 . 0 0 "[ . 1]" 1
1253 3 54 LEU HB2 3 54 LEU MD2 2.392 . 3.107 2.169 2.125 2.202 . 0 0 "[ . 1]" 1
1254 3 54 LEU HB3 3 54 LEU MD2 2.493 . 3.270 2.795 2.592 3.096 . 0 0 "[ . 1]" 1
1255 3 54 LEU MD1 3 54 LEU MD2 1.747 . 2.129 2.058 2.049 2.074 . 0 0 "[ . 1]" 1
1256 3 54 LEU MD1 3 57 GLU QB 2.663 . 3.549 3.171 3.084 3.356 . 0 0 "[ . 1]" 1
1257 3 54 LEU MD1 3 57 GLU QG 2.809 . 3.795 3.750 3.491 3.870 0.075 6 0 "[ . 1]" 1
1258 3 54 LEU MD2 3 54 LEU HG 2.323 . 2.997 2.121 2.108 2.128 . 0 0 "[ . 1]" 1
1259 3 55 LEU H 3 55 LEU HA 2.574 . 3.402 2.843 2.827 2.863 . 0 0 "[ . 1]" 1
1260 3 55 LEU H 3 55 LEU HB2 2.623 . 3.343 2.356 2.043 2.709 . 0 0 "[ . 1]" 1
1261 3 55 LEU H 3 55 LEU HB3 2.522 . 3.317 2.942 2.189 3.468 0.151 10 0 "[ . 1]" 1
1262 3 55 LEU H 3 55 LEU MD1 2.512 . 3.301 3.302 2.566 3.587 0.286 6 0 "[ . 1]" 1
1263 3 55 LEU H 3 55 LEU MD2 2.593 . 6.500 3.692 2.308 4.230 . 0 0 "[ . 1]" 1
1264 3 55 LEU H 3 55 LEU HG 2.700 . 6.500 3.936 2.524 4.550 . 0 0 "[ . 1]" 1
1265 3 55 LEU H 3 56 ALA H 2.968 . 4.069 2.450 2.306 2.591 . 0 0 "[ . 1]" 1
1266 3 55 LEU HA 3 55 LEU HB2 2.487 . 3.260 2.757 2.423 3.003 . 0 0 "[ . 1]" 1
1267 3 55 LEU HA 3 55 LEU HB3 2.401 . 3.122 2.791 2.544 3.015 . 0 0 "[ . 1]" 1
1268 3 55 LEU HA 3 55 LEU MD1 2.321 . 6.500 3.045 1.772 3.820 . 0 0 "[ . 1]" 1
1269 3 55 LEU HA 3 55 LEU MD2 2.484 . 3.255 2.554 1.959 3.457 0.202 5 0 "[ . 1]" 1
1270 3 55 LEU HA 3 56 ALA H 2.756 . 3.705 3.523 3.503 3.531 . 0 0 "[ . 1]" 1
1271 3 55 LEU HA 3 58 ALA H 3.005 . 4.133 3.505 3.338 3.781 . 0 0 "[ . 1]" 1
1272 3 55 LEU HA 3 58 ALA MB 2.635 . 3.503 2.738 2.531 3.211 . 0 0 "[ . 1]" 1
1273 3 55 LEU HB2 3 55 LEU MD1 2.397 . 3.115 2.727 2.164 3.139 0.024 3 0 "[ . 1]" 1
1274 3 55 LEU HB2 3 55 LEU MD2 2.399 . 3.118 2.602 2.141 3.190 0.072 10 0 "[ . 1]" 1
1275 3 55 LEU HB2 3 55 LEU HG 2.627 . 3.056 2.531 2.306 2.955 . 0 0 "[ . 1]" 1
1276 3 55 LEU HB2 3 56 ALA H 2.823 . 3.819 3.191 2.662 3.844 0.025 7 0 "[ . 1]" 1
1277 3 55 LEU HB3 3 55 LEU MD1 2.001 . 2.502 2.438 2.004 3.128 0.626 5 2 "[- + 1]" 1
1278 3 55 LEU HB3 3 55 LEU MD2 2.275 . 2.922 2.768 2.136 3.125 0.203 7 0 "[ . 1]" 1
1279 3 55 LEU HB3 3 55 LEU HG 2.341 . 2.949 2.597 2.270 2.966 0.017 10 0 "[ . 1]" 1
1280 3 55 LEU HB3 3 56 ALA H 2.778 . 3.743 2.963 2.443 3.489 . 0 0 "[ . 1]" 1
1281 3 55 LEU MD1 3 55 LEU HG 2.117 . 2.440 2.095 2.079 2.116 . 0 0 "[ . 1]" 1
1282 3 55 LEU MD2 3 55 LEU HG 2.013 . 2.519 2.108 2.087 2.123 . 0 0 "[ . 1]" 1
1283 3 55 LEU HG 3 56 ALA H 2.885 . 6.500 4.782 4.479 5.146 . 0 0 "[ . 1]" 1
1284 3 56 ALA H 3 56 ALA HA 2.668 . 3.066 2.813 2.791 2.853 . 0 0 "[ . 1]" 1
1285 3 56 ALA H 3 56 ALA MB 2.257 . 2.273 2.221 2.205 2.234 . 0 0 "[ . 1]" 1
1286 3 56 ALA H 3 57 GLU H 2.921 . 3.392 2.625 2.506 2.694 . 0 0 "[ . 1]" 1
1287 3 56 ALA H 3 57 GLU HA 2.922 . 6.500 5.250 5.151 5.306 . 0 0 "[ . 1]" 1
1288 3 56 ALA HA 3 57 GLU H 2.821 . 3.816 3.513 3.477 3.532 . 0 0 "[ . 1]" 1
1289 3 56 ALA HA 3 59 LYS H 2.879 . 3.915 3.458 3.316 3.634 . 0 0 "[ . 1]" 1
1290 3 56 ALA MB 3 57 GLU H 2.514 . 2.680 2.543 2.450 2.707 0.027 1 0 "[ . 1]" 1
1291 3 56 ALA MB 3 59 LYS H 2.990 . 6.500 4.584 4.519 4.659 . 0 0 "[ . 1]" 1
1292 3 57 GLU H 3 57 GLU HA 2.519 . 3.155 2.806 2.776 2.837 . 0 0 "[ . 1]" 1
1293 3 57 GLU H 3 57 GLU QB 2.446 . 2.650 2.221 2.186 2.243 . 0 0 "[ . 1]" 1
1294 3 57 GLU H 3 57 GLU QG 2.656 . 6.500 4.014 3.991 4.032 . 0 0 "[ . 1]" 1
1295 3 57 GLU H 3 58 ALA H 2.426 . 3.162 2.780 2.704 2.862 . 0 0 "[ . 1]" 1
1296 3 57 GLU H 3 58 ALA MB 2.883 . 6.500 4.378 4.261 4.462 . 0 0 "[ . 1]" 1
1297 3 57 GLU HA 3 58 ALA H 2.803 . 3.785 3.559 3.546 3.574 . 0 0 "[ . 1]" 1
1298 3 57 GLU HA 3 60 LYS H 2.755 . 3.651 3.582 3.426 3.694 0.043 1 0 "[ . 1]" 1
1299 3 57 GLU HA 3 61 LEU H 2.882 . 6.500 4.921 4.538 5.713 . 0 0 "[ . 1]" 1
1300 3 57 GLU QB 3 58 ALA H 2.307 . 2.973 2.250 2.129 2.362 . 0 0 "[ . 1]" 1
1301 3 57 GLU QB 3 58 ALA MB 2.909 . 3.967 3.734 3.638 3.800 . 0 0 "[ . 1]" 1
1302 3 57 GLU QG 3 58 ALA H 2.548 . 3.360 3.399 3.382 3.412 0.052 9 0 "[ . 1]" 1
1303 3 57 GLU QG 3 61 LEU MD1 2.861 . 3.885 3.801 3.063 3.964 0.079 6 0 "[ . 1]" 1
1304 3 58 ALA H 3 58 ALA HA 2.633 . 3.370 2.790 2.767 2.814 . 0 0 "[ . 1]" 1
1305 3 58 ALA H 3 58 ALA MB 2.455 . 2.623 2.237 2.225 2.255 . 0 0 "[ . 1]" 1
1306 3 58 ALA H 3 59 LYS H 2.906 . 3.593 2.748 2.638 2.804 . 0 0 "[ . 1]" 1
1307 3 58 ALA HA 3 58 ALA MB 2.188 . 2.787 2.128 2.125 2.131 . 0 0 "[ . 1]" 1
1308 3 58 ALA HA 3 59 LYS H 3.224 . 3.656 3.541 3.486 3.568 . 0 0 "[ . 1]" 1
1309 3 58 ALA HA 3 61 LEU H 3.046 . 3.742 3.324 3.046 3.497 . 0 0 "[ . 1]" 1
1310 3 58 ALA HA 3 62 ASN H 3.573 . 5.169 4.173 3.988 4.572 . 0 0 "[ . 1]" 1
1311 3 58 ALA MB 3 59 LYS H 2.338 . 3.022 2.582 2.449 2.769 . 0 0 "[ . 1]" 1
1312 3 59 LYS H 3 59 LYS HB2 2.387 . 3.099 2.082 2.035 2.127 . 0 0 "[ . 1]" 1
1313 3 59 LYS H 3 59 LYS HB3 2.351 . 6.500 3.354 3.279 3.437 . 0 0 "[ . 1]" 1
1314 3 59 LYS H 3 59 LYS QG 2.454 . 3.207 3.192 2.979 3.291 0.084 3 0 "[ . 1]" 1
1315 3 59 LYS H 3 60 LYS H 2.891 . 3.935 2.735 2.619 2.855 . 0 0 "[ . 1]" 1
1316 3 59 LYS H 3 61 LEU H 3.365 . 4.781 4.312 4.140 4.537 . 0 0 "[ . 1]" 1
1317 3 59 LYS HA 3 59 LYS HB2 2.823 . 3.819 2.879 2.834 2.930 . 0 0 "[ . 1]" 1
1318 3 59 LYS HA 3 59 LYS HB3 2.993 . 4.113 2.803 2.724 2.855 . 0 0 "[ . 1]" 1
1319 3 59 LYS HA 3 59 LYS QG 2.652 . 3.531 2.352 2.123 2.503 . 0 0 "[ . 1]" 1
1320 3 59 LYS HA 3 60 LYS H 3.657 . 5.328 3.498 3.460 3.539 . 0 0 "[ . 1]" 1
1321 3 59 LYS HA 3 62 ASN H 3.270 . 4.208 3.265 3.051 3.504 . 0 0 "[ . 1]" 1
1322 3 59 LYS HA 3 63 ASP H 3.369 . 4.788 3.891 3.715 4.021 . 0 0 "[ . 1]" 1
1323 3 59 LYS HB2 3 60 LYS H 2.821 . 3.816 3.254 3.155 3.436 . 0 0 "[ . 1]" 1
1324 3 59 LYS HB3 3 59 LYS QG 2.497 . 3.277 2.368 2.312 2.439 . 0 0 "[ . 1]" 1
1325 3 59 LYS HB3 3 60 LYS H 2.618 . 3.475 3.231 2.854 3.505 0.030 10 0 "[ . 1]" 1
1326 3 59 LYS HE2 3 59 LYS QG 2.680 . 3.578 2.703 2.356 3.312 . 0 0 "[ . 1]" 1
1327 3 59 LYS HE3 3 59 LYS QG 2.682 . 3.581 2.653 2.353 3.310 . 0 0 "[ . 1]" 1
1328 3 60 LYS H 3 60 LYS HA 2.489 . 3.230 2.814 2.785 2.854 . 0 0 "[ . 1]" 1
1329 3 60 LYS H 3 60 LYS QB 1.981 . 2.471 2.332 2.224 2.493 0.022 10 0 "[ . 1]" 1
1330 3 60 LYS H 3 61 LEU H 2.713 . 3.633 2.677 2.497 2.790 . 0 0 "[ . 1]" 1
1331 3 60 LYS H 3 62 ASN H 3.133 . 4.360 4.187 4.064 4.310 . 0 0 "[ . 1]" 1
1332 3 60 LYS HA 3 63 ASP H 3.149 . 4.389 3.570 3.415 3.779 . 0 0 "[ . 1]" 1
1333 3 60 LYS QB 3 61 LEU H 2.083 . 2.625 2.448 2.213 2.621 . 0 0 "[ . 1]" 1
1334 3 61 LEU H 3 61 LEU HA 2.694 . 2.911 2.817 2.777 2.870 . 0 0 "[ . 1]" 1
1335 3 61 LEU H 3 61 LEU HB2 2.530 . 3.120 2.159 1.969 2.634 . 0 0 "[ . 1]" 1
1336 3 61 LEU H 3 61 LEU HB3 2.554 . 6.500 3.246 2.887 3.650 . 0 0 "[ . 1]" 1
1337 3 61 LEU H 3 61 LEU MD1 2.779 . 3.744 3.373 1.850 3.866 0.122 8 0 "[ . 1]" 1
1338 3 61 LEU H 3 61 LEU MD2 2.712 . 6.500 4.178 3.945 4.359 . 0 0 "[ . 1]" 1
1339 3 61 LEU H 3 61 LEU HG 2.915 . 3.968 3.437 2.652 3.999 0.031 8 0 "[ . 1]" 1
1340 3 61 LEU H 3 62 ASN H 2.829 . 3.830 2.707 2.519 2.839 . 0 0 "[ . 1]" 1
1341 3 61 LEU HA 3 62 ASN H 3.353 . 4.758 3.557 3.530 3.590 . 0 0 "[ . 1]" 1
1342 3 61 LEU HA 3 64 ALA H 2.675 . 3.569 3.359 3.175 3.581 0.012 10 0 "[ . 1]" 1
1343 3 61 LEU HB2 3 61 LEU HG 2.424 . 3.159 2.621 2.509 2.952 . 0 0 "[ . 1]" 1
1344 3 61 LEU HB2 3 62 ASN H 2.713 . 3.633 2.875 2.409 3.291 . 0 0 "[ . 1]" 1
1345 3 61 LEU HB3 3 61 LEU HG 2.785 . 3.755 2.951 2.704 3.014 . 0 0 "[ . 1]" 1
1346 3 61 LEU HB3 3 62 ASN H 2.723 . 3.650 2.799 2.264 3.662 0.012 3 0 "[ . 1]" 1
1347 3 61 LEU MD2 3 64 ALA H 2.712 . 6.500 4.946 4.392 6.069 . 0 0 "[ . 1]" 1
1348 3 61 LEU HG 3 62 ASN H 2.832 . 6.500 4.780 4.502 4.928 . 0 0 "[ . 1]" 1
1349 3 62 ASN H 3 62 ASN HA 2.961 . 3.636 2.765 2.730 2.809 . 0 0 "[ . 1]" 1
1350 3 62 ASN H 3 62 ASN HB2 2.771 . 3.731 2.646 2.490 3.404 . 0 0 "[ . 1]" 1
1351 3 62 ASN H 3 62 ASN HB3 2.891 . 3.936 2.438 2.125 2.548 . 0 0 "[ . 1]" 1
1352 3 62 ASN H 3 63 ASP H 2.778 . 3.743 2.834 2.687 2.969 . 0 0 "[ . 1]" 1
1353 3 62 ASN HA 3 63 ASP H 3.652 . 5.319 3.540 3.502 3.575 . 0 0 "[ . 1]" 1
1354 3 62 ASN HA 3 65 GLN H 3.202 . 4.484 3.832 3.412 4.214 . 0 0 "[ . 1]" 1
1355 3 62 ASN HA 3 66 ALA H 3.098 . 6.500 4.911 4.467 5.310 . 0 0 "[ . 1]" 1
1356 3 62 ASN HB2 3 63 ASP H 3.145 . 4.382 3.984 3.847 4.257 . 0 0 "[ . 1]" 1
1357 3 62 ASN HB3 3 63 ASP H 3.286 . 4.636 2.739 2.465 3.539 . 0 0 "[ . 1]" 1
1358 3 63 ASP H 3 63 ASP HA 2.823 . 3.320 2.860 2.835 2.874 . 0 0 "[ . 1]" 1
1359 3 63 ASP H 3 63 ASP QB 2.570 . 3.035 2.281 2.233 2.449 . 0 0 "[ . 1]" 1
1360 3 63 ASP H 3 64 ALA H 2.717 . 3.610 2.446 2.421 2.506 . 0 0 "[ . 1]" 1
1361 3 63 ASP H 3 64 ALA MB 2.960 . 4.055 4.077 4.057 4.115 0.060 6 0 "[ . 1]" 1
1362 3 63 ASP H 3 65 GLN H 3.324 . 4.705 4.284 3.984 4.710 0.005 7 0 "[ . 1]" 1
1363 3 63 ASP H 3 66 ALA MB 3.085 . 4.275 4.273 4.210 4.300 0.025 6 0 "[ . 1]" 1
1364 3 63 ASP HA 3 64 ALA H 2.982 . 3.422 3.461 3.436 3.476 0.054 8 0 "[ . 1]" 1
1365 3 63 ASP HA 3 66 ALA H 2.691 . 3.596 3.495 3.347 3.616 0.020 2 0 "[ . 1]" 1
1366 3 63 ASP QB 3 64 ALA H 2.524 . 3.320 2.781 2.670 2.989 . 0 0 "[ . 1]" 1
1367 3 64 ALA H 3 64 ALA HA 2.431 . 2.824 2.811 2.783 2.840 0.016 8 0 "[ . 1]" 1
1368 3 64 ALA H 3 64 ALA MB . . 2.129 2.184 2.172 2.191 0.062 2 0 "[ . 1]" 1
1369 3 64 ALA H 3 65 GLN H 2.512 . 3.301 2.688 2.519 2.862 . 0 0 "[ . 1]" 1
1370 3 64 ALA H 3 66 ALA H 2.850 . 3.865 3.765 3.666 3.856 . 0 0 "[ . 1]" 1
1371 3 64 ALA HA 3 66 ALA H 2.790 . 6.500 3.792 3.605 3.931 . 0 0 "[ . 1]" 1
1372 3 64 ALA MB 3 66 ALA H 2.919 . 3.984 4.056 4.027 4.075 0.091 8 0 "[ . 1]" 1
1373 3 65 GLN H 3 66 ALA H 2.454 . 3.207 2.528 2.412 2.688 . 0 0 "[ . 1]" 1
1374 3 65 GLN HA 3 66 ALA H 2.339 . 6.500 3.148 2.966 3.259 . 0 0 "[ . 1]" 1
1375 3 66 ALA H 3 66 ALA HA 2.476 . 3.054 2.875 2.814 2.925 . 0 0 "[ . 1]" 1
1376 3 66 ALA H 3 66 ALA MB 2.130 . 2.144 2.218 2.209 2.234 0.090 6 0 "[ . 1]" 1
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