NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
620178 |
5jdx   |
30066 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5jdx
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 1357
_Distance_constraint_stats_list.Viol_count 2604
_Distance_constraint_stats_list.Viol_total 4833.862
_Distance_constraint_stats_list.Viol_max 1.126
_Distance_constraint_stats_list.Viol_rms 0.0407
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0089
_Distance_constraint_stats_list.Viol_average_violations_only 0.0928
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 LEU 0.726 0.140 14 0 "[ . 1 . 2]"
1 3 GLU 3.990 0.203 11 0 "[ . 1 . 2]"
1 4 SER 1.334 0.203 11 0 "[ . 1 . 2]"
1 5 LYS 0.353 0.134 12 0 "[ . 1 . 2]"
1 6 LEU 5.374 0.195 3 0 "[ . 1 . 2]"
1 7 ILE 8.383 0.281 7 0 "[ . 1 . 2]"
1 8 ASN 1.952 0.286 15 0 "[ . 1 . 2]"
1 9 HIS 4.656 0.286 15 0 "[ . 1 . 2]"
1 10 ILE 20.933 0.626 8 1 "[ . + 1 . 2]"
1 11 ALA 8.859 0.281 7 0 "[ . 1 . 2]"
1 12 THR 4.229 0.223 11 0 "[ . 1 . 2]"
1 13 GLN 5.889 0.626 8 1 "[ . + 1 . 2]"
1 14 PHE 16.112 0.390 1 0 "[ . 1 . 2]"
1 15 LEU 5.696 0.258 1 0 "[ . 1 . 2]"
1 16 ASP 5.177 0.270 16 0 "[ . 1 . 2]"
1 17 GLY 3.271 0.124 1 0 "[ . 1 . 2]"
1 18 GLU 6.554 0.270 16 0 "[ . 1 . 2]"
1 19 LYS 11.642 0.234 16 0 "[ . 1 . 2]"
1 20 ASP 4.884 0.203 15 0 "[ . 1 . 2]"
1 21 GLY 1.447 0.174 4 0 "[ . 1 . 2]"
1 22 LEU 6.200 0.233 13 0 "[ . 1 . 2]"
1 23 ASP 2.549 0.181 17 0 "[ . 1 . 2]"
1 24 SER 2.026 0.236 17 0 "[ . 1 . 2]"
1 25 GLN 3.338 0.258 11 0 "[ . 1 . 2]"
1 26 THR 7.658 0.224 10 0 "[ . 1 . 2]"
1 27 PRO 10.469 0.295 16 0 "[ . 1 . 2]"
1 28 LEU 4.530 0.201 7 0 "[ . 1 . 2]"
1 29 PHE 5.817 0.357 12 0 "[ . 1 . 2]"
1 30 GLU 1.149 0.192 2 0 "[ . 1 . 2]"
1 31 LEU 8.458 0.210 6 0 "[ . 1 . 2]"
1 32 ASN 5.172 0.295 16 0 "[ . 1 . 2]"
1 33 ILE 6.188 0.210 6 0 "[ . 1 . 2]"
1 34 VAL 8.632 0.210 8 0 "[ . 1 . 2]"
1 35 ASP 6.133 0.283 6 0 "[ . 1 . 2]"
1 36 SER 6.346 0.290 9 0 "[ . 1 . 2]"
1 37 ALA 1.400 0.153 17 0 "[ . 1 . 2]"
1 38 ALA 4.074 0.294 3 0 "[ . 1 . 2]"
1 39 ILE 9.815 0.280 16 0 "[ . 1 . 2]"
1 40 PHE 0.790 0.172 18 0 "[ . 1 . 2]"
1 41 ASP 0.536 0.114 16 0 "[ . 1 . 2]"
1 42 LEU 2.390 0.285 8 0 "[ . 1 . 2]"
1 43 VAL 4.605 0.285 8 0 "[ . 1 . 2]"
1 44 ASP 8.481 0.392 8 0 "[ . 1 . 2]"
1 45 PHE 7.761 0.392 8 0 "[ . 1 . 2]"
1 46 LEU 4.970 0.199 20 0 "[ . 1 . 2]"
1 47 ARG 5.154 0.270 16 0 "[ . 1 . 2]"
1 48 GLN 3.768 0.269 19 0 "[ . 1 . 2]"
1 49 GLU 1.860 0.196 6 0 "[ . 1 . 2]"
1 50 SER 6.790 0.374 9 0 "[ . 1 . 2]"
1 51 LYS 2.951 0.374 9 0 "[ . 1 . 2]"
1 52 VAL 6.574 0.290 12 0 "[ . 1 . 2]"
1 53 SER 3.567 0.270 16 0 "[ . 1 . 2]"
1 54 ILE 5.968 0.358 7 0 "[ . 1 . 2]"
1 55 GLY 3.341 0.497 3 0 "[ . 1 . 2]"
1 56 MET 2.066 0.497 3 0 "[ . 1 . 2]"
1 57 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 GLU 2.333 0.288 3 0 "[ . 1 . 2]"
1 59 ILE 8.866 0.279 11 0 "[ . 1 . 2]"
1 60 HIS 9.705 0.353 7 0 "[ . 1 . 2]"
1 61 PRO 6.466 0.309 18 0 "[ . 1 . 2]"
1 62 ALA 2.422 0.353 7 0 "[ . 1 . 2]"
1 63 ASN 0.806 0.094 3 0 "[ . 1 . 2]"
1 64 PHE 7.881 0.358 7 0 "[ . 1 . 2]"
1 65 ALA 5.714 0.357 12 0 "[ . 1 . 2]"
1 66 THR 2.694 0.219 4 0 "[ . 1 . 2]"
1 67 VAL 3.398 0.201 7 0 "[ . 1 . 2]"
1 68 GLN 2.256 0.172 5 0 "[ . 1 . 2]"
1 69 SER 0.817 0.094 3 0 "[ . 1 . 2]"
1 70 MET 6.970 0.236 17 0 "[ . 1 . 2]"
1 71 VAL 23.096 1.126 4 17 "[***+.****1******** -]"
1 72 ALA 19.041 1.126 4 17 "[***+.****1******** -]"
1 73 LEU 11.468 0.273 12 0 "[ . 1 . 2]"
1 74 VAL 1.056 0.121 19 0 "[ . 1 . 2]"
1 75 GLN 6.567 0.275 15 0 "[ . 1 . 2]"
1 76 ARG 2.719 0.211 1 0 "[ . 1 . 2]"
1 77 LEU 8.490 0.274 16 0 "[ . 1 . 2]"
1 78 LYS 12.158 0.290 12 0 "[ . 1 . 2]"
1 79 ALA 2.133 0.225 18 0 "[ . 1 . 2]"
1 80 HIS 0.281 0.103 16 0 "[ . 1 . 2]"
1 81 PRO 1.836 0.336 9 0 "[ . 1 . 2]"
1 82 GLU 0.528 0.151 1 0 "[ . 1 . 2]"
1 83 GLN 2.516 0.336 9 0 "[ . 1 . 2]"
1 84 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 85 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 ALA 0.504 0.164 18 0 "[ . 1 . 2]"
1 87 ALA 0.610 0.164 18 0 "[ . 1 . 2]"
1 88 LEU 2.094 0.405 18 0 "[ . 1 . 2]"
1 89 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 LEU QB 1 3 GLU H . . 4.050 2.955 2.274 4.081 0.031 16 0 "[ . 1 . 2]" 1
2 1 2 LEU QD 1 3 GLU H . . 4.040 3.635 2.404 4.180 0.140 14 0 "[ . 1 . 2]" 1
3 1 2 LEU QD 1 5 LYS H . . 5.270 4.789 4.373 5.301 0.031 3 0 "[ . 1 . 2]" 1
4 1 2 LEU QD 1 6 LEU H . . 5.410 4.808 4.311 5.302 . 0 0 "[ . 1 . 2]" 1
5 1 2 LEU QD 1 45 PHE QE . . 4.360 2.561 1.759 3.309 . 0 0 "[ . 1 . 2]" 1
6 1 2 LEU QD 1 45 PHE HZ . . 4.900 2.485 1.878 3.327 . 0 0 "[ . 1 . 2]" 1
7 1 2 LEU QD 1 49 GLU HB2 . . 4.550 3.657 2.853 4.529 . 0 0 "[ . 1 . 2]" 1
8 1 2 LEU QD 1 49 GLU HB3 . . 4.020 3.044 2.497 3.744 . 0 0 "[ . 1 . 2]" 1
9 1 2 LEU QD 1 49 GLU QG . . 2.660 2.082 1.624 2.759 0.099 4 0 "[ . 1 . 2]" 1
10 1 2 LEU HG 1 3 GLU H . . 5.500 3.878 3.007 4.509 . 0 0 "[ . 1 . 2]" 1
11 1 2 LEU HG 1 3 GLU HA . . 4.420 3.998 3.474 4.460 0.040 14 0 "[ . 1 . 2]" 1
12 1 2 LEU HG 1 45 PHE QE . . 3.540 2.541 1.750 3.535 . 0 0 "[ . 1 . 2]" 1
13 1 2 LEU HG 1 45 PHE HZ . . 4.100 3.235 2.386 4.178 0.078 13 0 "[ . 1 . 2]" 1
14 1 3 GLU H 1 3 GLU HB2 . . 4.000 2.806 2.320 3.650 . 0 0 "[ . 1 . 2]" 1
15 1 3 GLU H 1 3 GLU QB . . 3.470 2.527 2.212 2.812 . 0 0 "[ . 1 . 2]" 1
16 1 3 GLU H 1 3 GLU HB3 . . 4.000 3.321 2.437 3.688 . 0 0 "[ . 1 . 2]" 1
17 1 3 GLU H 1 3 GLU QG . . 4.000 2.897 1.973 4.000 . 0 0 "[ . 1 . 2]" 1
18 1 3 GLU H 1 4 SER H . . 4.430 2.603 2.442 2.817 . 0 0 "[ . 1 . 2]" 1
19 1 3 GLU HA 1 3 GLU HG2 . . 4.120 3.589 2.755 4.251 0.131 11 0 "[ . 1 . 2]" 1
20 1 3 GLU HA 1 3 GLU QG . . 3.470 2.823 2.312 3.518 0.048 7 0 "[ . 1 . 2]" 1
21 1 3 GLU HA 1 3 GLU HG3 . . 4.120 3.104 2.399 4.264 0.144 7 0 "[ . 1 . 2]" 1
22 1 3 GLU HA 1 6 LEU QB . . 5.000 4.031 3.589 4.309 . 0 0 "[ . 1 . 2]" 1
23 1 3 GLU HA 1 6 LEU MD2 . . 3.170 2.164 1.983 2.335 . 0 0 "[ . 1 . 2]" 1
24 1 3 GLU HA 1 24 SER QB . . 5.340 4.435 3.074 5.360 0.020 17 0 "[ . 1 . 2]" 1
25 1 3 GLU QB 1 4 SER H . . 3.570 2.778 2.228 3.652 0.082 9 0 "[ . 1 . 2]" 1
26 1 3 GLU QB 1 6 LEU MD1 . . 4.930 3.929 3.217 4.903 . 0 0 "[ . 1 . 2]" 1
27 1 3 GLU QB 1 24 SER QB . . 4.730 2.713 1.733 4.137 . 0 0 "[ . 1 . 2]" 1
28 1 3 GLU HB2 1 4 SER H . . 4.080 3.013 2.384 4.147 0.067 9 0 "[ . 1 . 2]" 1
29 1 3 GLU HB3 1 4 SER H . . 4.080 3.716 2.246 4.283 0.203 11 0 "[ . 1 . 2]" 1
30 1 3 GLU QG 1 6 LEU MD2 . . 3.830 3.434 2.139 4.024 0.194 11 0 "[ . 1 . 2]" 1
31 1 3 GLU QG 1 24 SER QB . . 3.990 2.957 1.895 3.989 . 0 0 "[ . 1 . 2]" 1
32 1 3 GLU HG2 1 6 LEU MD2 . . 4.450 4.324 2.965 4.645 0.195 3 0 "[ . 1 . 2]" 1
33 1 3 GLU HG3 1 6 LEU MD2 . . 4.450 3.720 2.194 4.568 0.118 5 0 "[ . 1 . 2]" 1
34 1 4 SER H 1 4 SER QB . . 3.530 2.544 2.310 2.708 . 0 0 "[ . 1 . 2]" 1
35 1 4 SER H 1 5 LYS H . . 4.140 2.646 2.382 2.840 . 0 0 "[ . 1 . 2]" 1
36 1 4 SER HA 1 7 ILE H . . 4.380 3.787 3.217 4.051 . 0 0 "[ . 1 . 2]" 1
37 1 4 SER HA 1 7 ILE HB . . 3.530 2.948 2.487 3.264 . 0 0 "[ . 1 . 2]" 1
38 1 4 SER HA 1 7 ILE MG . . 4.240 4.161 3.792 4.395 0.155 3 0 "[ . 1 . 2]" 1
39 1 4 SER HA 1 8 ASN H . . 4.470 4.028 3.621 4.532 0.062 7 0 "[ . 1 . 2]" 1
40 1 4 SER QB 1 5 LYS H . . 3.980 3.126 2.805 3.766 . 0 0 "[ . 1 . 2]" 1
41 1 4 SER QB 1 7 ILE HB . . 4.720 4.477 3.615 4.840 0.120 11 0 "[ . 1 . 2]" 1
42 1 5 LYS H 1 5 LYS HB2 . . 4.070 2.576 2.298 3.655 . 0 0 "[ . 1 . 2]" 1
43 1 5 LYS H 1 5 LYS QB . . 3.540 2.320 2.181 2.768 . 0 0 "[ . 1 . 2]" 1
44 1 5 LYS H 1 5 LYS HB3 . . 4.070 2.830 2.412 3.663 . 0 0 "[ . 1 . 2]" 1
45 1 5 LYS H 1 5 LYS HG2 . . 4.840 3.960 2.003 4.684 . 0 0 "[ . 1 . 2]" 1
46 1 5 LYS H 1 5 LYS QG . . 4.110 3.507 1.975 4.066 . 0 0 "[ . 1 . 2]" 1
47 1 5 LYS H 1 5 LYS HG3 . . 4.840 4.094 2.300 4.644 . 0 0 "[ . 1 . 2]" 1
48 1 5 LYS H 1 6 LEU H . . 4.140 2.595 2.477 2.743 . 0 0 "[ . 1 . 2]" 1
49 1 5 LYS HA 1 5 LYS HG2 . . 4.150 3.096 2.440 3.882 . 0 0 "[ . 1 . 2]" 1
50 1 5 LYS HA 1 5 LYS QG . . 3.580 2.649 2.392 3.393 . 0 0 "[ . 1 . 2]" 1
51 1 5 LYS HA 1 5 LYS HG3 . . 4.150 3.154 2.498 3.842 . 0 0 "[ . 1 . 2]" 1
52 1 5 LYS HA 1 7 ILE H . . 5.040 4.402 4.158 4.593 . 0 0 "[ . 1 . 2]" 1
53 1 5 LYS QB 1 5 LYS QD . . 3.190 2.464 2.158 2.852 . 0 0 "[ . 1 . 2]" 1
54 1 5 LYS QB 1 45 PHE QE . . 4.300 2.967 2.181 3.787 . 0 0 "[ . 1 . 2]" 1
55 1 5 LYS QB 1 45 PHE HZ . . 4.540 2.514 1.955 3.772 . 0 0 "[ . 1 . 2]" 1
56 1 5 LYS QD 1 45 PHE QE . . 5.340 3.197 1.545 5.438 0.098 1 0 "[ . 1 . 2]" 1
57 1 5 LYS QD 1 45 PHE HZ . . 5.340 3.594 1.992 5.474 0.134 12 0 "[ . 1 . 2]" 1
58 1 5 LYS QE 1 5 LYS QG . . 3.450 2.524 2.164 2.909 . 0 0 "[ . 1 . 2]" 1
59 1 5 LYS QE 1 45 PHE QE . . 5.500 3.528 1.813 4.682 . 0 0 "[ . 1 . 2]" 1
60 1 5 LYS QE 1 45 PHE HZ . . 5.500 4.228 2.276 5.484 . 0 0 "[ . 1 . 2]" 1
61 1 6 LEU H 1 6 LEU HB2 . . 4.080 3.682 3.655 3.721 . 0 0 "[ . 1 . 2]" 1
62 1 6 LEU H 1 6 LEU QB . . 3.470 2.611 2.474 2.673 . 0 0 "[ . 1 . 2]" 1
63 1 6 LEU H 1 6 LEU HB3 . . 4.080 2.671 2.516 2.743 . 0 0 "[ . 1 . 2]" 1
64 1 6 LEU H 1 6 LEU MD1 . . 4.370 3.748 3.597 4.010 . 0 0 "[ . 1 . 2]" 1
65 1 6 LEU H 1 6 LEU MD2 . . 3.910 3.239 3.090 3.377 . 0 0 "[ . 1 . 2]" 1
66 1 6 LEU H 1 6 LEU HG . . 3.990 2.317 2.153 2.642 . 0 0 "[ . 1 . 2]" 1
67 1 6 LEU H 1 7 ILE H . . 4.010 2.584 2.454 2.647 . 0 0 "[ . 1 . 2]" 1
68 1 6 LEU H 1 45 PHE QE . . 4.420 3.800 3.097 4.189 . 0 0 "[ . 1 . 2]" 1
69 1 6 LEU HA 1 6 LEU MD1 . . 3.900 3.776 3.714 3.818 . 0 0 "[ . 1 . 2]" 1
70 1 6 LEU HA 1 6 LEU MD2 . . 4.290 4.143 4.106 4.190 . 0 0 "[ . 1 . 2]" 1
71 1 6 LEU HA 1 6 LEU HG . . 3.720 3.768 3.740 3.814 0.094 3 0 "[ . 1 . 2]" 1
72 1 6 LEU HA 1 45 PHE QE . . 3.920 3.901 3.440 4.090 0.170 9 0 "[ . 1 . 2]" 1
73 1 6 LEU HA 1 45 PHE HZ . . 5.200 4.698 3.910 5.085 . 0 0 "[ . 1 . 2]" 1
74 1 6 LEU QB 1 6 LEU MD2 . . 2.840 2.136 2.117 2.149 . 0 0 "[ . 1 . 2]" 1
75 1 6 LEU QB 1 7 ILE H . . 3.850 3.589 3.539 3.633 . 0 0 "[ . 1 . 2]" 1
76 1 6 LEU QB 1 45 PHE HB2 . . 4.610 3.867 3.288 4.504 . 0 0 "[ . 1 . 2]" 1
77 1 6 LEU QB 1 45 PHE QD . . 3.570 2.823 2.208 3.251 . 0 0 "[ . 1 . 2]" 1
78 1 6 LEU HB2 1 6 LEU MD1 . . 3.250 2.329 2.299 2.396 . 0 0 "[ . 1 . 2]" 1
79 1 6 LEU HB2 1 6 LEU MD2 . . 3.310 2.738 2.657 2.824 . 0 0 "[ . 1 . 2]" 1
80 1 6 LEU HB2 1 7 ILE H . . 4.470 3.978 3.910 4.071 . 0 0 "[ . 1 . 2]" 1
81 1 6 LEU HB3 1 6 LEU MD1 . . 3.250 3.223 3.192 3.263 0.013 7 0 "[ . 1 . 2]" 1
82 1 6 LEU HB3 1 6 LEU MD2 . . 3.310 2.229 2.207 2.243 . 0 0 "[ . 1 . 2]" 1
83 1 6 LEU HB3 1 7 ILE H . . 4.470 4.088 3.952 4.155 . 0 0 "[ . 1 . 2]" 1
84 1 6 LEU MD1 1 7 ILE H . . 4.300 2.664 2.391 2.982 . 0 0 "[ . 1 . 2]" 1
85 1 6 LEU MD2 1 7 ILE H . . 4.120 4.134 3.931 4.238 0.118 7 0 "[ . 1 . 2]" 1
86 1 6 LEU MD2 1 45 PHE QD . . 3.800 2.986 2.474 3.920 0.120 3 0 "[ . 1 . 2]" 1
87 1 6 LEU MD2 1 45 PHE QE . . 4.170 2.559 2.179 2.995 . 0 0 "[ . 1 . 2]" 1
88 1 6 LEU HG 1 7 ILE H . . 5.170 2.489 2.237 2.651 . 0 0 "[ . 1 . 2]" 1
89 1 6 LEU HG 1 45 PHE QE . . 5.500 4.422 3.613 4.736 . 0 0 "[ . 1 . 2]" 1
90 1 6 LEU HG 1 45 PHE HZ . . 5.500 5.201 4.697 5.589 0.089 5 0 "[ . 1 . 2]" 1
91 1 7 ILE H 1 7 ILE HB . . 3.200 2.524 2.423 2.630 . 0 0 "[ . 1 . 2]" 1
92 1 7 ILE H 1 7 ILE MD . . 3.880 3.456 3.283 3.595 . 0 0 "[ . 1 . 2]" 1
93 1 7 ILE H 1 7 ILE QG . . 3.650 2.210 2.064 2.413 . 0 0 "[ . 1 . 2]" 1
94 1 7 ILE H 1 7 ILE MG . . 3.840 3.821 3.796 3.853 0.013 2 0 "[ . 1 . 2]" 1
95 1 7 ILE H 1 8 ASN H . . 3.820 2.747 2.627 2.847 . 0 0 "[ . 1 . 2]" 1
96 1 7 ILE HA 1 7 ILE MD . . 3.970 3.460 1.963 3.974 0.004 2 0 "[ . 1 . 2]" 1
97 1 7 ILE HA 1 7 ILE QG . . 3.140 2.615 2.440 2.992 . 0 0 "[ . 1 . 2]" 1
98 1 7 ILE HA 1 7 ILE MG . . 3.400 2.505 2.440 2.578 . 0 0 "[ . 1 . 2]" 1
99 1 7 ILE HA 1 22 LEU QD . . 4.040 3.178 2.471 3.821 . 0 0 "[ . 1 . 2]" 1
100 1 7 ILE HB 1 8 ASN H . . 3.590 2.267 2.101 2.428 . 0 0 "[ . 1 . 2]" 1
101 1 7 ILE HB 1 8 ASN QB . . 4.370 3.785 3.581 4.125 . 0 0 "[ . 1 . 2]" 1
102 1 7 ILE HB 1 19 LYS QD . . 3.880 2.969 2.176 3.752 . 0 0 "[ . 1 . 2]" 1
103 1 7 ILE MD 1 8 ASN H . . 4.420 4.338 4.070 4.629 0.209 3 0 "[ . 1 . 2]" 1
104 1 7 ILE MD 1 23 ASP HA . . 3.390 2.053 1.791 2.669 . 0 0 "[ . 1 . 2]" 1
105 1 7 ILE MD 1 23 ASP HB2 . . 4.610 4.097 3.468 4.791 0.181 17 0 "[ . 1 . 2]" 1
106 1 7 ILE MD 1 23 ASP QB . . 3.990 3.461 2.787 4.134 0.144 10 0 "[ . 1 . 2]" 1
107 1 7 ILE MD 1 23 ASP HB3 . . 4.610 3.936 2.843 4.732 0.122 15 0 "[ . 1 . 2]" 1
108 1 7 ILE MD 1 24 SER H . . 4.830 2.375 1.719 3.747 . 0 0 "[ . 1 . 2]" 1
109 1 7 ILE MD 1 24 SER QB . . 4.130 3.222 2.157 4.199 0.069 10 0 "[ . 1 . 2]" 1
110 1 7 ILE QG 1 22 LEU HG . . 5.340 3.724 2.649 5.444 0.104 2 0 "[ . 1 . 2]" 1
111 1 7 ILE MG 1 8 ASN H . . 3.720 3.125 2.988 3.256 . 0 0 "[ . 1 . 2]" 1
112 1 7 ILE MG 1 8 ASN QB . . 4.220 3.949 3.596 4.107 . 0 0 "[ . 1 . 2]" 1
113 1 7 ILE MG 1 9 HIS H . . 4.670 4.712 4.618 4.756 0.086 13 0 "[ . 1 . 2]" 1
114 1 7 ILE MG 1 11 ALA H . . 3.950 3.984 3.780 4.053 0.103 8 0 "[ . 1 . 2]" 1
115 1 7 ILE MG 1 11 ALA HA . . 4.310 4.410 4.180 4.591 0.281 7 0 "[ . 1 . 2]" 1
116 1 7 ILE MG 1 19 LYS HA . . 4.040 3.388 2.915 3.961 . 0 0 "[ . 1 . 2]" 1
117 1 7 ILE MG 1 19 LYS QE . . 4.990 4.160 3.680 4.852 . 0 0 "[ . 1 . 2]" 1
118 1 7 ILE MG 1 22 LEU HB2 . . 4.390 4.269 3.937 4.541 0.151 3 0 "[ . 1 . 2]" 1
119 1 7 ILE MG 1 22 LEU HB3 . . 3.300 2.985 2.604 3.312 0.012 18 0 "[ . 1 . 2]" 1
120 1 7 ILE MG 1 23 ASP HA . . 4.710 2.961 2.225 3.511 . 0 0 "[ . 1 . 2]" 1
121 1 7 ILE MG 1 23 ASP QB . . 5.340 4.346 3.545 4.996 . 0 0 "[ . 1 . 2]" 1
122 1 8 ASN H 1 8 ASN QB . . 3.120 2.255 2.180 2.433 . 0 0 "[ . 1 . 2]" 1
123 1 8 ASN H 1 8 ASN QD . . 4.830 4.474 4.249 4.579 . 0 0 "[ . 1 . 2]" 1
124 1 8 ASN H 1 9 HIS H . . 3.540 2.745 2.602 2.925 . 0 0 "[ . 1 . 2]" 1
125 1 8 ASN H 1 19 LYS QD . . 4.490 3.442 2.709 4.416 . 0 0 "[ . 1 . 2]" 1
126 1 8 ASN QB 1 9 HIS H . . 3.600 2.907 2.632 3.677 0.077 9 0 "[ . 1 . 2]" 1
127 1 8 ASN QB 1 19 LYS QD . . 4.650 2.612 1.768 4.017 . 0 0 "[ . 1 . 2]" 1
128 1 8 ASN QD 1 9 HIS HA . . 4.700 3.593 3.093 4.785 0.085 9 0 "[ . 1 . 2]" 1
129 1 8 ASN QD 1 9 HIS QB . . 4.900 4.597 3.869 5.186 0.286 15 0 "[ . 1 . 2]" 1
130 1 9 HIS H 1 9 HIS QB . . 3.130 2.220 2.159 2.256 . 0 0 "[ . 1 . 2]" 1
131 1 9 HIS H 1 10 ILE H . . 4.060 3.067 2.966 3.145 . 0 0 "[ . 1 . 2]" 1
132 1 9 HIS H 1 11 ALA H . . 4.050 3.858 3.722 3.996 . 0 0 "[ . 1 . 2]" 1
133 1 9 HIS HA 1 9 HIS HD2 . . 4.260 3.873 3.665 4.284 0.024 15 0 "[ . 1 . 2]" 1
134 1 9 HIS HA 1 11 ALA H . . 4.980 4.664 4.559 4.813 . 0 0 "[ . 1 . 2]" 1
135 1 9 HIS QB 1 10 ILE H . . 3.760 2.155 2.059 2.229 . 0 0 "[ . 1 . 2]" 1
136 1 9 HIS QB 1 10 ILE HG12 . . 4.650 4.535 3.758 4.726 0.076 15 0 "[ . 1 . 2]" 1
137 1 9 HIS QB 1 45 PHE QE . . 5.280 4.734 3.847 5.410 0.130 8 0 "[ . 1 . 2]" 1
138 1 9 HIS HD2 1 10 ILE HA . . 4.600 3.141 2.976 3.650 . 0 0 "[ . 1 . 2]" 1
139 1 9 HIS HD2 1 10 ILE HB . . 4.700 4.752 4.525 4.888 0.188 3 0 "[ . 1 . 2]" 1
140 1 9 HIS HD2 1 10 ILE HG12 . . 5.090 5.017 4.550 5.246 0.156 19 0 "[ . 1 . 2]" 1
141 1 10 ILE H 1 10 ILE HB . . 3.820 3.663 3.607 3.736 . 0 0 "[ . 1 . 2]" 1
142 1 10 ILE H 1 10 ILE MD . . 3.750 2.994 2.356 3.946 0.196 5 0 "[ . 1 . 2]" 1
143 1 10 ILE H 1 10 ILE HG12 . . 3.310 3.361 2.408 3.542 0.232 20 0 "[ . 1 . 2]" 1
144 1 10 ILE H 1 10 ILE HG13 . . 3.870 1.984 1.824 2.770 . 0 0 "[ . 1 . 2]" 1
145 1 10 ILE H 1 10 ILE MG . . 3.690 2.871 2.561 3.135 . 0 0 "[ . 1 . 2]" 1
146 1 10 ILE HA 1 10 ILE HG13 . . 4.060 3.684 3.629 3.705 . 0 0 "[ . 1 . 2]" 1
147 1 10 ILE HA 1 10 ILE MG . . 3.330 2.276 2.234 2.382 . 0 0 "[ . 1 . 2]" 1
148 1 10 ILE HA 1 11 ALA MB . . 4.950 4.984 4.947 5.022 0.072 3 0 "[ . 1 . 2]" 1
149 1 10 ILE HA 1 13 GLN H . . 4.050 3.231 3.014 3.433 . 0 0 "[ . 1 . 2]" 1
150 1 10 ILE HA 1 13 GLN HB2 . . 5.500 5.367 5.054 5.586 0.086 4 0 "[ . 1 . 2]" 1
151 1 10 ILE HA 1 13 GLN HB3 . . 5.210 4.596 4.262 4.996 . 0 0 "[ . 1 . 2]" 1
152 1 10 ILE HA 1 13 GLN QG . . 4.870 2.352 2.023 3.081 . 0 0 "[ . 1 . 2]" 1
153 1 10 ILE HA 1 14 PHE HB2 . . 4.990 4.431 4.306 4.546 . 0 0 "[ . 1 . 2]" 1
154 1 10 ILE HB 1 10 ILE MD . . 3.020 2.398 2.248 2.495 . 0 0 "[ . 1 . 2]" 1
155 1 10 ILE HB 1 11 ALA H . . 4.250 3.912 3.691 4.047 . 0 0 "[ . 1 . 2]" 1
156 1 10 ILE HB 1 12 THR H . . 4.940 5.091 5.021 5.163 0.223 11 0 "[ . 1 . 2]" 1
157 1 10 ILE HB 1 13 GLN H . . 4.590 4.566 4.323 4.735 0.145 11 0 "[ . 1 . 2]" 1
158 1 10 ILE HB 1 13 GLN HG2 . . 4.420 3.481 3.125 3.898 . 0 0 "[ . 1 . 2]" 1
159 1 10 ILE HB 1 13 GLN QG . . 3.780 3.125 2.815 3.384 . 0 0 "[ . 1 . 2]" 1
160 1 10 ILE HB 1 13 GLN HG3 . . 4.420 3.568 3.197 4.480 0.060 10 0 "[ . 1 . 2]" 1
161 1 10 ILE MD 1 13 GLN H . . 4.960 5.115 5.004 5.586 0.626 8 1 "[ . + 1 . 2]" 1
162 1 10 ILE MD 1 14 PHE HB3 . . 3.990 3.648 3.139 4.105 0.115 3 0 "[ . 1 . 2]" 1
163 1 10 ILE HG12 1 11 ALA H . . 4.630 4.369 3.566 4.597 . 0 0 "[ . 1 . 2]" 1
164 1 10 ILE HG12 1 14 PHE QD . . 4.570 4.767 4.648 4.935 0.365 5 0 "[ . 1 . 2]" 1
165 1 10 ILE HG12 1 38 ALA MB . . 3.990 3.025 2.095 3.946 . 0 0 "[ . 1 . 2]" 1
166 1 10 ILE HG13 1 10 ILE MG . . 3.280 2.701 2.509 3.253 . 0 0 "[ . 1 . 2]" 1
167 1 10 ILE MG 1 13 GLN HG2 . . 4.190 3.337 3.101 3.692 . 0 0 "[ . 1 . 2]" 1
168 1 10 ILE MG 1 13 GLN QG . . 3.630 3.119 2.884 3.386 . 0 0 "[ . 1 . 2]" 1
169 1 10 ILE MG 1 13 GLN HG3 . . 4.190 3.767 3.287 4.031 . 0 0 "[ . 1 . 2]" 1
170 1 10 ILE MG 1 14 PHE HB2 . . 4.520 4.698 4.372 4.910 0.390 1 0 "[ . 1 . 2]" 1
171 1 11 ALA H 1 11 ALA MB . . 3.030 2.260 2.250 2.282 . 0 0 "[ . 1 . 2]" 1
172 1 11 ALA H 1 12 THR H . . 3.510 2.787 2.684 2.879 . 0 0 "[ . 1 . 2]" 1
173 1 11 ALA H 1 12 THR HB . . 5.410 5.143 5.025 5.278 . 0 0 "[ . 1 . 2]" 1
174 1 11 ALA H 1 15 LEU HG . . 4.740 4.893 4.828 4.998 0.258 1 0 "[ . 1 . 2]" 1
175 1 11 ALA H 1 22 LEU QD . . 4.210 3.657 2.913 4.273 0.063 12 0 "[ . 1 . 2]" 1
176 1 11 ALA HA 1 15 LEU H . . 4.020 2.936 2.804 3.174 . 0 0 "[ . 1 . 2]" 1
177 1 11 ALA HA 1 15 LEU HB2 . . 3.540 3.052 2.834 3.277 . 0 0 "[ . 1 . 2]" 1
178 1 11 ALA HA 1 15 LEU MD1 . . 3.210 2.827 2.437 3.135 . 0 0 "[ . 1 . 2]" 1
179 1 11 ALA HA 1 15 LEU HG . . 4.260 2.263 2.197 2.347 . 0 0 "[ . 1 . 2]" 1
180 1 11 ALA HA 1 18 GLU H . . 5.340 5.304 5.133 5.411 0.071 20 0 "[ . 1 . 2]" 1
181 1 11 ALA HA 1 22 LEU HB2 . . 5.500 5.539 5.205 5.713 0.213 19 0 "[ . 1 . 2]" 1
182 1 11 ALA MB 1 12 THR H . . 3.510 2.912 2.821 2.962 . 0 0 "[ . 1 . 2]" 1
183 1 11 ALA MB 1 13 GLN H . . 4.870 4.777 4.682 4.901 0.031 1 0 "[ . 1 . 2]" 1
184 1 11 ALA MB 1 15 LEU H . . 4.930 3.937 3.792 4.188 . 0 0 "[ . 1 . 2]" 1
185 1 11 ALA MB 1 15 LEU HB2 . . 4.220 2.617 2.288 2.881 . 0 0 "[ . 1 . 2]" 1
186 1 11 ALA MB 1 15 LEU MD1 . . 3.080 2.058 1.946 2.325 . 0 0 "[ . 1 . 2]" 1
187 1 11 ALA MB 1 17 GLY HA2 . . 4.540 3.739 3.364 4.114 . 0 0 "[ . 1 . 2]" 1
188 1 11 ALA MB 1 18 GLU H . . 4.200 3.889 3.666 4.167 . 0 0 "[ . 1 . 2]" 1
189 1 11 ALA MB 1 22 LEU HB3 . . 4.120 3.921 3.712 4.154 0.034 6 0 "[ . 1 . 2]" 1
190 1 12 THR H 1 12 THR HB . . 3.140 2.617 2.513 2.745 . 0 0 "[ . 1 . 2]" 1
191 1 12 THR H 1 12 THR MG . . 3.900 3.794 3.766 3.826 . 0 0 "[ . 1 . 2]" 1
192 1 12 THR H 1 13 GLN H . . 3.250 2.697 2.601 2.799 . 0 0 "[ . 1 . 2]" 1
193 1 12 THR H 1 13 GLN QG . . 4.940 3.997 3.839 4.605 . 0 0 "[ . 1 . 2]" 1
194 1 12 THR HA 1 12 THR MG . . 3.090 2.417 2.373 2.473 . 0 0 "[ . 1 . 2]" 1
195 1 12 THR HA 1 17 GLY H . . 3.630 2.459 2.118 2.651 . 0 0 "[ . 1 . 2]" 1
196 1 12 THR HA 1 17 GLY HA2 . . 3.720 1.855 1.677 2.127 . 0 0 "[ . 1 . 2]" 1
197 1 12 THR HB 1 13 GLN H . . 3.460 2.551 2.384 2.720 . 0 0 "[ . 1 . 2]" 1
198 1 12 THR HB 1 13 GLN HB3 . . 4.280 3.863 3.673 4.066 . 0 0 "[ . 1 . 2]" 1
199 1 12 THR HB 1 13 GLN HG2 . . 5.290 3.777 3.431 4.525 . 0 0 "[ . 1 . 2]" 1
200 1 12 THR HB 1 13 GLN QG . . 4.500 3.695 3.371 4.287 . 0 0 "[ . 1 . 2]" 1
201 1 12 THR HB 1 13 GLN HG3 . . 5.290 5.274 4.935 5.360 0.070 16 0 "[ . 1 . 2]" 1
202 1 12 THR HB 1 14 PHE H . . 4.700 4.664 4.516 4.778 0.078 11 0 "[ . 1 . 2]" 1
203 1 12 THR MG 1 17 GLY H . . 4.200 4.184 3.855 4.278 0.078 2 0 "[ . 1 . 2]" 1
204 1 12 THR MG 1 17 GLY HA2 . . 4.090 3.391 3.210 3.745 . 0 0 "[ . 1 . 2]" 1
205 1 13 GLN H 1 13 GLN HB2 . . 3.890 3.695 3.662 3.721 . 0 0 "[ . 1 . 2]" 1
206 1 13 GLN H 1 13 GLN HB3 . . 3.900 2.892 2.791 3.009 . 0 0 "[ . 1 . 2]" 1
207 1 13 GLN H 1 13 GLN HG2 . . 3.810 2.080 1.947 2.497 . 0 0 "[ . 1 . 2]" 1
208 1 13 GLN H 1 13 GLN QG . . 3.310 2.049 1.931 2.464 . 0 0 "[ . 1 . 2]" 1
209 1 13 GLN H 1 13 GLN HG3 . . 3.810 3.103 2.889 3.779 . 0 0 "[ . 1 . 2]" 1
210 1 13 GLN H 1 14 PHE H . . 3.610 2.238 2.170 2.384 . 0 0 "[ . 1 . 2]" 1
211 1 13 GLN H 1 14 PHE HB2 . . 4.420 4.000 3.888 4.152 . 0 0 "[ . 1 . 2]" 1
212 1 13 GLN H 1 15 LEU H . . 4.370 3.938 3.827 4.049 . 0 0 "[ . 1 . 2]" 1
213 1 13 GLN H 1 17 GLY H . . 4.600 4.675 4.617 4.724 0.124 1 0 "[ . 1 . 2]" 1
214 1 13 GLN HB2 1 13 GLN QE . . 4.350 3.651 2.556 4.221 . 0 0 "[ . 1 . 2]" 1
215 1 13 GLN QG 1 14 PHE H . . 4.330 2.729 2.489 2.920 . 0 0 "[ . 1 . 2]" 1
216 1 13 GLN QG 1 15 LEU H . . 5.340 4.666 4.493 4.836 . 0 0 "[ . 1 . 2]" 1
217 1 14 PHE H 1 14 PHE HB2 . . 3.760 2.295 2.232 2.400 . 0 0 "[ . 1 . 2]" 1
218 1 14 PHE H 1 14 PHE HB3 . . 3.780 3.496 3.429 3.558 . 0 0 "[ . 1 . 2]" 1
219 1 14 PHE H 1 14 PHE QD . . 3.310 3.272 2.983 3.427 0.117 19 0 "[ . 1 . 2]" 1
220 1 14 PHE H 1 15 LEU H . . 3.230 2.213 2.095 2.360 . 0 0 "[ . 1 . 2]" 1
221 1 14 PHE H 1 15 LEU HG . . 4.320 4.108 3.941 4.215 . 0 0 "[ . 1 . 2]" 1
222 1 14 PHE H 1 16 ASP H . . 4.490 3.665 3.502 3.832 . 0 0 "[ . 1 . 2]" 1
223 1 14 PHE HA 1 14 PHE QD . . 2.950 2.259 1.981 3.028 0.078 18 0 "[ . 1 . 2]" 1
224 1 14 PHE HA 1 14 PHE QE . . 4.350 4.233 4.121 4.452 0.102 18 0 "[ . 1 . 2]" 1
225 1 14 PHE HA 1 22 LEU QD . . 5.440 5.453 4.969 5.627 0.187 14 0 "[ . 1 . 2]" 1
226 1 14 PHE HB2 1 15 LEU H . . 4.270 3.228 3.082 3.428 . 0 0 "[ . 1 . 2]" 1
227 1 14 PHE HB2 1 15 LEU MD1 . . 4.430 4.422 4.204 4.518 0.088 14 0 "[ . 1 . 2]" 1
228 1 14 PHE HB2 1 15 LEU HG . . 4.310 3.154 2.888 3.328 . 0 0 "[ . 1 . 2]" 1
229 1 14 PHE HB3 1 15 LEU H . . 4.400 3.548 3.422 3.716 . 0 0 "[ . 1 . 2]" 1
230 1 14 PHE HB3 1 15 LEU MD1 . . 3.970 4.040 3.876 4.157 0.187 6 0 "[ . 1 . 2]" 1
231 1 14 PHE HB3 1 15 LEU HG . . 4.430 2.655 2.477 2.817 . 0 0 "[ . 1 . 2]" 1
232 1 14 PHE HB3 1 34 VAL MG2 . . 5.500 5.130 4.548 5.533 0.033 19 0 "[ . 1 . 2]" 1
233 1 14 PHE HB3 1 38 ALA MB . . 5.500 5.473 5.021 5.794 0.294 3 0 "[ . 1 . 2]" 1
234 1 14 PHE QD 1 22 LEU QD . . 3.110 2.988 2.505 3.204 0.094 7 0 "[ . 1 . 2]" 1
235 1 14 PHE QD 1 34 VAL HA . . 3.940 2.697 2.424 3.009 . 0 0 "[ . 1 . 2]" 1
236 1 14 PHE QD 1 34 VAL HB . . 3.880 3.896 3.575 4.063 0.183 4 0 "[ . 1 . 2]" 1
237 1 14 PHE QE 1 34 VAL HA . . 4.690 2.048 1.695 2.499 . 0 0 "[ . 1 . 2]" 1
238 1 14 PHE QE 1 34 VAL HB . . 3.870 3.859 3.575 4.046 0.176 18 0 "[ . 1 . 2]" 1
239 1 14 PHE QE 1 34 VAL MG1 . . 4.790 4.295 4.121 4.554 . 0 0 "[ . 1 . 2]" 1
240 1 14 PHE QE 1 34 VAL MG2 . . 3.990 2.169 1.982 2.535 . 0 0 "[ . 1 . 2]" 1
241 1 14 PHE QE 1 35 ASP H . . 4.590 1.662 1.420 2.000 . 0 0 "[ . 1 . 2]" 1
242 1 14 PHE QE 1 38 ALA MB . . 3.630 2.513 2.347 2.652 . 0 0 "[ . 1 . 2]" 1
243 1 14 PHE HZ 1 38 ALA HA . . 4.510 4.405 4.021 4.594 0.084 16 0 "[ . 1 . 2]" 1
244 1 15 LEU H 1 15 LEU HB2 . . 3.770 2.788 2.721 2.863 . 0 0 "[ . 1 . 2]" 1
245 1 15 LEU H 1 15 LEU MD2 . . 3.690 3.650 3.561 3.726 0.036 14 0 "[ . 1 . 2]" 1
246 1 15 LEU H 1 15 LEU HG . . 3.940 2.919 2.796 3.055 . 0 0 "[ . 1 . 2]" 1
247 1 15 LEU H 1 16 ASP H . . 3.410 2.209 2.043 2.342 . 0 0 "[ . 1 . 2]" 1
248 1 15 LEU H 1 16 ASP HA . . 4.450 4.357 4.198 4.464 0.014 12 0 "[ . 1 . 2]" 1
249 1 15 LEU H 1 17 GLY H . . 4.260 3.078 2.975 3.169 . 0 0 "[ . 1 . 2]" 1
250 1 15 LEU HA 1 15 LEU MD1 . . 4.120 3.977 3.942 4.007 . 0 0 "[ . 1 . 2]" 1
251 1 15 LEU HA 1 15 LEU MD2 . . 3.150 2.314 2.201 2.385 . 0 0 "[ . 1 . 2]" 1
252 1 15 LEU HA 1 16 ASP HB2 . . 5.110 4.263 4.050 4.463 . 0 0 "[ . 1 . 2]" 1
253 1 15 LEU HA 1 16 ASP QB . . 4.470 3.919 3.833 4.022 . 0 0 "[ . 1 . 2]" 1
254 1 15 LEU HA 1 16 ASP HB3 . . 5.110 4.588 4.428 4.819 . 0 0 "[ . 1 . 2]" 1
255 1 15 LEU HB2 1 15 LEU MD1 . . 3.390 2.318 2.279 2.363 . 0 0 "[ . 1 . 2]" 1
256 1 15 LEU HB2 1 18 GLU H . . 5.120 2.879 2.580 3.017 . 0 0 "[ . 1 . 2]" 1
257 1 15 LEU HB3 1 18 GLU H . . 4.870 3.524 3.345 3.707 . 0 0 "[ . 1 . 2]" 1
258 1 15 LEU HB3 1 20 ASP H . . 5.040 3.946 3.434 4.475 . 0 0 "[ . 1 . 2]" 1
259 1 15 LEU MD1 1 18 GLU H . . 4.380 4.350 4.005 4.487 0.107 2 0 "[ . 1 . 2]" 1
260 1 15 LEU MD1 1 20 ASP H . . 4.400 2.035 1.708 2.557 . 0 0 "[ . 1 . 2]" 1
261 1 15 LEU MD2 1 16 ASP H . . 4.820 4.716 4.641 4.812 . 0 0 "[ . 1 . 2]" 1
262 1 16 ASP H 1 16 ASP HA . . 2.890 2.277 2.259 2.287 . 0 0 "[ . 1 . 2]" 1
263 1 16 ASP H 1 16 ASP HB2 . . 4.050 3.218 3.167 3.259 . 0 0 "[ . 1 . 2]" 1
264 1 16 ASP H 1 16 ASP QB . . 3.420 3.046 2.999 3.079 . 0 0 "[ . 1 . 2]" 1
265 1 16 ASP H 1 16 ASP HB3 . . 4.050 3.766 3.691 3.878 . 0 0 "[ . 1 . 2]" 1
266 1 16 ASP H 1 17 GLY H . . 3.780 2.593 2.525 2.637 . 0 0 "[ . 1 . 2]" 1
267 1 16 ASP HA 1 17 GLY HA3 . . 4.450 4.510 4.415 4.562 0.112 11 0 "[ . 1 . 2]" 1
268 1 16 ASP QB 1 18 GLU H . . 4.710 3.507 3.305 3.855 . 0 0 "[ . 1 . 2]" 1
269 1 16 ASP QB 1 18 GLU HB3 . . 4.280 3.457 3.314 3.630 . 0 0 "[ . 1 . 2]" 1
270 1 16 ASP QB 1 18 GLU HG2 . . 4.610 4.094 3.602 4.636 0.026 20 0 "[ . 1 . 2]" 1
271 1 16 ASP HB2 1 18 GLU HB3 . . 4.930 5.125 5.074 5.200 0.270 16 0 "[ . 1 . 2]" 1
272 1 16 ASP HB3 1 18 GLU HB3 . . 4.930 3.515 3.358 3.712 . 0 0 "[ . 1 . 2]" 1
273 1 17 GLY H 1 18 GLU H . . 3.470 2.487 2.362 2.619 . 0 0 "[ . 1 . 2]" 1
274 1 18 GLU H 1 18 GLU HB2 . . 3.790 3.679 3.547 3.766 . 0 0 "[ . 1 . 2]" 1
275 1 18 GLU H 1 18 GLU HB3 . . 3.030 2.489 2.314 2.662 . 0 0 "[ . 1 . 2]" 1
276 1 18 GLU H 1 18 GLU HG2 . . 3.350 2.858 2.728 3.309 . 0 0 "[ . 1 . 2]" 1
277 1 18 GLU H 1 19 LYS H . . 4.640 4.564 4.499 4.642 0.002 8 0 "[ . 1 . 2]" 1
278 1 18 GLU HA 1 18 GLU HG3 . . 3.950 3.624 3.393 3.679 . 0 0 "[ . 1 . 2]" 1
279 1 18 GLU HA 1 19 LYS H . . 2.580 2.291 2.198 2.342 . 0 0 "[ . 1 . 2]" 1
280 1 18 GLU HA 1 19 LYS HG2 . . 4.740 4.812 4.740 4.959 0.219 10 0 "[ . 1 . 2]" 1
281 1 18 GLU HA 1 19 LYS HG3 . . 4.250 4.142 3.902 4.358 0.108 17 0 "[ . 1 . 2]" 1
282 1 18 GLU HB2 1 20 ASP QB . . 4.330 3.993 3.631 4.269 . 0 0 "[ . 1 . 2]" 1
283 1 18 GLU HB3 1 19 LYS H . . 4.370 4.349 4.290 4.412 0.042 17 0 "[ . 1 . 2]" 1
284 1 18 GLU HG2 1 19 LYS H . . 5.500 4.417 4.173 4.623 . 0 0 "[ . 1 . 2]" 1
285 1 18 GLU HG2 1 20 ASP H . . 5.320 4.136 3.785 4.685 . 0 0 "[ . 1 . 2]" 1
286 1 18 GLU HG3 1 19 LYS H . . 4.920 3.392 2.900 3.653 . 0 0 "[ . 1 . 2]" 1
287 1 18 GLU HG3 1 20 ASP H . . 3.920 3.258 2.843 3.868 . 0 0 "[ . 1 . 2]" 1
288 1 18 GLU HG3 1 20 ASP QB . . 3.940 2.413 2.095 2.855 . 0 0 "[ . 1 . 2]" 1
289 1 19 LYS H 1 19 LYS HB2 . . 3.140 2.605 2.535 2.688 . 0 0 "[ . 1 . 2]" 1
290 1 19 LYS H 1 19 LYS HG2 . . 4.050 3.527 3.375 3.742 . 0 0 "[ . 1 . 2]" 1
291 1 19 LYS H 1 19 LYS HG3 . . 4.140 2.801 2.565 2.935 . 0 0 "[ . 1 . 2]" 1
292 1 19 LYS H 1 20 ASP QB . . 4.320 4.215 4.024 4.395 0.075 14 0 "[ . 1 . 2]" 1
293 1 19 LYS HA 1 19 LYS QD . . 3.660 3.837 3.767 3.894 0.234 16 0 "[ . 1 . 2]" 1
294 1 19 LYS HA 1 19 LYS HG2 . . 3.330 2.498 2.387 2.567 . 0 0 "[ . 1 . 2]" 1
295 1 19 LYS HA 1 22 LEU HB2 . . 5.500 5.533 5.242 5.733 0.233 13 0 "[ . 1 . 2]" 1
296 1 19 LYS HA 1 22 LEU HB3 . . 5.040 4.061 3.668 4.485 . 0 0 "[ . 1 . 2]" 1
297 1 19 LYS HB2 1 19 LYS QE . . 4.080 2.561 2.154 3.192 . 0 0 "[ . 1 . 2]" 1
298 1 19 LYS HB2 1 20 ASP H . . 4.630 4.376 4.228 4.437 . 0 0 "[ . 1 . 2]" 1
299 1 19 LYS HB2 1 20 ASP QB . . 4.770 4.888 4.706 4.973 0.203 15 0 "[ . 1 . 2]" 1
300 1 19 LYS QD 1 19 LYS HG3 . . 2.740 2.383 2.330 2.434 . 0 0 "[ . 1 . 2]" 1
301 1 19 LYS QD 1 20 ASP H . . 5.380 5.478 5.301 5.578 0.198 13 0 "[ . 1 . 2]" 1
302 1 19 LYS QE 1 19 LYS HG3 . . 3.010 2.571 2.416 3.066 0.056 13 0 "[ . 1 . 2]" 1
303 1 19 LYS HG2 1 20 ASP H . . 4.840 4.629 4.443 4.694 . 0 0 "[ . 1 . 2]" 1
304 1 19 LYS HG3 1 20 ASP H . . 5.500 5.418 5.202 5.513 0.013 3 0 "[ . 1 . 2]" 1
305 1 20 ASP H 1 20 ASP QB . . 3.110 2.892 2.798 3.010 . 0 0 "[ . 1 . 2]" 1
306 1 20 ASP HA 1 21 GLY H . . 3.560 2.159 2.106 2.244 . 0 0 "[ . 1 . 2]" 1
307 1 20 ASP HA 1 22 LEU H . . 3.900 3.625 3.323 3.934 0.034 4 0 "[ . 1 . 2]" 1
308 1 20 ASP QB 1 21 GLY H . . 4.280 3.827 3.635 4.002 . 0 0 "[ . 1 . 2]" 1
309 1 20 ASP QB 1 21 GLY HA3 . . 4.730 4.669 4.521 4.773 0.043 14 0 "[ . 1 . 2]" 1
310 1 20 ASP QB 1 22 LEU H . . 4.850 4.553 4.384 4.682 . 0 0 "[ . 1 . 2]" 1
311 1 21 GLY H 1 22 LEU H . . 3.590 2.871 2.568 3.132 . 0 0 "[ . 1 . 2]" 1
312 1 21 GLY H 1 23 ASP H . . 5.500 5.545 5.239 5.674 0.174 4 0 "[ . 1 . 2]" 1
313 1 21 GLY HA3 1 22 LEU H . . 3.370 3.029 2.897 3.231 . 0 0 "[ . 1 . 2]" 1
314 1 21 GLY HA3 1 22 LEU HB2 . . 5.260 4.517 4.259 4.720 . 0 0 "[ . 1 . 2]" 1
315 1 22 LEU H 1 22 LEU HB2 . . 3.220 2.855 2.576 3.154 . 0 0 "[ . 1 . 2]" 1
316 1 22 LEU H 1 22 LEU HB3 . . 3.790 2.603 2.424 2.882 . 0 0 "[ . 1 . 2]" 1
317 1 22 LEU H 1 22 LEU QD . . 4.580 3.913 3.795 4.010 . 0 0 "[ . 1 . 2]" 1
318 1 22 LEU H 1 23 ASP H . . 4.360 4.055 3.857 4.213 . 0 0 "[ . 1 . 2]" 1
319 1 22 LEU HA 1 22 LEU MD1 . . 4.330 2.411 2.019 3.790 . 0 0 "[ . 1 . 2]" 1
320 1 22 LEU HA 1 22 LEU QD . . 3.110 2.263 2.013 2.887 . 0 0 "[ . 1 . 2]" 1
321 1 22 LEU HA 1 22 LEU MD2 . . 4.330 3.797 2.903 3.996 . 0 0 "[ . 1 . 2]" 1
322 1 22 LEU HA 1 23 ASP H . . 3.120 2.152 2.099 2.191 . 0 0 "[ . 1 . 2]" 1
323 1 22 LEU HB2 1 22 LEU QD . . 3.090 2.187 2.152 2.242 . 0 0 "[ . 1 . 2]" 1
324 1 22 LEU HB2 1 23 ASP H . . 5.120 4.501 4.411 4.570 . 0 0 "[ . 1 . 2]" 1
325 1 22 LEU HB3 1 23 ASP H . . 4.520 4.342 4.248 4.407 . 0 0 "[ . 1 . 2]" 1
326 1 22 LEU QD 1 23 ASP H . . 3.480 3.094 2.696 3.354 . 0 0 "[ . 1 . 2]" 1
327 1 22 LEU QD 1 23 ASP QB . . 5.280 4.790 4.340 5.205 . 0 0 "[ . 1 . 2]" 1
328 1 22 LEU QD 1 26 THR HB . . 4.640 4.165 3.148 4.818 0.178 8 0 "[ . 1 . 2]" 1
329 1 22 LEU QD 1 28 LEU HB3 . . 4.810 3.626 2.856 4.349 . 0 0 "[ . 1 . 2]" 1
330 1 22 LEU QD 1 34 VAL HB . . 4.180 2.433 1.785 3.071 . 0 0 "[ . 1 . 2]" 1
331 1 22 LEU QD 1 34 VAL MG1 . . 3.650 3.288 2.577 3.729 0.079 6 0 "[ . 1 . 2]" 1
332 1 22 LEU HG 1 23 ASP H . . 5.130 3.839 3.677 4.097 . 0 0 "[ . 1 . 2]" 1
333 1 23 ASP H 1 26 THR H . . 4.070 3.666 3.354 4.111 0.041 15 0 "[ . 1 . 2]" 1
334 1 23 ASP H 1 26 THR HB . . 4.170 2.064 1.799 2.282 . 0 0 "[ . 1 . 2]" 1
335 1 23 ASP H 1 26 THR MG . . 4.260 3.078 2.830 3.406 . 0 0 "[ . 1 . 2]" 1
336 1 23 ASP QB 1 25 GLN H . . 4.680 3.073 2.131 4.008 . 0 0 "[ . 1 . 2]" 1
337 1 23 ASP HB2 1 24 SER H . . 4.060 3.623 3.187 3.974 . 0 0 "[ . 1 . 2]" 1
338 1 23 ASP HB3 1 24 SER H . . 4.060 2.882 1.912 3.910 . 0 0 "[ . 1 . 2]" 1
339 1 24 SER HA 1 67 VAL H . . 4.730 3.881 3.491 4.376 . 0 0 "[ . 1 . 2]" 1
340 1 24 SER HA 1 67 VAL MG1 . . 4.160 3.638 2.746 4.163 0.003 16 0 "[ . 1 . 2]" 1
341 1 24 SER HA 1 67 VAL QG . . 3.520 2.979 1.745 3.676 0.156 7 0 "[ . 1 . 2]" 1
342 1 24 SER HA 1 67 VAL MG2 . . 4.160 3.295 1.751 4.181 0.021 3 0 "[ . 1 . 2]" 1
343 1 24 SER HA 1 70 MET ME . . 4.730 4.430 3.800 4.966 0.236 17 0 "[ . 1 . 2]" 1
344 1 24 SER QB 1 25 GLN H . . 3.840 2.909 2.388 3.371 . 0 0 "[ . 1 . 2]" 1
345 1 24 SER QB 1 25 GLN QG . . 4.950 3.394 2.670 4.874 . 0 0 "[ . 1 . 2]" 1
346 1 24 SER QB 1 67 VAL HB . . 3.500 2.425 1.739 3.549 0.049 11 0 "[ . 1 . 2]" 1
347 1 24 SER QB 1 67 VAL QG . . 3.590 2.313 1.916 3.219 . 0 0 "[ . 1 . 2]" 1
348 1 25 GLN H 1 25 GLN HB2 . . 3.890 2.488 2.355 2.605 . 0 0 "[ . 1 . 2]" 1
349 1 25 GLN H 1 25 GLN QB . . 3.250 2.438 2.141 2.552 . 0 0 "[ . 1 . 2]" 1
350 1 25 GLN H 1 25 GLN HB3 . . 3.890 3.577 2.447 3.682 . 0 0 "[ . 1 . 2]" 1
351 1 25 GLN H 1 25 GLN HG2 . . 4.200 3.384 2.435 4.382 0.182 11 0 "[ . 1 . 2]" 1
352 1 25 GLN H 1 25 GLN HG3 . . 4.200 2.966 2.184 4.458 0.258 11 0 "[ . 1 . 2]" 1
353 1 25 GLN H 1 26 THR H . . 3.100 2.410 2.223 2.562 . 0 0 "[ . 1 . 2]" 1
354 1 25 GLN H 1 67 VAL MG1 . . 5.500 4.331 3.590 5.551 0.051 20 0 "[ . 1 . 2]" 1
355 1 25 GLN H 1 67 VAL QG . . 4.430 3.956 3.505 4.568 0.138 20 0 "[ . 1 . 2]" 1
356 1 25 GLN H 1 67 VAL MG2 . . 5.500 5.093 4.628 5.570 0.070 8 0 "[ . 1 . 2]" 1
357 1 25 GLN HA 1 25 GLN HG2 . . 3.500 2.830 2.424 3.709 0.209 5 0 "[ . 1 . 2]" 1
358 1 25 GLN HA 1 25 GLN HG3 . . 3.500 3.257 2.528 3.723 0.223 4 0 "[ . 1 . 2]" 1
359 1 25 GLN QB 1 25 GLN QG . . 2.260 2.070 1.980 2.115 . 0 0 "[ . 1 . 2]" 1
360 1 25 GLN QB 1 26 THR HA . . 4.850 4.100 3.935 4.287 . 0 0 "[ . 1 . 2]" 1
361 1 25 GLN HB2 1 26 THR H . . 4.100 3.337 3.134 4.084 . 0 0 "[ . 1 . 2]" 1
362 1 25 GLN HB3 1 26 THR H . . 4.100 4.102 3.166 4.275 0.175 17 0 "[ . 1 . 2]" 1
363 1 26 THR H 1 26 THR HB . . 3.370 2.469 2.362 2.667 . 0 0 "[ . 1 . 2]" 1
364 1 26 THR H 1 26 THR MG . . 4.010 3.773 3.742 3.813 . 0 0 "[ . 1 . 2]" 1
365 1 26 THR H 1 27 PRO HD3 . . 5.030 5.024 4.847 5.087 0.057 5 0 "[ . 1 . 2]" 1
366 1 26 THR HA 1 26 THR MG . . 3.150 2.455 2.347 2.517 . 0 0 "[ . 1 . 2]" 1
367 1 26 THR HA 1 27 PRO HD3 . . 3.170 2.457 2.331 2.550 . 0 0 "[ . 1 . 2]" 1
368 1 26 THR HA 1 27 PRO HG2 . . 4.430 4.435 4.360 4.501 0.071 11 0 "[ . 1 . 2]" 1
369 1 26 THR HA 1 27 PRO HG3 . . 5.280 4.536 4.448 4.570 . 0 0 "[ . 1 . 2]" 1
370 1 26 THR HA 1 28 LEU QD . . 5.270 4.577 4.191 4.921 . 0 0 "[ . 1 . 2]" 1
371 1 26 THR HA 1 31 LEU MD1 . . 4.380 4.325 3.918 4.463 0.083 8 0 "[ . 1 . 2]" 1
372 1 26 THR HB 1 27 PRO HD2 . . 4.210 4.206 4.106 4.302 0.092 10 0 "[ . 1 . 2]" 1
373 1 26 THR HB 1 28 LEU HA . . 5.500 4.897 4.427 5.304 . 0 0 "[ . 1 . 2]" 1
374 1 26 THR HB 1 28 LEU QD . . 3.830 2.779 2.211 3.225 . 0 0 "[ . 1 . 2]" 1
375 1 26 THR HB 1 31 LEU MD1 . . 4.940 4.344 4.066 4.532 . 0 0 "[ . 1 . 2]" 1
376 1 26 THR MG 1 27 PRO HD2 . . 3.690 2.015 1.930 2.096 . 0 0 "[ . 1 . 2]" 1
377 1 26 THR MG 1 27 PRO HD3 . . 3.280 3.423 3.368 3.494 0.214 14 0 "[ . 1 . 2]" 1
378 1 26 THR MG 1 27 PRO HG2 . . 4.260 3.264 3.099 3.419 . 0 0 "[ . 1 . 2]" 1
379 1 26 THR MG 1 27 PRO HG3 . . 4.110 4.204 4.084 4.334 0.224 10 0 "[ . 1 . 2]" 1
380 1 26 THR MG 1 28 LEU H . . 4.860 4.222 3.719 4.712 . 0 0 "[ . 1 . 2]" 1
381 1 26 THR MG 1 31 LEU HG . . 3.730 3.335 3.032 3.659 . 0 0 "[ . 1 . 2]" 1
382 1 27 PRO HA 1 28 LEU H . . 3.550 2.202 2.173 2.232 . 0 0 "[ . 1 . 2]" 1
383 1 27 PRO HA 1 28 LEU HB2 . . 5.070 4.766 4.611 4.888 . 0 0 "[ . 1 . 2]" 1
384 1 27 PRO HA 1 28 LEU HG . . 5.500 3.970 3.891 4.075 . 0 0 "[ . 1 . 2]" 1
385 1 27 PRO HB2 1 28 LEU H . . 3.980 4.006 3.850 4.096 0.116 18 0 "[ . 1 . 2]" 1
386 1 27 PRO HB2 1 31 LEU H . . 3.700 3.467 3.347 3.679 . 0 0 "[ . 1 . 2]" 1
387 1 27 PRO HB2 1 31 LEU HB2 . . 5.250 5.184 4.918 5.322 0.072 16 0 "[ . 1 . 2]" 1
388 1 27 PRO HB2 1 32 ASN H . . 5.250 5.384 5.263 5.545 0.295 16 0 "[ . 1 . 2]" 1
389 1 27 PRO HB2 1 66 THR MG . . 4.350 4.037 3.687 4.273 . 0 0 "[ . 1 . 2]" 1
390 1 27 PRO HB3 1 66 THR MG . . 4.310 3.288 2.983 3.512 . 0 0 "[ . 1 . 2]" 1
391 1 27 PRO HD2 1 31 LEU HB2 . . 5.500 5.406 4.794 5.560 0.060 16 0 "[ . 1 . 2]" 1
392 1 27 PRO HD2 1 31 LEU MD1 . . 4.100 2.926 2.566 3.118 . 0 0 "[ . 1 . 2]" 1
393 1 27 PRO HD3 1 31 LEU MD1 . . 4.550 4.378 3.982 4.599 0.049 8 0 "[ . 1 . 2]" 1
394 1 27 PRO HG2 1 31 LEU MD1 . . 3.320 2.892 2.439 3.154 . 0 0 "[ . 1 . 2]" 1
395 1 27 PRO HG2 1 31 LEU HG . . 2.810 2.115 1.863 2.242 . 0 0 "[ . 1 . 2]" 1
396 1 27 PRO HG3 1 31 LEU MD2 . . 3.940 3.882 3.555 4.050 0.110 8 0 "[ . 1 . 2]" 1
397 1 27 PRO HG3 1 31 LEU HG . . 3.820 3.806 3.545 3.920 0.100 16 0 "[ . 1 . 2]" 1
398 1 28 LEU H 1 28 LEU HB2 . . 3.710 2.621 2.515 2.724 . 0 0 "[ . 1 . 2]" 1
399 1 28 LEU H 1 28 LEU MD1 . . 3.730 3.736 3.656 3.787 0.057 17 0 "[ . 1 . 2]" 1
400 1 28 LEU H 1 28 LEU MD2 . . 3.730 2.901 2.604 3.156 . 0 0 "[ . 1 . 2]" 1
401 1 28 LEU H 1 28 LEU HG . . 3.890 2.200 2.139 2.285 . 0 0 "[ . 1 . 2]" 1
402 1 28 LEU H 1 29 PHE H . . 3.800 2.564 2.388 2.909 . 0 0 "[ . 1 . 2]" 1
403 1 28 LEU H 1 29 PHE QD . . 4.890 4.859 4.525 5.069 0.179 12 0 "[ . 1 . 2]" 1
404 1 28 LEU H 1 34 VAL MG1 . . 5.500 4.883 4.724 5.015 . 0 0 "[ . 1 . 2]" 1
405 1 28 LEU H 1 65 ALA MB . . 5.040 4.468 4.167 4.788 . 0 0 "[ . 1 . 2]" 1
406 1 28 LEU H 1 66 THR H . . 5.500 5.065 4.820 5.424 . 0 0 "[ . 1 . 2]" 1
407 1 28 LEU H 1 66 THR HA . . 3.940 3.222 2.880 3.539 . 0 0 "[ . 1 . 2]" 1
408 1 28 LEU H 1 66 THR MG . . 3.740 2.729 2.290 3.126 . 0 0 "[ . 1 . 2]" 1
409 1 28 LEU H 1 67 VAL H . . 5.500 5.405 5.013 5.701 0.201 7 0 "[ . 1 . 2]" 1
410 1 28 LEU HA 1 28 LEU MD1 . . 4.100 3.924 3.855 3.968 . 0 0 "[ . 1 . 2]" 1
411 1 28 LEU HA 1 28 LEU QD . . 2.950 2.195 2.057 2.308 . 0 0 "[ . 1 . 2]" 1
412 1 28 LEU HA 1 28 LEU MD2 . . 4.100 2.207 2.064 2.324 . 0 0 "[ . 1 . 2]" 1
413 1 28 LEU HA 1 31 LEU H . . 4.640 4.100 3.894 4.228 . 0 0 "[ . 1 . 2]" 1
414 1 28 LEU HA 1 31 LEU HB2 . . 4.690 3.682 3.442 3.811 . 0 0 "[ . 1 . 2]" 1
415 1 28 LEU HA 1 31 LEU HB3 . . 5.500 5.400 5.154 5.531 0.031 2 0 "[ . 1 . 2]" 1
416 1 28 LEU HA 1 31 LEU HG . . 4.670 4.689 4.541 4.762 0.092 7 0 "[ . 1 . 2]" 1
417 1 28 LEU HA 1 33 ILE H . . 5.090 3.370 2.954 3.707 . 0 0 "[ . 1 . 2]" 1
418 1 28 LEU HB2 1 28 LEU MD1 . . 3.330 2.448 2.403 2.490 . 0 0 "[ . 1 . 2]" 1
419 1 28 LEU HB2 1 28 LEU MD2 . . 3.330 3.255 3.243 3.265 . 0 0 "[ . 1 . 2]" 1
420 1 28 LEU HB2 1 29 PHE H . . 3.880 2.876 2.422 3.097 . 0 0 "[ . 1 . 2]" 1
421 1 28 LEU HB2 1 29 PHE QD . . 3.900 3.220 2.541 3.809 . 0 0 "[ . 1 . 2]" 1
422 1 28 LEU HB2 1 33 ILE H . . 5.500 5.320 5.023 5.565 0.065 1 0 "[ . 1 . 2]" 1
423 1 28 LEU HB2 1 34 VAL MG1 . . 4.240 2.899 2.669 3.083 . 0 0 "[ . 1 . 2]" 1
424 1 28 LEU HB2 1 65 ALA HA . . 4.630 3.031 2.567 3.313 . 0 0 "[ . 1 . 2]" 1
425 1 28 LEU HB2 1 66 THR HA . . 4.890 3.947 3.385 4.469 . 0 0 "[ . 1 . 2]" 1
426 1 28 LEU HB3 1 29 PHE H . . 4.260 3.961 3.465 4.139 . 0 0 "[ . 1 . 2]" 1
427 1 28 LEU HB3 1 29 PHE HA . . 5.120 4.736 4.408 4.892 . 0 0 "[ . 1 . 2]" 1
428 1 28 LEU HB3 1 34 VAL HA . . 5.500 5.309 5.065 5.592 0.092 3 0 "[ . 1 . 2]" 1
429 1 28 LEU HB3 1 34 VAL HB . . 4.420 3.501 3.164 3.890 . 0 0 "[ . 1 . 2]" 1
430 1 28 LEU HB3 1 34 VAL MG1 . . 4.130 1.837 1.680 2.028 . 0 0 "[ . 1 . 2]" 1
431 1 28 LEU QD 1 29 PHE H . . 4.310 4.155 4.052 4.245 . 0 0 "[ . 1 . 2]" 1
432 1 28 LEU QD 1 31 LEU H . . 5.440 5.319 5.141 5.485 0.045 12 0 "[ . 1 . 2]" 1
433 1 28 LEU QD 1 33 ILE H . . 4.760 4.440 4.124 4.648 . 0 0 "[ . 1 . 2]" 1
434 1 28 LEU QD 1 34 VAL MG1 . . 2.880 2.169 1.898 2.379 . 0 0 "[ . 1 . 2]" 1
435 1 28 LEU QD 1 64 PHE HB2 . . 5.440 4.681 4.373 4.997 . 0 0 "[ . 1 . 2]" 1
436 1 28 LEU QD 1 65 ALA HA . . 5.440 3.803 3.070 4.093 . 0 0 "[ . 1 . 2]" 1
437 1 28 LEU QD 1 66 THR H . . 4.570 3.993 3.771 4.305 . 0 0 "[ . 1 . 2]" 1
438 1 28 LEU QD 1 66 THR HA . . 3.950 2.963 2.603 3.332 . 0 0 "[ . 1 . 2]" 1
439 1 28 LEU QD 1 70 MET ME . . 3.210 2.418 2.237 2.663 . 0 0 "[ . 1 . 2]" 1
440 1 28 LEU MD1 1 29 PHE H . . 4.960 4.803 4.459 4.986 0.026 9 0 "[ . 1 . 2]" 1
441 1 28 LEU MD1 1 34 VAL MG1 . . 3.960 2.199 1.911 2.411 . 0 0 "[ . 1 . 2]" 1
442 1 28 LEU MD1 1 67 VAL H . . 5.060 4.053 3.022 4.748 . 0 0 "[ . 1 . 2]" 1
443 1 28 LEU MD2 1 29 PHE H . . 4.960 4.559 4.426 4.674 . 0 0 "[ . 1 . 2]" 1
444 1 28 LEU MD2 1 34 VAL MG1 . . 3.960 3.328 2.903 3.663 . 0 0 "[ . 1 . 2]" 1
445 1 28 LEU MD2 1 67 VAL H . . 5.060 4.656 3.771 5.141 0.081 9 0 "[ . 1 . 2]" 1
446 1 28 LEU HG 1 66 THR H . . 5.500 4.654 4.236 4.930 . 0 0 "[ . 1 . 2]" 1
447 1 28 LEU HG 1 66 THR HA . . 4.590 2.422 1.851 2.811 . 0 0 "[ . 1 . 2]" 1
448 1 28 LEU HG 1 67 VAL H . . 5.500 4.237 3.366 4.687 . 0 0 "[ . 1 . 2]" 1
449 1 29 PHE H 1 29 PHE HB2 . . 3.780 2.224 2.137 2.438 . 0 0 "[ . 1 . 2]" 1
450 1 29 PHE H 1 29 PHE QB . . 3.080 2.196 2.105 2.404 . 0 0 "[ . 1 . 2]" 1
451 1 29 PHE H 1 29 PHE HB3 . . 3.780 3.394 3.151 3.658 . 0 0 "[ . 1 . 2]" 1
452 1 29 PHE H 1 29 PHE QD . . 3.600 3.156 2.732 3.515 . 0 0 "[ . 1 . 2]" 1
453 1 29 PHE H 1 30 GLU H . . 3.440 2.486 2.346 2.622 . 0 0 "[ . 1 . 2]" 1
454 1 29 PHE H 1 30 GLU QB . . 5.040 4.406 4.055 4.820 . 0 0 "[ . 1 . 2]" 1
455 1 29 PHE H 1 31 LEU H . . 4.780 3.987 3.828 4.198 . 0 0 "[ . 1 . 2]" 1
456 1 29 PHE H 1 34 VAL MG1 . . 5.240 4.738 4.127 5.077 . 0 0 "[ . 1 . 2]" 1
457 1 29 PHE H 1 65 ALA HA . . 4.440 3.660 3.115 4.248 . 0 0 "[ . 1 . 2]" 1
458 1 29 PHE H 1 65 ALA MB . . 5.060 3.533 2.829 3.950 . 0 0 "[ . 1 . 2]" 1
459 1 29 PHE HA 1 29 PHE QD . . 3.250 2.660 2.157 3.025 . 0 0 "[ . 1 . 2]" 1
460 1 29 PHE HA 1 29 PHE QE . . 4.570 4.288 4.174 4.490 . 0 0 "[ . 1 . 2]" 1
461 1 29 PHE HA 1 31 LEU H . . 4.310 4.274 3.897 4.478 0.168 7 0 "[ . 1 . 2]" 1
462 1 29 PHE HA 1 32 ASN H . . 4.030 3.109 2.427 3.518 . 0 0 "[ . 1 . 2]" 1
463 1 29 PHE HA 1 32 ASN QB . . 5.220 4.437 3.857 5.245 0.025 20 0 "[ . 1 . 2]" 1
464 1 29 PHE HA 1 33 ILE H . . 4.920 4.416 3.596 5.084 0.164 3 0 "[ . 1 . 2]" 1
465 1 29 PHE QB 1 30 GLU H . . 3.430 2.813 2.388 3.307 . 0 0 "[ . 1 . 2]" 1
466 1 29 PHE QB 1 31 LEU H . . 4.990 4.729 4.408 4.995 0.005 18 0 "[ . 1 . 2]" 1
467 1 29 PHE QB 1 65 ALA HA . . 4.810 3.245 2.750 4.246 . 0 0 "[ . 1 . 2]" 1
468 1 29 PHE QB 1 65 ALA MB . . 4.540 2.365 1.800 3.099 . 0 0 "[ . 1 . 2]" 1
469 1 29 PHE QD 1 65 ALA HA . . 3.220 2.194 1.486 2.858 . 0 0 "[ . 1 . 2]" 1
470 1 29 PHE QD 1 65 ALA MB . . 4.240 3.010 2.649 3.293 . 0 0 "[ . 1 . 2]" 1
471 1 29 PHE QE 1 64 PHE H . . 5.310 4.934 4.199 5.391 0.081 15 0 "[ . 1 . 2]" 1
472 1 29 PHE QE 1 65 ALA HA . . 3.320 3.441 2.875 3.677 0.357 12 0 "[ . 1 . 2]" 1
473 1 29 PHE QE 1 65 ALA MB . . 4.100 3.829 3.407 4.345 0.245 2 0 "[ . 1 . 2]" 1
474 1 30 GLU H 1 30 GLU QB . . 2.930 2.376 2.208 2.640 . 0 0 "[ . 1 . 2]" 1
475 1 30 GLU H 1 30 GLU QG . . 4.610 3.123 2.111 4.069 . 0 0 "[ . 1 . 2]" 1
476 1 30 GLU H 1 31 LEU H . . 3.530 2.629 2.538 2.726 . 0 0 "[ . 1 . 2]" 1
477 1 30 GLU H 1 31 LEU HG . . 4.650 4.424 4.156 4.630 . 0 0 "[ . 1 . 2]" 1
478 1 30 GLU HA 1 30 GLU HG2 . . 3.920 3.250 2.502 3.909 . 0 0 "[ . 1 . 2]" 1
479 1 30 GLU HA 1 30 GLU QG . . 3.220 2.835 2.412 3.192 . 0 0 "[ . 1 . 2]" 1
480 1 30 GLU HA 1 30 GLU HG3 . . 3.920 3.316 2.605 3.848 . 0 0 "[ . 1 . 2]" 1
481 1 30 GLU QB 1 31 LEU H . . 3.880 2.697 2.481 2.959 . 0 0 "[ . 1 . 2]" 1
482 1 30 GLU QB 1 31 LEU MD1 . . 4.500 4.431 4.126 4.571 0.071 14 0 "[ . 1 . 2]" 1
483 1 30 GLU QB 1 31 LEU HG . . 4.420 3.110 2.710 3.339 . 0 0 "[ . 1 . 2]" 1
484 1 30 GLU HB2 1 31 LEU H . . 4.440 3.383 2.633 4.032 . 0 0 "[ . 1 . 2]" 1
485 1 30 GLU HB3 1 31 LEU H . . 4.440 3.262 2.514 4.016 . 0 0 "[ . 1 . 2]" 1
486 1 30 GLU QG 1 31 LEU H . . 4.460 3.918 3.555 4.401 . 0 0 "[ . 1 . 2]" 1
487 1 30 GLU QG 1 31 LEU MD2 . . 4.640 3.636 2.171 4.832 0.192 2 0 "[ . 1 . 2]" 1
488 1 30 GLU HG2 1 31 LEU H . . 5.090 4.705 3.924 5.111 0.021 10 0 "[ . 1 . 2]" 1
489 1 30 GLU HG3 1 31 LEU H . . 5.090 4.344 3.686 5.131 0.041 13 0 "[ . 1 . 2]" 1
490 1 31 LEU H 1 31 LEU HB2 . . 3.790 2.586 2.531 2.653 . 0 0 "[ . 1 . 2]" 1
491 1 31 LEU H 1 31 LEU HB3 . . 3.940 3.679 3.641 3.722 . 0 0 "[ . 1 . 2]" 1
492 1 31 LEU H 1 31 LEU MD1 . . 3.990 3.912 3.703 4.013 0.023 6 0 "[ . 1 . 2]" 1
493 1 31 LEU H 1 31 LEU MD2 . . 3.570 3.167 3.022 3.291 . 0 0 "[ . 1 . 2]" 1
494 1 31 LEU H 1 31 LEU HG . . 3.210 2.513 2.336 2.617 . 0 0 "[ . 1 . 2]" 1
495 1 31 LEU H 1 32 ASN H . . 3.450 2.202 2.111 2.298 . 0 0 "[ . 1 . 2]" 1
496 1 31 LEU H 1 33 ILE H . . 4.180 4.128 3.967 4.272 0.092 13 0 "[ . 1 . 2]" 1
497 1 31 LEU HA 1 31 LEU MD1 . . 4.000 3.886 3.829 3.949 . 0 0 "[ . 1 . 2]" 1
498 1 31 LEU HA 1 31 LEU MD2 . . 2.670 2.185 2.132 2.248 . 0 0 "[ . 1 . 2]" 1
499 1 31 LEU HA 1 31 LEU HG . . 3.690 3.398 3.267 3.491 . 0 0 "[ . 1 . 2]" 1
500 1 31 LEU HB2 1 33 ILE H . . 4.410 3.192 3.062 3.342 . 0 0 "[ . 1 . 2]" 1
501 1 31 LEU HB3 1 31 LEU MD1 . . 3.000 2.377 2.329 2.473 . 0 0 "[ . 1 . 2]" 1
502 1 31 LEU HB3 1 31 LEU MD2 . . 2.930 2.566 2.494 2.628 . 0 0 "[ . 1 . 2]" 1
503 1 31 LEU HB3 1 32 ASN H . . 4.200 4.143 4.022 4.234 0.034 6 0 "[ . 1 . 2]" 1
504 1 31 LEU HB3 1 32 ASN QB . . 5.280 5.108 5.023 5.237 . 0 0 "[ . 1 . 2]" 1
505 1 31 LEU HB3 1 33 ILE H . . 4.710 4.257 4.027 4.610 . 0 0 "[ . 1 . 2]" 1
506 1 31 LEU HB3 1 33 ILE QG . . 3.460 2.676 2.367 3.002 . 0 0 "[ . 1 . 2]" 1
507 1 31 LEU MD1 1 33 ILE H . . 4.800 4.913 4.848 5.010 0.210 6 0 "[ . 1 . 2]" 1
508 1 31 LEU MD2 1 32 ASN H . . 4.500 4.548 4.478 4.624 0.124 18 0 "[ . 1 . 2]" 1
509 1 31 LEU HG 1 33 ILE H . . 5.390 5.371 5.295 5.453 0.063 13 0 "[ . 1 . 2]" 1
510 1 32 ASN H 1 32 ASN HA . . 2.840 2.262 2.246 2.282 . 0 0 "[ . 1 . 2]" 1
511 1 32 ASN H 1 32 ASN HB2 . . 4.150 3.319 3.064 3.703 . 0 0 "[ . 1 . 2]" 1
512 1 32 ASN H 1 32 ASN QB . . 3.530 3.141 2.937 3.441 . 0 0 "[ . 1 . 2]" 1
513 1 32 ASN H 1 32 ASN HB3 . . 4.150 3.885 3.593 4.159 0.009 16 0 "[ . 1 . 2]" 1
514 1 32 ASN H 1 34 VAL MG1 . . 5.500 5.419 5.225 5.619 0.119 12 0 "[ . 1 . 2]" 1
515 1 32 ASN HA 1 33 ILE HB . . 5.190 5.203 5.121 5.293 0.103 20 0 "[ . 1 . 2]" 1
516 1 32 ASN HA 1 33 ILE QG . . 4.750 4.555 4.230 4.736 . 0 0 "[ . 1 . 2]" 1
517 1 32 ASN HA 1 34 VAL H . . 4.160 4.107 3.882 4.240 0.080 2 0 "[ . 1 . 2]" 1
518 1 32 ASN HA 1 34 VAL MG1 . . 4.860 4.639 4.457 4.880 0.020 20 0 "[ . 1 . 2]" 1
519 1 32 ASN QB 1 33 ILE HA . . 5.150 4.552 4.275 4.826 . 0 0 "[ . 1 . 2]" 1
520 1 33 ILE H 1 33 ILE HB . . 3.410 2.588 2.468 2.698 . 0 0 "[ . 1 . 2]" 1
521 1 33 ILE H 1 33 ILE MD . . 3.780 3.312 3.156 3.673 . 0 0 "[ . 1 . 2]" 1
522 1 33 ILE H 1 33 ILE HG12 . . 3.780 2.472 2.052 3.472 . 0 0 "[ . 1 . 2]" 1
523 1 33 ILE H 1 33 ILE QG . . 3.290 2.125 1.832 2.306 . 0 0 "[ . 1 . 2]" 1
524 1 33 ILE H 1 33 ILE HG13 . . 3.780 3.244 1.842 3.769 . 0 0 "[ . 1 . 2]" 1
525 1 33 ILE H 1 33 ILE MG . . 3.880 3.826 3.796 3.860 . 0 0 "[ . 1 . 2]" 1
526 1 33 ILE H 1 34 VAL H . . 3.390 2.663 2.526 2.799 . 0 0 "[ . 1 . 2]" 1
527 1 33 ILE H 1 34 VAL MG1 . . 4.390 4.047 3.873 4.208 . 0 0 "[ . 1 . 2]" 1
528 1 33 ILE HA 1 33 ILE HG12 . . 3.830 3.042 2.591 3.204 . 0 0 "[ . 1 . 2]" 1
529 1 33 ILE HA 1 33 ILE QG . . 3.270 2.893 2.466 3.053 . 0 0 "[ . 1 . 2]" 1
530 1 33 ILE HA 1 33 ILE HG13 . . 3.830 3.630 3.094 3.842 0.012 13 0 "[ . 1 . 2]" 1
531 1 33 ILE HA 1 33 ILE MG . . 3.150 2.423 2.315 2.518 . 0 0 "[ . 1 . 2]" 1
532 1 33 ILE HB 1 33 ILE MD . . 3.280 3.060 2.384 3.278 . 0 0 "[ . 1 . 2]" 1
533 1 33 ILE HB 1 34 VAL H . . 3.730 2.395 2.275 2.550 . 0 0 "[ . 1 . 2]" 1
534 1 33 ILE HB 1 34 VAL HA . . 4.510 4.331 4.156 4.519 0.009 5 0 "[ . 1 . 2]" 1
535 1 33 ILE HB 1 34 VAL HB . . 3.960 3.760 3.479 3.974 0.014 5 0 "[ . 1 . 2]" 1
536 1 33 ILE HB 1 34 VAL MG1 . . 3.910 3.755 3.469 3.962 0.052 19 0 "[ . 1 . 2]" 1
537 1 33 ILE HB 1 34 VAL MG2 . . 5.260 5.130 4.915 5.296 0.036 5 0 "[ . 1 . 2]" 1
538 1 33 ILE MD 1 34 VAL H . . 4.550 4.563 4.147 4.683 0.133 15 0 "[ . 1 . 2]" 1
539 1 33 ILE QG 1 34 VAL H . . 4.390 3.889 3.765 3.987 . 0 0 "[ . 1 . 2]" 1
540 1 33 ILE QG 1 34 VAL MG1 . . 5.340 4.947 4.771 5.206 . 0 0 "[ . 1 . 2]" 1
541 1 33 ILE HG12 1 34 VAL H . . 5.030 4.326 4.073 4.971 . 0 0 "[ . 1 . 2]" 1
542 1 33 ILE HG13 1 34 VAL H . . 5.030 4.595 3.927 4.879 . 0 0 "[ . 1 . 2]" 1
543 1 33 ILE MG 1 34 VAL H . . 3.870 3.370 3.242 3.532 . 0 0 "[ . 1 . 2]" 1
544 1 33 ILE MG 1 34 VAL HA . . 4.090 3.491 3.240 3.777 . 0 0 "[ . 1 . 2]" 1
545 1 33 ILE MG 1 34 VAL HB . . 3.850 3.710 3.304 3.843 . 0 0 "[ . 1 . 2]" 1
546 1 33 ILE MG 1 34 VAL MG1 . . 4.440 4.393 4.161 4.507 0.067 6 0 "[ . 1 . 2]" 1
547 1 33 ILE MG 1 35 ASP H . . 5.500 5.392 5.138 5.632 0.132 12 0 "[ . 1 . 2]" 1
548 1 34 VAL H 1 34 VAL HB . . 3.510 2.757 2.636 2.914 . 0 0 "[ . 1 . 2]" 1
549 1 34 VAL H 1 34 VAL MG1 . . 3.470 2.145 2.053 2.253 . 0 0 "[ . 1 . 2]" 1
550 1 34 VAL H 1 34 VAL MG2 . . 4.110 3.901 3.867 3.919 . 0 0 "[ . 1 . 2]" 1
551 1 34 VAL H 1 35 ASP H . . 4.740 4.571 4.499 4.625 . 0 0 "[ . 1 . 2]" 1
552 1 34 VAL HA 1 34 VAL MG1 . . 3.430 3.281 3.269 3.295 . 0 0 "[ . 1 . 2]" 1
553 1 34 VAL HA 1 34 VAL MG2 . . 3.410 2.371 2.335 2.407 . 0 0 "[ . 1 . 2]" 1
554 1 34 VAL HA 1 35 ASP H . . 3.080 2.236 2.159 2.389 . 0 0 "[ . 1 . 2]" 1
555 1 34 VAL HB 1 35 ASP H . . 4.200 4.116 3.971 4.210 0.010 1 0 "[ . 1 . 2]" 1
556 1 34 VAL MG1 1 35 ASP H . . 4.220 3.755 3.378 3.933 . 0 0 "[ . 1 . 2]" 1
557 1 34 VAL MG1 1 35 ASP HA . . 4.380 4.158 3.987 4.414 0.034 3 0 "[ . 1 . 2]" 1
558 1 34 VAL MG1 1 36 SER H . . 5.500 5.377 5.243 5.583 0.083 18 0 "[ . 1 . 2]" 1
559 1 34 VAL MG1 1 38 ALA H . . 5.470 5.587 5.463 5.680 0.210 8 0 "[ . 1 . 2]" 1
560 1 34 VAL MG1 1 38 ALA MB . . 4.550 4.102 3.949 4.269 . 0 0 "[ . 1 . 2]" 1
561 1 34 VAL MG1 1 42 LEU MD1 . . 4.950 3.804 2.854 5.029 0.079 6 0 "[ . 1 . 2]" 1
562 1 34 VAL MG1 1 42 LEU QD . . 3.820 3.266 2.830 3.908 0.088 6 0 "[ . 1 . 2]" 1
563 1 34 VAL MG1 1 42 LEU MD2 . . 4.950 4.411 3.241 5.072 0.122 10 0 "[ . 1 . 2]" 1
564 1 34 VAL MG1 1 70 MET ME . . 4.740 4.282 3.800 4.624 . 0 0 "[ . 1 . 2]" 1
565 1 34 VAL MG2 1 35 ASP H . . 3.780 2.379 1.987 2.631 . 0 0 "[ . 1 . 2]" 1
566 1 34 VAL MG2 1 35 ASP HA . . 4.570 4.092 3.946 4.178 . 0 0 "[ . 1 . 2]" 1
567 1 34 VAL MG2 1 36 SER H . . 5.500 5.022 4.889 5.230 . 0 0 "[ . 1 . 2]" 1
568 1 34 VAL MG2 1 37 ALA H . . 5.490 5.245 4.972 5.567 0.077 2 0 "[ . 1 . 2]" 1
569 1 34 VAL MG2 1 38 ALA H . . 4.340 3.690 3.523 3.943 . 0 0 "[ . 1 . 2]" 1
570 1 34 VAL MG2 1 38 ALA MB . . 3.480 2.012 1.903 2.146 . 0 0 "[ . 1 . 2]" 1
571 1 34 VAL MG2 1 39 ILE H . . 4.130 3.822 3.355 4.200 0.070 18 0 "[ . 1 . 2]" 1
572 1 34 VAL MG2 1 42 LEU HG . . 5.390 4.036 3.355 5.191 . 0 0 "[ . 1 . 2]" 1
573 1 35 ASP H 1 35 ASP HB2 . . 3.920 2.650 2.392 3.005 . 0 0 "[ . 1 . 2]" 1
574 1 35 ASP H 1 35 ASP HB3 . . 3.920 3.037 2.414 3.708 . 0 0 "[ . 1 . 2]" 1
575 1 35 ASP H 1 36 SER H . . 4.690 4.496 4.428 4.564 . 0 0 "[ . 1 . 2]" 1
576 1 35 ASP H 1 38 ALA H . . 4.130 3.940 3.679 4.207 0.077 7 0 "[ . 1 . 2]" 1
577 1 35 ASP H 1 38 ALA MB . . 3.380 3.013 2.595 3.406 0.026 15 0 "[ . 1 . 2]" 1
578 1 35 ASP HA 1 36 SER H . . 3.300 2.383 2.247 2.505 . 0 0 "[ . 1 . 2]" 1
579 1 35 ASP HA 1 37 ALA H . . 4.680 4.282 4.079 4.571 . 0 0 "[ . 1 . 2]" 1
580 1 35 ASP QB 1 36 SER H . . 3.050 2.795 2.110 3.256 0.206 3 0 "[ . 1 . 2]" 1
581 1 35 ASP QB 1 36 SER QB . . 5.060 4.340 3.407 5.037 . 0 0 "[ . 1 . 2]" 1
582 1 35 ASP QB 1 37 ALA H . . 3.810 2.847 2.384 3.295 . 0 0 "[ . 1 . 2]" 1
583 1 35 ASP QB 1 37 ALA MB . . 4.680 3.098 2.510 3.583 . 0 0 "[ . 1 . 2]" 1
584 1 35 ASP QB 1 38 ALA H . . 4.190 3.156 2.766 3.730 . 0 0 "[ . 1 . 2]" 1
585 1 35 ASP QB 1 38 ALA MB . . 4.300 3.463 2.876 4.211 . 0 0 "[ . 1 . 2]" 1
586 1 35 ASP HB2 1 36 SER H . . 3.540 3.665 3.427 3.823 0.283 6 0 "[ . 1 . 2]" 1
587 1 35 ASP HB2 1 37 ALA H . . 4.350 3.887 2.985 4.503 0.153 17 0 "[ . 1 . 2]" 1
588 1 35 ASP HB3 1 36 SER H . . 3.540 2.968 2.130 3.595 0.055 11 0 "[ . 1 . 2]" 1
589 1 35 ASP HB3 1 37 ALA H . . 4.350 2.937 2.452 3.396 . 0 0 "[ . 1 . 2]" 1
590 1 36 SER H 1 36 SER QB . . 3.060 2.209 2.033 2.402 . 0 0 "[ . 1 . 2]" 1
591 1 36 SER H 1 37 ALA H . . 3.720 2.637 2.479 2.836 . 0 0 "[ . 1 . 2]" 1
592 1 36 SER H 1 37 ALA MB . . 4.950 4.313 4.163 4.563 . 0 0 "[ . 1 . 2]" 1
593 1 36 SER H 1 38 ALA H . . 4.770 4.328 3.977 4.533 . 0 0 "[ . 1 . 2]" 1
594 1 36 SER H 1 39 ILE MD . . 5.500 5.224 4.867 5.516 0.016 7 0 "[ . 1 . 2]" 1
595 1 36 SER HA 1 39 ILE H . . 3.940 3.523 3.275 3.932 . 0 0 "[ . 1 . 2]" 1
596 1 36 SER HA 1 39 ILE MD . . 4.090 3.566 3.282 4.039 . 0 0 "[ . 1 . 2]" 1
597 1 36 SER HA 1 39 ILE HG12 . . 4.930 2.252 1.940 2.801 . 0 0 "[ . 1 . 2]" 1
598 1 36 SER HA 1 39 ILE QG . . 4.220 2.100 1.884 2.527 . 0 0 "[ . 1 . 2]" 1
599 1 36 SER HA 1 39 ILE HG13 . . 4.930 2.547 2.176 2.876 . 0 0 "[ . 1 . 2]" 1
600 1 36 SER QB 1 37 ALA H . . 3.870 3.126 2.584 3.662 . 0 0 "[ . 1 . 2]" 1
601 1 36 SER QB 1 37 ALA MB . . 4.800 4.335 3.761 4.867 0.067 5 0 "[ . 1 . 2]" 1
602 1 36 SER QB 1 39 ILE HB . . 5.140 4.656 3.804 5.333 0.193 12 0 "[ . 1 . 2]" 1
603 1 36 SER QB 1 39 ILE MD . . 5.310 4.945 4.380 5.388 0.078 19 0 "[ . 1 . 2]" 1
604 1 36 SER QB 1 61 PRO HD3 . . 4.130 3.556 2.262 4.420 0.290 9 0 "[ . 1 . 2]" 1
605 1 36 SER QB 1 61 PRO HG3 . . 3.430 2.629 1.743 3.609 0.179 13 0 "[ . 1 . 2]" 1
606 1 37 ALA H 1 37 ALA MB . . 2.780 2.256 2.212 2.321 . 0 0 "[ . 1 . 2]" 1
607 1 37 ALA HA 1 40 PHE QB . . 4.800 4.058 3.295 4.693 . 0 0 "[ . 1 . 2]" 1
608 1 37 ALA MB 1 40 PHE QB . . 5.080 4.740 4.100 5.175 0.095 18 0 "[ . 1 . 2]" 1
609 1 38 ALA H 1 38 ALA MB . . 2.800 2.287 2.258 2.309 . 0 0 "[ . 1 . 2]" 1
610 1 38 ALA H 1 39 ILE H . . 3.160 2.461 2.354 2.639 . 0 0 "[ . 1 . 2]" 1
611 1 38 ALA H 1 40 PHE H . . 4.650 4.487 4.257 4.702 0.052 12 0 "[ . 1 . 2]" 1
612 1 38 ALA HA 1 41 ASP HB2 . . 4.660 3.583 3.107 4.033 . 0 0 "[ . 1 . 2]" 1
613 1 38 ALA HA 1 41 ASP QB . . 3.870 3.004 2.473 3.492 . 0 0 "[ . 1 . 2]" 1
614 1 38 ALA HA 1 41 ASP HB3 . . 4.660 3.235 2.595 3.865 . 0 0 "[ . 1 . 2]" 1
615 1 38 ALA MB 1 41 ASP QB . . 4.380 3.445 3.139 3.731 . 0 0 "[ . 1 . 2]" 1
616 1 39 ILE H 1 39 ILE HB . . 3.030 2.536 2.474 2.675 . 0 0 "[ . 1 . 2]" 1
617 1 39 ILE H 1 39 ILE MD . . 4.350 3.191 3.015 3.367 . 0 0 "[ . 1 . 2]" 1
618 1 39 ILE H 1 39 ILE HG12 . . 3.770 2.140 2.050 2.209 . 0 0 "[ . 1 . 2]" 1
619 1 39 ILE H 1 39 ILE HG13 . . 3.770 3.624 3.555 3.692 . 0 0 "[ . 1 . 2]" 1
620 1 39 ILE H 1 39 ILE MG . . 3.770 3.826 3.799 3.848 0.078 10 0 "[ . 1 . 2]" 1
621 1 39 ILE H 1 40 PHE H . . 3.320 2.735 2.620 2.851 . 0 0 "[ . 1 . 2]" 1
622 1 39 ILE H 1 40 PHE QB . . 4.990 4.446 4.315 4.578 . 0 0 "[ . 1 . 2]" 1
623 1 39 ILE HA 1 39 ILE MD . . 3.940 2.064 1.988 2.191 . 0 0 "[ . 1 . 2]" 1
624 1 39 ILE HA 1 39 ILE HG12 . . 4.190 3.093 2.944 3.226 . 0 0 "[ . 1 . 2]" 1
625 1 39 ILE HA 1 39 ILE HG13 . . 4.190 3.759 3.713 3.831 . 0 0 "[ . 1 . 2]" 1
626 1 39 ILE HA 1 39 ILE MG . . 3.520 2.532 2.446 2.603 . 0 0 "[ . 1 . 2]" 1
627 1 39 ILE HA 1 42 LEU H . . 4.460 3.277 2.988 3.571 . 0 0 "[ . 1 . 2]" 1
628 1 39 ILE HA 1 42 LEU HB2 . . 4.270 2.480 2.095 2.732 . 0 0 "[ . 1 . 2]" 1
629 1 39 ILE HA 1 42 LEU QB . . 3.690 2.459 2.083 2.701 . 0 0 "[ . 1 . 2]" 1
630 1 39 ILE HA 1 42 LEU HB3 . . 4.270 4.081 3.628 4.303 0.033 17 0 "[ . 1 . 2]" 1
631 1 39 ILE HA 1 42 LEU QD . . 3.780 2.499 2.139 3.139 . 0 0 "[ . 1 . 2]" 1
632 1 39 ILE HB 1 39 ILE MD . . 3.350 3.275 3.263 3.281 . 0 0 "[ . 1 . 2]" 1
633 1 39 ILE HB 1 40 PHE H . . 3.790 2.717 2.541 2.977 . 0 0 "[ . 1 . 2]" 1
634 1 39 ILE HB 1 40 PHE HA . . 5.480 4.411 4.279 4.536 . 0 0 "[ . 1 . 2]" 1
635 1 39 ILE HB 1 40 PHE QB . . 5.340 4.190 3.919 4.421 . 0 0 "[ . 1 . 2]" 1
636 1 39 ILE HB 1 59 ILE MG . . 4.140 3.351 2.790 3.651 . 0 0 "[ . 1 . 2]" 1
637 1 39 ILE MD 1 39 ILE MG . . 3.150 2.153 2.084 2.211 . 0 0 "[ . 1 . 2]" 1
638 1 39 ILE MD 1 41 ASP H . . 5.500 5.493 5.371 5.614 0.114 16 0 "[ . 1 . 2]" 1
639 1 39 ILE MD 1 42 LEU QB . . 4.140 3.358 3.026 3.633 . 0 0 "[ . 1 . 2]" 1
640 1 39 ILE MD 1 42 LEU QD . . 3.540 2.221 1.785 2.999 . 0 0 "[ . 1 . 2]" 1
641 1 39 ILE MD 1 60 HIS HA . . 5.160 5.263 4.998 5.440 0.280 16 0 "[ . 1 . 2]" 1
642 1 39 ILE MD 1 61 PRO HA . . 3.280 2.329 2.119 2.597 . 0 0 "[ . 1 . 2]" 1
643 1 39 ILE MD 1 61 PRO QB . . 3.990 2.546 2.178 3.818 . 0 0 "[ . 1 . 2]" 1
644 1 39 ILE MD 1 61 PRO HD3 . . 4.780 4.180 3.615 4.564 . 0 0 "[ . 1 . 2]" 1
645 1 39 ILE MD 1 61 PRO HG2 . . 5.500 4.984 4.729 5.113 . 0 0 "[ . 1 . 2]" 1
646 1 39 ILE MD 1 61 PRO HG3 . . 5.360 4.423 3.620 4.759 . 0 0 "[ . 1 . 2]" 1
647 1 39 ILE MD 1 63 ASN H . . 5.500 5.485 5.364 5.575 0.075 19 0 "[ . 1 . 2]" 1
648 1 39 ILE MD 1 64 PHE H . . 4.050 4.005 3.860 4.129 0.079 19 0 "[ . 1 . 2]" 1
649 1 39 ILE MD 1 64 PHE HB2 . . 4.460 1.934 1.841 2.041 . 0 0 "[ . 1 . 2]" 1
650 1 39 ILE MD 1 64 PHE HB3 . . 4.040 2.446 2.221 2.614 . 0 0 "[ . 1 . 2]" 1
651 1 39 ILE MD 1 65 ALA H . . 5.320 5.182 4.886 5.381 0.061 19 0 "[ . 1 . 2]" 1
652 1 39 ILE MD 1 70 MET ME . . 4.490 3.979 3.514 4.288 . 0 0 "[ . 1 . 2]" 1
653 1 39 ILE QG 1 40 PHE H . . 4.690 4.084 3.856 4.187 . 0 0 "[ . 1 . 2]" 1
654 1 39 ILE QG 1 42 LEU QD . . 4.760 3.903 3.567 4.424 . 0 0 "[ . 1 . 2]" 1
655 1 39 ILE QG 1 61 PRO HA . . 5.340 2.565 2.295 2.805 . 0 0 "[ . 1 . 2]" 1
656 1 39 ILE HG12 1 40 PHE H . . 5.320 4.310 4.046 4.410 . 0 0 "[ . 1 . 2]" 1
657 1 39 ILE HG13 1 40 PHE H . . 5.320 5.064 4.853 5.228 . 0 0 "[ . 1 . 2]" 1
658 1 39 ILE MG 1 40 PHE H . . 3.620 3.497 3.246 3.693 0.073 19 0 "[ . 1 . 2]" 1
659 1 39 ILE MG 1 40 PHE HA . . 3.940 3.570 3.288 3.830 . 0 0 "[ . 1 . 2]" 1
660 1 39 ILE MG 1 41 ASP H . . 5.350 4.879 4.743 5.016 . 0 0 "[ . 1 . 2]" 1
661 1 39 ILE MG 1 42 LEU H . . 5.500 4.640 4.412 4.929 . 0 0 "[ . 1 . 2]" 1
662 1 39 ILE MG 1 42 LEU QB . . 4.390 3.466 3.105 3.952 . 0 0 "[ . 1 . 2]" 1
663 1 39 ILE MG 1 42 LEU QD . . 4.610 3.752 3.300 4.379 . 0 0 "[ . 1 . 2]" 1
664 1 39 ILE MG 1 43 VAL H . . 5.080 3.958 3.746 4.266 . 0 0 "[ . 1 . 2]" 1
665 1 39 ILE MG 1 43 VAL HB . . 4.980 4.156 2.889 5.163 0.183 10 0 "[ . 1 . 2]" 1
666 1 39 ILE MG 1 43 VAL QG . . 3.060 2.605 2.185 3.226 0.166 11 0 "[ . 1 . 2]" 1
667 1 39 ILE MG 1 59 ILE HB . . 5.340 4.364 4.164 4.669 . 0 0 "[ . 1 . 2]" 1
668 1 39 ILE MG 1 59 ILE MD . . 4.100 4.252 4.145 4.379 0.279 11 0 "[ . 1 . 2]" 1
669 1 39 ILE MG 1 59 ILE QG . . 4.470 4.147 3.907 4.557 0.087 9 0 "[ . 1 . 2]" 1
670 1 39 ILE MG 1 59 ILE MG . . 3.400 1.954 1.861 2.148 . 0 0 "[ . 1 . 2]" 1
671 1 39 ILE MG 1 60 HIS H . . 5.490 3.334 2.761 3.632 . 0 0 "[ . 1 . 2]" 1
672 1 39 ILE MG 1 61 PRO HA . . 4.440 3.035 2.858 3.630 . 0 0 "[ . 1 . 2]" 1
673 1 39 ILE MG 1 64 PHE H . . 5.500 4.272 4.023 4.417 . 0 0 "[ . 1 . 2]" 1
674 1 39 ILE MG 1 64 PHE HB3 . . 4.880 3.555 3.276 3.835 . 0 0 "[ . 1 . 2]" 1
675 1 40 PHE H 1 40 PHE HB2 . . 3.470 2.502 2.408 2.615 . 0 0 "[ . 1 . 2]" 1
676 1 40 PHE H 1 40 PHE QB . . 3.040 2.248 2.214 2.300 . 0 0 "[ . 1 . 2]" 1
677 1 40 PHE H 1 40 PHE HB3 . . 3.470 2.552 2.472 2.651 . 0 0 "[ . 1 . 2]" 1
678 1 40 PHE H 1 41 ASP H . . 3.470 2.709 2.603 2.829 . 0 0 "[ . 1 . 2]" 1
679 1 40 PHE H 1 41 ASP QB . . 5.040 4.467 4.331 4.580 . 0 0 "[ . 1 . 2]" 1
680 1 40 PHE H 1 42 LEU H . . 4.640 4.289 3.897 4.520 . 0 0 "[ . 1 . 2]" 1
681 1 40 PHE H 1 43 VAL QG . . 5.440 4.025 3.792 4.365 . 0 0 "[ . 1 . 2]" 1
682 1 40 PHE HA 1 40 PHE QD . . 3.130 2.655 2.118 2.954 . 0 0 "[ . 1 . 2]" 1
683 1 40 PHE HA 1 40 PHE QE . . 4.860 4.603 4.390 4.688 . 0 0 "[ . 1 . 2]" 1
684 1 40 PHE HA 1 43 VAL H . . 4.080 3.749 3.379 3.997 . 0 0 "[ . 1 . 2]" 1
685 1 40 PHE HA 1 43 VAL QG . . 3.350 2.305 2.112 2.902 . 0 0 "[ . 1 . 2]" 1
686 1 40 PHE QB 1 56 MET ME . . 4.720 3.664 2.470 4.892 0.172 18 0 "[ . 1 . 2]" 1
687 1 40 PHE HB2 1 41 ASP H . . 4.150 4.064 3.940 4.160 0.010 2 0 "[ . 1 . 2]" 1
688 1 40 PHE HB3 1 41 ASP H . . 4.150 2.932 2.734 3.098 . 0 0 "[ . 1 . 2]" 1
689 1 40 PHE QD 1 56 MET ME . . 4.050 2.354 1.810 3.634 . 0 0 "[ . 1 . 2]" 1
690 1 40 PHE QD 1 59 ILE MD . . 4.240 2.690 1.854 3.435 . 0 0 "[ . 1 . 2]" 1
691 1 40 PHE QD 1 59 ILE MG . . 4.720 2.919 2.270 3.733 . 0 0 "[ . 1 . 2]" 1
692 1 40 PHE QE 1 56 MET ME . . 4.890 2.763 2.042 3.802 . 0 0 "[ . 1 . 2]" 1
693 1 41 ASP H 1 41 ASP HB2 . . 3.230 2.632 2.470 2.753 . 0 0 "[ . 1 . 2]" 1
694 1 41 ASP H 1 41 ASP QB . . 2.820 2.268 2.245 2.297 . 0 0 "[ . 1 . 2]" 1
695 1 41 ASP H 1 41 ASP HB3 . . 3.230 2.483 2.422 2.593 . 0 0 "[ . 1 . 2]" 1
696 1 41 ASP H 1 42 LEU H . . 3.410 2.485 2.307 2.608 . 0 0 "[ . 1 . 2]" 1
697 1 41 ASP H 1 59 ILE MG . . 5.500 5.259 4.755 5.539 0.039 14 0 "[ . 1 . 2]" 1
698 1 41 ASP QB 1 42 LEU QD . . 4.440 3.215 2.437 4.243 . 0 0 "[ . 1 . 2]" 1
699 1 41 ASP HB2 1 42 LEU H . . 4.150 3.845 3.697 4.046 . 0 0 "[ . 1 . 2]" 1
700 1 41 ASP HB3 1 42 LEU H . . 4.150 2.546 2.289 3.010 . 0 0 "[ . 1 . 2]" 1
701 1 42 LEU H 1 42 LEU HB2 . . 4.030 2.436 2.257 2.589 . 0 0 "[ . 1 . 2]" 1
702 1 42 LEU H 1 42 LEU QB . . 3.530 2.398 2.233 2.535 . 0 0 "[ . 1 . 2]" 1
703 1 42 LEU H 1 42 LEU HB3 . . 4.030 3.601 3.542 3.642 . 0 0 "[ . 1 . 2]" 1
704 1 42 LEU H 1 42 LEU QD . . 3.630 2.725 2.136 3.385 . 0 0 "[ . 1 . 2]" 1
705 1 42 LEU H 1 42 LEU HG . . 4.060 2.983 2.198 4.124 0.064 6 0 "[ . 1 . 2]" 1
706 1 42 LEU H 1 43 VAL H . . 3.610 2.670 2.478 2.806 . 0 0 "[ . 1 . 2]" 1
707 1 42 LEU H 1 43 VAL QG . . 4.580 3.939 3.461 4.337 . 0 0 "[ . 1 . 2]" 1
708 1 42 LEU HA 1 42 LEU MD1 . . 4.100 3.349 2.013 3.963 . 0 0 "[ . 1 . 2]" 1
709 1 42 LEU HA 1 42 LEU QD . . 3.460 2.229 1.968 2.688 . 0 0 "[ . 1 . 2]" 1
710 1 42 LEU HA 1 42 LEU MD2 . . 4.100 2.710 2.060 3.889 . 0 0 "[ . 1 . 2]" 1
711 1 42 LEU QB 1 42 LEU QD . . 2.770 2.020 1.976 2.107 . 0 0 "[ . 1 . 2]" 1
712 1 42 LEU QB 1 43 VAL H . . 3.300 2.743 2.492 2.938 . 0 0 "[ . 1 . 2]" 1
713 1 42 LEU QB 1 43 VAL HA . . 4.660 3.958 3.620 4.172 . 0 0 "[ . 1 . 2]" 1
714 1 42 LEU QB 1 43 VAL QG . . 3.710 3.585 3.242 3.995 0.285 8 0 "[ . 1 . 2]" 1
715 1 42 LEU QB 1 64 PHE QD . . 4.050 2.798 2.277 3.155 . 0 0 "[ . 1 . 2]" 1
716 1 42 LEU QB 1 64 PHE QE . . 4.440 3.091 2.335 3.911 . 0 0 "[ . 1 . 2]" 1
717 1 42 LEU HB2 1 43 VAL H . . 4.110 2.837 2.543 3.097 . 0 0 "[ . 1 . 2]" 1
718 1 42 LEU HB3 1 43 VAL H . . 4.110 3.683 3.369 3.953 . 0 0 "[ . 1 . 2]" 1
719 1 42 LEU QD 1 64 PHE HB3 . . 5.140 3.347 2.866 4.447 . 0 0 "[ . 1 . 2]" 1
720 1 43 VAL H 1 43 VAL HB . . 3.820 2.827 2.250 3.714 . 0 0 "[ . 1 . 2]" 1
721 1 43 VAL H 1 43 VAL MG1 . . 3.770 2.821 2.059 3.805 0.035 16 0 "[ . 1 . 2]" 1
722 1 43 VAL H 1 43 VAL QG . . 3.060 2.167 1.979 2.508 . 0 0 "[ . 1 . 2]" 1
723 1 43 VAL H 1 43 VAL MG2 . . 3.770 2.776 2.150 3.813 0.043 9 0 "[ . 1 . 2]" 1
724 1 43 VAL H 1 44 ASP H . . 3.590 2.683 2.468 2.908 . 0 0 "[ . 1 . 2]" 1
725 1 43 VAL H 1 44 ASP HB2 . . 5.210 4.938 4.514 5.148 . 0 0 "[ . 1 . 2]" 1
726 1 43 VAL H 1 64 PHE QE . . 4.390 3.938 3.362 4.371 . 0 0 "[ . 1 . 2]" 1
727 1 43 VAL HA 1 45 PHE H . . 4.770 4.296 4.010 4.520 . 0 0 "[ . 1 . 2]" 1
728 1 43 VAL HA 1 46 LEU H . . 4.320 3.465 3.011 3.862 . 0 0 "[ . 1 . 2]" 1
729 1 43 VAL HA 1 46 LEU HB2 . . 4.280 2.966 2.509 3.363 . 0 0 "[ . 1 . 2]" 1
730 1 43 VAL HA 1 46 LEU HB3 . . 4.850 4.626 4.146 4.997 0.147 16 0 "[ . 1 . 2]" 1
731 1 43 VAL HA 1 46 LEU QD . . 3.930 3.008 2.416 3.490 . 0 0 "[ . 1 . 2]" 1
732 1 43 VAL HA 1 46 LEU HG . . 3.780 3.507 2.873 3.890 0.110 7 0 "[ . 1 . 2]" 1
733 1 43 VAL HA 1 47 ARG H . . 5.000 4.134 3.771 4.648 . 0 0 "[ . 1 . 2]" 1
734 1 43 VAL HA 1 47 ARG QD . . 5.340 4.464 2.841 5.394 0.054 8 0 "[ . 1 . 2]" 1
735 1 43 VAL HA 1 54 ILE MD . . 4.900 4.310 3.357 4.751 . 0 0 "[ . 1 . 2]" 1
736 1 43 VAL HA 1 64 PHE QE . . 3.940 2.700 2.297 3.262 . 0 0 "[ . 1 . 2]" 1
737 1 43 VAL HA 1 64 PHE HZ . . 4.520 2.989 2.224 4.076 . 0 0 "[ . 1 . 2]" 1
738 1 43 VAL HB 1 44 ASP H . . 3.990 3.323 2.139 4.065 0.075 15 0 "[ . 1 . 2]" 1
739 1 43 VAL HB 1 64 PHE HZ . . 4.530 3.768 2.501 4.735 0.205 17 0 "[ . 1 . 2]" 1
740 1 43 VAL QG 1 44 ASP H . . 3.460 2.495 1.981 3.096 . 0 0 "[ . 1 . 2]" 1
741 1 43 VAL QG 1 44 ASP HA . . 4.040 3.051 2.712 3.319 . 0 0 "[ . 1 . 2]" 1
742 1 43 VAL QG 1 44 ASP HB2 . . 4.650 3.655 3.127 4.208 . 0 0 "[ . 1 . 2]" 1
743 1 43 VAL QG 1 45 PHE H . . 4.630 4.263 4.087 4.497 . 0 0 "[ . 1 . 2]" 1
744 1 43 VAL QG 1 46 LEU H . . 5.440 4.438 4.024 4.720 . 0 0 "[ . 1 . 2]" 1
745 1 43 VAL QG 1 47 ARG H . . 5.440 4.048 3.428 4.684 . 0 0 "[ . 1 . 2]" 1
746 1 43 VAL QG 1 59 ILE MG . . 3.210 1.850 1.682 2.152 . 0 0 "[ . 1 . 2]" 1
747 1 43 VAL QG 1 64 PHE HZ . . 3.050 1.948 1.708 2.172 . 0 0 "[ . 1 . 2]" 1
748 1 43 VAL MG1 1 44 ASP H . . 4.300 3.046 2.143 4.038 . 0 0 "[ . 1 . 2]" 1
749 1 43 VAL MG2 1 44 ASP H . . 4.300 3.386 1.986 4.015 . 0 0 "[ . 1 . 2]" 1
750 1 44 ASP H 1 44 ASP HB2 . . 3.070 2.454 2.298 2.531 . 0 0 "[ . 1 . 2]" 1
751 1 44 ASP H 1 44 ASP HB3 . . 3.780 2.889 2.521 3.645 . 0 0 "[ . 1 . 2]" 1
752 1 44 ASP H 1 45 PHE H . . 3.540 2.640 2.428 2.740 . 0 0 "[ . 1 . 2]" 1
753 1 44 ASP H 1 46 LEU H . . 4.600 4.314 3.974 4.521 . 0 0 "[ . 1 . 2]" 1
754 1 44 ASP H 1 47 ARG QD . . 4.540 4.306 3.821 4.683 0.143 7 0 "[ . 1 . 2]" 1
755 1 44 ASP H 1 54 ILE MG . . 5.500 5.173 4.595 5.478 . 0 0 "[ . 1 . 2]" 1
756 1 44 ASP HA 1 47 ARG H . . 4.360 3.611 2.916 4.090 . 0 0 "[ . 1 . 2]" 1
757 1 44 ASP HA 1 47 ARG QB . . 4.560 3.350 2.277 4.236 . 0 0 "[ . 1 . 2]" 1
758 1 44 ASP HA 1 47 ARG HD2 . . 3.910 3.646 2.009 4.148 0.238 12 0 "[ . 1 . 2]" 1
759 1 44 ASP HA 1 47 ARG HD3 . . 3.910 2.795 1.871 4.050 0.140 12 0 "[ . 1 . 2]" 1
760 1 44 ASP HA 1 47 ARG QG . . 4.350 2.668 1.710 4.539 0.189 16 0 "[ . 1 . 2]" 1
761 1 44 ASP HB2 1 45 PHE H . . 4.060 3.597 2.840 3.881 . 0 0 "[ . 1 . 2]" 1
762 1 44 ASP HB2 1 45 PHE HA . . 5.160 5.326 4.487 5.552 0.392 8 0 "[ . 1 . 2]" 1
763 1 44 ASP HB3 1 45 PHE H . . 4.620 2.889 2.450 4.027 . 0 0 "[ . 1 . 2]" 1
764 1 44 ASP HB3 1 45 PHE HA . . 5.070 4.212 4.009 4.750 . 0 0 "[ . 1 . 2]" 1
765 1 44 ASP HB3 1 48 GLN HB2 . . 5.460 5.261 4.501 5.636 0.176 18 0 "[ . 1 . 2]" 1
766 1 45 PHE H 1 45 PHE HB2 . . 3.240 2.450 2.316 2.589 . 0 0 "[ . 1 . 2]" 1
767 1 45 PHE H 1 45 PHE HB3 . . 3.790 2.549 2.355 2.720 . 0 0 "[ . 1 . 2]" 1
768 1 45 PHE H 1 45 PHE QD . . 4.300 4.202 4.157 4.247 . 0 0 "[ . 1 . 2]" 1
769 1 45 PHE H 1 46 LEU H . . 3.670 2.730 2.635 2.824 . 0 0 "[ . 1 . 2]" 1
770 1 45 PHE H 1 46 LEU HB2 . . 5.290 4.943 4.775 5.100 . 0 0 "[ . 1 . 2]" 1
771 1 45 PHE H 1 47 ARG H . . 4.840 4.127 3.872 4.382 . 0 0 "[ . 1 . 2]" 1
772 1 45 PHE H 1 48 GLN HB2 . . 5.500 5.313 4.844 5.515 0.015 12 0 "[ . 1 . 2]" 1
773 1 45 PHE H 1 48 GLN QE . . 5.230 4.913 4.277 5.270 0.040 19 0 "[ . 1 . 2]" 1
774 1 45 PHE HA 1 45 PHE QD . . 3.080 2.947 2.595 3.168 0.088 18 0 "[ . 1 . 2]" 1
775 1 45 PHE HA 1 48 GLN H . . 4.380 3.814 3.436 4.156 . 0 0 "[ . 1 . 2]" 1
776 1 45 PHE HA 1 48 GLN HB2 . . 4.090 3.586 3.008 4.104 0.014 13 0 "[ . 1 . 2]" 1
777 1 45 PHE HA 1 48 GLN QE . . 3.870 2.611 2.191 3.188 . 0 0 "[ . 1 . 2]" 1
778 1 45 PHE HB2 1 46 LEU H . . 4.330 3.782 3.687 3.938 . 0 0 "[ . 1 . 2]" 1
779 1 45 PHE HB2 1 46 LEU QD . . 5.440 4.832 4.658 4.963 . 0 0 "[ . 1 . 2]" 1
780 1 45 PHE HB2 1 48 GLN QE . . 4.840 4.451 3.864 4.922 0.082 9 0 "[ . 1 . 2]" 1
781 1 45 PHE HB3 1 46 LEU H . . 4.120 2.467 2.270 2.600 . 0 0 "[ . 1 . 2]" 1
782 1 45 PHE HB3 1 46 LEU MD1 . . 5.060 4.796 4.584 5.079 0.019 19 0 "[ . 1 . 2]" 1
783 1 45 PHE HB3 1 46 LEU QD . . 4.010 3.521 3.363 3.713 . 0 0 "[ . 1 . 2]" 1
784 1 45 PHE HB3 1 46 LEU MD2 . . 5.060 3.626 3.418 3.820 . 0 0 "[ . 1 . 2]" 1
785 1 45 PHE HB3 1 46 LEU HG . . 4.530 3.325 3.099 3.622 . 0 0 "[ . 1 . 2]" 1
786 1 45 PHE QD 1 46 LEU H . . 4.260 3.458 3.015 3.830 . 0 0 "[ . 1 . 2]" 1
787 1 45 PHE QD 1 46 LEU HA . . 3.970 3.343 2.932 3.999 0.029 8 0 "[ . 1 . 2]" 1
788 1 45 PHE QD 1 49 GLU QG . . 4.190 3.328 2.558 3.747 . 0 0 "[ . 1 . 2]" 1
789 1 45 PHE QE 1 49 GLU HG2 . . 5.160 3.939 3.286 4.519 . 0 0 "[ . 1 . 2]" 1
790 1 45 PHE QE 1 49 GLU QG . . 4.510 3.051 2.601 3.582 . 0 0 "[ . 1 . 2]" 1
791 1 45 PHE QE 1 49 GLU HG3 . . 5.160 3.200 2.676 3.877 . 0 0 "[ . 1 . 2]" 1
792 1 46 LEU H 1 46 LEU HB2 . . 3.910 2.528 2.454 2.621 . 0 0 "[ . 1 . 2]" 1
793 1 46 LEU H 1 46 LEU HB3 . . 3.750 3.630 3.584 3.662 . 0 0 "[ . 1 . 2]" 1
794 1 46 LEU H 1 46 LEU MD1 . . 4.120 3.757 3.569 3.899 . 0 0 "[ . 1 . 2]" 1
795 1 46 LEU H 1 46 LEU QD . . 3.300 3.046 2.886 3.125 . 0 0 "[ . 1 . 2]" 1
796 1 46 LEU H 1 46 LEU MD2 . . 4.120 3.225 2.996 3.355 . 0 0 "[ . 1 . 2]" 1
797 1 46 LEU H 1 46 LEU HG . . 4.010 2.359 2.199 2.525 . 0 0 "[ . 1 . 2]" 1
798 1 46 LEU H 1 64 PHE QE . . 4.940 4.812 4.351 5.139 0.199 20 0 "[ . 1 . 2]" 1
799 1 46 LEU HA 1 46 LEU MD1 . . 4.340 3.912 3.878 3.949 . 0 0 "[ . 1 . 2]" 1
800 1 46 LEU HA 1 46 LEU QD . . 2.900 2.099 2.032 2.191 . 0 0 "[ . 1 . 2]" 1
801 1 46 LEU HA 1 46 LEU MD2 . . 4.340 2.108 2.039 2.202 . 0 0 "[ . 1 . 2]" 1
802 1 46 LEU HA 1 50 SER H . . 3.830 3.870 3.539 4.022 0.192 1 0 "[ . 1 . 2]" 1
803 1 46 LEU HB2 1 47 ARG H . . 3.410 2.793 2.467 3.014 . 0 0 "[ . 1 . 2]" 1
804 1 46 LEU HB2 1 50 SER QB . . 5.340 5.223 4.911 5.390 0.050 9 0 "[ . 1 . 2]" 1
805 1 46 LEU HB3 1 46 LEU MD1 . . 3.220 2.413 2.351 2.483 . 0 0 "[ . 1 . 2]" 1
806 1 46 LEU HB3 1 46 LEU MD2 . . 3.220 2.517 2.468 2.590 . 0 0 "[ . 1 . 2]" 1
807 1 46 LEU HB3 1 47 ARG H . . 4.310 3.785 3.503 3.963 . 0 0 "[ . 1 . 2]" 1
808 1 46 LEU HB3 1 47 ARG HA . . 4.550 4.483 4.294 4.643 0.093 17 0 "[ . 1 . 2]" 1
809 1 46 LEU HB3 1 50 SER QB . . 4.510 4.240 3.740 4.570 0.060 19 0 "[ . 1 . 2]" 1
810 1 46 LEU QD 1 47 ARG H . . 4.880 4.221 4.074 4.322 . 0 0 "[ . 1 . 2]" 1
811 1 46 LEU QD 1 49 GLU HB2 . . 4.900 3.839 3.448 4.246 . 0 0 "[ . 1 . 2]" 1
812 1 46 LEU QD 1 50 SER H . . 5.310 4.961 4.584 5.126 . 0 0 "[ . 1 . 2]" 1
813 1 46 LEU QD 1 64 PHE HB3 . . 5.150 4.944 4.491 5.193 0.043 12 0 "[ . 1 . 2]" 1
814 1 46 LEU QD 1 64 PHE QD . . 3.580 3.157 2.723 3.463 . 0 0 "[ . 1 . 2]" 1
815 1 46 LEU QD 1 64 PHE HZ . . 4.430 3.141 2.641 3.649 . 0 0 "[ . 1 . 2]" 1
816 1 46 LEU QD 1 70 MET HA . . 3.950 3.950 3.568 4.124 0.174 16 0 "[ . 1 . 2]" 1
817 1 46 LEU QD 1 70 MET HB2 . . 4.400 2.508 1.988 2.811 . 0 0 "[ . 1 . 2]" 1
818 1 46 LEU QD 1 70 MET QG . . 3.530 2.337 1.997 2.642 . 0 0 "[ . 1 . 2]" 1
819 1 47 ARG H 1 47 ARG HB2 . . 3.790 3.121 2.283 3.676 . 0 0 "[ . 1 . 2]" 1
820 1 47 ARG H 1 47 ARG QB . . 3.310 2.479 2.258 2.727 . 0 0 "[ . 1 . 2]" 1
821 1 47 ARG H 1 47 ARG HB3 . . 3.790 3.044 2.392 3.729 . 0 0 "[ . 1 . 2]" 1
822 1 47 ARG H 1 47 ARG HD2 . . 4.900 3.809 1.983 4.955 0.055 6 0 "[ . 1 . 2]" 1
823 1 47 ARG H 1 47 ARG HD3 . . 4.900 4.067 3.138 4.722 . 0 0 "[ . 1 . 2]" 1
824 1 47 ARG H 1 47 ARG HG2 . . 4.170 2.954 2.212 4.219 0.049 19 0 "[ . 1 . 2]" 1
825 1 47 ARG H 1 47 ARG QG . . 3.660 2.621 2.180 3.666 0.006 12 0 "[ . 1 . 2]" 1
826 1 47 ARG H 1 47 ARG HG3 . . 4.170 3.465 2.382 4.117 . 0 0 "[ . 1 . 2]" 1
827 1 47 ARG H 1 48 GLN H . . 3.500 2.453 2.312 2.647 . 0 0 "[ . 1 . 2]" 1
828 1 47 ARG H 1 49 GLU H . . 5.260 4.099 3.770 4.443 . 0 0 "[ . 1 . 2]" 1
829 1 47 ARG H 1 52 VAL QG . . 5.440 4.698 4.315 5.367 . 0 0 "[ . 1 . 2]" 1
830 1 47 ARG H 1 54 ILE MG . . 5.250 4.594 3.722 5.262 0.012 7 0 "[ . 1 . 2]" 1
831 1 47 ARG HA 1 47 ARG QD . . 4.710 3.952 2.424 4.590 . 0 0 "[ . 1 . 2]" 1
832 1 47 ARG HA 1 47 ARG QG . . 3.670 3.062 2.387 3.410 . 0 0 "[ . 1 . 2]" 1
833 1 47 ARG HA 1 52 VAL H . . 3.950 3.077 2.685 3.401 . 0 0 "[ . 1 . 2]" 1
834 1 47 ARG HA 1 52 VAL QG . . 3.530 2.496 2.061 3.131 . 0 0 "[ . 1 . 2]" 1
835 1 47 ARG QB 1 47 ARG QD . . 3.220 2.385 2.165 2.997 . 0 0 "[ . 1 . 2]" 1
836 1 47 ARG QB 1 48 GLN H . . 4.180 3.201 2.463 3.654 . 0 0 "[ . 1 . 2]" 1
837 1 47 ARG QB 1 53 SER HA . . 3.390 3.044 2.342 3.543 0.153 16 0 "[ . 1 . 2]" 1
838 1 47 ARG QB 1 53 SER QB . . 4.760 4.707 4.004 5.030 0.270 16 0 "[ . 1 . 2]" 1
839 1 47 ARG QB 1 54 ILE MG . . 4.260 3.004 1.982 4.092 . 0 0 "[ . 1 . 2]" 1
840 1 47 ARG QD 1 48 GLN H . . 4.880 4.393 4.004 4.903 0.023 10 0 "[ . 1 . 2]" 1
841 1 47 ARG QD 1 54 ILE MD . . 5.150 4.313 2.197 5.187 0.037 11 0 "[ . 1 . 2]" 1
842 1 47 ARG QD 1 54 ILE MG . . 4.110 2.265 1.566 2.934 . 0 0 "[ . 1 . 2]" 1
843 1 47 ARG QG 1 48 GLN H . . 4.910 3.259 2.246 4.767 . 0 0 "[ . 1 . 2]" 1
844 1 47 ARG QG 1 54 ILE MG . . 4.340 3.042 2.184 3.844 . 0 0 "[ . 1 . 2]" 1
845 1 47 ARG HG2 1 53 SER HA . . 5.200 4.496 2.654 5.442 0.242 15 0 "[ . 1 . 2]" 1
846 1 47 ARG HG3 1 53 SER HA . . 5.200 4.178 2.644 5.008 . 0 0 "[ . 1 . 2]" 1
847 1 48 GLN H 1 48 GLN HB2 . . 3.500 2.525 2.403 2.712 . 0 0 "[ . 1 . 2]" 1
848 1 48 GLN H 1 48 GLN HB3 . . 2.780 2.436 2.295 2.541 . 0 0 "[ . 1 . 2]" 1
849 1 48 GLN H 1 48 GLN HG2 . . 4.730 4.449 4.361 4.516 . 0 0 "[ . 1 . 2]" 1
850 1 48 GLN H 1 48 GLN QG . . 4.030 3.984 3.936 4.081 0.051 19 0 "[ . 1 . 2]" 1
851 1 48 GLN H 1 48 GLN HG3 . . 4.730 4.498 4.412 4.653 . 0 0 "[ . 1 . 2]" 1
852 1 48 GLN H 1 49 GLU H . . 3.410 2.586 2.400 2.756 . 0 0 "[ . 1 . 2]" 1
853 1 48 GLN H 1 49 GLU HB2 . . 4.780 4.747 4.506 4.864 0.084 7 0 "[ . 1 . 2]" 1
854 1 48 GLN H 1 50 SER H . . 4.460 4.092 3.825 4.361 . 0 0 "[ . 1 . 2]" 1
855 1 48 GLN H 1 52 VAL H . . 5.120 5.165 4.789 5.329 0.209 12 0 "[ . 1 . 2]" 1
856 1 48 GLN HA 1 48 GLN HG2 . . 3.400 3.121 2.646 3.240 . 0 0 "[ . 1 . 2]" 1
857 1 48 GLN HA 1 48 GLN HG3 . . 3.400 2.762 2.601 3.669 0.269 19 0 "[ . 1 . 2]" 1
858 1 48 GLN HB3 1 48 GLN HE21 . . 4.700 2.004 1.735 2.682 . 0 0 "[ . 1 . 2]" 1
859 1 48 GLN HB3 1 48 GLN QE . . 3.990 1.989 1.729 2.632 . 0 0 "[ . 1 . 2]" 1
860 1 48 GLN HB3 1 48 GLN HE22 . . 4.700 3.518 3.335 3.813 . 0 0 "[ . 1 . 2]" 1
861 1 48 GLN HB3 1 49 GLU H . . 3.850 2.476 2.235 2.799 . 0 0 "[ . 1 . 2]" 1
862 1 48 GLN HB3 1 49 GLU QG . . 4.320 3.170 2.820 3.574 . 0 0 "[ . 1 . 2]" 1
863 1 48 GLN QG 1 49 GLU H . . 5.120 3.624 3.286 4.156 . 0 0 "[ . 1 . 2]" 1
864 1 49 GLU H 1 49 GLU HB2 . . 3.580 2.470 2.358 2.575 . 0 0 "[ . 1 . 2]" 1
865 1 49 GLU H 1 49 GLU HB3 . . 3.900 3.608 3.573 3.649 . 0 0 "[ . 1 . 2]" 1
866 1 49 GLU H 1 49 GLU QG . . 3.280 2.361 2.139 2.501 . 0 0 "[ . 1 . 2]" 1
867 1 49 GLU HA 1 49 GLU QG . . 3.050 2.982 2.470 3.134 0.084 1 0 "[ . 1 . 2]" 1
868 1 49 GLU HB2 1 50 SER H . . 3.770 2.576 2.287 3.000 . 0 0 "[ . 1 . 2]" 1
869 1 49 GLU HB3 1 50 SER H . . 3.640 3.588 3.341 3.836 0.196 6 0 "[ . 1 . 2]" 1
870 1 50 SER H 1 50 SER HB2 . . 4.080 2.551 2.423 2.706 . 0 0 "[ . 1 . 2]" 1
871 1 50 SER H 1 50 SER QB . . 3.580 2.417 2.275 2.561 . 0 0 "[ . 1 . 2]" 1
872 1 50 SER H 1 50 SER HB3 . . 4.080 3.240 2.466 3.718 . 0 0 "[ . 1 . 2]" 1
873 1 50 SER H 1 51 LYS H . . 3.280 2.504 2.304 2.639 . 0 0 "[ . 1 . 2]" 1
874 1 50 SER H 1 52 VAL H . . 4.520 4.129 3.932 4.542 0.022 16 0 "[ . 1 . 2]" 1
875 1 50 SER H 1 52 VAL QG . . 4.150 3.828 3.583 4.041 . 0 0 "[ . 1 . 2]" 1
876 1 50 SER H 1 74 VAL QG . . 5.440 4.228 3.971 4.546 . 0 0 "[ . 1 . 2]" 1
877 1 50 SER HA 1 51 LYS QD . . 5.340 4.773 2.573 5.498 0.158 14 0 "[ . 1 . 2]" 1
878 1 50 SER HA 1 51 LYS HG2 . . 5.390 3.985 3.370 5.655 0.265 6 0 "[ . 1 . 2]" 1
879 1 50 SER HA 1 51 LYS QG . . 4.620 3.795 3.323 4.777 0.157 9 0 "[ . 1 . 2]" 1
880 1 50 SER HA 1 51 LYS HG3 . . 5.390 5.215 4.765 5.486 0.096 19 0 "[ . 1 . 2]" 1
881 1 50 SER QB 1 51 LYS H . . 4.050 3.358 3.190 3.487 . 0 0 "[ . 1 . 2]" 1
882 1 50 SER QB 1 51 LYS QG . . 5.180 4.953 4.623 5.554 0.374 9 0 "[ . 1 . 2]" 1
883 1 50 SER QB 1 52 VAL H . . 4.160 3.343 2.715 4.164 0.004 11 0 "[ . 1 . 2]" 1
884 1 50 SER QB 1 52 VAL HB . . 4.390 4.105 3.372 4.603 0.213 1 0 "[ . 1 . 2]" 1
885 1 50 SER QB 1 52 VAL QG . . 3.410 1.980 1.750 2.420 . 0 0 "[ . 1 . 2]" 1
886 1 50 SER QB 1 74 VAL QG . . 3.010 2.337 1.983 2.701 . 0 0 "[ . 1 . 2]" 1
887 1 50 SER QB 1 78 LYS QD . . 4.350 3.178 1.979 4.463 0.113 5 0 "[ . 1 . 2]" 1
888 1 50 SER HB2 1 78 LYS QE . . 5.080 4.473 3.276 5.256 0.176 15 0 "[ . 1 . 2]" 1
889 1 50 SER HB3 1 78 LYS QE . . 5.080 3.552 1.980 5.071 . 0 0 "[ . 1 . 2]" 1
890 1 51 LYS H 1 51 LYS HD2 . . 4.590 3.806 2.630 4.618 0.028 14 0 "[ . 1 . 2]" 1
891 1 51 LYS H 1 51 LYS QD . . 3.910 2.841 2.367 3.352 . 0 0 "[ . 1 . 2]" 1
892 1 51 LYS H 1 51 LYS HD3 . . 4.590 3.416 2.385 4.568 . 0 0 "[ . 1 . 2]" 1
893 1 51 LYS H 1 51 LYS HG2 . . 4.390 3.171 2.853 4.465 0.075 9 0 "[ . 1 . 2]" 1
894 1 51 LYS H 1 51 LYS QG . . 3.620 2.932 2.819 3.204 . 0 0 "[ . 1 . 2]" 1
895 1 51 LYS H 1 51 LYS HG3 . . 4.390 4.229 3.036 4.455 0.065 13 0 "[ . 1 . 2]" 1
896 1 51 LYS H 1 52 VAL H . . 3.700 2.728 2.624 2.879 . 0 0 "[ . 1 . 2]" 1
897 1 51 LYS H 1 52 VAL QG . . 4.570 3.650 3.320 3.834 . 0 0 "[ . 1 . 2]" 1
898 1 51 LYS HA 1 51 LYS QD . . 3.520 2.349 2.006 3.511 . 0 0 "[ . 1 . 2]" 1
899 1 51 LYS HA 1 51 LYS QE . . 4.460 3.802 2.662 4.478 0.018 2 0 "[ . 1 . 2]" 1
900 1 51 LYS HA 1 51 LYS HG2 . . 4.000 3.282 3.053 3.676 . 0 0 "[ . 1 . 2]" 1
901 1 51 LYS HA 1 51 LYS QG . . 3.240 2.967 2.405 3.168 . 0 0 "[ . 1 . 2]" 1
902 1 51 LYS HA 1 51 LYS HG3 . . 4.000 3.637 2.443 3.909 . 0 0 "[ . 1 . 2]" 1
903 1 51 LYS HA 1 52 VAL H . . 3.270 2.816 2.422 3.000 . 0 0 "[ . 1 . 2]" 1
904 1 51 LYS QD 1 52 VAL H . . 5.040 4.619 4.285 4.890 . 0 0 "[ . 1 . 2]" 1
905 1 51 LYS QE 1 51 LYS HG2 . . 3.920 2.851 2.399 3.573 . 0 0 "[ . 1 . 2]" 1
906 1 51 LYS QE 1 51 LYS QG . . 3.370 2.431 2.178 2.878 . 0 0 "[ . 1 . 2]" 1
907 1 51 LYS QE 1 51 LYS HG3 . . 3.920 2.790 2.413 3.374 . 0 0 "[ . 1 . 2]" 1
908 1 51 LYS QG 1 52 VAL H . . 4.830 4.761 4.603 4.905 0.075 11 0 "[ . 1 . 2]" 1
909 1 52 VAL H 1 52 VAL HB . . 3.580 3.395 2.890 3.851 0.271 18 0 "[ . 1 . 2]" 1
910 1 52 VAL H 1 52 VAL MG1 . . 3.990 2.719 2.136 4.016 0.026 16 0 "[ . 1 . 2]" 1
911 1 52 VAL H 1 52 VAL QG . . 3.080 2.213 1.953 2.505 . 0 0 "[ . 1 . 2]" 1
912 1 52 VAL H 1 52 VAL MG2 . . 3.990 3.103 1.981 4.057 0.067 20 0 "[ . 1 . 2]" 1
913 1 52 VAL H 1 53 SER H . . 4.750 4.429 4.286 4.520 . 0 0 "[ . 1 . 2]" 1
914 1 52 VAL HA 1 52 VAL MG1 . . 3.500 2.823 2.325 3.293 . 0 0 "[ . 1 . 2]" 1
915 1 52 VAL HA 1 52 VAL QG . . 3.010 2.323 2.209 2.388 . 0 0 "[ . 1 . 2]" 1
916 1 52 VAL HA 1 52 VAL MG2 . . 3.500 2.784 2.379 3.287 . 0 0 "[ . 1 . 2]" 1
917 1 52 VAL HA 1 53 SER H . . 3.070 2.303 2.177 2.426 . 0 0 "[ . 1 . 2]" 1
918 1 52 VAL HA 1 78 LYS QD . . 5.240 4.883 3.926 5.530 0.290 12 0 "[ . 1 . 2]" 1
919 1 52 VAL HB 1 53 SER H . . 4.090 3.430 2.294 4.162 0.072 13 0 "[ . 1 . 2]" 1
920 1 52 VAL QG 1 53 SER H . . 3.400 2.669 2.110 3.294 . 0 0 "[ . 1 . 2]" 1
921 1 52 VAL QG 1 53 SER QB . . 4.490 4.201 3.620 4.631 0.141 1 0 "[ . 1 . 2]" 1
922 1 52 VAL QG 1 54 ILE H . . 5.140 4.279 3.017 5.208 0.068 18 0 "[ . 1 . 2]" 1
923 1 52 VAL QG 1 78 LYS QE . . 3.630 2.879 1.922 3.573 . 0 0 "[ . 1 . 2]" 1
924 1 52 VAL MG1 1 53 SER H . . 4.220 3.570 2.146 4.052 . 0 0 "[ . 1 . 2]" 1
925 1 52 VAL MG1 1 78 LYS QE . . 4.390 3.143 1.976 4.551 0.161 11 0 "[ . 1 . 2]" 1
926 1 52 VAL MG2 1 53 SER H . . 4.220 3.024 2.125 4.250 0.030 11 0 "[ . 1 . 2]" 1
927 1 52 VAL MG2 1 78 LYS QE . . 4.390 3.704 2.613 4.505 0.115 1 0 "[ . 1 . 2]" 1
928 1 53 SER H 1 53 SER HB2 . . 3.760 3.064 2.491 3.688 . 0 0 "[ . 1 . 2]" 1
929 1 53 SER H 1 53 SER HB3 . . 3.760 3.208 2.617 3.742 . 0 0 "[ . 1 . 2]" 1
930 1 53 SER HA 1 54 ILE HB . . 4.780 4.481 4.055 4.738 . 0 0 "[ . 1 . 2]" 1
931 1 53 SER HA 1 54 ILE MG . . 4.070 3.570 3.309 3.856 . 0 0 "[ . 1 . 2]" 1
932 1 54 ILE H 1 54 ILE MD . . 4.920 4.733 4.494 4.827 . 0 0 "[ . 1 . 2]" 1
933 1 54 ILE HA 1 54 ILE MD . . 3.890 3.881 3.738 3.955 0.065 4 0 "[ . 1 . 2]" 1
934 1 54 ILE HA 1 54 ILE HG12 . . 4.090 3.146 3.014 3.275 . 0 0 "[ . 1 . 2]" 1
935 1 54 ILE HA 1 54 ILE QG . . 3.490 2.463 2.294 2.574 . 0 0 "[ . 1 . 2]" 1
936 1 54 ILE HA 1 54 ILE HG13 . . 4.090 2.574 2.359 2.712 . 0 0 "[ . 1 . 2]" 1
937 1 54 ILE HA 1 54 ILE MG . . 3.260 3.261 3.240 3.278 0.018 16 0 "[ . 1 . 2]" 1
938 1 54 ILE HA 1 55 GLY H . . 2.990 2.268 2.206 2.314 . 0 0 "[ . 1 . 2]" 1
939 1 54 ILE HB 1 55 GLY H . . 4.970 4.066 3.990 4.143 . 0 0 "[ . 1 . 2]" 1
940 1 54 ILE MD 1 55 GLY H . . 3.980 4.030 3.974 4.113 0.133 3 0 "[ . 1 . 2]" 1
941 1 54 ILE MD 1 55 GLY HA2 . . 5.500 5.502 5.317 5.600 0.100 15 0 "[ . 1 . 2]" 1
942 1 54 ILE MD 1 55 GLY QA . . 4.840 4.844 4.731 4.913 0.073 9 0 "[ . 1 . 2]" 1
943 1 54 ILE MD 1 55 GLY HA3 . . 5.500 5.386 5.176 5.601 0.101 6 0 "[ . 1 . 2]" 1
944 1 54 ILE MD 1 58 GLU H . . 4.390 4.175 3.763 4.400 0.010 14 0 "[ . 1 . 2]" 1
945 1 54 ILE MD 1 58 GLU QB . . 3.410 2.182 1.940 2.415 . 0 0 "[ . 1 . 2]" 1
946 1 54 ILE MD 1 59 ILE H . . 3.350 3.354 2.929 3.514 0.164 17 0 "[ . 1 . 2]" 1
947 1 54 ILE MD 1 64 PHE QE . . 4.690 3.259 2.833 3.557 . 0 0 "[ . 1 . 2]" 1
948 1 54 ILE MD 1 64 PHE HZ . . 4.430 3.009 2.237 3.800 . 0 0 "[ . 1 . 2]" 1
949 1 54 ILE QG 1 55 GLY H . . 4.360 2.352 2.303 2.441 . 0 0 "[ . 1 . 2]" 1
950 1 54 ILE HG12 1 55 GLY H . . 5.120 2.587 2.446 2.839 . 0 0 "[ . 1 . 2]" 1
951 1 54 ILE HG13 1 55 GLY H . . 5.120 2.724 2.582 2.900 . 0 0 "[ . 1 . 2]" 1
952 1 54 ILE MG 1 55 GLY H . . 4.040 3.855 3.689 4.042 0.002 3 0 "[ . 1 . 2]" 1
953 1 54 ILE MG 1 55 GLY QA . . 5.340 4.075 3.600 4.334 . 0 0 "[ . 1 . 2]" 1
954 1 54 ILE MG 1 58 GLU H . . 5.500 5.504 5.155 5.788 0.288 3 0 "[ . 1 . 2]" 1
955 1 54 ILE MG 1 59 ILE H . . 5.230 4.731 4.282 5.129 . 0 0 "[ . 1 . 2]" 1
956 1 54 ILE MG 1 64 PHE HZ . . 4.520 4.247 3.594 4.878 0.358 7 0 "[ . 1 . 2]" 1
957 1 55 GLY H 1 58 GLU H . . 4.760 4.133 3.650 4.567 . 0 0 "[ . 1 . 2]" 1
958 1 55 GLY H 1 58 GLU QB . . 4.190 3.329 2.917 3.755 . 0 0 "[ . 1 . 2]" 1
959 1 55 GLY H 1 58 GLU QG . . 4.660 3.492 2.845 4.414 . 0 0 "[ . 1 . 2]" 1
960 1 55 GLY H 1 77 LEU MD2 . . 5.500 4.186 2.963 5.441 . 0 0 "[ . 1 . 2]" 1
961 1 55 GLY QA 1 56 MET H . . 3.060 2.228 2.162 2.301 . 0 0 "[ . 1 . 2]" 1
962 1 55 GLY QA 1 56 MET QB . . 4.800 4.144 3.754 4.322 . 0 0 "[ . 1 . 2]" 1
963 1 55 GLY QA 1 56 MET QG . . 4.730 3.982 3.571 5.227 0.497 3 0 "[ . 1 . 2]" 1
964 1 55 GLY QA 1 58 GLU QG . . 5.070 3.828 2.888 5.127 0.057 13 0 "[ . 1 . 2]" 1
965 1 56 MET H 1 56 MET QB . . 3.260 2.389 2.061 2.596 . 0 0 "[ . 1 . 2]" 1
966 1 56 MET H 1 56 MET HG2 . . 4.520 2.849 2.132 4.538 0.018 10 0 "[ . 1 . 2]" 1
967 1 56 MET H 1 56 MET QG . . 3.700 2.587 2.118 3.901 0.201 3 0 "[ . 1 . 2]" 1
968 1 56 MET H 1 56 MET HG3 . . 4.520 3.610 2.270 4.332 . 0 0 "[ . 1 . 2]" 1
969 1 56 MET H 1 59 ILE MD . . 4.840 3.895 3.427 4.450 . 0 0 "[ . 1 . 2]" 1
970 1 56 MET HA 1 56 MET ME . . 3.950 3.112 2.191 4.287 0.337 10 0 "[ . 1 . 2]" 1
971 1 56 MET HA 1 56 MET HG2 . . 4.020 2.979 2.344 3.979 . 0 0 "[ . 1 . 2]" 1
972 1 56 MET HA 1 56 MET HG3 . . 4.020 3.558 2.307 3.822 . 0 0 "[ . 1 . 2]" 1
973 1 56 MET HA 1 59 ILE H . . 3.730 3.135 2.634 3.408 . 0 0 "[ . 1 . 2]" 1
974 1 56 MET HA 1 59 ILE HB . . 4.130 2.433 1.753 3.111 . 0 0 "[ . 1 . 2]" 1
975 1 56 MET HA 1 59 ILE MD . . 3.120 2.107 1.847 2.460 . 0 0 "[ . 1 . 2]" 1
976 1 56 MET HA 1 59 ILE HG12 . . 4.440 3.984 3.699 4.259 . 0 0 "[ . 1 . 2]" 1
977 1 56 MET HA 1 59 ILE HG13 . . 4.440 2.554 2.175 2.876 . 0 0 "[ . 1 . 2]" 1
978 1 56 MET HA 1 59 ILE MG . . 4.260 3.790 3.386 4.281 0.021 5 0 "[ . 1 . 2]" 1
979 1 56 MET QB 1 57 GLN H . . 4.110 3.071 2.795 3.331 . 0 0 "[ . 1 . 2]" 1
980 1 56 MET ME 1 56 MET QG . . 3.290 2.415 2.176 2.569 . 0 0 "[ . 1 . 2]" 1
981 1 56 MET ME 1 59 ILE MG . . 4.190 3.143 2.184 4.335 0.145 18 0 "[ . 1 . 2]" 1
982 1 56 MET QG 1 59 ILE MD . . 4.610 3.071 2.010 4.079 . 0 0 "[ . 1 . 2]" 1
983 1 57 GLN H 1 57 GLN HG2 . . 5.500 3.414 1.956 4.664 . 0 0 "[ . 1 . 2]" 1
984 1 57 GLN H 1 57 GLN HG3 . . 5.500 3.197 2.034 4.553 . 0 0 "[ . 1 . 2]" 1
985 1 57 GLN H 1 58 GLU H . . 4.180 2.559 2.341 2.718 . 0 0 "[ . 1 . 2]" 1
986 1 57 GLN HA 1 57 GLN QB . . 2.680 2.357 2.193 2.421 . 0 0 "[ . 1 . 2]" 1
987 1 57 GLN HA 1 57 GLN QG . . 3.700 2.760 2.445 3.405 . 0 0 "[ . 1 . 2]" 1
988 1 57 GLN HA 1 59 ILE H . . 4.700 4.299 4.063 4.601 . 0 0 "[ . 1 . 2]" 1
989 1 57 GLN QB 1 58 GLU H . . 4.420 2.847 2.548 3.574 . 0 0 "[ . 1 . 2]" 1
990 1 58 GLU H 1 58 GLU HB2 . . 4.200 2.541 2.366 2.692 . 0 0 "[ . 1 . 2]" 1
991 1 58 GLU H 1 58 GLU QB . . 3.340 2.495 2.335 2.629 . 0 0 "[ . 1 . 2]" 1
992 1 58 GLU H 1 58 GLU HB3 . . 4.200 3.649 3.581 3.715 . 0 0 "[ . 1 . 2]" 1
993 1 58 GLU H 1 58 GLU QG . . 3.130 2.537 2.197 3.384 0.254 5 0 "[ . 1 . 2]" 1
994 1 58 GLU H 1 59 ILE H . . 3.200 2.289 2.086 2.376 . 0 0 "[ . 1 . 2]" 1
995 1 58 GLU H 1 59 ILE HA . . 5.300 4.986 4.802 5.078 . 0 0 "[ . 1 . 2]" 1
996 1 58 GLU H 1 59 ILE HB . . 4.760 4.616 4.330 4.838 0.078 18 0 "[ . 1 . 2]" 1
997 1 58 GLU H 1 59 ILE MD . . 4.990 4.953 4.716 5.078 0.088 10 0 "[ . 1 . 2]" 1
998 1 58 GLU HA 1 58 GLU QG . . 3.540 2.846 2.509 3.168 . 0 0 "[ . 1 . 2]" 1
999 1 58 GLU HA 1 63 ASN QD . . 4.980 3.212 2.714 4.264 . 0 0 "[ . 1 . 2]" 1
1000 1 58 GLU QB 1 59 ILE H . . 4.110 2.936 2.809 3.131 . 0 0 "[ . 1 . 2]" 1
1001 1 58 GLU QB 1 59 ILE HA . . 4.610 4.128 3.964 4.317 . 0 0 "[ . 1 . 2]" 1
1002 1 58 GLU QB 1 63 ASN QD . . 4.630 3.510 2.940 4.096 . 0 0 "[ . 1 . 2]" 1
1003 1 59 ILE H 1 59 ILE HB . . 3.230 2.601 2.500 2.754 . 0 0 "[ . 1 . 2]" 1
1004 1 59 ILE H 1 59 ILE MD . . 3.930 3.692 3.603 3.756 . 0 0 "[ . 1 . 2]" 1
1005 1 59 ILE H 1 59 ILE HG12 . . 4.250 3.355 3.254 3.474 . 0 0 "[ . 1 . 2]" 1
1006 1 59 ILE H 1 59 ILE QG . . 3.640 2.155 2.060 2.230 . 0 0 "[ . 1 . 2]" 1
1007 1 59 ILE H 1 59 ILE HG13 . . 4.250 2.182 2.083 2.258 . 0 0 "[ . 1 . 2]" 1
1008 1 59 ILE H 1 59 ILE MG . . 3.930 3.831 3.757 3.867 . 0 0 "[ . 1 . 2]" 1
1009 1 59 ILE HA 1 59 ILE MD . . 3.850 3.884 3.832 3.938 0.088 9 0 "[ . 1 . 2]" 1
1010 1 59 ILE HA 1 59 ILE HG12 . . 4.160 2.615 2.504 2.751 . 0 0 "[ . 1 . 2]" 1
1011 1 59 ILE HA 1 59 ILE HG13 . . 4.160 3.173 3.054 3.295 . 0 0 "[ . 1 . 2]" 1
1012 1 59 ILE HA 1 59 ILE MG . . 3.300 2.434 2.345 2.519 . 0 0 "[ . 1 . 2]" 1
1013 1 59 ILE HA 1 60 HIS H . . 3.070 2.279 2.150 2.392 . 0 0 "[ . 1 . 2]" 1
1014 1 59 ILE HA 1 63 ASN QB . . 5.270 4.585 4.154 4.966 . 0 0 "[ . 1 . 2]" 1
1015 1 59 ILE HA 1 64 PHE QE . . 3.460 2.465 1.902 2.954 . 0 0 "[ . 1 . 2]" 1
1016 1 59 ILE HA 1 64 PHE HZ . . 4.720 3.885 2.840 4.643 . 0 0 "[ . 1 . 2]" 1
1017 1 59 ILE HB 1 59 ILE MD . . 2.990 2.493 2.430 2.555 . 0 0 "[ . 1 . 2]" 1
1018 1 59 ILE HB 1 60 HIS H . . 4.570 4.465 4.349 4.533 . 0 0 "[ . 1 . 2]" 1
1019 1 59 ILE MD 1 59 ILE MG . . 2.840 1.991 1.929 2.040 . 0 0 "[ . 1 . 2]" 1
1020 1 59 ILE MD 1 64 PHE HZ . . 5.500 5.139 4.594 5.582 0.082 6 0 "[ . 1 . 2]" 1
1021 1 59 ILE QG 1 59 ILE MG . . 3.240 2.417 2.324 2.490 . 0 0 "[ . 1 . 2]" 1
1022 1 59 ILE QG 1 60 HIS H . . 4.750 4.481 4.360 4.622 . 0 0 "[ . 1 . 2]" 1
1023 1 59 ILE MG 1 60 HIS H . . 3.630 3.537 3.186 3.721 0.091 15 0 "[ . 1 . 2]" 1
1024 1 59 ILE MG 1 60 HIS QB . . 5.140 4.785 4.510 5.038 . 0 0 "[ . 1 . 2]" 1
1025 1 59 ILE MG 1 64 PHE HB2 . . 5.500 5.633 5.505 5.754 0.254 17 0 "[ . 1 . 2]" 1
1026 1 60 HIS H 1 60 HIS QB . . 3.680 2.858 2.576 3.309 . 0 0 "[ . 1 . 2]" 1
1027 1 60 HIS H 1 61 PRO HD3 . . 5.090 4.857 4.577 5.021 . 0 0 "[ . 1 . 2]" 1
1028 1 60 HIS H 1 63 ASN QB . . 4.170 3.151 2.783 3.644 . 0 0 "[ . 1 . 2]" 1
1029 1 60 HIS H 1 63 ASN QD . . 4.720 3.640 2.748 4.763 0.043 11 0 "[ . 1 . 2]" 1
1030 1 60 HIS H 1 64 PHE HB2 . . 5.500 5.179 4.770 5.506 0.006 11 0 "[ . 1 . 2]" 1
1031 1 60 HIS HA 1 61 PRO HD2 . . 3.090 2.290 1.958 2.737 . 0 0 "[ . 1 . 2]" 1
1032 1 60 HIS HA 1 61 PRO HD3 . . 3.120 2.480 2.353 2.641 . 0 0 "[ . 1 . 2]" 1
1033 1 60 HIS QB 1 60 HIS HD2 . . 2.990 2.696 2.604 2.928 . 0 0 "[ . 1 . 2]" 1
1034 1 60 HIS QB 1 61 PRO HA . . 4.780 4.773 4.562 5.089 0.309 18 0 "[ . 1 . 2]" 1
1035 1 60 HIS QB 1 61 PRO HD2 . . 3.450 2.883 2.071 3.405 . 0 0 "[ . 1 . 2]" 1
1036 1 60 HIS QB 1 61 PRO HD3 . . 4.100 4.006 3.257 4.380 0.280 18 0 "[ . 1 . 2]" 1
1037 1 60 HIS QB 1 61 PRO HG2 . . 4.630 4.336 3.816 4.856 0.226 2 0 "[ . 1 . 2]" 1
1038 1 60 HIS QB 1 63 ASN H . . 4.710 3.177 2.146 4.587 . 0 0 "[ . 1 . 2]" 1
1039 1 60 HIS HD2 1 61 PRO HD2 . . 4.350 3.514 2.352 4.396 0.046 1 0 "[ . 1 . 2]" 1
1040 1 60 HIS HD2 1 61 PRO HD3 . . 5.500 5.099 4.012 5.624 0.124 11 0 "[ . 1 . 2]" 1
1041 1 60 HIS HD2 1 61 PRO HG2 . . 5.340 4.413 3.385 5.351 0.011 13 0 "[ . 1 . 2]" 1
1042 1 60 HIS HD2 1 62 ALA HA . . 5.190 5.014 4.133 5.543 0.353 7 0 "[ . 1 . 2]" 1
1043 1 61 PRO HA 1 63 ASN H . . 4.560 4.030 3.791 4.409 . 0 0 "[ . 1 . 2]" 1
1044 1 61 PRO HA 1 64 PHE H . . 4.000 2.944 2.576 3.449 . 0 0 "[ . 1 . 2]" 1
1045 1 61 PRO HA 1 64 PHE HB3 . . 4.330 3.782 3.435 4.331 0.001 2 0 "[ . 1 . 2]" 1
1046 1 61 PRO HA 1 64 PHE QD . . 4.160 3.409 2.905 4.063 . 0 0 "[ . 1 . 2]" 1
1047 1 61 PRO HA 1 65 ALA H . . 4.680 4.691 4.347 4.842 0.162 13 0 "[ . 1 . 2]" 1
1048 1 62 ALA H 1 63 ASN H . . 4.660 2.706 2.581 2.809 . 0 0 "[ . 1 . 2]" 1
1049 1 62 ALA HA 1 65 ALA H . . 4.230 4.143 3.674 4.339 0.109 7 0 "[ . 1 . 2]" 1
1050 1 62 ALA HA 1 65 ALA MB . . 3.280 2.907 2.252 3.235 . 0 0 "[ . 1 . 2]" 1
1051 1 62 ALA MB 1 63 ASN H . . 3.300 2.659 2.503 2.890 . 0 0 "[ . 1 . 2]" 1
1052 1 62 ALA MB 1 63 ASN QB . . 4.990 4.263 4.075 4.524 . 0 0 "[ . 1 . 2]" 1
1053 1 63 ASN H 1 63 ASN HB2 . . 3.860 2.459 2.343 2.585 . 0 0 "[ . 1 . 2]" 1
1054 1 63 ASN H 1 63 ASN QB . . 3.190 2.421 2.314 2.532 . 0 0 "[ . 1 . 2]" 1
1055 1 63 ASN H 1 63 ASN HB3 . . 3.860 3.627 3.588 3.663 . 0 0 "[ . 1 . 2]" 1
1056 1 63 ASN H 1 63 ASN QD . . 5.130 3.937 3.497 4.351 . 0 0 "[ . 1 . 2]" 1
1057 1 63 ASN HA 1 65 ALA H . . 4.540 3.686 3.612 3.827 . 0 0 "[ . 1 . 2]" 1
1058 1 63 ASN HA 1 65 ALA MB . . 4.790 4.298 4.213 4.450 . 0 0 "[ . 1 . 2]" 1
1059 1 63 ASN HA 1 69 SER QB . . 3.870 3.526 2.812 3.964 0.094 3 0 "[ . 1 . 2]" 1
1060 1 63 ASN HA 1 73 LEU MD1 . . 5.500 4.669 4.104 5.133 . 0 0 "[ . 1 . 2]" 1
1061 1 63 ASN HA 1 73 LEU MD2 . . 4.250 4.080 3.808 4.280 0.030 19 0 "[ . 1 . 2]" 1
1062 1 63 ASN QB 1 73 LEU QB . . 4.150 2.494 1.895 2.848 . 0 0 "[ . 1 . 2]" 1
1063 1 63 ASN QB 1 73 LEU MD1 . . 3.610 2.635 1.988 3.113 . 0 0 "[ . 1 . 2]" 1
1064 1 63 ASN HB2 1 73 LEU MD1 . . 4.170 3.563 3.002 4.110 . 0 0 "[ . 1 . 2]" 1
1065 1 63 ASN HB2 1 73 LEU MD2 . . 4.310 2.463 2.211 2.629 . 0 0 "[ . 1 . 2]" 1
1066 1 63 ASN HB3 1 73 LEU MD1 . . 4.170 2.720 2.018 3.255 . 0 0 "[ . 1 . 2]" 1
1067 1 63 ASN HB3 1 73 LEU MD2 . . 4.310 1.897 1.676 2.232 . 0 0 "[ . 1 . 2]" 1
1068 1 63 ASN QD 1 73 LEU MD2 . . 3.840 2.834 2.193 3.532 . 0 0 "[ . 1 . 2]" 1
1069 1 64 PHE H 1 64 PHE HB2 . . 3.840 2.430 2.382 2.503 . 0 0 "[ . 1 . 2]" 1
1070 1 64 PHE H 1 64 PHE HB3 . . 3.810 3.651 3.625 3.686 . 0 0 "[ . 1 . 2]" 1
1071 1 64 PHE H 1 64 PHE QE . . 5.500 4.648 4.442 4.856 . 0 0 "[ . 1 . 2]" 1
1072 1 64 PHE H 1 65 ALA H . . 3.270 2.658 2.522 2.811 . 0 0 "[ . 1 . 2]" 1
1073 1 64 PHE H 1 65 ALA MB . . 4.260 4.092 3.935 4.247 . 0 0 "[ . 1 . 2]" 1
1074 1 64 PHE H 1 66 THR H . . 5.040 5.003 4.864 5.165 0.125 7 0 "[ . 1 . 2]" 1
1075 1 64 PHE H 1 70 MET HB2 . . 5.500 5.392 5.106 5.559 0.059 1 0 "[ . 1 . 2]" 1
1076 1 64 PHE H 1 70 MET HB3 . . 4.950 4.730 4.541 4.845 . 0 0 "[ . 1 . 2]" 1
1077 1 64 PHE HA 1 64 PHE QD . . 3.480 3.162 3.071 3.223 . 0 0 "[ . 1 . 2]" 1
1078 1 64 PHE HA 1 70 MET H . . 4.460 3.696 3.525 3.999 . 0 0 "[ . 1 . 2]" 1
1079 1 64 PHE HA 1 70 MET HB2 . . 4.030 3.018 2.899 3.129 . 0 0 "[ . 1 . 2]" 1
1080 1 64 PHE HA 1 70 MET HB3 . . 4.050 1.877 1.763 1.968 . 0 0 "[ . 1 . 2]" 1
1081 1 64 PHE HA 1 70 MET ME . . 3.580 2.461 2.223 2.671 . 0 0 "[ . 1 . 2]" 1
1082 1 64 PHE HA 1 70 MET HG2 . . 4.990 4.218 4.071 4.346 . 0 0 "[ . 1 . 2]" 1
1083 1 64 PHE HA 1 70 MET QG . . 4.340 3.975 3.842 4.075 . 0 0 "[ . 1 . 2]" 1
1084 1 64 PHE HA 1 70 MET HG3 . . 4.990 4.862 4.712 4.935 . 0 0 "[ . 1 . 2]" 1
1085 1 64 PHE HB2 1 65 ALA H . . 4.750 4.047 3.948 4.123 . 0 0 "[ . 1 . 2]" 1
1086 1 64 PHE HB2 1 65 ALA MB . . 5.240 5.239 5.038 5.325 0.085 4 0 "[ . 1 . 2]" 1
1087 1 64 PHE HB2 1 70 MET HB3 . . 5.150 4.635 4.489 4.863 . 0 0 "[ . 1 . 2]" 1
1088 1 64 PHE HB2 1 70 MET ME . . 4.410 3.878 3.710 4.113 . 0 0 "[ . 1 . 2]" 1
1089 1 64 PHE HB3 1 65 ALA H . . 4.590 4.443 4.395 4.481 . 0 0 "[ . 1 . 2]" 1
1090 1 64 PHE HB3 1 70 MET ME . . 3.320 2.431 2.217 2.738 . 0 0 "[ . 1 . 2]" 1
1091 1 64 PHE QE 1 73 LEU MD2 . . 2.840 2.425 2.158 2.752 . 0 0 "[ . 1 . 2]" 1
1092 1 64 PHE HZ 1 73 LEU MD1 . . 5.010 4.968 4.517 5.188 0.178 14 0 "[ . 1 . 2]" 1
1093 1 64 PHE HZ 1 73 LEU MD2 . . 5.190 2.880 2.670 3.048 . 0 0 "[ . 1 . 2]" 1
1094 1 65 ALA H 1 65 ALA MB . . 2.950 2.227 2.212 2.250 . 0 0 "[ . 1 . 2]" 1
1095 1 65 ALA H 1 66 THR H . . 3.590 2.705 2.543 2.863 . 0 0 "[ . 1 . 2]" 1
1096 1 65 ALA H 1 70 MET ME . . 5.090 4.565 4.310 4.822 . 0 0 "[ . 1 . 2]" 1
1097 1 65 ALA MB 1 66 THR H . . 3.550 2.766 2.624 3.055 . 0 0 "[ . 1 . 2]" 1
1098 1 65 ALA MB 1 66 THR HA . . 5.150 4.443 4.353 4.521 . 0 0 "[ . 1 . 2]" 1
1099 1 65 ALA MB 1 66 THR MG . . 3.490 3.167 2.983 3.344 . 0 0 "[ . 1 . 2]" 1
1100 1 66 THR H 1 66 THR MG . . 3.900 3.363 3.199 3.558 . 0 0 "[ . 1 . 2]" 1
1101 1 66 THR H 1 67 VAL H . . 4.980 4.399 4.360 4.441 . 0 0 "[ . 1 . 2]" 1
1102 1 66 THR H 1 69 SER H . . 4.310 3.571 3.292 3.847 . 0 0 "[ . 1 . 2]" 1
1103 1 66 THR H 1 69 SER HB2 . . 4.050 2.772 1.858 4.048 . 0 0 "[ . 1 . 2]" 1
1104 1 66 THR H 1 69 SER QB . . 3.440 2.286 1.850 3.445 0.005 15 0 "[ . 1 . 2]" 1
1105 1 66 THR H 1 69 SER HB3 . . 4.050 3.175 2.096 3.897 . 0 0 "[ . 1 . 2]" 1
1106 1 66 THR H 1 70 MET HB3 . . 3.950 4.065 3.973 4.169 0.219 4 0 "[ . 1 . 2]" 1
1107 1 66 THR HA 1 66 THR MG . . 3.570 2.429 2.365 2.494 . 0 0 "[ . 1 . 2]" 1
1108 1 66 THR HA 1 69 SER QB . . 5.340 4.633 4.381 5.393 0.053 6 0 "[ . 1 . 2]" 1
1109 1 67 VAL H 1 67 VAL HB . . 3.740 2.541 2.429 2.611 . 0 0 "[ . 1 . 2]" 1
1110 1 67 VAL H 1 67 VAL MG1 . . 4.520 2.806 2.236 3.856 . 0 0 "[ . 1 . 2]" 1
1111 1 67 VAL H 1 67 VAL QG . . 3.360 2.318 2.147 2.531 . 0 0 "[ . 1 . 2]" 1
1112 1 67 VAL H 1 67 VAL MG2 . . 4.520 3.380 2.158 3.885 . 0 0 "[ . 1 . 2]" 1
1113 1 67 VAL H 1 68 GLN H . . 3.880 2.615 2.469 2.729 . 0 0 "[ . 1 . 2]" 1
1114 1 67 VAL H 1 68 GLN QB . . 5.000 4.633 4.167 4.974 . 0 0 "[ . 1 . 2]" 1
1115 1 67 VAL H 1 69 SER H . . 5.410 4.192 4.075 4.476 . 0 0 "[ . 1 . 2]" 1
1116 1 67 VAL H 1 70 MET H . . 5.500 4.785 4.669 4.899 . 0 0 "[ . 1 . 2]" 1
1117 1 67 VAL H 1 70 MET ME . . 4.950 3.526 3.288 3.714 . 0 0 "[ . 1 . 2]" 1
1118 1 67 VAL HA 1 67 VAL MG1 . . 3.340 3.058 2.480 3.302 . 0 0 "[ . 1 . 2]" 1
1119 1 67 VAL HA 1 67 VAL QG . . 2.740 2.254 2.148 2.330 . 0 0 "[ . 1 . 2]" 1
1120 1 67 VAL HA 1 67 VAL MG2 . . 3.340 2.351 2.248 2.481 . 0 0 "[ . 1 . 2]" 1
1121 1 67 VAL HA 1 68 GLN HA . . 4.870 4.842 4.782 4.896 0.026 6 0 "[ . 1 . 2]" 1
1122 1 67 VAL HA 1 70 MET H . . 4.340 3.321 3.062 3.565 . 0 0 "[ . 1 . 2]" 1
1123 1 67 VAL HA 1 70 MET ME . . 3.130 2.300 1.802 2.662 . 0 0 "[ . 1 . 2]" 1
1124 1 67 VAL HA 1 70 MET HG2 . . 4.020 1.786 1.637 1.991 . 0 0 "[ . 1 . 2]" 1
1125 1 67 VAL HA 1 70 MET HG3 . . 4.020 3.319 3.118 3.533 . 0 0 "[ . 1 . 2]" 1
1126 1 67 VAL HA 1 71 VAL H . . 4.250 3.801 3.673 3.951 . 0 0 "[ . 1 . 2]" 1
1127 1 67 VAL HB 1 68 GLN H . . 4.260 3.657 2.923 4.028 . 0 0 "[ . 1 . 2]" 1
1128 1 67 VAL QG 1 68 GLN H . . 3.370 2.605 2.141 3.460 0.090 20 0 "[ . 1 . 2]" 1
1129 1 67 VAL QG 1 68 GLN HA . . 3.910 3.238 2.890 3.912 0.002 20 0 "[ . 1 . 2]" 1
1130 1 67 VAL QG 1 69 SER H . . 5.440 4.356 4.073 4.851 . 0 0 "[ . 1 . 2]" 1
1131 1 67 VAL QG 1 70 MET H . . 4.950 4.294 4.210 4.431 . 0 0 "[ . 1 . 2]" 1
1132 1 67 VAL QG 1 71 VAL H . . 4.370 3.746 3.509 3.903 . 0 0 "[ . 1 . 2]" 1
1133 1 67 VAL MG1 1 68 GLN H . . 4.090 2.699 2.154 3.817 . 0 0 "[ . 1 . 2]" 1
1134 1 67 VAL MG2 1 68 GLN H . . 4.090 3.932 3.742 4.163 0.073 19 0 "[ . 1 . 2]" 1
1135 1 68 GLN H 1 68 GLN QB . . 2.970 2.439 2.211 2.617 . 0 0 "[ . 1 . 2]" 1
1136 1 68 GLN H 1 68 GLN HG2 . . 4.720 3.109 1.923 4.663 . 0 0 "[ . 1 . 2]" 1
1137 1 68 GLN H 1 68 GLN QG . . 4.080 2.783 1.906 4.100 0.020 20 0 "[ . 1 . 2]" 1
1138 1 68 GLN H 1 68 GLN HG3 . . 4.720 3.632 2.025 4.546 . 0 0 "[ . 1 . 2]" 1
1139 1 68 GLN H 1 69 SER H . . 3.700 2.646 2.535 2.749 . 0 0 "[ . 1 . 2]" 1
1140 1 68 GLN H 1 70 MET H . . 4.710 4.108 3.975 4.251 . 0 0 "[ . 1 . 2]" 1
1141 1 68 GLN H 1 71 VAL H . . 4.980 4.813 4.622 4.915 . 0 0 "[ . 1 . 2]" 1
1142 1 68 GLN H 1 71 VAL QG . . 5.440 4.458 4.106 4.698 . 0 0 "[ . 1 . 2]" 1
1143 1 68 GLN HA 1 68 GLN QG . . 3.520 3.026 2.503 3.402 . 0 0 "[ . 1 . 2]" 1
1144 1 68 GLN HA 1 71 VAL H . . 3.830 3.877 3.602 4.002 0.172 5 0 "[ . 1 . 2]" 1
1145 1 68 GLN HA 1 71 VAL QG . . 3.640 2.690 2.123 3.789 0.149 2 0 "[ . 1 . 2]" 1
1146 1 68 GLN QB 1 68 GLN QE . . 3.800 3.264 2.680 3.770 . 0 0 "[ . 1 . 2]" 1
1147 1 68 GLN QB 1 68 GLN HE22 . . 4.500 4.024 3.625 4.470 . 0 0 "[ . 1 . 2]" 1
1148 1 68 GLN QB 1 69 SER H . . 3.510 2.942 2.340 3.575 0.065 1 0 "[ . 1 . 2]" 1
1149 1 68 GLN QG 1 69 SER H . . 4.920 3.195 2.193 4.438 . 0 0 "[ . 1 . 2]" 1
1150 1 69 SER H 1 69 SER HB2 . . 3.940 2.659 2.458 3.655 . 0 0 "[ . 1 . 2]" 1
1151 1 69 SER H 1 69 SER HB3 . . 3.940 3.145 2.535 3.625 . 0 0 "[ . 1 . 2]" 1
1152 1 69 SER H 1 70 MET H . . 3.570 2.621 2.495 2.745 . 0 0 "[ . 1 . 2]" 1
1153 1 69 SER H 1 70 MET HB3 . . 5.040 4.885 4.762 5.013 . 0 0 "[ . 1 . 2]" 1
1154 1 69 SER H 1 71 VAL H . . 4.580 4.188 3.914 4.398 . 0 0 "[ . 1 . 2]" 1
1155 1 69 SER H 1 72 ALA H . . 5.210 4.877 4.617 5.077 . 0 0 "[ . 1 . 2]" 1
1156 1 69 SER H 1 72 ALA MB . . 4.850 4.764 4.557 4.912 0.062 17 0 "[ . 1 . 2]" 1
1157 1 69 SER HA 1 69 SER QB . . 2.590 2.369 2.205 2.425 . 0 0 "[ . 1 . 2]" 1
1158 1 69 SER HA 1 72 ALA MB . . 3.330 2.965 2.492 3.269 . 0 0 "[ . 1 . 2]" 1
1159 1 69 SER QB 1 70 MET H . . 3.750 2.727 2.428 3.557 . 0 0 "[ . 1 . 2]" 1
1160 1 69 SER QB 1 72 ALA H . . 5.340 5.177 4.960 5.373 0.033 9 0 "[ . 1 . 2]" 1
1161 1 70 MET H 1 70 MET HB2 . . 3.700 3.661 3.625 3.701 0.001 3 0 "[ . 1 . 2]" 1
1162 1 70 MET H 1 70 MET HB3 . . 3.820 2.529 2.424 2.624 . 0 0 "[ . 1 . 2]" 1
1163 1 70 MET H 1 70 MET ME . . 3.850 3.627 3.563 3.753 . 0 0 "[ . 1 . 2]" 1
1164 1 70 MET H 1 70 MET HG2 . . 3.830 2.494 2.380 2.713 . 0 0 "[ . 1 . 2]" 1
1165 1 70 MET H 1 70 MET QG . . 3.330 2.450 2.344 2.652 . 0 0 "[ . 1 . 2]" 1
1166 1 70 MET H 1 70 MET HG3 . . 3.830 3.603 3.496 3.762 . 0 0 "[ . 1 . 2]" 1
1167 1 70 MET H 1 71 VAL H . . 3.420 2.521 2.462 2.590 . 0 0 "[ . 1 . 2]" 1
1168 1 70 MET H 1 71 VAL QG . . 4.280 4.144 3.882 4.351 0.071 13 0 "[ . 1 . 2]" 1
1169 1 70 MET H 1 72 ALA MB . . 5.030 4.785 4.570 4.933 . 0 0 "[ . 1 . 2]" 1
1170 1 70 MET HA 1 70 MET QG . . 3.570 3.389 3.374 3.402 . 0 0 "[ . 1 . 2]" 1
1171 1 70 MET HA 1 73 LEU H . . 3.830 3.398 3.209 3.600 . 0 0 "[ . 1 . 2]" 1
1172 1 70 MET HA 1 73 LEU HB2 . . 4.900 3.432 3.106 3.614 . 0 0 "[ . 1 . 2]" 1
1173 1 70 MET HA 1 73 LEU QB . . 4.160 2.262 2.038 2.523 . 0 0 "[ . 1 . 2]" 1
1174 1 70 MET HA 1 73 LEU HB3 . . 4.900 2.295 2.059 2.577 . 0 0 "[ . 1 . 2]" 1
1175 1 70 MET HA 1 73 LEU MD1 . . 4.840 4.684 4.422 4.873 0.033 8 0 "[ . 1 . 2]" 1
1176 1 70 MET HA 1 73 LEU HG . . 4.950 4.380 4.055 4.659 . 0 0 "[ . 1 . 2]" 1
1177 1 70 MET HA 1 74 VAL H . . 5.180 4.303 4.031 4.528 . 0 0 "[ . 1 . 2]" 1
1178 1 70 MET HA 1 74 VAL QG . . 5.440 4.157 4.066 4.290 . 0 0 "[ . 1 . 2]" 1
1179 1 70 MET HB2 1 70 MET ME . . 3.270 2.981 2.923 3.050 . 0 0 "[ . 1 . 2]" 1
1180 1 70 MET HB2 1 71 VAL H . . 5.040 4.084 4.016 4.179 . 0 0 "[ . 1 . 2]" 1
1181 1 70 MET ME 1 71 VAL H . . 4.630 4.734 4.677 4.792 0.162 13 0 "[ . 1 . 2]" 1
1182 1 70 MET QG 1 71 VAL H . . 3.840 2.430 2.329 2.549 . 0 0 "[ . 1 . 2]" 1
1183 1 71 VAL H 1 71 VAL HB . . 3.080 2.429 2.252 2.617 . 0 0 "[ . 1 . 2]" 1
1184 1 71 VAL H 1 71 VAL MG1 . . 4.300 2.885 2.210 3.845 . 0 0 "[ . 1 . 2]" 1
1185 1 71 VAL H 1 71 VAL QG . . 2.810 2.468 2.197 2.745 . 0 0 "[ . 1 . 2]" 1
1186 1 71 VAL H 1 71 VAL MG2 . . 4.300 3.409 2.268 3.864 . 0 0 "[ . 1 . 2]" 1
1187 1 71 VAL H 1 72 ALA MB . . 4.270 4.171 3.965 4.283 0.013 16 0 "[ . 1 . 2]" 1
1188 1 71 VAL HA 1 71 VAL MG1 . . 3.100 3.092 2.546 3.292 0.192 11 0 "[ . 1 . 2]" 1
1189 1 71 VAL HA 1 71 VAL QG . . 2.570 2.232 2.189 2.304 . 0 0 "[ . 1 . 2]" 1
1190 1 71 VAL HA 1 71 VAL MG2 . . 3.100 2.311 2.246 2.407 . 0 0 "[ . 1 . 2]" 1
1191 1 71 VAL HA 1 72 ALA MB . . 5.140 5.020 4.920 5.095 . 0 0 "[ . 1 . 2]" 1
1192 1 71 VAL HA 1 73 LEU H . . 4.690 4.381 4.283 4.459 . 0 0 "[ . 1 . 2]" 1
1193 1 71 VAL HA 1 74 VAL H . . 4.110 3.630 3.343 3.923 . 0 0 "[ . 1 . 2]" 1
1194 1 71 VAL HA 1 75 GLN QG . . 5.340 4.298 4.030 4.607 . 0 0 "[ . 1 . 2]" 1
1195 1 71 VAL HB 1 72 ALA H . . 4.000 3.432 2.548 3.933 . 0 0 "[ . 1 . 2]" 1
1196 1 71 VAL HB 1 72 ALA MB . . 4.170 4.716 3.939 5.296 1.126 4 12 "[* +.** *1****. ** -]" 1
1197 1 71 VAL QG 1 72 ALA H . . 3.990 2.455 2.171 3.231 . 0 0 "[ . 1 . 2]" 1
1198 1 71 VAL QG 1 72 ALA HA . . 3.860 3.090 2.929 3.389 . 0 0 "[ . 1 . 2]" 1
1199 1 71 VAL QG 1 72 ALA MB . . 4.600 2.960 2.468 3.919 . 0 0 "[ . 1 . 2]" 1
1200 1 71 VAL QG 1 75 GLN H . . 4.560 4.197 3.966 4.534 . 0 0 "[ . 1 . 2]" 1
1201 1 71 VAL QG 1 75 GLN QE . . 3.880 2.470 1.639 3.346 . 0 0 "[ . 1 . 2]" 1
1202 1 71 VAL QG 1 75 GLN QG . . 3.390 2.900 2.349 3.399 0.009 10 0 "[ . 1 . 2]" 1
1203 1 71 VAL MG1 1 72 ALA H . . 4.590 2.506 2.179 3.419 . 0 0 "[ . 1 . 2]" 1
1204 1 71 VAL MG1 1 72 ALA HA . . 4.550 3.153 2.965 3.421 . 0 0 "[ . 1 . 2]" 1
1205 1 71 VAL MG2 1 72 ALA H . . 4.590 4.010 3.826 4.199 . 0 0 "[ . 1 . 2]" 1
1206 1 71 VAL MG2 1 72 ALA HA . . 4.550 4.622 3.873 5.501 0.951 2 5 "[ +* . - 1 ** 2]" 1
1207 1 72 ALA H 1 72 ALA MB . . 2.730 2.241 2.190 2.274 . 0 0 "[ . 1 . 2]" 1
1208 1 72 ALA H 1 73 LEU H . . 3.240 2.493 2.310 2.710 . 0 0 "[ . 1 . 2]" 1
1209 1 72 ALA H 1 73 LEU QB . . 4.810 4.042 3.854 4.245 . 0 0 "[ . 1 . 2]" 1
1210 1 72 ALA HA 1 75 GLN H . . 3.850 3.158 2.870 3.483 . 0 0 "[ . 1 . 2]" 1
1211 1 72 ALA HA 1 75 GLN HB2 . . 3.520 2.660 2.127 3.393 . 0 0 "[ . 1 . 2]" 1
1212 1 72 ALA HA 1 75 GLN QG . . 4.190 2.586 2.218 2.761 . 0 0 "[ . 1 . 2]" 1
1213 1 72 ALA HA 1 76 ARG H . . 4.750 4.364 4.110 4.717 . 0 0 "[ . 1 . 2]" 1
1214 1 72 ALA MB 1 73 LEU H . . 3.220 2.736 2.589 2.814 . 0 0 "[ . 1 . 2]" 1
1215 1 72 ALA MB 1 75 GLN QG . . 4.010 4.019 3.692 4.222 0.212 19 0 "[ . 1 . 2]" 1
1216 1 72 ALA MB 1 76 ARG H . . 4.790 4.770 4.556 4.929 0.139 4 0 "[ . 1 . 2]" 1
1217 1 73 LEU H 1 73 LEU HB2 . . 3.580 2.900 2.801 3.081 . 0 0 "[ . 1 . 2]" 1
1218 1 73 LEU H 1 73 LEU QB . . 2.890 2.047 2.006 2.076 . 0 0 "[ . 1 . 2]" 1
1219 1 73 LEU H 1 73 LEU HB3 . . 3.580 2.094 2.042 2.129 . 0 0 "[ . 1 . 2]" 1
1220 1 73 LEU H 1 73 LEU MD1 . . 4.560 4.388 4.339 4.447 . 0 0 "[ . 1 . 2]" 1
1221 1 73 LEU H 1 73 LEU MD2 . . 3.810 3.989 3.887 4.052 0.242 11 0 "[ . 1 . 2]" 1
1222 1 73 LEU H 1 73 LEU HG . . 3.870 4.085 3.955 4.143 0.273 12 0 "[ . 1 . 2]" 1
1223 1 73 LEU HA 1 73 LEU MD1 . . 3.900 2.703 2.556 2.936 . 0 0 "[ . 1 . 2]" 1
1224 1 73 LEU HA 1 73 LEU HG . . 3.940 3.437 3.369 3.592 . 0 0 "[ . 1 . 2]" 1
1225 1 73 LEU QB 1 73 LEU MD2 . . 2.910 2.109 2.099 2.119 . 0 0 "[ . 1 . 2]" 1
1226 1 73 LEU MD1 1 74 VAL HA . . 5.160 4.075 3.754 4.313 . 0 0 "[ . 1 . 2]" 1
1227 1 73 LEU MD1 1 75 GLN H . . 5.500 5.571 5.499 5.652 0.152 7 0 "[ . 1 . 2]" 1
1228 1 73 LEU MD2 1 74 VAL QG . . 3.430 3.087 2.710 3.372 . 0 0 "[ . 1 . 2]" 1
1229 1 73 LEU HG 1 74 VAL H . . 3.680 2.883 2.629 3.110 . 0 0 "[ . 1 . 2]" 1
1230 1 73 LEU HG 1 74 VAL HA . . 4.970 3.121 2.935 3.304 . 0 0 "[ . 1 . 2]" 1
1231 1 73 LEU HG 1 74 VAL QG . . 3.210 3.062 2.688 3.331 0.121 19 0 "[ . 1 . 2]" 1
1232 1 73 LEU HG 1 75 GLN H . . 5.120 5.132 4.968 5.238 0.118 2 0 "[ . 1 . 2]" 1
1233 1 73 LEU HG 1 77 LEU HG . . 4.540 3.843 3.343 4.455 . 0 0 "[ . 1 . 2]" 1
1234 1 74 VAL H 1 74 VAL HB . . 3.140 2.571 2.455 2.666 . 0 0 "[ . 1 . 2]" 1
1235 1 74 VAL H 1 74 VAL MG1 . . 4.010 3.829 3.801 3.853 . 0 0 "[ . 1 . 2]" 1
1236 1 74 VAL H 1 74 VAL QG . . 3.020 2.143 2.028 2.271 . 0 0 "[ . 1 . 2]" 1
1237 1 74 VAL H 1 74 VAL MG2 . . 4.010 2.155 2.036 2.289 . 0 0 "[ . 1 . 2]" 1
1238 1 74 VAL H 1 75 GLN H . . 3.630 2.732 2.545 2.869 . 0 0 "[ . 1 . 2]" 1
1239 1 74 VAL H 1 75 GLN QG . . 4.770 4.207 4.032 4.520 . 0 0 "[ . 1 . 2]" 1
1240 1 74 VAL H 1 76 ARG H . . 4.260 4.101 3.937 4.276 0.016 13 0 "[ . 1 . 2]" 1
1241 1 74 VAL HA 1 74 VAL QG . . 2.970 2.193 2.172 2.215 . 0 0 "[ . 1 . 2]" 1
1242 1 74 VAL HA 1 77 LEU H . . 3.990 3.565 3.379 3.787 . 0 0 "[ . 1 . 2]" 1
1243 1 74 VAL HA 1 77 LEU HB2 . . 5.040 4.964 4.796 5.102 0.062 5 0 "[ . 1 . 2]" 1
1244 1 74 VAL HA 1 77 LEU QB . . 4.310 4.213 3.933 4.391 0.081 13 0 "[ . 1 . 2]" 1
1245 1 74 VAL HA 1 77 LEU HB3 . . 5.040 4.558 4.174 4.791 . 0 0 "[ . 1 . 2]" 1
1246 1 74 VAL HA 1 77 LEU MD1 . . 3.140 2.488 2.240 2.812 . 0 0 "[ . 1 . 2]" 1
1247 1 74 VAL HA 1 77 LEU MD2 . . 3.840 2.474 2.173 2.696 . 0 0 "[ . 1 . 2]" 1
1248 1 74 VAL HB 1 75 GLN H . . 3.040 2.666 2.530 2.901 . 0 0 "[ . 1 . 2]" 1
1249 1 74 VAL QG 1 75 GLN H . . 3.400 3.235 3.019 3.389 . 0 0 "[ . 1 . 2]" 1
1250 1 74 VAL QG 1 75 GLN HA . . 4.050 3.417 3.095 3.705 . 0 0 "[ . 1 . 2]" 1
1251 1 74 VAL QG 1 75 GLN HB2 . . 5.360 4.974 4.768 5.154 . 0 0 "[ . 1 . 2]" 1
1252 1 74 VAL QG 1 77 LEU MD2 . . 3.640 2.943 2.455 3.243 . 0 0 "[ . 1 . 2]" 1
1253 1 74 VAL QG 1 78 LYS QE . . 4.160 3.531 2.124 4.258 0.098 15 0 "[ . 1 . 2]" 1
1254 1 74 VAL MG1 1 75 GLN H . . 4.120 3.456 3.125 3.677 . 0 0 "[ . 1 . 2]" 1
1255 1 74 VAL MG2 1 75 GLN H . . 4.120 3.913 3.745 4.005 . 0 0 "[ . 1 . 2]" 1
1256 1 75 GLN H 1 75 GLN HB2 . . 3.410 2.609 2.469 2.809 . 0 0 "[ . 1 . 2]" 1
1257 1 75 GLN H 1 75 GLN HB3 . . 3.660 3.627 3.592 3.655 . 0 0 "[ . 1 . 2]" 1
1258 1 75 GLN H 1 75 GLN HG2 . . 3.670 2.711 2.078 3.633 . 0 0 "[ . 1 . 2]" 1
1259 1 75 GLN H 1 75 GLN HG3 . . 3.670 2.985 1.994 3.745 0.075 13 0 "[ . 1 . 2]" 1
1260 1 75 GLN H 1 76 ARG H . . 3.690 2.675 2.548 2.822 . 0 0 "[ . 1 . 2]" 1
1261 1 75 GLN H 1 78 LYS HG2 . . 4.670 4.417 4.136 4.755 0.085 4 0 "[ . 1 . 2]" 1
1262 1 75 GLN HA 1 75 GLN QG . . 3.520 2.848 2.430 3.284 . 0 0 "[ . 1 . 2]" 1
1263 1 75 GLN HA 1 78 LYS HB3 . . 4.010 3.950 3.612 4.109 0.099 1 0 "[ . 1 . 2]" 1
1264 1 75 GLN HA 1 78 LYS QE . . 4.720 4.731 4.262 4.995 0.275 15 0 "[ . 1 . 2]" 1
1265 1 75 GLN HA 1 78 LYS HG3 . . 4.100 2.658 2.348 3.058 . 0 0 "[ . 1 . 2]" 1
1266 1 75 GLN HB2 1 75 GLN QG . . 2.430 2.261 2.164 2.398 . 0 0 "[ . 1 . 2]" 1
1267 1 75 GLN HB2 1 76 ARG H . . 3.870 3.010 2.877 3.167 . 0 0 "[ . 1 . 2]" 1
1268 1 75 GLN HB3 1 75 GLN QE . . 4.470 3.976 3.701 4.191 . 0 0 "[ . 1 . 2]" 1
1269 1 75 GLN HB3 1 75 GLN HE22 . . 5.170 4.677 4.438 4.893 . 0 0 "[ . 1 . 2]" 1
1270 1 75 GLN HB3 1 76 ARG H . . 4.090 4.018 3.867 4.129 0.039 8 0 "[ . 1 . 2]" 1
1271 1 75 GLN HB3 1 78 LYS HG2 . . 5.500 5.312 4.867 5.604 0.104 17 0 "[ . 1 . 2]" 1
1272 1 75 GLN HB3 1 78 LYS HG3 . . 5.070 4.816 4.407 5.157 0.087 19 0 "[ . 1 . 2]" 1
1273 1 75 GLN QG 1 76 ARG H . . 4.530 4.163 3.898 4.370 . 0 0 "[ . 1 . 2]" 1
1274 1 76 ARG H 1 76 ARG QB . . 2.900 2.444 2.325 2.630 . 0 0 "[ . 1 . 2]" 1
1275 1 76 ARG H 1 76 ARG QD . . 4.150 3.765 3.245 4.310 0.160 13 0 "[ . 1 . 2]" 1
1276 1 76 ARG H 1 76 ARG HG2 . . 4.100 3.115 2.054 3.876 . 0 0 "[ . 1 . 2]" 1
1277 1 76 ARG H 1 76 ARG QG . . 3.310 2.414 2.042 2.635 . 0 0 "[ . 1 . 2]" 1
1278 1 76 ARG H 1 76 ARG HG3 . . 4.100 3.030 2.240 3.938 . 0 0 "[ . 1 . 2]" 1
1279 1 76 ARG H 1 77 LEU MD1 . . 4.750 4.812 4.735 4.874 0.124 14 0 "[ . 1 . 2]" 1
1280 1 76 ARG H 1 78 LYS HG2 . . 5.050 4.855 4.551 5.052 0.002 12 0 "[ . 1 . 2]" 1
1281 1 76 ARG HA 1 76 ARG QD . . 4.410 3.480 1.921 4.515 0.105 13 0 "[ . 1 . 2]" 1
1282 1 76 ARG HA 1 76 ARG QG . . 3.150 2.737 2.380 3.361 0.211 1 0 "[ . 1 . 2]" 1
1283 1 76 ARG QB 1 76 ARG HD2 . . 3.850 2.924 2.298 3.379 . 0 0 "[ . 1 . 2]" 1
1284 1 76 ARG QB 1 76 ARG QD . . 3.270 2.427 2.132 2.898 . 0 0 "[ . 1 . 2]" 1
1285 1 76 ARG QB 1 76 ARG HD3 . . 3.850 2.753 2.378 3.579 . 0 0 "[ . 1 . 2]" 1
1286 1 76 ARG QG 1 77 LEU H . . 4.480 3.923 2.161 4.325 . 0 0 "[ . 1 . 2]" 1
1287 1 77 LEU H 1 77 LEU HB2 . . 3.760 3.675 3.640 3.703 . 0 0 "[ . 1 . 2]" 1
1288 1 77 LEU H 1 77 LEU HB3 . . 3.760 2.802 2.737 2.888 . 0 0 "[ . 1 . 2]" 1
1289 1 77 LEU H 1 77 LEU MD1 . . 3.580 3.298 3.120 3.435 . 0 0 "[ . 1 . 2]" 1
1290 1 77 LEU H 1 77 LEU MD2 . . 3.440 3.457 3.294 3.570 0.130 16 0 "[ . 1 . 2]" 1
1291 1 77 LEU H 1 77 LEU HG . . 3.100 2.070 1.917 2.178 . 0 0 "[ . 1 . 2]" 1
1292 1 77 LEU HA 1 77 LEU MD2 . . 4.090 4.135 4.106 4.156 0.066 6 0 "[ . 1 . 2]" 1
1293 1 77 LEU HA 1 77 LEU HG . . 4.060 3.767 3.719 3.801 . 0 0 "[ . 1 . 2]" 1
1294 1 77 LEU QB 1 77 LEU MD1 . . 3.060 2.345 2.302 2.386 . 0 0 "[ . 1 . 2]" 1
1295 1 77 LEU QB 1 77 LEU MD2 . . 2.990 2.121 2.094 2.134 . 0 0 "[ . 1 . 2]" 1
1296 1 77 LEU MD1 1 78 LYS H . . 3.770 2.469 2.321 2.576 . 0 0 "[ . 1 . 2]" 1
1297 1 77 LEU MD1 1 78 LYS HB2 . . 3.960 4.059 3.975 4.206 0.246 16 0 "[ . 1 . 2]" 1
1298 1 77 LEU MD1 1 78 LYS HB3 . . 4.380 4.531 4.377 4.654 0.274 16 0 "[ . 1 . 2]" 1
1299 1 77 LEU MD1 1 78 LYS QD . . 3.540 2.811 2.419 3.113 . 0 0 "[ . 1 . 2]" 1
1300 1 78 LYS H 1 78 LYS HB2 . . 3.030 2.386 2.297 2.458 . 0 0 "[ . 1 . 2]" 1
1301 1 78 LYS H 1 78 LYS HB3 . . 3.760 3.592 3.557 3.620 . 0 0 "[ . 1 . 2]" 1
1302 1 78 LYS H 1 78 LYS QD . . 4.300 3.699 3.435 3.916 . 0 0 "[ . 1 . 2]" 1
1303 1 78 LYS H 1 78 LYS HG2 . . 3.750 2.510 2.267 2.660 . 0 0 "[ . 1 . 2]" 1
1304 1 78 LYS H 1 78 LYS HG3 . . 3.950 3.794 3.597 3.946 . 0 0 "[ . 1 . 2]" 1
1305 1 78 LYS H 1 79 ALA H . . 3.480 2.631 2.418 2.817 . 0 0 "[ . 1 . 2]" 1
1306 1 78 LYS HA 1 78 LYS HB2 . . 3.010 3.036 3.022 3.048 0.038 14 0 "[ . 1 . 2]" 1
1307 1 78 LYS HA 1 78 LYS QD . . 3.410 2.088 1.940 2.176 . 0 0 "[ . 1 . 2]" 1
1308 1 78 LYS HA 1 78 LYS QE . . 4.880 3.620 2.911 4.165 . 0 0 "[ . 1 . 2]" 1
1309 1 78 LYS HA 1 78 LYS HG2 . . 3.490 3.026 2.864 3.166 . 0 0 "[ . 1 . 2]" 1
1310 1 78 LYS HA 1 78 LYS HG3 . . 4.010 3.789 3.747 3.847 . 0 0 "[ . 1 . 2]" 1
1311 1 78 LYS HB2 1 78 LYS QE . . 4.520 3.966 3.540 4.562 0.042 5 0 "[ . 1 . 2]" 1
1312 1 78 LYS HB2 1 79 ALA H . . 4.320 2.766 2.493 3.150 . 0 0 "[ . 1 . 2]" 1
1313 1 78 LYS HB2 1 79 ALA MB . . 4.250 3.995 3.740 4.281 0.031 8 0 "[ . 1 . 2]" 1
1314 1 78 LYS HB3 1 78 LYS QE . . 4.280 2.960 2.009 4.275 . 0 0 "[ . 1 . 2]" 1
1315 1 78 LYS HB3 1 79 ALA H . . 4.190 3.623 3.302 3.818 . 0 0 "[ . 1 . 2]" 1
1316 1 78 LYS HB3 1 79 ALA HA . . 4.300 4.398 4.168 4.525 0.225 18 0 "[ . 1 . 2]" 1
1317 1 79 ALA H 1 79 ALA MB . . 2.940 2.260 2.237 2.312 . 0 0 "[ . 1 . 2]" 1
1318 1 79 ALA H 1 80 HIS H . . 4.040 2.559 2.428 2.824 . 0 0 "[ . 1 . 2]" 1
1319 1 79 ALA MB 1 80 HIS H . . 4.020 3.082 2.771 3.545 . 0 0 "[ . 1 . 2]" 1
1320 1 80 HIS H 1 80 HIS QB . . 3.450 2.439 2.224 2.774 . 0 0 "[ . 1 . 2]" 1
1321 1 80 HIS HA 1 81 PRO HD2 . . 3.260 2.533 1.998 2.946 . 0 0 "[ . 1 . 2]" 1
1322 1 80 HIS HA 1 81 PRO QD . . 2.830 1.991 1.828 2.198 . 0 0 "[ . 1 . 2]" 1
1323 1 80 HIS HA 1 81 PRO HD3 . . 3.260 2.226 1.852 2.722 . 0 0 "[ . 1 . 2]" 1
1324 1 80 HIS HA 1 81 PRO QG . . 4.360 3.908 3.720 4.164 . 0 0 "[ . 1 . 2]" 1
1325 1 80 HIS QB 1 80 HIS HD2 . . 3.310 2.922 2.619 3.313 0.003 19 0 "[ . 1 . 2]" 1
1326 1 80 HIS QB 1 82 GLU H . . 4.700 3.389 2.570 4.776 0.076 14 0 "[ . 1 . 2]" 1
1327 1 80 HIS QB 1 83 GLN QB . . 4.670 3.455 1.971 4.773 0.103 16 0 "[ . 1 . 2]" 1
1328 1 80 HIS QB 1 83 GLN QG . . 4.040 2.975 2.098 3.891 . 0 0 "[ . 1 . 2]" 1
1329 1 80 HIS HB2 1 83 GLN QG . . 4.890 3.367 2.180 4.530 . 0 0 "[ . 1 . 2]" 1
1330 1 80 HIS HB3 1 83 GLN QG . . 4.890 3.587 2.734 4.904 0.014 10 0 "[ . 1 . 2]" 1
1331 1 81 PRO QB 1 82 GLU H . . 3.590 2.874 2.178 3.544 . 0 0 "[ . 1 . 2]" 1
1332 1 81 PRO QD 1 82 GLU H . . 4.380 2.639 1.963 3.121 . 0 0 "[ . 1 . 2]" 1
1333 1 81 PRO QD 1 83 GLN QG . . 5.350 5.264 4.181 5.686 0.336 9 0 "[ . 1 . 2]" 1
1334 1 82 GLU H 1 82 GLU QB . . 3.110 2.750 2.215 3.217 0.107 2 0 "[ . 1 . 2]" 1
1335 1 82 GLU H 1 82 GLU HG2 . . 5.420 4.014 2.029 5.224 . 0 0 "[ . 1 . 2]" 1
1336 1 82 GLU H 1 82 GLU QG . . 4.770 3.589 1.992 4.442 . 0 0 "[ . 1 . 2]" 1
1337 1 82 GLU H 1 82 GLU HG3 . . 5.420 4.217 2.341 5.172 . 0 0 "[ . 1 . 2]" 1
1338 1 82 GLU H 1 83 GLN H . . 4.800 3.695 2.441 4.326 . 0 0 "[ . 1 . 2]" 1
1339 1 82 GLU QG 1 83 GLN H . . 4.090 3.337 2.001 4.241 0.151 1 0 "[ . 1 . 2]" 1
1340 1 83 GLN H 1 83 GLN QB . . 3.530 2.735 2.261 3.358 . 0 0 "[ . 1 . 2]" 1
1341 1 83 GLN H 1 84 GLY QA . . 4.940 4.324 3.798 4.863 . 0 0 "[ . 1 . 2]" 1
1342 1 83 GLN HA 1 83 GLN QG . . 3.370 2.868 2.312 3.534 0.164 1 0 "[ . 1 . 2]" 1
1343 1 83 GLN QB 1 84 GLY QA . . 4.440 3.978 3.534 4.352 . 0 0 "[ . 1 . 2]" 1
1344 1 85 GLY QA 1 86 ALA MB . . 5.470 3.891 3.587 4.230 . 0 0 "[ . 1 . 2]" 1
1345 1 86 ALA MB 1 87 ALA H . . 3.500 3.030 2.104 3.664 0.164 18 0 "[ . 1 . 2]" 1
1346 1 87 ALA H 1 87 ALA MB . . 3.270 2.466 2.243 2.910 . 0 0 "[ . 1 . 2]" 1
1347 1 87 ALA HA 1 88 LEU H . . 3.030 2.324 2.168 3.001 . 0 0 "[ . 1 . 2]" 1
1348 1 87 ALA MB 1 88 LEU H . . 3.650 3.214 2.590 3.715 0.065 15 0 "[ . 1 . 2]" 1
1349 1 88 LEU H 1 88 LEU QB . . 3.540 2.428 2.175 3.364 . 0 0 "[ . 1 . 2]" 1
1350 1 88 LEU H 1 88 LEU QD . . 4.360 3.210 1.913 3.848 . 0 0 "[ . 1 . 2]" 1
1351 1 88 LEU H 1 88 LEU HG . . 4.550 4.077 2.436 4.673 0.123 16 0 "[ . 1 . 2]" 1
1352 1 88 LEU HA 1 88 LEU MD1 . . 4.070 3.040 2.067 4.165 0.095 20 0 "[ . 1 . 2]" 1
1353 1 88 LEU HA 1 88 LEU QD . . 3.020 2.438 1.969 3.425 0.405 18 0 "[ . 1 . 2]" 1
1354 1 88 LEU HA 1 88 LEU MD2 . . 4.070 3.130 2.002 4.151 0.081 18 0 "[ . 1 . 2]" 1
1355 1 88 LEU HA 1 88 LEU HG . . 3.750 3.313 2.544 3.821 0.071 20 0 "[ . 1 . 2]" 1
1356 1 88 LEU HA 1 89 GLU H . . 3.130 2.264 2.121 2.799 . 0 0 "[ . 1 . 2]" 1
1357 1 88 LEU QB 1 88 LEU QD . . 2.770 2.032 1.956 2.111 . 0 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Sunday, May 12, 2024 7:16:27 AM GMT (wattos1)