NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
405005 |
1x4q   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1x4q
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 2001
_Distance_constraint_stats_list.Viol_count 1301
_Distance_constraint_stats_list.Viol_total 3582.622
_Distance_constraint_stats_list.Viol_max 2.079
_Distance_constraint_stats_list.Viol_rms 0.0499
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0045
_Distance_constraint_stats_list.Viol_average_violations_only 0.1377
_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 8 MET 0.017 0.017 15 0 "[ . 1 . 2]"
1 9 ALA 2.835 0.254 9 0 "[ . 1 . 2]"
1 10 LEU 3.751 0.254 9 0 "[ . 1 . 2]"
1 11 SER 2.530 0.252 17 0 "[ . 1 . 2]"
1 12 LYS 1.102 0.153 19 0 "[ . 1 . 2]"
1 13 ARG 3.514 0.280 6 0 "[ . 1 . 2]"
1 14 GLU 0.334 0.148 17 0 "[ . 1 . 2]"
1 15 LEU 3.086 0.355 15 0 "[ . 1 . 2]"
1 16 ASP 0.001 0.001 15 0 "[ . 1 . 2]"
1 17 GLU 1.769 0.280 6 0 "[ . 1 . 2]"
1 18 LEU 20.594 0.743 4 5 "[ *+. *1 *. *2]"
1 19 LYS 18.043 0.518 13 5 "[* -.* 1 + . * 2]"
1 20 PRO 15.813 0.461 4 0 "[ . 1 . 2]"
1 21 TRP 21.704 0.461 4 0 "[ . 1 . 2]"
1 22 ILE 15.655 0.518 13 5 "[* -.* 1 + . * 2]"
1 23 GLU 6.081 0.440 1 0 "[ . 1 . 2]"
1 24 LYS 3.348 0.261 13 0 "[ . 1 . 2]"
1 25 THR 5.477 0.296 11 0 "[ . 1 . 2]"
1 26 VAL 4.350 0.296 3 0 "[ . 1 . 2]"
1 27 LYS 2.313 0.311 15 0 "[ . 1 . 2]"
1 28 ARG 2.985 0.266 6 0 "[ . 1 . 2]"
1 29 VAL 0.442 0.131 14 0 "[ . 1 . 2]"
1 30 LEU 5.788 0.669 7 3 "[ .*+ 1 - . 2]"
1 31 GLY 0.024 0.024 15 0 "[ . 1 . 2]"
1 32 PHE 1.649 0.267 15 0 "[ . 1 . 2]"
1 33 SER 2.135 0.311 15 0 "[ . 1 . 2]"
1 34 GLU 12.907 0.669 7 3 "[ .*+ 1 - . 2]"
1 35 PRO 0.101 0.013 7 0 "[ . 1 . 2]"
1 36 THR 4.419 0.201 6 0 "[ . 1 . 2]"
1 37 VAL 3.304 0.251 15 0 "[ . 1 . 2]"
1 38 VAL 0.998 0.271 1 0 "[ . 1 . 2]"
1 39 THR 2.841 0.201 6 0 "[ . 1 . 2]"
1 40 ALA 1.814 0.187 7 0 "[ . 1 . 2]"
1 41 ALA 0.004 0.004 7 0 "[ . 1 . 2]"
1 42 LEU 10.171 0.227 5 0 "[ . 1 . 2]"
1 43 ASN 0.056 0.050 9 0 "[ . 1 . 2]"
1 44 CYS 0.790 0.213 19 0 "[ . 1 . 2]"
1 45 VAL 2.045 0.283 20 0 "[ . 1 . 2]"
1 46 GLY 0.498 0.159 20 0 "[ . 1 . 2]"
1 47 LYS 0.861 0.085 6 0 "[ . 1 . 2]"
1 48 GLY 0.063 0.063 17 0 "[ . 1 . 2]"
1 49 MET 0.068 0.051 18 0 "[ . 1 . 2]"
1 50 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 LYS 0.002 0.002 18 0 "[ . 1 . 2]"
1 52 LYS 0.931 0.163 13 0 "[ . 1 . 2]"
1 53 LYS 0.060 0.051 18 0 "[ . 1 . 2]"
1 54 ALA 5.959 0.283 20 0 "[ . 1 . 2]"
1 55 ALA 1.428 0.337 10 0 "[ . 1 . 2]"
1 56 ASP 4.133 0.280 14 0 "[ . 1 . 2]"
1 57 HIS 0.498 0.183 14 0 "[ . 1 . 2]"
1 58 LEU 4.992 0.233 19 0 "[ . 1 . 2]"
1 59 LYS 2.452 0.240 16 0 "[ . 1 . 2]"
1 60 PRO 0.233 0.021 8 0 "[ . 1 . 2]"
1 61 PHE 1.335 0.299 8 0 "[ . 1 . 2]"
1 62 LEU 0.802 0.131 14 0 "[ . 1 . 2]"
1 63 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 THR 3.516 0.299 8 0 "[ . 1 . 2]"
1 67 LEU 0.016 0.014 17 0 "[ . 1 . 2]"
1 68 ARG 3.129 0.260 17 0 "[ . 1 . 2]"
1 69 PHE 6.266 0.337 10 0 "[ . 1 . 2]"
1 70 VAL 5.587 0.233 19 0 "[ . 1 . 2]"
1 71 ASP 0.002 0.002 8 0 "[ . 1 . 2]"
1 72 LYS 4.150 0.282 1 0 "[ . 1 . 2]"
1 73 LEU 11.600 0.631 6 3 "[ .+ * - . 2]"
1 74 PHE 5.188 0.356 20 0 "[ . 1 . 2]"
1 75 GLU 6.593 0.631 6 3 "[ .+ * - . 2]"
1 76 ALA 1.479 0.275 18 0 "[ . 1 . 2]"
1 77 VAL 35.252 2.079 17 20 [****************+*-*]
1 78 GLU 2.152 0.229 1 0 "[ . 1 . 2]"
1 79 GLU 1.747 0.275 18 0 "[ . 1 . 2]"
1 80 GLY 7.874 0.743 4 5 "[ *+. *1 *. *2]"
1 81 ARG 12.697 0.347 20 0 "[ . 1 . 2]"
1 82 SER 35.251 2.079 17 20 [****************+*-*]
1 83 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 ARG 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 8 MET H 1 8 MET HG2 . . 5.210 4.069 2.180 4.722 . 0 0 "[ . 1 . 2]" 1
2 1 8 MET H 1 8 MET QG . . 4.590 3.609 1.897 4.349 . 0 0 "[ . 1 . 2]" 1
3 1 8 MET H 1 8 MET HG3 . . 5.210 4.132 1.905 5.090 . 0 0 "[ . 1 . 2]" 1
4 1 8 MET HA 1 8 MET ME . . 4.830 3.902 3.156 4.589 . 0 0 "[ . 1 . 2]" 1
5 1 8 MET HA 1 9 ALA MB . . 4.510 4.038 3.712 4.386 . 0 0 "[ . 1 . 2]" 1
6 1 8 MET QB 1 9 ALA H . . 3.920 2.159 1.884 2.533 . 0 0 "[ . 1 . 2]" 1
7 1 8 MET QB 1 10 LEU H . . 5.340 4.318 2.683 5.117 . 0 0 "[ . 1 . 2]" 1
8 1 8 MET HB2 1 9 ALA H . . 4.540 3.202 1.901 3.729 . 0 0 "[ . 1 . 2]" 1
9 1 8 MET HB3 1 9 ALA H . . 4.540 2.465 1.901 3.701 . 0 0 "[ . 1 . 2]" 1
10 1 8 MET ME 1 9 ALA H . . 4.810 3.218 2.397 4.056 . 0 0 "[ . 1 . 2]" 1
11 1 8 MET ME 1 10 LEU H . . 3.870 3.210 1.914 3.834 . 0 0 "[ . 1 . 2]" 1
12 1 8 MET ME 1 10 LEU HA . . 5.010 2.987 2.100 5.027 0.017 15 0 "[ . 1 . 2]" 1
13 1 8 MET ME 1 10 LEU HB2 . . 4.470 3.854 2.959 4.211 . 0 0 "[ . 1 . 2]" 1
14 1 8 MET ME 1 10 LEU HB3 . . 4.770 3.920 3.397 4.519 . 0 0 "[ . 1 . 2]" 1
15 1 8 MET ME 1 10 LEU MD1 . . 5.500 3.679 2.788 4.921 . 0 0 "[ . 1 . 2]" 1
16 1 8 MET ME 1 10 LEU QD . . 4.810 2.667 1.822 4.300 . 0 0 "[ . 1 . 2]" 1
17 1 8 MET ME 1 10 LEU MD2 . . 5.500 3.012 1.836 4.921 . 0 0 "[ . 1 . 2]" 1
18 1 9 ALA H 1 9 ALA MB . . 3.460 2.733 2.076 2.936 . 0 0 "[ . 1 . 2]" 1
19 1 9 ALA H 1 10 LEU H . . 3.930 3.267 1.810 3.932 0.002 9 0 "[ . 1 . 2]" 1
20 1 9 ALA H 1 47 LYS HA . . 5.500 4.637 3.451 5.400 . 0 0 "[ . 1 . 2]" 1
21 1 9 ALA HA 1 10 LEU QD . . 5.440 4.269 3.768 4.917 . 0 0 "[ . 1 . 2]" 1
22 1 9 ALA MB 1 10 LEU H . . 3.610 2.997 2.188 3.549 . 0 0 "[ . 1 . 2]" 1
23 1 9 ALA MB 1 10 LEU HA . . 4.870 4.126 3.778 4.327 . 0 0 "[ . 1 . 2]" 1
24 1 9 ALA MB 1 10 LEU QD . . 4.470 4.115 2.855 4.724 0.254 9 0 "[ . 1 . 2]" 1
25 1 9 ALA MB 1 47 LYS HA . . 5.070 3.905 2.293 4.480 . 0 0 "[ . 1 . 2]" 1
26 1 9 ALA MB 1 48 GLY H . . 5.010 3.780 2.297 4.703 . 0 0 "[ . 1 . 2]" 1
27 1 9 ALA MB 1 48 GLY HA2 . . 5.500 4.461 2.696 5.243 . 0 0 "[ . 1 . 2]" 1
28 1 9 ALA MB 1 48 GLY QA . . 4.710 3.777 2.494 4.449 . 0 0 "[ . 1 . 2]" 1
29 1 9 ALA MB 1 48 GLY HA3 . . 5.500 4.107 2.756 4.817 . 0 0 "[ . 1 . 2]" 1
30 1 10 LEU H 1 10 LEU HB2 . . 3.010 2.544 2.406 2.631 . 0 0 "[ . 1 . 2]" 1
31 1 10 LEU H 1 10 LEU HB3 . . 3.730 3.676 3.597 3.744 0.014 5 0 "[ . 1 . 2]" 1
32 1 10 LEU H 1 10 LEU MD1 . . 4.420 3.150 2.437 3.831 . 0 0 "[ . 1 . 2]" 1
33 1 10 LEU H 1 10 LEU QD . . 3.540 2.977 2.417 3.336 . 0 0 "[ . 1 . 2]" 1
34 1 10 LEU H 1 10 LEU MD2 . . 4.420 3.983 3.355 4.188 . 0 0 "[ . 1 . 2]" 1
35 1 10 LEU H 1 10 LEU HG . . 3.140 2.711 2.450 2.909 . 0 0 "[ . 1 . 2]" 1
36 1 10 LEU H 1 11 SER H . . 4.830 4.555 4.503 4.607 . 0 0 "[ . 1 . 2]" 1
37 1 10 LEU H 1 15 LEU MD1 . . 3.290 3.245 3.111 3.295 0.005 5 0 "[ . 1 . 2]" 1
38 1 10 LEU H 1 15 LEU MD2 . . 5.070 4.503 4.077 4.928 . 0 0 "[ . 1 . 2]" 1
39 1 10 LEU H 1 46 GLY HA2 . . 5.010 2.466 2.072 2.893 . 0 0 "[ . 1 . 2]" 1
40 1 10 LEU H 1 46 GLY HA3 . . 5.500 3.870 3.473 4.329 . 0 0 "[ . 1 . 2]" 1
41 1 10 LEU HA 1 10 LEU MD1 . . 3.910 3.888 3.818 3.937 0.027 9 0 "[ . 1 . 2]" 1
42 1 10 LEU HA 1 10 LEU QD . . 3.400 2.587 1.945 2.951 . 0 0 "[ . 1 . 2]" 1
43 1 10 LEU HA 1 10 LEU MD2 . . 3.910 2.639 1.951 3.070 . 0 0 "[ . 1 . 2]" 1
44 1 10 LEU HA 1 10 LEU HG . . 4.090 2.822 2.613 3.189 . 0 0 "[ . 1 . 2]" 1
45 1 10 LEU HA 1 11 SER H . . 2.960 2.313 2.260 2.371 . 0 0 "[ . 1 . 2]" 1
46 1 10 LEU HA 1 14 GLU QB . . 4.510 3.273 2.902 3.881 . 0 0 "[ . 1 . 2]" 1
47 1 10 LEU HA 1 14 GLU QG . . 5.500 3.910 3.331 4.491 . 0 0 "[ . 1 . 2]" 1
48 1 10 LEU HA 1 15 LEU MD1 . . 4.890 4.330 4.040 4.612 . 0 0 "[ . 1 . 2]" 1
49 1 10 LEU HB2 1 10 LEU MD1 . . 3.620 2.122 1.967 2.409 . 0 0 "[ . 1 . 2]" 1
50 1 10 LEU HB2 1 10 LEU QD . . 3.040 2.085 1.945 2.342 . 0 0 "[ . 1 . 2]" 1
51 1 10 LEU HB2 1 10 LEU MD2 . . 3.620 3.068 2.954 3.192 . 0 0 "[ . 1 . 2]" 1
52 1 10 LEU HB2 1 10 LEU HG . . 2.970 2.689 2.410 2.841 . 0 0 "[ . 1 . 2]" 1
53 1 10 LEU HB2 1 11 SER H . . 3.830 3.725 3.563 3.832 0.002 17 0 "[ . 1 . 2]" 1
54 1 10 LEU HB2 1 14 GLU HB2 . . 4.320 3.631 3.202 4.247 . 0 0 "[ . 1 . 2]" 1
55 1 10 LEU HB2 1 14 GLU QB . . 3.800 3.361 2.992 3.858 0.058 15 0 "[ . 1 . 2]" 1
56 1 10 LEU HB2 1 14 GLU HB3 . . 4.320 4.006 3.592 4.468 0.148 17 0 "[ . 1 . 2]" 1
57 1 10 LEU HB2 1 15 LEU H . . 4.200 3.841 3.515 4.201 0.001 15 0 "[ . 1 . 2]" 1
58 1 10 LEU HB2 1 15 LEU MD1 . . 3.660 2.149 1.968 2.605 . 0 0 "[ . 1 . 2]" 1
59 1 10 LEU HB2 1 15 LEU MD2 . . 3.640 3.111 2.572 3.372 . 0 0 "[ . 1 . 2]" 1
60 1 10 LEU HB2 1 15 LEU HG . . 2.800 2.029 1.999 2.238 . 0 0 "[ . 1 . 2]" 1
61 1 10 LEU HB2 1 46 GLY HA2 . . 4.160 2.974 2.403 3.483 . 0 0 "[ . 1 . 2]" 1
62 1 10 LEU HB2 1 46 GLY HA3 . . 5.150 4.097 3.585 4.631 . 0 0 "[ . 1 . 2]" 1
63 1 10 LEU HB3 1 10 LEU MD1 . . 3.310 2.703 2.216 2.913 . 0 0 "[ . 1 . 2]" 1
64 1 10 LEU HB3 1 10 LEU QD . . 2.740 2.026 1.918 2.119 . 0 0 "[ . 1 . 2]" 1
65 1 10 LEU HB3 1 10 LEU MD2 . . 3.310 2.123 1.962 2.428 . 0 0 "[ . 1 . 2]" 1
66 1 10 LEU HB3 1 11 SER H . . 3.520 2.649 2.488 2.800 . 0 0 "[ . 1 . 2]" 1
67 1 10 LEU HB3 1 14 GLU QB . . 3.180 1.975 1.801 2.491 . 0 0 "[ . 1 . 2]" 1
68 1 10 LEU HB3 1 14 GLU QG . . 3.970 3.652 3.229 3.969 . 0 0 "[ . 1 . 2]" 1
69 1 10 LEU HB3 1 15 LEU H . . 4.790 3.239 2.958 3.527 . 0 0 "[ . 1 . 2]" 1
70 1 10 LEU QD 1 11 SER H . . 4.550 3.545 3.234 3.783 . 0 0 "[ . 1 . 2]" 1
71 1 10 LEU QD 1 14 GLU QB . . 3.330 2.149 1.924 2.838 . 0 0 "[ . 1 . 2]" 1
72 1 10 LEU QD 1 14 GLU QG . . 4.640 3.427 2.634 3.715 . 0 0 "[ . 1 . 2]" 1
73 1 10 LEU QD 1 15 LEU H . . 4.120 3.807 3.665 3.884 . 0 0 "[ . 1 . 2]" 1
74 1 10 LEU QD 1 15 LEU HA . . 3.230 3.176 2.823 3.370 0.140 20 0 "[ . 1 . 2]" 1
75 1 10 LEU QD 1 15 LEU HG . . 3.420 2.226 1.966 2.655 . 0 0 "[ . 1 . 2]" 1
76 1 10 LEU QD 1 46 GLY H . . 4.640 3.388 3.023 3.810 . 0 0 "[ . 1 . 2]" 1
77 1 10 LEU QD 1 46 GLY HA2 . . 3.720 2.304 1.958 3.157 . 0 0 "[ . 1 . 2]" 1
78 1 10 LEU QD 1 46 GLY HA3 . . 4.050 3.459 3.195 4.035 . 0 0 "[ . 1 . 2]" 1
79 1 10 LEU QD 1 48 GLY H . . 5.010 4.400 3.711 5.073 0.063 17 0 "[ . 1 . 2]" 1
80 1 10 LEU MD1 1 11 SER H . . 5.340 4.843 4.334 5.005 . 0 0 "[ . 1 . 2]" 1
81 1 10 LEU MD1 1 15 LEU HG . . 4.090 2.253 1.974 2.797 . 0 0 "[ . 1 . 2]" 1
82 1 10 LEU MD2 1 11 SER H . . 5.340 3.646 3.338 3.915 . 0 0 "[ . 1 . 2]" 1
83 1 10 LEU MD2 1 15 LEU HG . . 4.090 3.684 3.305 4.122 0.032 9 0 "[ . 1 . 2]" 1
84 1 10 LEU HG 1 11 SER H . . 5.470 4.748 4.545 5.060 . 0 0 "[ . 1 . 2]" 1
85 1 10 LEU HG 1 46 GLY HA2 . . 5.090 3.475 2.004 3.836 . 0 0 "[ . 1 . 2]" 1
86 1 10 LEU HG 1 46 GLY HA3 . . 5.500 5.172 3.717 5.505 0.005 6 0 "[ . 1 . 2]" 1
87 1 11 SER H 1 11 SER HB2 . . 3.840 2.765 2.477 3.590 . 0 0 "[ . 1 . 2]" 1
88 1 11 SER H 1 11 SER QB . . 3.250 2.535 2.296 2.966 . 0 0 "[ . 1 . 2]" 1
89 1 11 SER H 1 11 SER HB3 . . 3.840 3.298 2.513 3.656 . 0 0 "[ . 1 . 2]" 1
90 1 11 SER H 1 14 GLU H . . 4.580 3.494 3.186 3.951 . 0 0 "[ . 1 . 2]" 1
91 1 11 SER H 1 14 GLU HB2 . . 4.140 2.026 1.899 2.220 . 0 0 "[ . 1 . 2]" 1
92 1 11 SER H 1 14 GLU HB3 . . 4.140 3.302 3.146 3.514 . 0 0 "[ . 1 . 2]" 1
93 1 11 SER H 1 14 GLU QG . . 3.470 2.460 1.918 3.153 . 0 0 "[ . 1 . 2]" 1
94 1 11 SER H 1 15 LEU H . . 5.240 3.997 3.615 4.333 . 0 0 "[ . 1 . 2]" 1
95 1 11 SER H 1 15 LEU MD1 . . 4.540 4.193 3.725 4.532 . 0 0 "[ . 1 . 2]" 1
96 1 11 SER H 1 15 LEU HG . . 5.500 4.792 4.287 5.223 . 0 0 "[ . 1 . 2]" 1
97 1 11 SER HA 1 11 SER QB . . 2.370 2.313 2.158 2.384 0.014 17 0 "[ . 1 . 2]" 1
98 1 11 SER HA 1 12 LYS H . . 3.380 2.476 2.341 2.679 . 0 0 "[ . 1 . 2]" 1
99 1 11 SER HA 1 13 ARG H . . 4.490 4.360 4.120 4.472 . 0 0 "[ . 1 . 2]" 1
100 1 11 SER HA 1 14 GLU H . . 4.730 4.486 4.308 4.719 . 0 0 "[ . 1 . 2]" 1
101 1 11 SER HA 1 15 LEU H . . 5.500 5.014 4.816 5.199 . 0 0 "[ . 1 . 2]" 1
102 1 11 SER HA 1 15 LEU MD1 . . 5.190 4.017 3.454 4.466 . 0 0 "[ . 1 . 2]" 1
103 1 11 SER QB 1 13 ARG H . . 3.400 2.699 2.387 2.907 . 0 0 "[ . 1 . 2]" 1
104 1 11 SER QB 1 13 ARG QD . . 5.180 3.743 2.891 4.476 . 0 0 "[ . 1 . 2]" 1
105 1 11 SER QB 1 14 GLU H . . 4.550 2.608 2.171 3.485 . 0 0 "[ . 1 . 2]" 1
106 1 11 SER QB 1 14 GLU QG . . 5.340 2.536 2.005 3.819 . 0 0 "[ . 1 . 2]" 1
107 1 11 SER HB2 1 12 LYS H . . 3.490 3.283 1.988 3.643 0.153 19 0 "[ . 1 . 2]" 1
108 1 11 SER HB2 1 13 ARG H . . 4.040 3.231 2.402 4.292 0.252 17 0 "[ . 1 . 2]" 1
109 1 11 SER HB3 1 12 LYS H . . 3.490 2.760 2.230 3.514 0.024 13 0 "[ . 1 . 2]" 1
110 1 11 SER HB3 1 13 ARG H . . 4.040 3.228 2.719 4.232 0.192 3 0 "[ . 1 . 2]" 1
111 1 12 LYS H 1 12 LYS HB2 . . 3.270 2.292 2.063 2.579 . 0 0 "[ . 1 . 2]" 1
112 1 12 LYS H 1 12 LYS HB3 . . 3.270 2.840 2.483 3.222 . 0 0 "[ . 1 . 2]" 1
113 1 12 LYS H 1 12 LYS QG . . 4.620 3.908 3.496 4.044 . 0 0 "[ . 1 . 2]" 1
114 1 12 LYS H 1 13 ARG H . . 4.100 2.728 2.467 2.945 . 0 0 "[ . 1 . 2]" 1
115 1 12 LYS H 1 13 ARG QG . . 5.340 3.948 3.715 4.109 . 0 0 "[ . 1 . 2]" 1
116 1 12 LYS H 1 14 GLU H . . 5.320 4.119 3.847 4.604 . 0 0 "[ . 1 . 2]" 1
117 1 12 LYS HA 1 12 LYS QG . . 3.460 2.292 2.009 2.566 . 0 0 "[ . 1 . 2]" 1
118 1 12 LYS HA 1 15 LEU H . . 4.230 3.953 3.779 4.160 . 0 0 "[ . 1 . 2]" 1
119 1 12 LYS HA 1 15 LEU HB2 . . 3.880 3.384 3.100 3.760 . 0 0 "[ . 1 . 2]" 1
120 1 12 LYS HA 1 15 LEU MD1 . . 3.800 3.218 2.929 3.550 . 0 0 "[ . 1 . 2]" 1
121 1 12 LYS HA 1 16 ASP H . . 5.040 4.279 3.844 4.597 . 0 0 "[ . 1 . 2]" 1
122 1 12 LYS QB 1 12 LYS QD . . 2.530 2.040 1.945 2.248 . 0 0 "[ . 1 . 2]" 1
123 1 12 LYS QB 1 13 ARG H . . 3.710 2.701 2.413 2.985 . 0 0 "[ . 1 . 2]" 1
124 1 12 LYS HB2 1 13 ARG H . . 4.310 3.706 3.261 4.063 . 0 0 "[ . 1 . 2]" 1
125 1 12 LYS HB3 1 13 ARG H . . 4.310 2.795 2.443 3.227 . 0 0 "[ . 1 . 2]" 1
126 1 13 ARG H 1 13 ARG HB2 . . 3.670 3.608 3.574 3.645 . 0 0 "[ . 1 . 2]" 1
127 1 13 ARG H 1 13 ARG QB . . 3.180 2.639 2.538 2.768 . 0 0 "[ . 1 . 2]" 1
128 1 13 ARG H 1 13 ARG HB3 . . 3.670 2.714 2.594 2.870 . 0 0 "[ . 1 . 2]" 1
129 1 13 ARG H 1 13 ARG HG2 . . 3.750 2.163 1.905 2.636 . 0 0 "[ . 1 . 2]" 1
130 1 13 ARG H 1 13 ARG QG . . 3.220 2.028 1.892 2.259 . 0 0 "[ . 1 . 2]" 1
131 1 13 ARG H 1 13 ARG HG3 . . 3.750 2.961 2.054 3.554 . 0 0 "[ . 1 . 2]" 1
132 1 13 ARG H 1 14 GLU H . . 3.240 2.448 2.237 2.675 . 0 0 "[ . 1 . 2]" 1
133 1 13 ARG H 1 14 GLU QG . . 5.050 4.293 3.915 4.827 . 0 0 "[ . 1 . 2]" 1
134 1 13 ARG H 1 16 ASP H . . 4.730 4.654 4.486 4.731 0.001 15 0 "[ . 1 . 2]" 1
135 1 13 ARG HA 1 13 ARG HD2 . . 5.250 4.699 4.287 5.169 . 0 0 "[ . 1 . 2]" 1
136 1 13 ARG HA 1 13 ARG QD . . 4.570 4.187 4.054 4.263 . 0 0 "[ . 1 . 2]" 1
137 1 13 ARG HA 1 13 ARG HD3 . . 5.250 4.795 4.400 5.206 . 0 0 "[ . 1 . 2]" 1
138 1 13 ARG HA 1 13 ARG HG2 . . 4.040 3.781 3.596 4.042 0.002 15 0 "[ . 1 . 2]" 1
139 1 13 ARG HA 1 13 ARG QG . . 3.500 3.342 3.328 3.352 . 0 0 "[ . 1 . 2]" 1
140 1 13 ARG HA 1 13 ARG HG3 . . 4.040 3.763 3.567 3.981 . 0 0 "[ . 1 . 2]" 1
141 1 13 ARG HA 1 15 LEU H . . 4.760 4.702 4.421 4.843 0.083 13 0 "[ . 1 . 2]" 1
142 1 13 ARG HA 1 16 ASP H . . 4.300 3.459 3.161 3.743 . 0 0 "[ . 1 . 2]" 1
143 1 13 ARG HA 1 16 ASP HB2 . . 4.250 2.326 2.026 2.630 . 0 0 "[ . 1 . 2]" 1
144 1 13 ARG HA 1 16 ASP QB . . 3.450 2.272 1.979 2.582 . 0 0 "[ . 1 . 2]" 1
145 1 13 ARG HA 1 16 ASP HB3 . . 4.250 3.341 2.739 3.767 . 0 0 "[ . 1 . 2]" 1
146 1 13 ARG HA 1 17 GLU H . . 4.570 4.610 4.140 4.850 0.280 6 0 "[ . 1 . 2]" 1
147 1 13 ARG QB 1 14 GLU H . . 3.830 3.448 3.148 3.658 . 0 0 "[ . 1 . 2]" 1
148 1 13 ARG HB2 1 14 GLU H . . 4.510 3.764 3.385 4.053 . 0 0 "[ . 1 . 2]" 1
149 1 13 ARG HB3 1 14 GLU H . . 4.510 4.003 3.743 4.167 . 0 0 "[ . 1 . 2]" 1
150 1 13 ARG QD 1 14 GLU QG . . 4.520 3.802 2.457 4.519 . 0 0 "[ . 1 . 2]" 1
151 1 13 ARG QG 1 14 GLU H . . 3.180 2.051 1.778 2.373 . 0 0 "[ . 1 . 2]" 1
152 1 13 ARG QG 1 14 GLU QG . . 3.810 2.583 2.177 2.905 . 0 0 "[ . 1 . 2]" 1
153 1 13 ARG HG2 1 14 GLU H . . 3.750 2.774 1.938 3.672 . 0 0 "[ . 1 . 2]" 1
154 1 13 ARG HG3 1 14 GLU H . . 3.750 2.338 1.949 2.821 . 0 0 "[ . 1 . 2]" 1
155 1 14 GLU H 1 14 GLU HB2 . . 3.770 2.369 2.180 2.564 . 0 0 "[ . 1 . 2]" 1
156 1 14 GLU H 1 14 GLU QB . . 3.150 2.336 2.159 2.512 . 0 0 "[ . 1 . 2]" 1
157 1 14 GLU H 1 14 GLU HB3 . . 3.770 3.565 3.488 3.604 . 0 0 "[ . 1 . 2]" 1
158 1 14 GLU H 1 14 GLU QG . . 2.940 2.515 2.132 2.855 . 0 0 "[ . 1 . 2]" 1
159 1 14 GLU H 1 15 LEU H . . 3.260 2.776 2.503 3.030 . 0 0 "[ . 1 . 2]" 1
160 1 14 GLU H 1 16 ASP H . . 4.230 3.869 3.678 4.060 . 0 0 "[ . 1 . 2]" 1
161 1 14 GLU HA 1 14 GLU QG . . 3.320 2.392 2.231 2.694 . 0 0 "[ . 1 . 2]" 1
162 1 14 GLU HA 1 17 GLU H . . 4.440 3.843 3.701 4.054 . 0 0 "[ . 1 . 2]" 1
163 1 14 GLU HA 1 17 GLU QG . . 4.660 3.626 2.526 4.471 . 0 0 "[ . 1 . 2]" 1
164 1 14 GLU QB 1 15 LEU H . . 2.910 2.378 2.290 2.525 . 0 0 "[ . 1 . 2]" 1
165 1 14 GLU QB 1 15 LEU HG . . 5.040 3.539 3.239 3.817 . 0 0 "[ . 1 . 2]" 1
166 1 14 GLU HB2 1 15 LEU H . . 3.520 2.452 2.341 2.611 . 0 0 "[ . 1 . 2]" 1
167 1 14 GLU HB3 1 15 LEU H . . 3.520 3.252 2.890 3.501 . 0 0 "[ . 1 . 2]" 1
168 1 14 GLU QG 1 15 LEU H . . 4.260 4.084 3.856 4.259 . 0 0 "[ . 1 . 2]" 1
169 1 15 LEU H 1 15 LEU HB2 . . 3.050 2.282 2.185 2.422 . 0 0 "[ . 1 . 2]" 1
170 1 15 LEU H 1 15 LEU HB3 . . 3.820 3.541 3.495 3.581 . 0 0 "[ . 1 . 2]" 1
171 1 15 LEU H 1 15 LEU MD1 . . 3.650 2.987 2.607 3.291 . 0 0 "[ . 1 . 2]" 1
172 1 15 LEU H 1 15 LEU MD2 . . 4.770 4.115 3.939 4.174 . 0 0 "[ . 1 . 2]" 1
173 1 15 LEU H 1 15 LEU HG . . 3.010 2.847 2.510 3.012 0.002 5 0 "[ . 1 . 2]" 1
174 1 15 LEU H 1 16 ASP H . . 3.040 2.593 2.469 2.712 . 0 0 "[ . 1 . 2]" 1
175 1 15 LEU H 1 16 ASP HA . . 5.500 5.171 5.051 5.283 . 0 0 "[ . 1 . 2]" 1
176 1 15 LEU H 1 16 ASP QB . . 5.340 4.276 4.186 4.386 . 0 0 "[ . 1 . 2]" 1
177 1 15 LEU H 1 17 GLU H . . 4.670 4.331 4.193 4.445 . 0 0 "[ . 1 . 2]" 1
178 1 15 LEU H 1 18 LEU H . . 5.210 5.056 4.944 5.181 . 0 0 "[ . 1 . 2]" 1
179 1 15 LEU HA 1 15 LEU MD2 . . 2.990 2.726 2.554 2.887 . 0 0 "[ . 1 . 2]" 1
180 1 15 LEU HA 1 15 LEU HG . . 3.860 2.493 2.411 2.659 . 0 0 "[ . 1 . 2]" 1
181 1 15 LEU HA 1 17 GLU H . . 4.940 4.049 3.888 4.486 . 0 0 "[ . 1 . 2]" 1
182 1 15 LEU HA 1 18 LEU H . . 3.490 3.201 3.024 3.362 . 0 0 "[ . 1 . 2]" 1
183 1 15 LEU HA 1 18 LEU HB2 . . 3.460 2.480 2.342 2.691 . 0 0 "[ . 1 . 2]" 1
184 1 15 LEU HA 1 18 LEU HB3 . . 3.910 4.013 3.792 4.265 0.355 15 0 "[ . 1 . 2]" 1
185 1 15 LEU HA 1 18 LEU QD . . 5.280 2.755 2.380 3.069 . 0 0 "[ . 1 . 2]" 1
186 1 15 LEU HA 1 19 LYS H . . 5.450 4.385 4.181 4.697 . 0 0 "[ . 1 . 2]" 1
187 1 15 LEU HB2 1 15 LEU MD1 . . 3.090 2.022 1.958 2.149 . 0 0 "[ . 1 . 2]" 1
188 1 15 LEU HB2 1 15 LEU MD2 . . 3.560 3.071 3.019 3.121 . 0 0 "[ . 1 . 2]" 1
189 1 15 LEU HB2 1 16 ASP H . . 3.860 2.905 2.705 3.138 . 0 0 "[ . 1 . 2]" 1
190 1 15 LEU HB2 1 16 ASP HA . . 5.360 4.496 4.303 4.678 . 0 0 "[ . 1 . 2]" 1
191 1 15 LEU HB3 1 15 LEU MD2 . . 3.180 2.038 1.960 2.165 . 0 0 "[ . 1 . 2]" 1
192 1 15 LEU HB3 1 16 ASP H . . 4.090 3.627 3.467 3.877 . 0 0 "[ . 1 . 2]" 1
193 1 15 LEU MD1 1 16 ASP H . . 5.260 4.408 4.132 4.600 . 0 0 "[ . 1 . 2]" 1
194 1 15 LEU MD1 1 46 GLY H . . 5.500 4.285 4.016 4.658 . 0 0 "[ . 1 . 2]" 1
195 1 15 LEU MD1 1 46 GLY HA2 . . 3.440 2.901 2.662 3.411 . 0 0 "[ . 1 . 2]" 1
196 1 15 LEU MD1 1 46 GLY HA3 . . 3.350 2.857 2.646 3.196 . 0 0 "[ . 1 . 2]" 1
197 1 15 LEU MD2 1 16 ASP H . . 5.500 4.932 4.829 5.039 . 0 0 "[ . 1 . 2]" 1
198 1 15 LEU MD2 1 45 VAL H . . 5.350 4.569 4.378 4.731 . 0 0 "[ . 1 . 2]" 1
199 1 15 LEU MD2 1 45 VAL HB . . 3.960 3.850 3.709 3.962 0.002 8 0 "[ . 1 . 2]" 1
200 1 15 LEU MD2 1 46 GLY H . . 4.630 2.976 2.586 3.319 . 0 0 "[ . 1 . 2]" 1
201 1 15 LEU MD2 1 46 GLY HA2 . . 3.550 3.040 2.010 3.456 . 0 0 "[ . 1 . 2]" 1
202 1 15 LEU MD2 1 46 GLY HA3 . . 3.500 2.745 2.267 3.129 . 0 0 "[ . 1 . 2]" 1
203 1 15 LEU MD2 1 47 LYS H . . 5.500 4.847 4.406 5.133 . 0 0 "[ . 1 . 2]" 1
204 1 15 LEU HG 1 16 ASP H . . 5.170 4.758 4.569 4.882 . 0 0 "[ . 1 . 2]" 1
205 1 15 LEU HG 1 45 VAL MG2 . . 5.500 3.934 3.646 4.264 . 0 0 "[ . 1 . 2]" 1
206 1 15 LEU HG 1 46 GLY HA2 . . 5.480 3.940 3.463 4.546 . 0 0 "[ . 1 . 2]" 1
207 1 15 LEU HG 1 46 GLY HA3 . . 5.500 4.433 4.129 4.879 . 0 0 "[ . 1 . 2]" 1
208 1 16 ASP H 1 16 ASP HB2 . . 3.870 2.136 2.066 2.283 . 0 0 "[ . 1 . 2]" 1
209 1 16 ASP H 1 16 ASP QB . . 3.220 2.101 2.045 2.189 . 0 0 "[ . 1 . 2]" 1
210 1 16 ASP H 1 16 ASP HB3 . . 3.870 3.201 2.812 3.502 . 0 0 "[ . 1 . 2]" 1
211 1 16 ASP H 1 17 GLU H . . 3.430 2.761 2.631 2.869 . 0 0 "[ . 1 . 2]" 1
212 1 16 ASP H 1 17 GLU QB . . 5.470 4.716 4.498 5.048 . 0 0 "[ . 1 . 2]" 1
213 1 16 ASP H 1 18 LEU H . . 4.850 4.017 3.859 4.139 . 0 0 "[ . 1 . 2]" 1
214 1 16 ASP HA 1 19 LYS H . . 3.760 3.386 3.229 3.524 . 0 0 "[ . 1 . 2]" 1
215 1 16 ASP HA 1 19 LYS HB2 . . 4.050 2.713 2.598 2.786 . 0 0 "[ . 1 . 2]" 1
216 1 16 ASP HA 1 19 LYS HB3 . . 4.600 4.307 4.185 4.335 . 0 0 "[ . 1 . 2]" 1
217 1 16 ASP HA 1 19 LYS QD . . 4.450 2.604 2.304 2.958 . 0 0 "[ . 1 . 2]" 1
218 1 16 ASP QB 1 17 GLU H . . 3.190 2.723 2.385 2.856 . 0 0 "[ . 1 . 2]" 1
219 1 16 ASP HB2 1 17 GLU H . . 3.710 3.324 2.899 3.696 . 0 0 "[ . 1 . 2]" 1
220 1 16 ASP HB3 1 17 GLU H . . 3.710 2.956 2.423 3.319 . 0 0 "[ . 1 . 2]" 1
221 1 17 GLU H 1 17 GLU QB . . 2.960 2.321 2.101 2.610 . 0 0 "[ . 1 . 2]" 1
222 1 17 GLU H 1 17 GLU HG2 . . 3.740 3.023 1.896 3.708 . 0 0 "[ . 1 . 2]" 1
223 1 17 GLU H 1 17 GLU QG . . 3.180 2.555 1.879 3.119 . 0 0 "[ . 1 . 2]" 1
224 1 17 GLU H 1 17 GLU HG3 . . 3.740 3.132 2.285 3.742 0.002 16 0 "[ . 1 . 2]" 1
225 1 17 GLU H 1 18 LEU QD . . 5.390 4.243 3.411 5.195 . 0 0 "[ . 1 . 2]" 1
226 1 17 GLU HA 1 17 GLU HG2 . . 4.050 2.616 2.061 3.850 . 0 0 "[ . 1 . 2]" 1
227 1 17 GLU HA 1 17 GLU QG . . 3.390 2.498 2.039 3.331 . 0 0 "[ . 1 . 2]" 1
228 1 17 GLU HA 1 17 GLU HG3 . . 4.050 3.432 2.812 3.795 . 0 0 "[ . 1 . 2]" 1
229 1 17 GLU HA 1 19 LYS H . . 4.740 4.365 4.211 4.468 . 0 0 "[ . 1 . 2]" 1
230 1 17 GLU HA 1 20 PRO HD2 . . 4.530 3.224 3.141 3.323 . 0 0 "[ . 1 . 2]" 1
231 1 17 GLU HA 1 20 PRO HD3 . . 4.930 4.096 3.974 4.263 . 0 0 "[ . 1 . 2]" 1
232 1 17 GLU HA 1 20 PRO HG2 . . 5.270 3.361 3.116 3.583 . 0 0 "[ . 1 . 2]" 1
233 1 17 GLU HA 1 20 PRO QG . . 4.430 3.027 2.833 3.202 . 0 0 "[ . 1 . 2]" 1
234 1 17 GLU HA 1 20 PRO HG3 . . 5.270 3.440 3.254 3.604 . 0 0 "[ . 1 . 2]" 1
235 1 17 GLU QB 1 18 LEU H . . 3.830 3.027 2.789 3.586 . 0 0 "[ . 1 . 2]" 1
236 1 17 GLU QB 1 18 LEU QD . . 4.580 3.387 2.507 4.597 0.017 18 0 "[ . 1 . 2]" 1
237 1 17 GLU QG 1 18 LEU H . . 4.560 4.137 2.489 4.544 . 0 0 "[ . 1 . 2]" 1
238 1 18 LEU H 1 18 LEU HB2 . . 2.940 2.154 2.086 2.250 . 0 0 "[ . 1 . 2]" 1
239 1 18 LEU H 1 18 LEU HB3 . . 3.450 3.402 3.258 3.536 0.086 15 0 "[ . 1 . 2]" 1
240 1 18 LEU H 1 18 LEU MD1 . . 4.590 3.666 2.974 4.145 . 0 0 "[ . 1 . 2]" 1
241 1 18 LEU H 1 18 LEU QD . . 3.570 2.868 1.941 3.573 0.003 17 0 "[ . 1 . 2]" 1
242 1 18 LEU H 1 18 LEU MD2 . . 4.590 3.414 1.945 4.395 . 0 0 "[ . 1 . 2]" 1
243 1 18 LEU H 1 18 LEU HG . . 4.570 3.964 3.161 4.547 . 0 0 "[ . 1 . 2]" 1
244 1 18 LEU H 1 19 LYS H . . 2.840 2.376 2.210 2.507 . 0 0 "[ . 1 . 2]" 1
245 1 18 LEU H 1 20 PRO HD2 . . 3.500 3.403 3.272 3.489 . 0 0 "[ . 1 . 2]" 1
246 1 18 LEU H 1 20 PRO HD3 . . 5.360 4.844 4.694 4.942 . 0 0 "[ . 1 . 2]" 1
247 1 18 LEU HA 1 18 LEU MD1 . . 3.760 2.684 2.038 3.800 0.040 18 0 "[ . 1 . 2]" 1
248 1 18 LEU HA 1 18 LEU QD . . 3.180 2.125 1.936 2.474 . 0 0 "[ . 1 . 2]" 1
249 1 18 LEU HA 1 18 LEU MD2 . . 3.760 2.737 1.954 3.780 0.020 19 0 "[ . 1 . 2]" 1
250 1 18 LEU HA 1 18 LEU HG . . 4.190 2.995 2.345 3.723 . 0 0 "[ . 1 . 2]" 1
251 1 18 LEU HA 1 21 TRP H . . 3.940 3.140 3.102 3.168 . 0 0 "[ . 1 . 2]" 1
252 1 18 LEU HA 1 21 TRP QB . . 4.460 2.096 2.051 2.137 . 0 0 "[ . 1 . 2]" 1
253 1 18 LEU HA 1 21 TRP HE3 . . 5.500 4.544 4.416 4.646 . 0 0 "[ . 1 . 2]" 1
254 1 18 LEU HA 1 22 ILE H . . 5.120 4.058 4.035 4.088 . 0 0 "[ . 1 . 2]" 1
255 1 18 LEU HA 1 22 ILE MD . . 5.470 4.022 3.813 4.187 . 0 0 "[ . 1 . 2]" 1
256 1 18 LEU HB2 1 18 LEU QD . . 2.980 2.176 1.971 2.455 . 0 0 "[ . 1 . 2]" 1
257 1 18 LEU HB2 1 19 LYS H . . 3.620 3.007 2.773 3.220 . 0 0 "[ . 1 . 2]" 1
258 1 18 LEU HB3 1 18 LEU MD1 . . 3.640 2.606 2.240 3.194 . 0 0 "[ . 1 . 2]" 1
259 1 18 LEU HB3 1 18 LEU MD2 . . 3.640 2.666 2.217 3.195 . 0 0 "[ . 1 . 2]" 1
260 1 18 LEU HB3 1 19 LYS H . . 3.530 3.302 3.137 3.504 . 0 0 "[ . 1 . 2]" 1
261 1 18 LEU HB3 1 19 LYS HA . . 4.420 4.047 3.919 4.219 . 0 0 "[ . 1 . 2]" 1
262 1 18 LEU HB3 1 22 ILE MD . . 3.040 2.001 1.876 2.250 . 0 0 "[ . 1 . 2]" 1
263 1 18 LEU HB3 1 22 ILE QG . . 4.560 2.721 2.574 2.879 . 0 0 "[ . 1 . 2]" 1
264 1 18 LEU QD 1 19 LYS H . . 4.710 4.031 3.779 4.218 . 0 0 "[ . 1 . 2]" 1
265 1 18 LEU QD 1 19 LYS HA . . 5.440 4.980 4.696 5.165 . 0 0 "[ . 1 . 2]" 1
266 1 18 LEU QD 1 21 TRP H . . 5.120 4.208 3.910 4.590 . 0 0 "[ . 1 . 2]" 1
267 1 18 LEU QD 1 21 TRP QB . . 3.880 2.479 2.070 2.934 . 0 0 "[ . 1 . 2]" 1
268 1 18 LEU QD 1 21 TRP HD1 . . 5.440 4.565 4.331 4.842 . 0 0 "[ . 1 . 2]" 1
269 1 18 LEU QD 1 21 TRP HE3 . . 4.340 3.331 2.719 4.283 . 0 0 "[ . 1 . 2]" 1
270 1 18 LEU QD 1 22 ILE H . . 5.440 4.212 3.590 4.909 . 0 0 "[ . 1 . 2]" 1
271 1 18 LEU QD 1 22 ILE HB . . 4.880 4.749 4.111 5.263 0.383 19 0 "[ . 1 . 2]" 1
272 1 18 LEU QD 1 22 ILE QG . . 3.170 2.624 1.892 3.385 0.215 19 0 "[ . 1 . 2]" 1
273 1 18 LEU QD 1 77 VAL H . . 5.200 3.562 3.277 3.931 . 0 0 "[ . 1 . 2]" 1
274 1 18 LEU QD 1 77 VAL HA . . 3.630 2.685 2.333 2.928 . 0 0 "[ . 1 . 2]" 1
275 1 18 LEU QD 1 80 GLY H . . 4.430 4.081 3.510 4.349 . 0 0 "[ . 1 . 2]" 1
276 1 18 LEU QD 1 80 GLY HA2 . . 5.440 5.027 4.428 5.298 . 0 0 "[ . 1 . 2]" 1
277 1 18 LEU QD 1 80 GLY HA3 . . 4.330 3.693 2.981 4.021 . 0 0 "[ . 1 . 2]" 1
278 1 18 LEU QD 1 81 ARG H . . 4.400 4.275 3.980 4.409 0.009 8 0 "[ . 1 . 2]" 1
279 1 18 LEU QD 1 81 ARG HA . . 5.100 5.350 5.098 5.447 0.347 20 0 "[ . 1 . 2]" 1
280 1 18 LEU QD 1 81 ARG HB3 . . 5.440 5.489 5.271 5.725 0.285 19 0 "[ . 1 . 2]" 1
281 1 18 LEU QD 1 81 ARG QD . . 3.740 3.225 2.746 3.906 0.166 19 0 "[ . 1 . 2]" 1
282 1 18 LEU QD 1 81 ARG HG2 . . 3.910 3.768 3.469 4.069 0.159 19 0 "[ . 1 . 2]" 1
283 1 18 LEU QD 1 81 ARG HG3 . . 3.260 3.350 3.184 3.465 0.205 14 0 "[ . 1 . 2]" 1
284 1 18 LEU MD1 1 19 LYS H . . 5.430 4.662 4.479 4.826 . 0 0 "[ . 1 . 2]" 1
285 1 18 LEU MD1 1 80 GLY H . . 5.500 4.734 4.088 5.594 0.094 18 0 "[ . 1 . 2]" 1
286 1 18 LEU MD1 1 80 GLY HA3 . . 5.500 4.365 3.643 5.342 . 0 0 "[ . 1 . 2]" 1
287 1 18 LEU MD1 1 81 ARG QD . . 4.910 3.848 2.763 4.914 0.004 15 0 "[ . 1 . 2]" 1
288 1 18 LEU MD2 1 19 LYS H . . 5.430 4.453 3.994 4.835 . 0 0 "[ . 1 . 2]" 1
289 1 18 LEU MD2 1 80 GLY H . . 5.500 4.990 3.547 6.243 0.743 4 5 "[ *+. -1 *. *2]" 1
290 1 18 LEU MD2 1 80 GLY HA3 . . 5.500 4.585 2.996 6.115 0.615 14 4 "[ *-. 1 +. *2]" 1
291 1 18 LEU MD2 1 81 ARG QD . . 4.910 4.134 2.991 4.914 0.004 4 0 "[ . 1 . 2]" 1
292 1 18 LEU HG 1 19 LYS H . . 5.440 5.064 4.897 5.134 . 0 0 "[ . 1 . 2]" 1
293 1 18 LEU HG 1 77 VAL HA . . 5.120 4.396 3.534 5.056 . 0 0 "[ . 1 . 2]" 1
294 1 19 LYS H 1 19 LYS HB2 . . 3.050 2.103 2.082 2.116 . 0 0 "[ . 1 . 2]" 1
295 1 19 LYS H 1 19 LYS HB3 . . 3.560 3.365 3.324 3.384 . 0 0 "[ . 1 . 2]" 1
296 1 19 LYS H 1 19 LYS QD . . 3.740 3.842 3.693 3.973 0.233 10 0 "[ . 1 . 2]" 1
297 1 19 LYS H 1 19 LYS HG2 . . 4.590 4.404 4.354 4.470 . 0 0 "[ . 1 . 2]" 1
298 1 19 LYS H 1 19 LYS HG3 . . 4.070 3.426 3.374 3.518 . 0 0 "[ . 1 . 2]" 1
299 1 19 LYS H 1 20 PRO HD2 . . 3.340 2.347 2.280 2.387 . 0 0 "[ . 1 . 2]" 1
300 1 19 LYS H 1 20 PRO HD3 . . 3.500 3.362 3.296 3.399 . 0 0 "[ . 1 . 2]" 1
301 1 19 LYS H 1 21 TRP H . . 4.800 3.884 3.862 3.912 . 0 0 "[ . 1 . 2]" 1
302 1 19 LYS H 1 22 ILE H . . 4.980 4.709 4.691 4.719 . 0 0 "[ . 1 . 2]" 1
303 1 19 LYS H 1 22 ILE MD . . 4.160 4.000 3.835 4.204 0.044 13 0 "[ . 1 . 2]" 1
304 1 19 LYS H 1 42 LEU MD1 . . 5.500 4.414 4.218 4.625 . 0 0 "[ . 1 . 2]" 1
305 1 19 LYS H 1 42 LEU MD2 . . 4.320 2.874 2.527 3.120 . 0 0 "[ . 1 . 2]" 1
306 1 19 LYS HA 1 19 LYS QD . . 4.580 3.901 3.842 3.944 . 0 0 "[ . 1 . 2]" 1
307 1 19 LYS HA 1 19 LYS HG2 . . 3.780 2.745 2.648 2.874 . 0 0 "[ . 1 . 2]" 1
308 1 19 LYS HA 1 19 LYS HG3 . . 3.690 2.278 2.178 2.360 . 0 0 "[ . 1 . 2]" 1
309 1 19 LYS HA 1 21 TRP H . . 4.400 4.000 3.951 4.080 . 0 0 "[ . 1 . 2]" 1
310 1 19 LYS HA 1 22 ILE H . . 4.100 3.655 3.622 3.691 . 0 0 "[ . 1 . 2]" 1
311 1 19 LYS HA 1 22 ILE HB . . 3.400 3.370 3.265 3.424 0.024 10 0 "[ . 1 . 2]" 1
312 1 19 LYS HA 1 22 ILE MD . . 3.310 3.220 2.959 3.309 . 0 0 "[ . 1 . 2]" 1
313 1 19 LYS HA 1 22 ILE QG . . 4.010 4.005 3.904 4.121 0.111 18 0 "[ . 1 . 2]" 1
314 1 19 LYS HA 1 22 ILE MG . . 4.270 4.721 4.628 4.788 0.518 13 5 "[* -.* 1 + . * 2]" 1
315 1 19 LYS HA 1 23 GLU H . . 4.400 4.001 3.859 4.070 . 0 0 "[ . 1 . 2]" 1
316 1 19 LYS HA 1 23 GLU QG . . 5.500 3.734 3.384 4.027 . 0 0 "[ . 1 . 2]" 1
317 1 19 LYS HA 1 42 LEU MD1 . . 3.660 2.843 2.442 3.129 . 0 0 "[ . 1 . 2]" 1
318 1 19 LYS HA 1 42 LEU MD2 . . 3.190 2.395 2.112 2.642 . 0 0 "[ . 1 . 2]" 1
319 1 19 LYS HB2 1 19 LYS QD . . 2.630 2.211 2.083 2.344 . 0 0 "[ . 1 . 2]" 1
320 1 19 LYS HB2 1 19 LYS QE . . 5.130 3.869 3.527 4.026 . 0 0 "[ . 1 . 2]" 1
321 1 19 LYS HB2 1 20 PRO HD2 . . 3.260 2.716 2.674 2.771 . 0 0 "[ . 1 . 2]" 1
322 1 19 LYS HB2 1 20 PRO HD3 . . 3.510 2.396 2.358 2.446 . 0 0 "[ . 1 . 2]" 1
323 1 19 LYS HB2 1 42 LEU MD2 . . 3.500 3.518 3.268 3.714 0.214 18 0 "[ . 1 . 2]" 1
324 1 19 LYS HB3 1 19 LYS QD . . 3.310 2.583 2.427 2.759 . 0 0 "[ . 1 . 2]" 1
325 1 19 LYS HB3 1 20 PRO HD2 . . 3.690 3.052 3.047 3.057 . 0 0 "[ . 1 . 2]" 1
326 1 19 LYS HB3 1 20 PRO HD3 . . 3.040 1.996 1.991 2.001 . 0 0 "[ . 1 . 2]" 1
327 1 19 LYS HB3 1 42 LEU MD2 . . 4.530 4.348 4.096 4.531 0.001 18 0 "[ . 1 . 2]" 1
328 1 19 LYS QD 1 20 PRO HD3 . . 4.340 3.738 3.615 3.860 . 0 0 "[ . 1 . 2]" 1
329 1 19 LYS QD 1 23 GLU QG . . 5.500 5.237 5.173 5.279 . 0 0 "[ . 1 . 2]" 1
330 1 19 LYS QD 1 42 LEU MD1 . . 3.420 3.579 3.136 3.647 0.227 5 0 "[ . 1 . 2]" 1
331 1 19 LYS QE 1 38 VAL MG1 . . 4.390 4.332 4.031 4.661 0.271 1 0 "[ . 1 . 2]" 1
332 1 19 LYS QE 1 42 LEU MD1 . . 5.500 2.713 2.109 4.080 . 0 0 "[ . 1 . 2]" 1
333 1 19 LYS QE 1 42 LEU MD2 . . 5.500 3.702 2.648 5.013 . 0 0 "[ . 1 . 2]" 1
334 1 19 LYS HG2 1 20 PRO HA . . 5.500 5.382 5.325 5.424 . 0 0 "[ . 1 . 2]" 1
335 1 19 LYS HG2 1 20 PRO HD2 . . 5.500 5.069 5.061 5.082 . 0 0 "[ . 1 . 2]" 1
336 1 19 LYS HG2 1 20 PRO HD3 . . 4.460 4.319 4.276 4.353 . 0 0 "[ . 1 . 2]" 1
337 1 19 LYS HG2 1 23 GLU H . . 5.500 5.485 5.296 5.522 0.022 11 0 "[ . 1 . 2]" 1
338 1 19 LYS HG2 1 23 GLU QG . . 4.150 3.629 3.379 3.775 . 0 0 "[ . 1 . 2]" 1
339 1 19 LYS HG2 1 38 VAL MG1 . . 3.870 3.642 3.396 3.794 . 0 0 "[ . 1 . 2]" 1
340 1 19 LYS HG2 1 42 LEU MD1 . . 4.150 2.930 2.649 3.171 . 0 0 "[ . 1 . 2]" 1
341 1 19 LYS HG3 1 20 PRO HD3 . . 4.980 4.640 4.620 4.667 . 0 0 "[ . 1 . 2]" 1
342 1 19 LYS HG3 1 23 GLU QG . . 4.750 4.709 4.405 4.830 0.080 14 0 "[ . 1 . 2]" 1
343 1 19 LYS HG3 1 38 VAL MG1 . . 5.300 3.949 3.723 4.187 . 0 0 "[ . 1 . 2]" 1
344 1 19 LYS HG3 1 42 LEU MD1 . . 3.490 2.018 1.942 2.173 . 0 0 "[ . 1 . 2]" 1
345 1 20 PRO HA 1 23 GLU H . . 4.160 3.699 3.593 3.788 . 0 0 "[ . 1 . 2]" 1
346 1 20 PRO HA 1 23 GLU HB2 . . 3.750 2.766 2.648 2.894 . 0 0 "[ . 1 . 2]" 1
347 1 20 PRO HA 1 23 GLU HB3 . . 4.640 4.303 3.984 4.517 . 0 0 "[ . 1 . 2]" 1
348 1 20 PRO HA 1 23 GLU QG . . 3.540 3.801 3.448 3.980 0.440 1 0 "[ . 1 . 2]" 1
349 1 20 PRO HA 1 24 LYS H . . 4.640 4.313 4.191 4.515 . 0 0 "[ . 1 . 2]" 1
350 1 20 PRO HA 1 24 LYS QG . . 5.340 4.607 4.305 5.032 . 0 0 "[ . 1 . 2]" 1
351 1 20 PRO QB 1 21 TRP H . . 3.440 3.520 3.471 3.546 0.106 4 0 "[ . 1 . 2]" 1
352 1 20 PRO QB 1 21 TRP QB . . 5.250 4.348 4.316 4.364 . 0 0 "[ . 1 . 2]" 1
353 1 20 PRO QB 1 22 ILE H . . 5.340 5.032 4.974 5.074 . 0 0 "[ . 1 . 2]" 1
354 1 20 PRO HB2 1 21 TRP H . . 3.920 3.715 3.655 3.747 . 0 0 "[ . 1 . 2]" 1
355 1 20 PRO HB3 1 21 TRP H . . 3.920 4.362 4.328 4.381 0.461 4 0 "[ . 1 . 2]" 1
356 1 20 PRO HD2 1 21 TRP H . . 3.670 2.776 2.737 2.799 . 0 0 "[ . 1 . 2]" 1
357 1 20 PRO HD2 1 22 ILE H . . 4.530 4.520 4.482 4.540 0.010 10 0 "[ . 1 . 2]" 1
358 1 20 PRO HD3 1 21 TRP H . . 4.240 3.911 3.890 3.924 . 0 0 "[ . 1 . 2]" 1
359 1 20 PRO QG 1 21 TRP H . . 3.910 2.864 2.774 2.912 . 0 0 "[ . 1 . 2]" 1
360 1 21 TRP H 1 21 TRP QB . . 2.930 2.342 2.325 2.353 . 0 0 "[ . 1 . 2]" 1
361 1 21 TRP H 1 22 ILE H . . 3.190 2.220 2.190 2.270 . 0 0 "[ . 1 . 2]" 1
362 1 21 TRP H 1 22 ILE HB . . 5.500 4.543 4.469 4.592 . 0 0 "[ . 1 . 2]" 1
363 1 21 TRP H 1 22 ILE MD . . 5.020 4.680 4.473 4.743 . 0 0 "[ . 1 . 2]" 1
364 1 21 TRP H 1 22 ILE QG . . 3.970 3.702 3.627 3.766 . 0 0 "[ . 1 . 2]" 1
365 1 21 TRP H 1 23 GLU H . . 4.800 3.813 3.670 3.903 . 0 0 "[ . 1 . 2]" 1
366 1 21 TRP H 1 23 GLU QG . . 5.500 5.216 4.926 5.515 0.015 18 0 "[ . 1 . 2]" 1
367 1 21 TRP H 1 24 LYS H . . 5.140 4.873 4.786 4.924 . 0 0 "[ . 1 . 2]" 1
368 1 21 TRP HA 1 21 TRP HD1 . . 4.330 3.539 3.514 3.579 . 0 0 "[ . 1 . 2]" 1
369 1 21 TRP HA 1 21 TRP HE3 . . 4.260 4.000 3.956 4.023 . 0 0 "[ . 1 . 2]" 1
370 1 21 TRP HA 1 23 GLU H . . 5.160 4.696 4.487 4.803 . 0 0 "[ . 1 . 2]" 1
371 1 21 TRP HA 1 24 LYS H . . 3.990 4.039 3.973 4.114 0.124 13 0 "[ . 1 . 2]" 1
372 1 21 TRP HA 1 24 LYS QB . . 4.300 4.337 4.202 4.561 0.261 13 0 "[ . 1 . 2]" 1
373 1 21 TRP HA 1 24 LYS QD . . 4.930 2.946 2.162 3.607 . 0 0 "[ . 1 . 2]" 1
374 1 21 TRP HA 1 24 LYS QE . . 4.960 2.724 1.949 3.731 . 0 0 "[ . 1 . 2]" 1
375 1 21 TRP HA 1 24 LYS QG . . 4.460 2.505 2.339 2.771 . 0 0 "[ . 1 . 2]" 1
376 1 21 TRP HA 1 25 THR H . . 5.160 4.490 4.370 4.654 . 0 0 "[ . 1 . 2]" 1
377 1 21 TRP QB 1 21 TRP HD1 . . 3.580 2.533 2.526 2.540 . 0 0 "[ . 1 . 2]" 1
378 1 21 TRP QB 1 21 TRP HE3 . . 3.600 2.724 2.708 2.748 . 0 0 "[ . 1 . 2]" 1
379 1 21 TRP QB 1 22 ILE H . . 3.290 2.922 2.866 2.986 . 0 0 "[ . 1 . 2]" 1
380 1 21 TRP QB 1 22 ILE MD . . 4.840 4.172 4.017 4.257 . 0 0 "[ . 1 . 2]" 1
381 1 21 TRP QB 1 22 ILE QG . . 4.720 2.882 2.795 2.951 . 0 0 "[ . 1 . 2]" 1
382 1 21 TRP QB 1 24 LYS H . . 5.420 5.396 5.335 5.428 0.008 9 0 "[ . 1 . 2]" 1
383 1 21 TRP QB 1 76 ALA MB . . 4.200 3.935 3.694 4.119 . 0 0 "[ . 1 . 2]" 1
384 1 21 TRP HD1 1 24 LYS QD . . 5.110 4.872 4.372 5.112 0.002 12 0 "[ . 1 . 2]" 1
385 1 21 TRP HD1 1 24 LYS QE . . 5.500 3.920 3.330 4.583 . 0 0 "[ . 1 . 2]" 1
386 1 21 TRP HD1 1 76 ALA MB . . 5.320 4.957 4.647 5.218 . 0 0 "[ . 1 . 2]" 1
387 1 21 TRP HD1 1 79 GLU HB3 . . 5.410 5.048 4.480 5.423 0.013 8 0 "[ . 1 . 2]" 1
388 1 21 TRP HD1 1 80 GLY HA2 . . 5.340 3.124 2.302 3.892 . 0 0 "[ . 1 . 2]" 1
389 1 21 TRP HE1 1 76 ALA MB . . 4.980 4.207 3.869 4.478 . 0 0 "[ . 1 . 2]" 1
390 1 21 TRP HE1 1 79 GLU HB3 . . 5.500 3.001 2.438 3.337 . 0 0 "[ . 1 . 2]" 1
391 1 21 TRP HE1 1 79 GLU QG . . 5.290 3.194 2.371 4.128 . 0 0 "[ . 1 . 2]" 1
392 1 21 TRP HE1 1 80 GLY H . . 5.500 3.613 3.259 4.160 . 0 0 "[ . 1 . 2]" 1
393 1 21 TRP HE1 1 80 GLY HA2 . . 4.950 3.155 2.978 3.321 . 0 0 "[ . 1 . 2]" 1
394 1 21 TRP HE1 1 80 GLY HA3 . . 5.500 3.655 3.381 4.023 . 0 0 "[ . 1 . 2]" 1
395 1 21 TRP HE3 1 22 ILE H . . 4.920 3.524 3.423 3.701 . 0 0 "[ . 1 . 2]" 1
396 1 21 TRP HE3 1 22 ILE HA . . 3.910 2.517 2.387 2.647 . 0 0 "[ . 1 . 2]" 1
397 1 21 TRP HE3 1 22 ILE MD . . 4.650 4.122 4.027 4.297 . 0 0 "[ . 1 . 2]" 1
398 1 21 TRP HE3 1 22 ILE QG . . 3.790 2.491 2.392 2.668 . 0 0 "[ . 1 . 2]" 1
399 1 21 TRP HE3 1 22 ILE MG . . 4.860 3.997 3.868 4.163 . 0 0 "[ . 1 . 2]" 1
400 1 21 TRP HE3 1 73 LEU HA . . 5.500 4.667 4.387 4.998 . 0 0 "[ . 1 . 2]" 1
401 1 21 TRP HE3 1 73 LEU MD1 . . 5.090 4.180 3.908 4.431 . 0 0 "[ . 1 . 2]" 1
402 1 21 TRP HE3 1 76 ALA MB . . 4.150 3.043 2.820 3.216 . 0 0 "[ . 1 . 2]" 1
403 1 21 TRP HH2 1 25 THR MG . . 3.830 3.239 2.964 3.361 . 0 0 "[ . 1 . 2]" 1
404 1 21 TRP HH2 1 72 LYS HA . . 5.500 4.462 3.899 4.685 . 0 0 "[ . 1 . 2]" 1
405 1 21 TRP HH2 1 72 LYS QB . . 4.100 2.928 2.750 3.063 . 0 0 "[ . 1 . 2]" 1
406 1 21 TRP HH2 1 73 LEU H . . 5.500 5.206 4.881 5.498 . 0 0 "[ . 1 . 2]" 1
407 1 21 TRP HH2 1 73 LEU HA . . 4.520 4.077 3.625 4.350 . 0 0 "[ . 1 . 2]" 1
408 1 21 TRP HH2 1 75 GLU QB . . 5.340 4.822 4.372 5.348 0.008 17 0 "[ . 1 . 2]" 1
409 1 21 TRP HH2 1 76 ALA MB . . 5.410 2.525 2.273 2.760 . 0 0 "[ . 1 . 2]" 1
410 1 21 TRP HH2 1 79 GLU HB2 . . 5.500 4.763 4.529 5.023 . 0 0 "[ . 1 . 2]" 1
411 1 21 TRP HH2 1 79 GLU QG . . 5.330 4.536 4.088 4.941 . 0 0 "[ . 1 . 2]" 1
412 1 21 TRP HZ2 1 25 THR MG . . 4.630 4.904 4.714 4.926 0.296 11 0 "[ . 1 . 2]" 1
413 1 21 TRP HZ2 1 72 LYS QB . . 5.070 4.956 4.811 5.075 0.005 10 0 "[ . 1 . 2]" 1
414 1 21 TRP HZ2 1 72 LYS QD . . 4.920 5.098 4.868 5.202 0.282 1 0 "[ . 1 . 2]" 1
415 1 21 TRP HZ2 1 76 ALA MB . . 4.260 3.210 2.983 3.393 . 0 0 "[ . 1 . 2]" 1
416 1 21 TRP HZ2 1 79 GLU HA . . 5.500 5.332 5.055 5.499 . 0 0 "[ . 1 . 2]" 1
417 1 21 TRP HZ2 1 79 GLU HB3 . . 4.020 2.652 2.394 2.869 . 0 0 "[ . 1 . 2]" 1
418 1 21 TRP HZ2 1 79 GLU QG . . 5.340 2.527 2.053 2.985 . 0 0 "[ . 1 . 2]" 1
419 1 21 TRP HZ2 1 80 GLY HA2 . . 5.500 5.465 5.375 5.512 0.012 5 0 "[ . 1 . 2]" 1
420 1 21 TRP HZ3 1 22 ILE HA . . 4.630 3.633 3.493 3.837 . 0 0 "[ . 1 . 2]" 1
421 1 21 TRP HZ3 1 22 ILE QG . . 4.550 3.619 3.503 3.890 . 0 0 "[ . 1 . 2]" 1
422 1 21 TRP HZ3 1 25 THR MG . . 3.570 2.809 2.591 3.023 . 0 0 "[ . 1 . 2]" 1
423 1 21 TRP HZ3 1 72 LYS QB . . 5.500 3.800 3.625 4.064 . 0 0 "[ . 1 . 2]" 1
424 1 21 TRP HZ3 1 73 LEU H . . 5.500 4.821 4.619 5.154 . 0 0 "[ . 1 . 2]" 1
425 1 21 TRP HZ3 1 73 LEU HA . . 3.840 2.985 2.671 3.374 . 0 0 "[ . 1 . 2]" 1
426 1 21 TRP HZ3 1 73 LEU MD1 . . 4.070 3.799 3.566 4.098 0.028 10 0 "[ . 1 . 2]" 1
427 1 21 TRP HZ3 1 76 ALA MB . . 4.960 2.477 2.238 2.794 . 0 0 "[ . 1 . 2]" 1
428 1 22 ILE H 1 22 ILE HB . . 3.250 2.554 2.510 2.594 . 0 0 "[ . 1 . 2]" 1
429 1 22 ILE H 1 22 ILE MD . . 3.880 3.601 3.418 3.690 . 0 0 "[ . 1 . 2]" 1
430 1 22 ILE H 1 22 ILE QG . . 3.420 2.339 2.279 2.422 . 0 0 "[ . 1 . 2]" 1
431 1 22 ILE H 1 22 ILE MG . . 3.900 3.803 3.789 3.815 . 0 0 "[ . 1 . 2]" 1
432 1 22 ILE H 1 23 GLU H . . 3.530 2.263 2.194 2.355 . 0 0 "[ . 1 . 2]" 1
433 1 22 ILE H 1 23 GLU HA . . 5.020 4.916 4.856 4.991 . 0 0 "[ . 1 . 2]" 1
434 1 22 ILE H 1 23 GLU QG . . 5.500 4.337 4.041 4.688 . 0 0 "[ . 1 . 2]" 1
435 1 22 ILE H 1 24 LYS H . . 4.880 3.807 3.720 3.878 . 0 0 "[ . 1 . 2]" 1
436 1 22 ILE H 1 25 THR H . . 5.150 4.576 4.457 4.666 . 0 0 "[ . 1 . 2]" 1
437 1 22 ILE H 1 38 VAL MG1 . . 4.620 4.449 4.302 4.619 . 0 0 "[ . 1 . 2]" 1
438 1 22 ILE HA 1 22 ILE MD . . 4.060 3.881 3.861 3.915 . 0 0 "[ . 1 . 2]" 1
439 1 22 ILE HA 1 22 ILE QG . . 3.700 2.471 2.435 2.512 . 0 0 "[ . 1 . 2]" 1
440 1 22 ILE HA 1 22 ILE MG . . 3.130 2.345 2.243 2.445 . 0 0 "[ . 1 . 2]" 1
441 1 22 ILE HA 1 23 GLU HA . . 4.860 4.838 4.805 4.867 0.007 15 0 "[ . 1 . 2]" 1
442 1 22 ILE HA 1 24 LYS H . . 5.500 3.996 3.851 4.154 . 0 0 "[ . 1 . 2]" 1
443 1 22 ILE HA 1 25 THR H . . 4.030 3.148 2.988 3.253 . 0 0 "[ . 1 . 2]" 1
444 1 22 ILE HA 1 25 THR HB . . 3.750 2.445 2.195 2.620 . 0 0 "[ . 1 . 2]" 1
445 1 22 ILE HA 1 25 THR MG . . 4.310 3.906 3.701 4.059 . 0 0 "[ . 1 . 2]" 1
446 1 22 ILE HA 1 26 VAL H . . 5.090 3.570 3.429 3.709 . 0 0 "[ . 1 . 2]" 1
447 1 22 ILE HA 1 26 VAL MG2 . . 3.880 3.478 3.322 3.577 . 0 0 "[ . 1 . 2]" 1
448 1 22 ILE HA 1 69 PHE QE . . 5.290 4.667 4.461 4.943 . 0 0 "[ . 1 . 2]" 1
449 1 22 ILE HA 1 73 LEU MD1 . . 5.000 4.603 4.319 4.809 . 0 0 "[ . 1 . 2]" 1
450 1 22 ILE HB 1 22 ILE MD . . 3.190 2.350 2.271 2.403 . 0 0 "[ . 1 . 2]" 1
451 1 22 ILE HB 1 23 GLU H . . 3.710 2.648 2.552 2.850 . 0 0 "[ . 1 . 2]" 1
452 1 22 ILE HB 1 38 VAL MG1 . . 3.030 2.591 2.402 2.774 . 0 0 "[ . 1 . 2]" 1
453 1 22 ILE HB 1 42 LEU MD2 . . 4.690 3.883 3.670 4.140 . 0 0 "[ . 1 . 2]" 1
454 1 22 ILE MD 1 22 ILE MG . . 2.920 2.093 1.948 2.288 . 0 0 "[ . 1 . 2]" 1
455 1 22 ILE MD 1 23 GLU H . . 4.890 4.484 4.419 4.555 . 0 0 "[ . 1 . 2]" 1
456 1 22 ILE MD 1 38 VAL HA . . 5.200 4.081 3.838 4.464 . 0 0 "[ . 1 . 2]" 1
457 1 22 ILE MD 1 41 ALA HA . . 5.460 4.640 4.531 4.957 . 0 0 "[ . 1 . 2]" 1
458 1 22 ILE MD 1 41 ALA MB . . 3.310 2.419 2.231 2.628 . 0 0 "[ . 1 . 2]" 1
459 1 22 ILE MD 1 42 LEU H . . 4.180 3.190 3.037 3.413 . 0 0 "[ . 1 . 2]" 1
460 1 22 ILE MD 1 42 LEU HA . . 3.280 2.899 2.761 3.090 . 0 0 "[ . 1 . 2]" 1
461 1 22 ILE MD 1 42 LEU HG . . 3.270 2.055 1.851 2.241 . 0 0 "[ . 1 . 2]" 1
462 1 22 ILE MD 1 69 PHE HZ . . 4.980 4.195 3.981 4.492 . 0 0 "[ . 1 . 2]" 1
463 1 22 ILE QG 1 23 GLU H . . 5.500 3.958 3.895 4.020 . 0 0 "[ . 1 . 2]" 1
464 1 22 ILE MG 1 23 GLU H . . 4.120 3.571 3.433 3.776 . 0 0 "[ . 1 . 2]" 1
465 1 22 ILE MG 1 23 GLU HA . . 4.080 3.635 3.444 3.859 . 0 0 "[ . 1 . 2]" 1
466 1 22 ILE MG 1 25 THR H . . 5.120 4.330 4.170 4.484 . 0 0 "[ . 1 . 2]" 1
467 1 22 ILE MG 1 26 VAL MG2 . . 2.550 1.905 1.772 2.065 . 0 0 "[ . 1 . 2]" 1
468 1 22 ILE MG 1 37 VAL MG1 . . 4.160 3.761 3.630 3.963 . 0 0 "[ . 1 . 2]" 1
469 1 22 ILE MG 1 38 VAL H . . 4.770 4.482 4.317 4.663 . 0 0 "[ . 1 . 2]" 1
470 1 22 ILE MG 1 38 VAL HA . . 3.030 2.235 2.043 2.416 . 0 0 "[ . 1 . 2]" 1
471 1 22 ILE MG 1 38 VAL MG1 . . 2.550 2.477 2.201 2.552 0.002 16 0 "[ . 1 . 2]" 1
472 1 22 ILE MG 1 41 ALA H . . 4.990 4.265 4.153 4.408 . 0 0 "[ . 1 . 2]" 1
473 1 22 ILE MG 1 41 ALA HA . . 5.210 4.818 4.660 4.978 . 0 0 "[ . 1 . 2]" 1
474 1 22 ILE MG 1 41 ALA MB . . 2.850 2.268 2.121 2.424 . 0 0 "[ . 1 . 2]" 1
475 1 22 ILE MG 1 42 LEU H . . 4.040 3.935 3.793 4.033 . 0 0 "[ . 1 . 2]" 1
476 1 22 ILE MG 1 42 LEU HA . . 5.500 4.926 4.770 5.053 . 0 0 "[ . 1 . 2]" 1
477 1 22 ILE MG 1 42 LEU HB2 . . 5.500 5.410 5.228 5.506 0.006 6 0 "[ . 1 . 2]" 1
478 1 22 ILE MG 1 42 LEU HG . . 3.400 3.592 3.497 3.621 0.221 5 0 "[ . 1 . 2]" 1
479 1 22 ILE MG 1 69 PHE QE . . 4.200 2.975 2.768 3.150 . 0 0 "[ . 1 . 2]" 1
480 1 22 ILE MG 1 69 PHE HZ . . 3.510 2.365 2.236 2.488 . 0 0 "[ . 1 . 2]" 1
481 1 23 GLU H 1 23 GLU HB2 . . 3.240 2.290 2.126 2.403 . 0 0 "[ . 1 . 2]" 1
482 1 23 GLU H 1 23 GLU HB3 . . 3.670 3.541 3.437 3.579 . 0 0 "[ . 1 . 2]" 1
483 1 23 GLU H 1 23 GLU QG . . 3.460 2.649 2.377 3.067 . 0 0 "[ . 1 . 2]" 1
484 1 23 GLU H 1 24 LYS H . . 3.600 2.707 2.606 2.769 . 0 0 "[ . 1 . 2]" 1
485 1 23 GLU H 1 24 LYS QG . . 5.340 4.010 3.893 4.148 . 0 0 "[ . 1 . 2]" 1
486 1 23 GLU H 1 25 THR H . . 4.360 4.171 3.952 4.360 . 0 0 "[ . 1 . 2]" 1
487 1 23 GLU H 1 38 VAL MG1 . . 4.050 3.371 3.135 3.553 . 0 0 "[ . 1 . 2]" 1
488 1 23 GLU H 1 38 VAL MG2 . . 5.340 3.843 3.606 4.155 . 0 0 "[ . 1 . 2]" 1
489 1 23 GLU HA 1 23 GLU QG . . 3.870 2.185 2.049 2.304 . 0 0 "[ . 1 . 2]" 1
490 1 23 GLU HA 1 26 VAL H . . 4.770 4.070 3.834 4.262 . 0 0 "[ . 1 . 2]" 1
491 1 23 GLU HA 1 26 VAL HB . . 3.690 3.428 3.242 3.669 . 0 0 "[ . 1 . 2]" 1
492 1 23 GLU HA 1 26 VAL MG2 . . 3.890 3.237 2.818 3.671 . 0 0 "[ . 1 . 2]" 1
493 1 23 GLU HA 1 27 LYS H . . 5.030 4.689 4.506 5.029 . 0 0 "[ . 1 . 2]" 1
494 1 23 GLU HA 1 38 VAL H . . 5.500 5.497 5.469 5.506 0.006 18 0 "[ . 1 . 2]" 1
495 1 23 GLU HA 1 38 VAL HA . . 5.500 4.557 4.423 4.705 . 0 0 "[ . 1 . 2]" 1
496 1 23 GLU HA 1 38 VAL MG1 . . 4.130 3.072 2.774 3.340 . 0 0 "[ . 1 . 2]" 1
497 1 23 GLU HA 1 38 VAL MG2 . . 3.120 1.981 1.967 2.034 . 0 0 "[ . 1 . 2]" 1
498 1 23 GLU HB2 1 24 LYS H . . 3.340 2.939 2.796 3.199 . 0 0 "[ . 1 . 2]" 1
499 1 23 GLU HB3 1 24 LYS H . . 3.880 3.582 3.359 3.775 . 0 0 "[ . 1 . 2]" 1
500 1 23 GLU HB3 1 38 VAL MG2 . . 4.130 3.802 3.628 3.988 . 0 0 "[ . 1 . 2]" 1
501 1 23 GLU QG 1 24 LYS H . . 4.510 4.340 4.211 4.512 0.002 18 0 "[ . 1 . 2]" 1
502 1 23 GLU QG 1 38 VAL MG1 . . 3.560 1.880 1.770 1.970 . 0 0 "[ . 1 . 2]" 1
503 1 23 GLU QG 1 38 VAL MG2 . . 3.640 2.055 1.930 2.355 . 0 0 "[ . 1 . 2]" 1
504 1 24 LYS H 1 24 LYS QB . . 3.000 2.639 2.532 2.750 . 0 0 "[ . 1 . 2]" 1
505 1 24 LYS H 1 24 LYS QD . . 3.940 3.884 3.616 4.180 0.240 10 0 "[ . 1 . 2]" 1
506 1 24 LYS H 1 24 LYS QG . . 3.510 2.067 1.907 2.293 . 0 0 "[ . 1 . 2]" 1
507 1 24 LYS H 1 25 THR H . . 2.640 2.376 2.228 2.471 . 0 0 "[ . 1 . 2]" 1
508 1 24 LYS H 1 26 VAL H . . 4.860 4.178 3.991 4.369 . 0 0 "[ . 1 . 2]" 1
509 1 24 LYS H 1 38 VAL MG2 . . 5.450 5.052 4.958 5.147 . 0 0 "[ . 1 . 2]" 1
510 1 24 LYS HA 1 24 LYS QG . . 3.570 3.347 3.338 3.383 . 0 0 "[ . 1 . 2]" 1
511 1 24 LYS HA 1 27 LYS H . . 3.810 3.675 3.506 3.799 . 0 0 "[ . 1 . 2]" 1
512 1 24 LYS HA 1 27 LYS QB . . 3.600 2.967 2.823 3.066 . 0 0 "[ . 1 . 2]" 1
513 1 24 LYS HA 1 27 LYS QD . . 4.260 3.804 3.425 4.188 . 0 0 "[ . 1 . 2]" 1
514 1 24 LYS QB 1 24 LYS QD . . 2.860 2.070 1.979 2.132 . 0 0 "[ . 1 . 2]" 1
515 1 24 LYS QB 1 25 THR H . . 3.720 3.416 3.282 3.622 . 0 0 "[ . 1 . 2]" 1
516 1 24 LYS QD 1 25 THR H . . 5.270 3.862 2.884 4.209 . 0 0 "[ . 1 . 2]" 1
517 1 24 LYS QE 1 24 LYS HG2 . . 3.560 2.467 1.972 3.307 . 0 0 "[ . 1 . 2]" 1
518 1 24 LYS QE 1 24 LYS QG . . 3.060 2.073 1.948 2.257 . 0 0 "[ . 1 . 2]" 1
519 1 24 LYS QE 1 24 LYS HG3 . . 3.560 2.624 2.012 3.279 . 0 0 "[ . 1 . 2]" 1
520 1 24 LYS QG 1 25 THR H . . 4.610 1.986 1.877 2.267 . 0 0 "[ . 1 . 2]" 1
521 1 25 THR H 1 25 THR HB . . 3.000 2.544 2.416 2.657 . 0 0 "[ . 1 . 2]" 1
522 1 25 THR H 1 25 THR MG . . 3.850 3.763 3.745 3.776 . 0 0 "[ . 1 . 2]" 1
523 1 25 THR H 1 26 VAL H . . 3.320 2.757 2.535 2.933 . 0 0 "[ . 1 . 2]" 1
524 1 25 THR H 1 26 VAL MG2 . . 4.380 4.106 3.918 4.276 . 0 0 "[ . 1 . 2]" 1
525 1 25 THR HA 1 25 THR MG . . 2.960 2.312 2.230 2.428 . 0 0 "[ . 1 . 2]" 1
526 1 25 THR HA 1 26 VAL HA . . 5.500 4.857 4.806 4.894 . 0 0 "[ . 1 . 2]" 1
527 1 25 THR HA 1 28 ARG H . . 3.860 3.312 3.138 3.468 . 0 0 "[ . 1 . 2]" 1
528 1 25 THR HA 1 28 ARG QB . . 3.720 2.820 2.558 3.050 . 0 0 "[ . 1 . 2]" 1
529 1 25 THR HA 1 28 ARG QD . . 5.190 4.426 3.662 4.870 . 0 0 "[ . 1 . 2]" 1
530 1 25 THR HA 1 28 ARG QG . . 4.560 3.268 2.393 4.317 . 0 0 "[ . 1 . 2]" 1
531 1 25 THR HA 1 29 VAL H . . 4.380 4.157 4.029 4.376 . 0 0 "[ . 1 . 2]" 1
532 1 25 THR HA 1 29 VAL QG . . 4.670 3.835 3.610 4.104 . 0 0 "[ . 1 . 2]" 1
533 1 25 THR HB 1 26 VAL H . . 3.220 2.375 2.196 2.628 . 0 0 "[ . 1 . 2]" 1
534 1 25 THR HB 1 26 VAL HA . . 5.080 4.179 4.035 4.337 . 0 0 "[ . 1 . 2]" 1
535 1 25 THR HB 1 26 VAL MG2 . . 4.520 3.090 3.012 3.237 . 0 0 "[ . 1 . 2]" 1
536 1 25 THR HB 1 69 PHE QD . . 5.500 5.163 4.756 5.451 . 0 0 "[ . 1 . 2]" 1
537 1 25 THR HB 1 69 PHE QE . . 4.660 3.729 3.238 4.112 . 0 0 "[ . 1 . 2]" 1
538 1 25 THR MG 1 26 VAL H . . 4.560 3.287 3.043 3.434 . 0 0 "[ . 1 . 2]" 1
539 1 25 THR MG 1 28 ARG H . . 4.510 4.127 4.028 4.258 . 0 0 "[ . 1 . 2]" 1
540 1 25 THR MG 1 28 ARG QB . . 3.360 3.280 3.113 3.358 . 0 0 "[ . 1 . 2]" 1
541 1 25 THR MG 1 28 ARG QD . . 5.500 4.815 4.042 5.423 . 0 0 "[ . 1 . 2]" 1
542 1 25 THR MG 1 28 ARG QG . . 4.540 3.763 3.372 4.072 . 0 0 "[ . 1 . 2]" 1
543 1 25 THR MG 1 29 VAL H . . 4.020 3.546 3.343 3.690 . 0 0 "[ . 1 . 2]" 1
544 1 25 THR MG 1 29 VAL QG . . 3.200 2.192 2.001 2.405 . 0 0 "[ . 1 . 2]" 1
545 1 25 THR MG 1 69 PHE HA . . 4.840 4.411 4.268 4.563 . 0 0 "[ . 1 . 2]" 1
546 1 25 THR MG 1 69 PHE QD . . 4.120 3.457 3.179 3.667 . 0 0 "[ . 1 . 2]" 1
547 1 25 THR MG 1 69 PHE QE . . 4.360 3.141 2.752 3.372 . 0 0 "[ . 1 . 2]" 1
548 1 25 THR MG 1 72 LYS H . . 5.500 5.149 4.861 5.302 . 0 0 "[ . 1 . 2]" 1
549 1 25 THR MG 1 72 LYS HA . . 5.500 5.175 4.691 5.429 . 0 0 "[ . 1 . 2]" 1
550 1 25 THR MG 1 72 LYS QB . . 3.430 2.791 2.384 3.010 . 0 0 "[ . 1 . 2]" 1
551 1 25 THR MG 1 72 LYS QD . . 4.740 3.485 2.964 3.792 . 0 0 "[ . 1 . 2]" 1
552 1 25 THR MG 1 73 LEU H . . 5.500 4.663 4.349 5.098 . 0 0 "[ . 1 . 2]" 1
553 1 26 VAL H 1 26 VAL HB . . 3.100 2.638 2.536 2.759 . 0 0 "[ . 1 . 2]" 1
554 1 26 VAL H 1 26 VAL MG1 . . 4.130 3.764 3.753 3.774 . 0 0 "[ . 1 . 2]" 1
555 1 26 VAL H 1 26 VAL MG2 . . 3.000 1.943 1.873 2.038 . 0 0 "[ . 1 . 2]" 1
556 1 26 VAL H 1 27 LYS H . . 3.260 2.802 2.656 2.903 . 0 0 "[ . 1 . 2]" 1
557 1 26 VAL H 1 27 LYS QB . . 5.340 4.557 4.431 4.647 . 0 0 "[ . 1 . 2]" 1
558 1 26 VAL H 1 28 ARG H . . 5.120 4.176 4.022 4.313 . 0 0 "[ . 1 . 2]" 1
559 1 26 VAL H 1 69 PHE QE . . 4.560 3.418 3.002 3.677 . 0 0 "[ . 1 . 2]" 1
560 1 26 VAL HA 1 26 VAL MG1 . . 3.330 2.394 2.296 2.447 . 0 0 "[ . 1 . 2]" 1
561 1 26 VAL HA 1 26 VAL MG2 . . 3.110 2.436 2.407 2.459 . 0 0 "[ . 1 . 2]" 1
562 1 26 VAL HA 1 27 LYS HA . . 5.500 4.771 4.735 4.816 . 0 0 "[ . 1 . 2]" 1
563 1 26 VAL HA 1 28 ARG H . . 5.150 4.105 3.783 4.359 . 0 0 "[ . 1 . 2]" 1
564 1 26 VAL HA 1 29 VAL H . . 4.260 3.443 3.187 3.554 . 0 0 "[ . 1 . 2]" 1
565 1 26 VAL HA 1 29 VAL HB . . 3.620 2.798 2.635 2.949 . 0 0 "[ . 1 . 2]" 1
566 1 26 VAL HA 1 29 VAL MG1 . . 4.640 4.180 4.000 4.331 . 0 0 "[ . 1 . 2]" 1
567 1 26 VAL HA 1 29 VAL QG . . 3.490 3.011 2.834 3.163 . 0 0 "[ . 1 . 2]" 1
568 1 26 VAL HA 1 29 VAL MG2 . . 4.640 3.089 2.893 3.254 . 0 0 "[ . 1 . 2]" 1
569 1 26 VAL HA 1 30 LEU H . . 4.390 3.716 3.605 3.834 . 0 0 "[ . 1 . 2]" 1
570 1 26 VAL HA 1 30 LEU HB2 . . 5.500 5.161 5.062 5.287 . 0 0 "[ . 1 . 2]" 1
571 1 26 VAL HA 1 30 LEU MD1 . . 4.150 4.067 3.911 4.151 0.001 1 0 "[ . 1 . 2]" 1
572 1 26 VAL HA 1 30 LEU HG . . 4.810 3.335 3.224 3.433 . 0 0 "[ . 1 . 2]" 1
573 1 26 VAL HA 1 37 VAL MG1 . . 4.810 4.003 3.841 4.159 . 0 0 "[ . 1 . 2]" 1
574 1 26 VAL HA 1 69 PHE HB2 . . 5.500 5.243 4.991 5.422 . 0 0 "[ . 1 . 2]" 1
575 1 26 VAL HA 1 69 PHE QE . . 3.340 2.632 2.242 2.952 . 0 0 "[ . 1 . 2]" 1
576 1 26 VAL HB 1 27 LYS H . . 3.350 2.750 2.449 2.958 . 0 0 "[ . 1 . 2]" 1
577 1 26 VAL HB 1 33 SER HA . . 4.580 3.246 3.033 3.442 . 0 0 "[ . 1 . 2]" 1
578 1 26 VAL HB 1 33 SER HB2 . . 5.500 4.419 3.152 4.980 . 0 0 "[ . 1 . 2]" 1
579 1 26 VAL HB 1 33 SER QB . . 4.720 4.078 3.094 4.538 . 0 0 "[ . 1 . 2]" 1
580 1 26 VAL HB 1 33 SER HB3 . . 5.500 4.932 4.502 5.227 . 0 0 "[ . 1 . 2]" 1
581 1 26 VAL HB 1 34 GLU H . . 3.770 3.389 3.082 3.714 . 0 0 "[ . 1 . 2]" 1
582 1 26 VAL HB 1 37 VAL MG1 . . 4.550 4.254 4.052 4.455 . 0 0 "[ . 1 . 2]" 1
583 1 26 VAL HB 1 69 PHE QE . . 5.000 4.236 4.022 4.418 . 0 0 "[ . 1 . 2]" 1
584 1 26 VAL MG1 1 27 LYS H . . 3.620 3.594 3.504 3.622 0.002 4 0 "[ . 1 . 2]" 1
585 1 26 VAL MG1 1 27 LYS HA . . 3.890 3.553 3.469 3.716 . 0 0 "[ . 1 . 2]" 1
586 1 26 VAL MG1 1 30 LEU HB2 . . 3.710 3.467 3.227 3.628 . 0 0 "[ . 1 . 2]" 1
587 1 26 VAL MG1 1 30 LEU MD1 . . 2.920 1.999 1.878 2.196 . 0 0 "[ . 1 . 2]" 1
588 1 26 VAL MG1 1 30 LEU HG . . 3.530 2.450 2.143 2.644 . 0 0 "[ . 1 . 2]" 1
589 1 26 VAL MG1 1 32 PHE QD . . 5.470 4.658 4.401 5.002 . 0 0 "[ . 1 . 2]" 1
590 1 26 VAL MG1 1 33 SER HA . . 3.850 2.067 1.971 2.444 . 0 0 "[ . 1 . 2]" 1
591 1 26 VAL MG1 1 33 SER HB2 . . 4.920 4.146 3.410 4.630 . 0 0 "[ . 1 . 2]" 1
592 1 26 VAL MG1 1 33 SER QB . . 4.280 3.787 3.298 4.153 . 0 0 "[ . 1 . 2]" 1
593 1 26 VAL MG1 1 33 SER HB3 . . 4.920 4.440 4.299 4.696 . 0 0 "[ . 1 . 2]" 1
594 1 26 VAL MG1 1 34 GLU H . . 3.300 1.855 1.749 2.040 . 0 0 "[ . 1 . 2]" 1
595 1 26 VAL MG1 1 34 GLU HB2 . . 4.150 3.208 2.935 3.364 . 0 0 "[ . 1 . 2]" 1
596 1 26 VAL MG1 1 34 GLU HG2 . . 5.170 5.084 4.950 5.199 0.029 7 0 "[ . 1 . 2]" 1
597 1 26 VAL MG1 1 34 GLU HG3 . . 5.020 5.196 4.992 5.316 0.296 3 0 "[ . 1 . 2]" 1
598 1 26 VAL MG1 1 37 VAL H . . 4.200 4.217 4.073 4.451 0.251 15 0 "[ . 1 . 2]" 1
599 1 26 VAL MG1 1 37 VAL HB . . 3.190 2.314 2.110 2.538 . 0 0 "[ . 1 . 2]" 1
600 1 26 VAL MG1 1 37 VAL MG1 . . 3.150 2.101 1.934 2.284 . 0 0 "[ . 1 . 2]" 1
601 1 26 VAL MG1 1 37 VAL MG2 . . 4.490 3.028 2.908 3.107 . 0 0 "[ . 1 . 2]" 1
602 1 26 VAL MG1 1 38 VAL H . . 4.510 3.513 3.407 3.761 . 0 0 "[ . 1 . 2]" 1
603 1 26 VAL MG1 1 38 VAL HB . . 5.500 5.220 5.061 5.449 . 0 0 "[ . 1 . 2]" 1
604 1 26 VAL MG1 1 69 PHE QE . . 4.310 3.329 2.948 3.639 . 0 0 "[ . 1 . 2]" 1
605 1 26 VAL MG1 1 69 PHE HZ . . 5.140 4.583 4.234 4.914 . 0 0 "[ . 1 . 2]" 1
606 1 26 VAL MG2 1 27 LYS H . . 4.580 3.849 3.677 3.980 . 0 0 "[ . 1 . 2]" 1
607 1 26 VAL MG2 1 33 SER HA . . 5.470 4.517 4.394 4.646 . 0 0 "[ . 1 . 2]" 1
608 1 26 VAL MG2 1 37 VAL HB . . 3.430 3.339 3.151 3.440 0.010 12 0 "[ . 1 . 2]" 1
609 1 26 VAL MG2 1 37 VAL MG1 . . 3.090 2.219 1.907 2.469 . 0 0 "[ . 1 . 2]" 1
610 1 26 VAL MG2 1 38 VAL H . . 4.740 3.568 3.310 3.697 . 0 0 "[ . 1 . 2]" 1
611 1 26 VAL MG2 1 38 VAL HA . . 3.570 2.619 2.441 2.839 . 0 0 "[ . 1 . 2]" 1
612 1 26 VAL MG2 1 41 ALA MB . . 4.220 3.612 3.487 3.816 . 0 0 "[ . 1 . 2]" 1
613 1 26 VAL MG2 1 69 PHE QE . . 3.330 1.846 1.792 1.932 . 0 0 "[ . 1 . 2]" 1
614 1 26 VAL MG2 1 69 PHE HZ . . 3.340 2.737 2.232 3.025 . 0 0 "[ . 1 . 2]" 1
615 1 27 LYS H 1 27 LYS HB2 . . 2.990 2.504 2.405 2.674 . 0 0 "[ . 1 . 2]" 1
616 1 27 LYS H 1 27 LYS HB3 . . 2.990 2.561 2.407 2.653 . 0 0 "[ . 1 . 2]" 1
617 1 27 LYS H 1 27 LYS QD . . 5.050 4.347 4.254 4.438 . 0 0 "[ . 1 . 2]" 1
618 1 27 LYS H 1 27 LYS HG2 . . 4.700 4.506 4.371 4.580 . 0 0 "[ . 1 . 2]" 1
619 1 27 LYS H 1 27 LYS HG3 . . 4.660 4.422 4.366 4.527 . 0 0 "[ . 1 . 2]" 1
620 1 27 LYS H 1 28 ARG H . . 3.370 2.560 2.458 2.679 . 0 0 "[ . 1 . 2]" 1
621 1 27 LYS H 1 28 ARG QB . . 4.920 4.505 4.228 4.802 . 0 0 "[ . 1 . 2]" 1
622 1 27 LYS H 1 29 VAL H . . 4.850 4.216 3.920 4.479 . 0 0 "[ . 1 . 2]" 1
623 1 27 LYS H 1 33 SER HA . . 5.030 3.617 3.364 3.767 . 0 0 "[ . 1 . 2]" 1
624 1 27 LYS H 1 33 SER HB2 . . 5.500 3.715 3.142 4.001 . 0 0 "[ . 1 . 2]" 1
625 1 27 LYS H 1 33 SER HB3 . . 5.500 4.714 3.651 5.169 . 0 0 "[ . 1 . 2]" 1
626 1 27 LYS H 1 34 GLU H . . 5.500 5.076 4.659 5.308 . 0 0 "[ . 1 . 2]" 1
627 1 27 LYS HA 1 27 LYS QD . . 3.990 3.807 3.587 4.025 0.035 20 0 "[ . 1 . 2]" 1
628 1 27 LYS HA 1 27 LYS HG2 . . 3.770 3.290 3.082 3.488 . 0 0 "[ . 1 . 2]" 1
629 1 27 LYS HA 1 27 LYS HG3 . . 3.590 2.425 2.301 2.647 . 0 0 "[ . 1 . 2]" 1
630 1 27 LYS HA 1 28 ARG HA . . 5.330 4.696 4.643 4.729 . 0 0 "[ . 1 . 2]" 1
631 1 27 LYS HA 1 30 LEU H . . 4.160 3.951 3.778 4.159 . 0 0 "[ . 1 . 2]" 1
632 1 27 LYS HA 1 30 LEU HB2 . . 4.110 3.692 3.603 3.744 . 0 0 "[ . 1 . 2]" 1
633 1 27 LYS HA 1 30 LEU HB3 . . 5.500 5.449 5.363 5.501 0.001 7 0 "[ . 1 . 2]" 1
634 1 27 LYS HA 1 31 GLY H . . 3.970 3.261 3.171 3.413 . 0 0 "[ . 1 . 2]" 1
635 1 27 LYS HA 1 32 PHE H . . 3.760 3.372 3.077 3.570 . 0 0 "[ . 1 . 2]" 1
636 1 27 LYS HA 1 32 PHE QD . . 5.500 4.916 4.537 5.293 . 0 0 "[ . 1 . 2]" 1
637 1 27 LYS HA 1 33 SER H . . 4.590 2.403 2.018 2.566 . 0 0 "[ . 1 . 2]" 1
638 1 27 LYS HA 1 33 SER HA . . 4.900 2.323 2.142 2.434 . 0 0 "[ . 1 . 2]" 1
639 1 27 LYS QB 1 28 ARG H . . 3.430 2.802 2.621 3.026 . 0 0 "[ . 1 . 2]" 1
640 1 27 LYS QB 1 33 SER HA . . 4.590 3.517 3.338 3.670 . 0 0 "[ . 1 . 2]" 1
641 1 27 LYS QB 1 33 SER QB . . 4.310 1.976 1.779 2.111 . 0 0 "[ . 1 . 2]" 1
642 1 27 LYS HB2 1 27 LYS QD . . 3.130 2.205 2.028 2.402 . 0 0 "[ . 1 . 2]" 1
643 1 27 LYS HB2 1 33 SER HA . . 5.320 3.615 3.423 3.780 . 0 0 "[ . 1 . 2]" 1
644 1 27 LYS HB3 1 27 LYS QD . . 3.130 2.609 2.315 2.887 . 0 0 "[ . 1 . 2]" 1
645 1 27 LYS HB3 1 33 SER HA . . 5.320 4.819 4.634 4.966 . 0 0 "[ . 1 . 2]" 1
646 1 27 LYS QD 1 33 SER HA . . 4.880 4.881 4.496 5.191 0.311 15 0 "[ . 1 . 2]" 1
647 1 27 LYS QD 1 33 SER HB2 . . 5.360 2.774 2.151 3.890 . 0 0 "[ . 1 . 2]" 1
648 1 27 LYS QD 1 33 SER QB . . 4.630 2.484 2.098 2.914 . 0 0 "[ . 1 . 2]" 1
649 1 27 LYS QD 1 33 SER HB3 . . 5.360 3.191 2.366 4.029 . 0 0 "[ . 1 . 2]" 1
650 1 27 LYS QE 1 27 LYS HG2 . . 3.310 2.269 1.981 2.947 . 0 0 "[ . 1 . 2]" 1
651 1 27 LYS QE 1 33 SER QB . . 5.340 3.784 2.438 4.544 . 0 0 "[ . 1 . 2]" 1
652 1 27 LYS HG2 1 28 ARG H . . 5.290 4.162 3.909 4.477 . 0 0 "[ . 1 . 2]" 1
653 1 27 LYS HG2 1 31 GLY H . . 5.080 4.768 4.340 5.071 . 0 0 "[ . 1 . 2]" 1
654 1 27 LYS HG2 1 32 PHE H . . 5.500 5.098 4.492 5.541 0.041 16 0 "[ . 1 . 2]" 1
655 1 27 LYS HG2 1 33 SER HA . . 5.500 5.410 5.230 5.501 0.001 16 0 "[ . 1 . 2]" 1
656 1 27 LYS HG3 1 28 ARG H . . 5.310 4.778 4.591 4.996 . 0 0 "[ . 1 . 2]" 1
657 1 27 LYS HG3 1 31 GLY H . . 4.900 4.510 4.213 4.924 0.024 15 0 "[ . 1 . 2]" 1
658 1 27 LYS HG3 1 32 PHE H . . 4.360 4.039 3.712 4.407 0.047 20 0 "[ . 1 . 2]" 1
659 1 27 LYS HG3 1 33 SER HA . . 5.390 4.139 4.057 4.298 . 0 0 "[ . 1 . 2]" 1
660 1 27 LYS HG3 1 33 SER QB . . 4.690 2.088 1.990 2.517 . 0 0 "[ . 1 . 2]" 1
661 1 28 ARG H 1 28 ARG QB . . 2.930 2.328 2.125 2.606 . 0 0 "[ . 1 . 2]" 1
662 1 28 ARG H 1 28 ARG QD . . 5.060 4.393 4.026 4.700 . 0 0 "[ . 1 . 2]" 1
663 1 28 ARG H 1 28 ARG QG . . 3.630 2.987 2.205 3.731 0.101 11 0 "[ . 1 . 2]" 1
664 1 28 ARG H 1 29 VAL H . . 3.410 2.468 2.331 2.560 . 0 0 "[ . 1 . 2]" 1
665 1 28 ARG H 1 29 VAL QG . . 4.610 3.793 3.622 3.904 . 0 0 "[ . 1 . 2]" 1
666 1 28 ARG H 1 30 LEU H . . 3.990 4.084 3.836 4.256 0.266 6 0 "[ . 1 . 2]" 1
667 1 28 ARG HA 1 28 ARG QD . . 4.420 3.413 2.654 4.074 . 0 0 "[ . 1 . 2]" 1
668 1 28 ARG HA 1 28 ARG HG2 . . 3.810 3.134 2.492 3.815 0.005 15 0 "[ . 1 . 2]" 1
669 1 28 ARG HA 1 28 ARG QG . . 3.300 2.637 2.454 2.759 . 0 0 "[ . 1 . 2]" 1
670 1 28 ARG HA 1 28 ARG HG3 . . 3.810 3.328 2.816 3.812 0.002 17 0 "[ . 1 . 2]" 1
671 1 28 ARG HA 1 30 LEU H . . 4.930 4.674 4.522 4.805 . 0 0 "[ . 1 . 2]" 1
672 1 28 ARG HA 1 31 GLY H . . 3.800 3.592 3.486 3.686 . 0 0 "[ . 1 . 2]" 1
673 1 28 ARG HA 1 31 GLY QA . . 5.340 3.220 3.116 3.302 . 0 0 "[ . 1 . 2]" 1
674 1 28 ARG QB 1 28 ARG QD . . 3.440 2.028 1.942 2.179 . 0 0 "[ . 1 . 2]" 1
675 1 28 ARG QB 1 29 VAL H . . 3.290 2.582 2.272 2.914 . 0 0 "[ . 1 . 2]" 1
676 1 28 ARG QB 1 29 VAL QG . . 3.460 3.208 3.022 3.451 . 0 0 "[ . 1 . 2]" 1
677 1 28 ARG QD 1 29 VAL H . . 5.500 4.915 4.634 5.080 . 0 0 "[ . 1 . 2]" 1
678 1 28 ARG QD 1 29 VAL QG . . 5.440 4.840 4.175 5.313 . 0 0 "[ . 1 . 2]" 1
679 1 28 ARG HG2 1 29 VAL H . . 4.580 3.857 3.055 4.498 . 0 0 "[ . 1 . 2]" 1
680 1 28 ARG HG3 1 29 VAL H . . 4.580 4.057 3.567 4.529 . 0 0 "[ . 1 . 2]" 1
681 1 29 VAL H 1 29 VAL HB . . 3.660 2.560 2.521 2.611 . 0 0 "[ . 1 . 2]" 1
682 1 29 VAL H 1 29 VAL MG1 . . 3.820 3.764 3.763 3.769 . 0 0 "[ . 1 . 2]" 1
683 1 29 VAL H 1 29 VAL QG . . 3.000 2.038 1.945 2.113 . 0 0 "[ . 1 . 2]" 1
684 1 29 VAL H 1 29 VAL MG2 . . 3.820 2.047 1.952 2.124 . 0 0 "[ . 1 . 2]" 1
685 1 29 VAL H 1 30 LEU H . . 3.340 2.752 2.634 2.913 . 0 0 "[ . 1 . 2]" 1
686 1 29 VAL H 1 30 LEU HA . . 5.500 5.338 5.247 5.452 . 0 0 "[ . 1 . 2]" 1
687 1 29 VAL H 1 30 LEU HG . . 5.440 4.359 4.262 4.527 . 0 0 "[ . 1 . 2]" 1
688 1 29 VAL H 1 31 GLY H . . 3.910 3.783 3.575 3.870 . 0 0 "[ . 1 . 2]" 1
689 1 29 VAL H 1 69 PHE QD . . 4.980 4.763 4.539 4.943 . 0 0 "[ . 1 . 2]" 1
690 1 29 VAL HA 1 29 VAL MG1 . . 3.210 2.382 2.269 2.443 . 0 0 "[ . 1 . 2]" 1
691 1 29 VAL HA 1 29 VAL QG . . 2.770 2.115 2.075 2.142 . 0 0 "[ . 1 . 2]" 1
692 1 29 VAL HA 1 29 VAL MG2 . . 3.210 2.369 2.338 2.421 . 0 0 "[ . 1 . 2]" 1
693 1 29 VAL HA 1 31 GLY H . . 4.960 4.638 4.424 4.691 . 0 0 "[ . 1 . 2]" 1
694 1 29 VAL HA 1 69 PHE QD . . 5.500 5.284 5.072 5.481 . 0 0 "[ . 1 . 2]" 1
695 1 29 VAL HB 1 30 LEU H . . 3.640 2.434 2.338 2.533 . 0 0 "[ . 1 . 2]" 1
696 1 29 VAL HB 1 30 LEU HG . . 4.440 2.882 2.828 2.979 . 0 0 "[ . 1 . 2]" 1
697 1 29 VAL HB 1 31 GLY H . . 5.360 4.593 4.538 4.671 . 0 0 "[ . 1 . 2]" 1
698 1 29 VAL HB 1 62 LEU MD2 . . 5.300 4.197 4.041 4.521 . 0 0 "[ . 1 . 2]" 1
699 1 29 VAL HB 1 69 PHE QD . . 4.100 2.853 2.724 2.983 . 0 0 "[ . 1 . 2]" 1
700 1 29 VAL HB 1 69 PHE QE . . 5.390 4.348 4.041 4.611 . 0 0 "[ . 1 . 2]" 1
701 1 29 VAL QG 1 30 LEU H . . 3.340 3.142 3.071 3.224 . 0 0 "[ . 1 . 2]" 1
702 1 29 VAL QG 1 30 LEU HA . . 4.390 3.530 3.435 3.698 . 0 0 "[ . 1 . 2]" 1
703 1 29 VAL QG 1 30 LEU HB2 . . 5.440 4.755 4.675 4.881 . 0 0 "[ . 1 . 2]" 1
704 1 29 VAL QG 1 30 LEU MD2 . . 3.120 2.197 2.052 2.365 . 0 0 "[ . 1 . 2]" 1
705 1 29 VAL QG 1 30 LEU HG . . 3.990 3.393 3.222 3.615 . 0 0 "[ . 1 . 2]" 1
706 1 29 VAL QG 1 31 GLY H . . 4.770 4.516 4.416 4.565 . 0 0 "[ . 1 . 2]" 1
707 1 29 VAL QG 1 62 LEU MD1 . . 3.960 3.298 3.199 3.399 . 0 0 "[ . 1 . 2]" 1
708 1 29 VAL QG 1 62 LEU MD2 . . 3.290 3.244 3.095 3.421 0.131 14 0 "[ . 1 . 2]" 1
709 1 29 VAL QG 1 65 SER QB . . 3.100 2.147 1.886 2.411 . 0 0 "[ . 1 . 2]" 1
710 1 29 VAL QG 1 68 ARG QD . . 4.700 3.302 2.278 4.138 . 0 0 "[ . 1 . 2]" 1
711 1 29 VAL QG 1 68 ARG QG . . 3.800 2.521 2.192 2.876 . 0 0 "[ . 1 . 2]" 1
712 1 29 VAL QG 1 69 PHE H . . 4.680 3.498 3.264 3.651 . 0 0 "[ . 1 . 2]" 1
713 1 29 VAL QG 1 69 PHE HA . . 3.300 2.475 2.339 2.632 . 0 0 "[ . 1 . 2]" 1
714 1 29 VAL QG 1 69 PHE HB3 . . 4.310 3.567 3.280 3.766 . 0 0 "[ . 1 . 2]" 1
715 1 29 VAL QG 1 69 PHE QD . . 3.000 2.088 1.921 2.263 . 0 0 "[ . 1 . 2]" 1
716 1 29 VAL QG 1 72 LYS H . . 5.440 4.652 4.474 4.822 . 0 0 "[ . 1 . 2]" 1
717 1 29 VAL QG 1 72 LYS QB . . 3.630 3.446 3.162 3.586 . 0 0 "[ . 1 . 2]" 1
718 1 29 VAL QG 1 72 LYS HG3 . . 4.240 3.316 2.877 3.556 . 0 0 "[ . 1 . 2]" 1
719 1 29 VAL MG1 1 30 LEU H . . 4.170 3.379 3.263 3.546 . 0 0 "[ . 1 . 2]" 1
720 1 29 VAL MG1 1 31 GLY H . . 5.500 4.996 4.880 5.126 . 0 0 "[ . 1 . 2]" 1
721 1 29 VAL MG1 1 62 LEU MD1 . . 4.760 3.397 3.279 3.521 . 0 0 "[ . 1 . 2]" 1
722 1 29 VAL MG1 1 69 PHE HA . . 3.950 2.853 2.496 3.125 . 0 0 "[ . 1 . 2]" 1
723 1 29 VAL MG1 1 69 PHE HB2 . . 4.170 2.265 2.044 2.511 . 0 0 "[ . 1 . 2]" 1
724 1 29 VAL MG1 1 69 PHE QD . . 3.570 2.773 2.471 3.039 . 0 0 "[ . 1 . 2]" 1
725 1 29 VAL MG2 1 30 LEU H . . 4.170 3.742 3.704 3.753 . 0 0 "[ . 1 . 2]" 1
726 1 29 VAL MG2 1 31 GLY H . . 5.500 5.152 5.044 5.193 . 0 0 "[ . 1 . 2]" 1
727 1 29 VAL MG2 1 62 LEU MD1 . . 4.760 4.470 4.410 4.484 . 0 0 "[ . 1 . 2]" 1
728 1 29 VAL MG2 1 69 PHE HA . . 3.950 2.729 2.481 2.962 . 0 0 "[ . 1 . 2]" 1
729 1 29 VAL MG2 1 69 PHE HB2 . . 4.170 3.233 2.792 3.410 . 0 0 "[ . 1 . 2]" 1
730 1 29 VAL MG2 1 69 PHE QD . . 3.570 2.168 1.969 2.385 . 0 0 "[ . 1 . 2]" 1
731 1 30 LEU H 1 30 LEU HB2 . . 3.290 2.693 2.661 2.731 . 0 0 "[ . 1 . 2]" 1
732 1 30 LEU H 1 30 LEU HB3 . . 4.140 3.642 3.617 3.674 . 0 0 "[ . 1 . 2]" 1
733 1 30 LEU H 1 30 LEU MD1 . . 4.160 3.731 3.673 3.809 . 0 0 "[ . 1 . 2]" 1
734 1 30 LEU H 1 30 LEU MD2 . . 3.990 3.028 2.851 3.127 . 0 0 "[ . 1 . 2]" 1
735 1 30 LEU H 1 30 LEU HG . . 3.430 2.184 2.103 2.289 . 0 0 "[ . 1 . 2]" 1
736 1 30 LEU H 1 31 GLY H . . 3.210 2.274 2.167 2.363 . 0 0 "[ . 1 . 2]" 1
737 1 30 LEU H 1 31 GLY HA2 . . 5.500 4.566 4.464 4.647 . 0 0 "[ . 1 . 2]" 1
738 1 30 LEU H 1 31 GLY HA3 . . 5.500 4.944 4.859 5.013 . 0 0 "[ . 1 . 2]" 1
739 1 30 LEU H 1 32 PHE H . . 4.380 4.049 3.946 4.216 . 0 0 "[ . 1 . 2]" 1
740 1 30 LEU H 1 69 PHE QD . . 5.500 5.072 4.880 5.245 . 0 0 "[ . 1 . 2]" 1
741 1 30 LEU HA 1 30 LEU MD1 . . 4.010 3.887 3.839 3.912 . 0 0 "[ . 1 . 2]" 1
742 1 30 LEU HA 1 30 LEU MD2 . . 3.070 1.995 1.976 2.027 . 0 0 "[ . 1 . 2]" 1
743 1 30 LEU HA 1 30 LEU HG . . 4.090 3.417 3.353 3.509 . 0 0 "[ . 1 . 2]" 1
744 1 30 LEU HA 1 32 PHE H . . 5.400 4.261 4.113 4.369 . 0 0 "[ . 1 . 2]" 1
745 1 30 LEU HA 1 62 LEU MD2 . . 5.500 4.742 4.589 4.873 . 0 0 "[ . 1 . 2]" 1
746 1 30 LEU HB2 1 30 LEU MD1 . . 3.230 2.346 2.238 2.441 . 0 0 "[ . 1 . 2]" 1
747 1 30 LEU HB2 1 31 GLY H . . 3.900 2.847 2.775 3.052 . 0 0 "[ . 1 . 2]" 1
748 1 30 LEU HB2 1 32 PHE H . . 3.400 2.344 2.306 2.402 . 0 0 "[ . 1 . 2]" 1
749 1 30 LEU HB2 1 32 PHE HZ . . 5.300 3.968 3.832 4.281 . 0 0 "[ . 1 . 2]" 1
750 1 30 LEU HB2 1 33 SER H . . 3.910 2.207 2.138 2.367 . 0 0 "[ . 1 . 2]" 1
751 1 30 LEU HB2 1 33 SER HA . . 5.420 3.471 3.276 3.589 . 0 0 "[ . 1 . 2]" 1
752 1 30 LEU HB2 1 62 LEU MD2 . . 5.330 4.726 4.531 4.870 . 0 0 "[ . 1 . 2]" 1
753 1 30 LEU HB3 1 30 LEU MD1 . . 3.360 2.334 2.231 2.408 . 0 0 "[ . 1 . 2]" 1
754 1 30 LEU HB3 1 30 LEU MD2 . . 3.540 2.427 2.388 2.478 . 0 0 "[ . 1 . 2]" 1
755 1 30 LEU HB3 1 31 GLY H . . 4.180 4.034 3.995 4.149 . 0 0 "[ . 1 . 2]" 1
756 1 30 LEU HB3 1 31 GLY QA . . 5.340 4.813 4.772 4.872 . 0 0 "[ . 1 . 2]" 1
757 1 30 LEU HB3 1 32 PHE H . . 3.860 3.415 3.302 3.533 . 0 0 "[ . 1 . 2]" 1
758 1 30 LEU HB3 1 32 PHE QD . . 5.500 3.645 3.530 3.748 . 0 0 "[ . 1 . 2]" 1
759 1 30 LEU HB3 1 32 PHE QE . . 5.160 2.697 2.536 2.864 . 0 0 "[ . 1 . 2]" 1
760 1 30 LEU HB3 1 32 PHE HZ . . 5.460 2.586 2.504 2.689 . 0 0 "[ . 1 . 2]" 1
761 1 30 LEU HB3 1 33 SER H . . 4.650 3.709 3.615 3.906 . 0 0 "[ . 1 . 2]" 1
762 1 30 LEU MD1 1 31 GLY H . . 5.230 4.639 4.581 4.792 . 0 0 "[ . 1 . 2]" 1
763 1 30 LEU MD1 1 32 PHE H . . 4.940 4.074 3.961 4.176 . 0 0 "[ . 1 . 2]" 1
764 1 30 LEU MD1 1 32 PHE HB2 . . 5.500 5.360 5.121 5.470 . 0 0 "[ . 1 . 2]" 1
765 1 30 LEU MD1 1 32 PHE QD . . 4.160 3.393 3.204 3.582 . 0 0 "[ . 1 . 2]" 1
766 1 30 LEU MD1 1 32 PHE QE . . 4.070 2.224 2.062 2.622 . 0 0 "[ . 1 . 2]" 1
767 1 30 LEU MD1 1 32 PHE HZ . . 5.500 2.644 2.139 3.586 . 0 0 "[ . 1 . 2]" 1
768 1 30 LEU MD1 1 33 SER H . . 5.280 3.197 2.973 3.529 . 0 0 "[ . 1 . 2]" 1
769 1 30 LEU MD1 1 34 GLU H . . 4.690 2.720 2.119 3.476 . 0 0 "[ . 1 . 2]" 1
770 1 30 LEU MD1 1 34 GLU HB2 . . 3.830 2.220 1.980 2.324 . 0 0 "[ . 1 . 2]" 1
771 1 30 LEU MD1 1 34 GLU HB3 . . 3.500 3.241 3.051 3.500 . 0 0 "[ . 1 . 2]" 1
772 1 30 LEU MD1 1 34 GLU HG2 . . 3.700 3.882 3.677 4.369 0.669 7 3 "[ .*+ 1 - . 2]" 1
773 1 30 LEU MD1 1 34 GLU HG3 . . 4.750 4.554 4.184 4.718 . 0 0 "[ . 1 . 2]" 1
774 1 30 LEU MD1 1 37 VAL H . . 5.310 4.875 4.674 4.993 . 0 0 "[ . 1 . 2]" 1
775 1 30 LEU MD1 1 37 VAL HA . . 5.500 5.327 5.034 5.426 . 0 0 "[ . 1 . 2]" 1
776 1 30 LEU MD1 1 37 VAL HB . . 3.650 3.381 3.138 3.533 . 0 0 "[ . 1 . 2]" 1
777 1 30 LEU MD1 1 38 VAL H . . 5.500 5.346 5.168 5.502 0.002 20 0 "[ . 1 . 2]" 1
778 1 30 LEU MD1 1 69 PHE HB2 . . 5.500 5.480 5.360 5.504 0.004 11 0 "[ . 1 . 2]" 1
779 1 30 LEU MD2 1 31 GLY H . . 5.310 4.458 4.350 4.516 . 0 0 "[ . 1 . 2]" 1
780 1 30 LEU MD2 1 32 PHE QE . . 5.320 3.826 3.662 3.991 . 0 0 "[ . 1 . 2]" 1
781 1 30 LEU MD2 1 32 PHE HZ . . 5.500 3.510 3.359 3.721 . 0 0 "[ . 1 . 2]" 1
782 1 30 LEU MD2 1 62 LEU HA . . 3.890 3.368 2.989 3.655 . 0 0 "[ . 1 . 2]" 1
783 1 30 LEU MD2 1 62 LEU MD2 . . 2.880 1.719 1.663 1.820 . 0 0 "[ . 1 . 2]" 1
784 1 30 LEU MD2 1 69 PHE HB2 . . 5.320 3.660 3.570 3.780 . 0 0 "[ . 1 . 2]" 1
785 1 30 LEU MD2 1 69 PHE QD . . 4.190 3.824 3.585 3.973 . 0 0 "[ . 1 . 2]" 1
786 1 30 LEU HG 1 31 GLY H . . 4.940 3.984 3.897 4.118 . 0 0 "[ . 1 . 2]" 1
787 1 30 LEU HG 1 32 PHE H . . 4.730 4.631 4.542 4.719 . 0 0 "[ . 1 . 2]" 1
788 1 30 LEU HG 1 37 VAL MG1 . . 4.340 4.222 3.860 4.353 0.013 20 0 "[ . 1 . 2]" 1
789 1 30 LEU HG 1 62 LEU MD2 . . 4.060 3.219 3.009 3.398 . 0 0 "[ . 1 . 2]" 1
790 1 30 LEU HG 1 69 PHE QD . . 4.800 4.491 4.216 4.653 . 0 0 "[ . 1 . 2]" 1
791 1 31 GLY H 1 32 PHE H . . 3.340 2.585 2.426 2.755 . 0 0 "[ . 1 . 2]" 1
792 1 31 GLY QA 1 32 PHE QD . . 4.650 3.890 3.575 4.144 . 0 0 "[ . 1 . 2]" 1
793 1 31 GLY HA2 1 32 PHE QD . . 5.500 5.198 4.909 5.391 . 0 0 "[ . 1 . 2]" 1
794 1 31 GLY HA2 1 33 SER H . . 5.500 4.667 4.274 4.820 . 0 0 "[ . 1 . 2]" 1
795 1 31 GLY HA3 1 32 PHE QD . . 5.500 4.019 3.667 4.307 . 0 0 "[ . 1 . 2]" 1
796 1 31 GLY HA3 1 33 SER H . . 5.500 4.864 4.621 5.020 . 0 0 "[ . 1 . 2]" 1
797 1 32 PHE H 1 32 PHE HB3 . . 3.570 3.293 3.156 3.423 . 0 0 "[ . 1 . 2]" 1
798 1 32 PHE H 1 33 SER H . . 4.420 1.837 1.792 1.920 . 0 0 "[ . 1 . 2]" 1
799 1 32 PHE HA 1 33 SER H . . 3.490 3.457 3.303 3.499 0.009 17 0 "[ . 1 . 2]" 1
800 1 32 PHE HB2 1 33 SER H . . 4.690 3.804 3.515 4.077 . 0 0 "[ . 1 . 2]" 1
801 1 32 PHE HB2 1 33 SER QB . . 5.340 4.656 4.416 5.161 . 0 0 "[ . 1 . 2]" 1
802 1 32 PHE HB3 1 33 SER H . . 4.840 4.188 4.089 4.447 . 0 0 "[ . 1 . 2]" 1
803 1 32 PHE QD 1 34 GLU HB2 . . 4.470 3.700 3.551 3.927 . 0 0 "[ . 1 . 2]" 1
804 1 32 PHE QD 1 34 GLU HB3 . . 5.500 5.228 5.129 5.476 . 0 0 "[ . 1 . 2]" 1
805 1 32 PHE QD 1 34 GLU HG2 . . 5.350 5.045 4.543 5.351 0.001 6 0 "[ . 1 . 2]" 1
806 1 32 PHE QD 1 34 GLU HG3 . . 5.300 5.002 3.950 5.356 0.056 2 0 "[ . 1 . 2]" 1
807 1 32 PHE QE 1 34 GLU HB2 . . 4.760 2.417 2.022 3.570 . 0 0 "[ . 1 . 2]" 1
808 1 32 PHE QE 1 34 GLU HG2 . . 4.350 3.541 2.904 4.617 0.267 15 0 "[ . 1 . 2]" 1
809 1 32 PHE QE 1 34 GLU HG3 . . 4.700 4.198 3.309 4.474 . 0 0 "[ . 1 . 2]" 1
810 1 33 SER HA 1 34 GLU H . . 3.090 2.179 2.139 2.383 . 0 0 "[ . 1 . 2]" 1
811 1 33 SER HA 1 34 GLU HB2 . . 5.500 4.132 3.909 4.248 . 0 0 "[ . 1 . 2]" 1
812 1 33 SER QB 1 34 GLU H . . 4.030 3.511 2.684 3.856 . 0 0 "[ . 1 . 2]" 1
813 1 33 SER HB2 1 34 GLU H . . 4.730 4.110 2.725 4.576 . 0 0 "[ . 1 . 2]" 1
814 1 33 SER HB3 1 34 GLU H . . 4.730 4.002 3.752 4.432 . 0 0 "[ . 1 . 2]" 1
815 1 34 GLU H 1 34 GLU HB2 . . 3.530 2.642 2.298 2.958 . 0 0 "[ . 1 . 2]" 1
816 1 34 GLU H 1 34 GLU HB3 . . 4.020 3.133 2.995 3.409 . 0 0 "[ . 1 . 2]" 1
817 1 34 GLU H 1 34 GLU HG2 . . 5.050 4.878 4.732 5.122 0.072 15 0 "[ . 1 . 2]" 1
818 1 34 GLU H 1 34 GLU HG3 . . 5.140 4.646 4.304 4.836 . 0 0 "[ . 1 . 2]" 1
819 1 34 GLU H 1 35 PRO HD2 . . 5.300 4.818 4.745 4.841 . 0 0 "[ . 1 . 2]" 1
820 1 34 GLU H 1 35 PRO QD . . 4.520 4.261 4.120 4.325 . 0 0 "[ . 1 . 2]" 1
821 1 34 GLU H 1 35 PRO HD3 . . 5.300 4.751 4.523 4.870 . 0 0 "[ . 1 . 2]" 1
822 1 34 GLU H 1 37 VAL H . . 5.130 4.765 4.660 5.052 . 0 0 "[ . 1 . 2]" 1
823 1 34 GLU H 1 37 VAL HB . . 4.060 3.507 3.360 3.855 . 0 0 "[ . 1 . 2]" 1
824 1 34 GLU H 1 37 VAL MG1 . . 4.850 4.313 4.123 4.653 . 0 0 "[ . 1 . 2]" 1
825 1 34 GLU H 1 37 VAL MG2 . . 4.720 3.881 3.644 4.354 . 0 0 "[ . 1 . 2]" 1
826 1 34 GLU H 1 38 VAL H . . 5.270 4.578 4.419 4.839 . 0 0 "[ . 1 . 2]" 1
827 1 34 GLU H 1 38 VAL MG2 . . 4.490 3.649 3.310 4.036 . 0 0 "[ . 1 . 2]" 1
828 1 34 GLU HB2 1 35 PRO HD2 . . 5.300 4.076 3.979 4.163 . 0 0 "[ . 1 . 2]" 1
829 1 34 GLU HB2 1 35 PRO QD . . 4.620 3.887 3.805 3.962 . 0 0 "[ . 1 . 2]" 1
830 1 34 GLU HB2 1 35 PRO HD3 . . 5.300 4.903 4.840 4.968 . 0 0 "[ . 1 . 2]" 1
831 1 34 GLU HB2 1 37 VAL H . . 4.930 4.165 4.030 4.265 . 0 0 "[ . 1 . 2]" 1
832 1 34 GLU HB2 1 37 VAL HB . . 3.800 3.538 3.273 3.743 . 0 0 "[ . 1 . 2]" 1
833 1 34 GLU HB2 1 37 VAL MG1 . . 5.110 4.376 4.182 4.547 . 0 0 "[ . 1 . 2]" 1
834 1 34 GLU HB2 1 37 VAL MG2 . . 3.900 2.532 2.275 2.908 . 0 0 "[ . 1 . 2]" 1
835 1 34 GLU HB2 1 38 VAL H . . 5.500 5.346 5.102 5.507 0.007 1 0 "[ . 1 . 2]" 1
836 1 34 GLU HB2 1 62 LEU MD2 . . 5.500 4.104 3.914 4.357 . 0 0 "[ . 1 . 2]" 1
837 1 34 GLU HB3 1 37 VAL H . . 3.220 2.422 2.333 2.516 . 0 0 "[ . 1 . 2]" 1
838 1 34 GLU HB3 1 37 VAL HB . . 2.480 2.477 2.407 2.494 0.014 11 0 "[ . 1 . 2]" 1
839 1 34 GLU HB3 1 37 VAL MG1 . . 4.750 3.888 3.798 3.972 . 0 0 "[ . 1 . 2]" 1
840 1 34 GLU HB3 1 37 VAL MG2 . . 3.000 1.984 1.870 2.171 . 0 0 "[ . 1 . 2]" 1
841 1 34 GLU HB3 1 38 VAL H . . 4.010 3.967 3.846 4.014 0.004 9 0 "[ . 1 . 2]" 1
842 1 34 GLU HB3 1 62 LEU MD2 . . 5.500 4.258 3.977 4.578 . 0 0 "[ . 1 . 2]" 1
843 1 34 GLU HG2 1 35 PRO QD . . 5.180 3.340 2.608 3.588 . 0 0 "[ . 1 . 2]" 1
844 1 34 GLU HG2 1 36 THR H . . 4.970 4.164 3.288 4.629 . 0 0 "[ . 1 . 2]" 1
845 1 34 GLU HG2 1 36 THR HB . . 5.330 5.122 4.253 5.504 0.174 2 0 "[ . 1 . 2]" 1
846 1 34 GLU HG2 1 37 VAL H . . 4.150 4.012 3.357 4.384 0.234 2 0 "[ . 1 . 2]" 1
847 1 34 GLU HG2 1 37 VAL HB . . 5.500 4.705 4.527 4.885 . 0 0 "[ . 1 . 2]" 1
848 1 34 GLU HG2 1 37 VAL MG1 . . 5.500 5.421 5.255 5.588 0.088 2 0 "[ . 1 . 2]" 1
849 1 34 GLU HG2 1 37 VAL MG2 . . 3.690 2.958 2.693 3.191 . 0 0 "[ . 1 . 2]" 1
850 1 34 GLU HG2 1 62 LEU MD2 . . 5.500 4.981 4.666 5.425 . 0 0 "[ . 1 . 2]" 1
851 1 34 GLU HG3 1 35 PRO HD2 . . 4.990 1.993 1.989 1.995 . 0 0 "[ . 1 . 2]" 1
852 1 34 GLU HG3 1 35 PRO HD3 . . 4.990 3.541 3.260 3.682 . 0 0 "[ . 1 . 2]" 1
853 1 34 GLU HG3 1 36 THR HB . . 5.500 4.646 4.114 5.514 0.014 7 0 "[ . 1 . 2]" 1
854 1 34 GLU HG3 1 37 VAL H . . 4.880 3.814 3.353 4.577 . 0 0 "[ . 1 . 2]" 1
855 1 34 GLU HG3 1 37 VAL MG2 . . 3.950 3.622 3.266 4.198 0.248 12 0 "[ . 1 . 2]" 1
856 1 35 PRO HA 1 37 VAL H . . 4.610 4.158 3.942 4.427 . 0 0 "[ . 1 . 2]" 1
857 1 35 PRO HA 1 38 VAL H . . 3.900 3.531 3.487 3.614 . 0 0 "[ . 1 . 2]" 1
858 1 35 PRO HA 1 38 VAL HA . . 5.500 5.485 5.454 5.509 0.009 11 0 "[ . 1 . 2]" 1
859 1 35 PRO HA 1 38 VAL HB . . 3.360 3.127 2.973 3.250 . 0 0 "[ . 1 . 2]" 1
860 1 35 PRO HA 1 38 VAL MG1 . . 4.400 4.331 4.214 4.403 0.003 1 0 "[ . 1 . 2]" 1
861 1 35 PRO HA 1 38 VAL MG2 . . 3.640 2.432 2.268 2.573 . 0 0 "[ . 1 . 2]" 1
862 1 35 PRO HA 1 39 THR H . . 5.280 4.619 4.489 4.787 . 0 0 "[ . 1 . 2]" 1
863 1 35 PRO HB2 1 36 THR H . . 4.270 3.010 2.881 3.190 . 0 0 "[ . 1 . 2]" 1
864 1 35 PRO HB2 1 36 THR HA . . 4.910 3.968 3.922 4.029 . 0 0 "[ . 1 . 2]" 1
865 1 35 PRO HB2 1 36 THR MG . . 4.870 4.710 4.602 4.779 . 0 0 "[ . 1 . 2]" 1
866 1 35 PRO HB2 1 37 VAL H . . 5.240 5.055 4.919 5.171 . 0 0 "[ . 1 . 2]" 1
867 1 35 PRO HB3 1 36 THR MG . . 5.500 5.474 5.378 5.513 0.013 7 0 "[ . 1 . 2]" 1
868 1 35 PRO HB3 1 38 VAL MG2 . . 4.980 4.362 4.234 4.462 . 0 0 "[ . 1 . 2]" 1
869 1 35 PRO QD 1 36 THR H . . 4.960 2.659 2.611 2.707 . 0 0 "[ . 1 . 2]" 1
870 1 35 PRO QD 1 37 VAL H . . 5.350 4.065 4.018 4.144 . 0 0 "[ . 1 . 2]" 1
871 1 35 PRO QG 1 36 THR H . . 4.160 2.010 1.898 2.185 . 0 0 "[ . 1 . 2]" 1
872 1 35 PRO QG 1 36 THR MG . . 4.710 3.359 3.122 3.464 . 0 0 "[ . 1 . 2]" 1
873 1 35 PRO HG2 1 36 THR MG . . 5.500 3.428 3.175 3.541 . 0 0 "[ . 1 . 2]" 1
874 1 35 PRO HG3 1 36 THR MG . . 5.500 4.829 4.611 4.901 . 0 0 "[ . 1 . 2]" 1
875 1 36 THR H 1 36 THR HB . . 4.110 2.569 2.487 2.666 . 0 0 "[ . 1 . 2]" 1
876 1 36 THR H 1 36 THR MG . . 4.600 2.049 1.931 2.162 . 0 0 "[ . 1 . 2]" 1
877 1 36 THR H 1 37 VAL H . . 3.870 2.671 2.586 2.796 . 0 0 "[ . 1 . 2]" 1
878 1 36 THR H 1 37 VAL MG2 . . 5.370 4.146 3.962 4.331 . 0 0 "[ . 1 . 2]" 1
879 1 36 THR H 1 38 VAL H . . 5.360 4.400 4.294 4.472 . 0 0 "[ . 1 . 2]" 1
880 1 36 THR HA 1 36 THR MG . . 3.290 3.202 3.193 3.207 . 0 0 "[ . 1 . 2]" 1
881 1 36 THR HA 1 38 VAL H . . 5.220 4.673 4.539 4.755 . 0 0 "[ . 1 . 2]" 1
882 1 36 THR HA 1 39 THR H . . 3.980 3.854 3.721 3.914 . 0 0 "[ . 1 . 2]" 1
883 1 36 THR HA 1 39 THR HB . . 3.360 3.501 3.356 3.561 0.201 6 0 "[ . 1 . 2]" 1
884 1 36 THR HA 1 40 ALA H . . 4.570 4.374 4.219 4.530 . 0 0 "[ . 1 . 2]" 1
885 1 36 THR HB 1 37 VAL H . . 4.220 4.044 3.872 4.197 . 0 0 "[ . 1 . 2]" 1
886 1 36 THR HB 1 37 VAL MG2 . . 5.040 4.746 4.657 4.897 . 0 0 "[ . 1 . 2]" 1
887 1 36 THR HB 1 61 PHE QD . . 4.650 4.547 4.178 4.651 0.001 8 0 "[ . 1 . 2]" 1
888 1 36 THR HB 1 61 PHE QE . . 5.500 4.342 3.994 4.811 . 0 0 "[ . 1 . 2]" 1
889 1 36 THR MG 1 37 VAL H . . 4.540 2.197 1.984 2.469 . 0 0 "[ . 1 . 2]" 1
890 1 36 THR MG 1 37 VAL HA . . 4.640 3.348 3.135 3.541 . 0 0 "[ . 1 . 2]" 1
891 1 36 THR MG 1 37 VAL MG2 . . 3.740 2.138 2.016 2.350 . 0 0 "[ . 1 . 2]" 1
892 1 36 THR MG 1 61 PHE HB3 . . 5.500 2.951 2.448 3.373 . 0 0 "[ . 1 . 2]" 1
893 1 36 THR MG 1 61 PHE QD . . 3.710 2.488 1.996 2.771 . 0 0 "[ . 1 . 2]" 1
894 1 36 THR MG 1 61 PHE QE . . 5.220 3.507 3.085 3.949 . 0 0 "[ . 1 . 2]" 1
895 1 37 VAL H 1 37 VAL HB . . 3.140 2.467 2.402 2.517 . 0 0 "[ . 1 . 2]" 1
896 1 37 VAL H 1 37 VAL MG1 . . 3.980 3.758 3.739 3.772 . 0 0 "[ . 1 . 2]" 1
897 1 37 VAL H 1 37 VAL MG2 . . 3.220 2.289 2.110 2.420 . 0 0 "[ . 1 . 2]" 1
898 1 37 VAL H 1 38 VAL HA . . 5.500 5.179 5.061 5.305 . 0 0 "[ . 1 . 2]" 1
899 1 37 VAL H 1 39 THR H . . 5.010 4.160 3.963 4.302 . 0 0 "[ . 1 . 2]" 1
900 1 37 VAL HA 1 37 VAL MG1 . . 3.440 2.458 2.378 2.503 . 0 0 "[ . 1 . 2]" 1
901 1 37 VAL HA 1 37 VAL MG2 . . 3.290 2.389 2.252 2.438 . 0 0 "[ . 1 . 2]" 1
902 1 37 VAL HA 1 39 THR H . . 5.480 4.247 4.075 4.402 . 0 0 "[ . 1 . 2]" 1
903 1 37 VAL HA 1 40 ALA H . . 3.620 3.408 3.174 3.590 . 0 0 "[ . 1 . 2]" 1
904 1 37 VAL HA 1 40 ALA MB . . 3.470 2.492 2.264 2.762 . 0 0 "[ . 1 . 2]" 1
905 1 37 VAL HA 1 41 ALA H . . 4.910 4.360 4.220 4.503 . 0 0 "[ . 1 . 2]" 1
906 1 37 VAL HA 1 41 ALA MB . . 5.450 4.782 4.555 4.971 . 0 0 "[ . 1 . 2]" 1
907 1 37 VAL HA 1 58 LEU MD2 . . 4.620 3.312 3.089 3.551 . 0 0 "[ . 1 . 2]" 1
908 1 37 VAL HA 1 61 PHE QD . . 4.600 3.828 3.394 4.111 . 0 0 "[ . 1 . 2]" 1
909 1 37 VAL HB 1 38 VAL H . . 3.440 2.492 2.414 2.566 . 0 0 "[ . 1 . 2]" 1
910 1 37 VAL HB 1 38 VAL HA . . 4.930 4.214 4.162 4.303 . 0 0 "[ . 1 . 2]" 1
911 1 37 VAL HB 1 38 VAL HB . . 5.500 5.070 4.973 5.178 . 0 0 "[ . 1 . 2]" 1
912 1 37 VAL HB 1 38 VAL MG2 . . 4.310 3.334 3.220 3.444 . 0 0 "[ . 1 . 2]" 1
913 1 37 VAL HB 1 39 THR H . . 5.110 5.033 4.911 5.114 0.004 7 0 "[ . 1 . 2]" 1
914 1 37 VAL HB 1 61 PHE HB3 . . 5.500 4.522 4.206 4.787 . 0 0 "[ . 1 . 2]" 1
915 1 37 VAL MG1 1 38 VAL H . . 4.430 3.289 3.117 3.398 . 0 0 "[ . 1 . 2]" 1
916 1 37 VAL MG1 1 38 VAL HA . . 4.660 3.379 3.170 3.529 . 0 0 "[ . 1 . 2]" 1
917 1 37 VAL MG1 1 38 VAL MG2 . . 3.800 3.663 3.477 3.800 . 0 0 "[ . 1 . 2]" 1
918 1 37 VAL MG1 1 39 THR H . . 5.500 4.769 4.638 4.863 . 0 0 "[ . 1 . 2]" 1
919 1 37 VAL MG1 1 40 ALA H . . 5.500 4.584 4.324 4.827 . 0 0 "[ . 1 . 2]" 1
920 1 37 VAL MG1 1 40 ALA MB . . 3.600 3.369 3.196 3.551 . 0 0 "[ . 1 . 2]" 1
921 1 37 VAL MG1 1 41 ALA H . . 5.000 4.007 3.820 4.164 . 0 0 "[ . 1 . 2]" 1
922 1 37 VAL MG1 1 41 ALA MB . . 3.900 3.239 2.962 3.442 . 0 0 "[ . 1 . 2]" 1
923 1 37 VAL MG1 1 58 LEU HB3 . . 5.330 3.809 3.397 4.159 . 0 0 "[ . 1 . 2]" 1
924 1 37 VAL MG1 1 58 LEU MD1 . . 4.490 3.672 3.543 3.850 . 0 0 "[ . 1 . 2]" 1
925 1 37 VAL MG1 1 61 PHE HA . . 5.500 5.338 5.140 5.500 . 0 0 "[ . 1 . 2]" 1
926 1 37 VAL MG1 1 61 PHE HB2 . . 4.330 3.771 3.494 4.108 . 0 0 "[ . 1 . 2]" 1
927 1 37 VAL MG1 1 61 PHE HB3 . . 4.470 3.424 3.182 3.677 . 0 0 "[ . 1 . 2]" 1
928 1 37 VAL MG1 1 61 PHE QD . . 5.500 4.561 4.298 4.883 . 0 0 "[ . 1 . 2]" 1
929 1 37 VAL MG1 1 62 LEU HA . . 5.500 4.804 4.518 5.129 . 0 0 "[ . 1 . 2]" 1
930 1 37 VAL MG1 1 62 LEU MD1 . . 3.410 2.280 1.984 2.419 . 0 0 "[ . 1 . 2]" 1
931 1 37 VAL MG1 1 62 LEU HG . . 5.500 2.556 2.267 2.953 . 0 0 "[ . 1 . 2]" 1
932 1 37 VAL MG1 1 69 PHE HB3 . . 5.500 4.848 4.685 4.942 . 0 0 "[ . 1 . 2]" 1
933 1 37 VAL MG1 1 69 PHE QD . . 5.240 3.754 3.554 3.917 . 0 0 "[ . 1 . 2]" 1
934 1 37 VAL MG1 1 69 PHE QE . . 4.020 3.165 2.965 3.406 . 0 0 "[ . 1 . 2]" 1
935 1 37 VAL MG1 1 69 PHE HZ . . 4.200 3.247 3.089 3.436 . 0 0 "[ . 1 . 2]" 1
936 1 37 VAL MG2 1 38 VAL H . . 4.300 3.830 3.785 3.902 . 0 0 "[ . 1 . 2]" 1
937 1 37 VAL MG2 1 61 PHE HA . . 4.530 3.454 3.166 3.665 . 0 0 "[ . 1 . 2]" 1
938 1 37 VAL MG2 1 61 PHE HB2 . . 3.750 3.065 2.573 3.521 . 0 0 "[ . 1 . 2]" 1
939 1 37 VAL MG2 1 61 PHE HB3 . . 3.500 1.959 1.827 2.243 . 0 0 "[ . 1 . 2]" 1
940 1 37 VAL MG2 1 61 PHE QD . . 3.770 3.557 3.241 3.773 0.003 16 0 "[ . 1 . 2]" 1
941 1 37 VAL MG2 1 62 LEU HA . . 4.940 3.842 3.615 4.131 . 0 0 "[ . 1 . 2]" 1
942 1 37 VAL MG2 1 62 LEU MD1 . . 3.720 3.426 3.211 3.585 . 0 0 "[ . 1 . 2]" 1
943 1 37 VAL MG2 1 62 LEU HG . . 4.430 2.508 2.112 2.827 . 0 0 "[ . 1 . 2]" 1
944 1 38 VAL H 1 38 VAL HB . . 3.080 2.620 2.556 2.681 . 0 0 "[ . 1 . 2]" 1
945 1 38 VAL H 1 38 VAL MG1 . . 4.020 3.768 3.759 3.774 . 0 0 "[ . 1 . 2]" 1
946 1 38 VAL H 1 38 VAL MG2 . . 2.890 2.102 1.971 2.191 . 0 0 "[ . 1 . 2]" 1
947 1 38 VAL H 1 39 THR H . . 3.200 2.889 2.819 2.954 . 0 0 "[ . 1 . 2]" 1
948 1 38 VAL H 1 39 THR HA . . 5.500 5.457 5.404 5.502 0.002 7 0 "[ . 1 . 2]" 1
949 1 38 VAL H 1 41 ALA H . . 5.500 5.025 4.887 5.100 . 0 0 "[ . 1 . 2]" 1
950 1 38 VAL H 1 41 ALA MB . . 5.230 4.864 4.672 4.981 . 0 0 "[ . 1 . 2]" 1
951 1 38 VAL HA 1 38 VAL MG1 . . 3.030 2.347 2.262 2.460 . 0 0 "[ . 1 . 2]" 1
952 1 38 VAL HA 1 38 VAL MG2 . . 2.890 2.353 2.306 2.426 . 0 0 "[ . 1 . 2]" 1
953 1 38 VAL HA 1 39 THR HA . . 5.500 4.741 4.708 4.757 . 0 0 "[ . 1 . 2]" 1
954 1 38 VAL HA 1 40 ALA H . . 5.500 4.932 4.623 5.147 . 0 0 "[ . 1 . 2]" 1
955 1 38 VAL HA 1 41 ALA H . . 4.280 3.912 3.805 4.007 . 0 0 "[ . 1 . 2]" 1
956 1 38 VAL HA 1 41 ALA MB . . 3.660 3.028 2.885 3.281 . 0 0 "[ . 1 . 2]" 1
957 1 38 VAL HA 1 42 LEU H . . 4.840 4.414 4.223 4.538 . 0 0 "[ . 1 . 2]" 1
958 1 38 VAL HA 1 69 PHE HZ . . 4.870 4.086 3.847 4.279 . 0 0 "[ . 1 . 2]" 1
959 1 38 VAL HB 1 39 THR H . . 3.230 2.579 2.456 2.707 . 0 0 "[ . 1 . 2]" 1
960 1 38 VAL HB 1 39 THR HA . . 4.610 4.290 4.197 4.347 . 0 0 "[ . 1 . 2]" 1
961 1 38 VAL HB 1 40 ALA H . . 5.500 5.175 4.927 5.329 . 0 0 "[ . 1 . 2]" 1
962 1 38 VAL MG1 1 39 THR H . . 3.970 3.413 3.255 3.565 . 0 0 "[ . 1 . 2]" 1
963 1 38 VAL MG1 1 39 THR HB . . 5.300 5.136 4.955 5.274 . 0 0 "[ . 1 . 2]" 1
964 1 38 VAL MG1 1 40 ALA H . . 5.500 5.280 5.036 5.425 . 0 0 "[ . 1 . 2]" 1
965 1 38 VAL MG1 1 41 ALA H . . 5.460 4.737 4.604 4.870 . 0 0 "[ . 1 . 2]" 1
966 1 38 VAL MG1 1 41 ALA MB . . 4.450 3.889 3.732 4.054 . 0 0 "[ . 1 . 2]" 1
967 1 38 VAL MG1 1 42 LEU H . . 5.150 4.147 3.979 4.330 . 0 0 "[ . 1 . 2]" 1
968 1 38 VAL MG1 1 42 LEU HG . . 3.740 3.233 3.084 3.446 . 0 0 "[ . 1 . 2]" 1
969 1 38 VAL MG2 1 39 THR H . . 4.150 3.837 3.739 3.897 . 0 0 "[ . 1 . 2]" 1
970 1 39 THR H 1 39 THR HB . . 3.050 2.509 2.483 2.537 . 0 0 "[ . 1 . 2]" 1
971 1 39 THR H 1 39 THR MG . . 4.000 3.768 3.764 3.775 . 0 0 "[ . 1 . 2]" 1
972 1 39 THR H 1 40 ALA H . . 3.220 2.678 2.493 2.806 . 0 0 "[ . 1 . 2]" 1
973 1 39 THR H 1 40 ALA MB . . 4.350 4.237 4.145 4.319 . 0 0 "[ . 1 . 2]" 1
974 1 39 THR H 1 41 ALA H . . 4.840 3.901 3.851 3.992 . 0 0 "[ . 1 . 2]" 1
975 1 39 THR H 1 41 ALA MB . . 5.500 4.712 4.635 4.842 . 0 0 "[ . 1 . 2]" 1
976 1 39 THR H 1 42 LEU H . . 5.240 4.783 4.708 4.870 . 0 0 "[ . 1 . 2]" 1
977 1 39 THR H 1 42 LEU MD1 . . 4.410 4.089 3.783 4.329 . 0 0 "[ . 1 . 2]" 1
978 1 39 THR HA 1 39 THR MG . . 3.280 2.463 2.447 2.478 . 0 0 "[ . 1 . 2]" 1
979 1 39 THR HA 1 41 ALA H . . 5.030 3.786 3.662 3.917 . 0 0 "[ . 1 . 2]" 1
980 1 39 THR HA 1 41 ALA MB . . 5.050 4.615 4.559 4.716 . 0 0 "[ . 1 . 2]" 1
981 1 39 THR HA 1 42 LEU H . . 3.580 3.231 3.155 3.348 . 0 0 "[ . 1 . 2]" 1
982 1 39 THR HA 1 42 LEU HB2 . . 3.730 2.583 2.399 2.648 . 0 0 "[ . 1 . 2]" 1
983 1 39 THR HA 1 42 LEU HB3 . . 4.340 4.255 4.045 4.320 . 0 0 "[ . 1 . 2]" 1
984 1 39 THR HA 1 42 LEU MD1 . . 3.590 2.334 2.124 2.662 . 0 0 "[ . 1 . 2]" 1
985 1 39 THR HA 1 42 LEU HG . . 4.280 3.943 3.766 4.234 . 0 0 "[ . 1 . 2]" 1
986 1 39 THR HA 1 43 ASN H . . 4.410 4.013 3.923 4.137 . 0 0 "[ . 1 . 2]" 1
987 1 39 THR HB 1 40 ALA H . . 3.320 2.365 2.199 2.629 . 0 0 "[ . 1 . 2]" 1
988 1 39 THR HB 1 40 ALA HA . . 4.980 4.177 4.124 4.248 . 0 0 "[ . 1 . 2]" 1
989 1 39 THR HB 1 40 ALA MB . . 4.720 3.941 3.833 4.030 . 0 0 "[ . 1 . 2]" 1
990 1 39 THR MG 1 40 ALA H . . 3.620 3.261 3.091 3.514 . 0 0 "[ . 1 . 2]" 1
991 1 39 THR MG 1 40 ALA HA . . 3.740 3.408 3.303 3.552 . 0 0 "[ . 1 . 2]" 1
992 1 39 THR MG 1 41 ALA H . . 4.480 4.430 4.353 4.480 0.000 19 0 "[ . 1 . 2]" 1
993 1 39 THR MG 1 42 LEU H . . 5.150 4.445 4.363 4.583 . 0 0 "[ . 1 . 2]" 1
994 1 39 THR MG 1 42 LEU HB2 . . 4.810 3.606 3.463 3.754 . 0 0 "[ . 1 . 2]" 1
995 1 39 THR MG 1 43 ASN H . . 4.690 3.650 3.485 3.813 . 0 0 "[ . 1 . 2]" 1
996 1 39 THR MG 1 43 ASN QB . . 4.520 2.955 2.822 3.126 . 0 0 "[ . 1 . 2]" 1
997 1 39 THR MG 1 43 ASN HD21 . . 5.040 3.476 3.198 3.613 . 0 0 "[ . 1 . 2]" 1
998 1 39 THR MG 1 43 ASN HD22 . . 5.330 4.875 4.543 5.020 . 0 0 "[ . 1 . 2]" 1
999 1 40 ALA H 1 40 ALA MB . . 2.970 2.188 2.038 2.238 . 0 0 "[ . 1 . 2]" 1
1000 1 40 ALA H 1 41 ALA H . . 3.410 2.805 2.665 2.932 . 0 0 "[ . 1 . 2]" 1
1001 1 40 ALA H 1 41 ALA MB . . 4.830 4.454 4.305 4.605 . 0 0 "[ . 1 . 2]" 1
1002 1 40 ALA H 1 42 LEU H . . 4.730 4.569 4.366 4.663 . 0 0 "[ . 1 . 2]" 1
1003 1 40 ALA H 1 42 LEU HB2 . . 5.500 5.421 5.295 5.492 . 0 0 "[ . 1 . 2]" 1
1004 1 40 ALA H 1 42 LEU MD1 . . 5.500 5.273 5.020 5.500 0.000 14 0 "[ . 1 . 2]" 1
1005 1 40 ALA H 1 43 ASN H . . 5.500 4.993 4.912 5.067 . 0 0 "[ . 1 . 2]" 1
1006 1 40 ALA H 1 58 LEU MD2 . . 4.360 4.058 3.919 4.101 . 0 0 "[ . 1 . 2]" 1
1007 1 40 ALA H 1 61 PHE QD . . 5.210 4.880 4.422 5.210 . 18 0 "[ . 1 . 2]" 1
1008 1 40 ALA HA 1 41 ALA HA . . 5.500 4.679 4.642 4.718 . 0 0 "[ . 1 . 2]" 1
1009 1 40 ALA HA 1 42 LEU H . . 4.880 4.914 4.740 5.003 0.123 9 0 "[ . 1 . 2]" 1
1010 1 40 ALA HA 1 43 ASN H . . 4.020 3.933 3.868 4.002 . 0 0 "[ . 1 . 2]" 1
1011 1 40 ALA HA 1 43 ASN HB2 . . 3.980 3.705 3.552 3.821 . 0 0 "[ . 1 . 2]" 1
1012 1 40 ALA HA 1 43 ASN HB3 . . 3.980 3.506 3.300 3.622 . 0 0 "[ . 1 . 2]" 1
1013 1 40 ALA HA 1 43 ASN HD21 . . 5.500 4.701 4.507 4.910 . 0 0 "[ . 1 . 2]" 1
1014 1 40 ALA HA 1 44 CYS H . . 5.010 4.387 4.157 4.477 . 0 0 "[ . 1 . 2]" 1
1015 1 40 ALA HA 1 57 HIS HD2 . . 5.500 2.916 1.998 3.639 . 0 0 "[ . 1 . 2]" 1
1016 1 40 ALA HA 1 58 LEU MD2 . . 4.140 3.656 3.418 3.884 . 0 0 "[ . 1 . 2]" 1
1017 1 40 ALA HA 1 61 PHE QD . . 5.370 4.626 4.243 5.147 . 0 0 "[ . 1 . 2]" 1
1018 1 40 ALA HA 1 61 PHE QE . . 5.500 4.052 3.456 4.690 . 0 0 "[ . 1 . 2]" 1
1019 1 40 ALA MB 1 41 ALA H . . 3.240 2.880 2.702 3.055 . 0 0 "[ . 1 . 2]" 1
1020 1 40 ALA MB 1 41 ALA HA . . 5.040 3.917 3.845 3.987 . 0 0 "[ . 1 . 2]" 1
1021 1 40 ALA MB 1 41 ALA MB . . 5.500 3.782 3.636 3.860 . 0 0 "[ . 1 . 2]" 1
1022 1 40 ALA MB 1 43 ASN H . . 5.010 4.938 4.849 5.010 0.000 4 0 "[ . 1 . 2]" 1
1023 1 40 ALA MB 1 43 ASN HB2 . . 5.500 5.133 4.999 5.230 . 0 0 "[ . 1 . 2]" 1
1024 1 40 ALA MB 1 43 ASN HB3 . . 5.500 4.777 4.670 4.892 . 0 0 "[ . 1 . 2]" 1
1025 1 40 ALA MB 1 44 CYS H . . 5.500 4.928 4.742 5.044 . 0 0 "[ . 1 . 2]" 1
1026 1 40 ALA MB 1 57 HIS HD2 . . 4.320 2.060 1.887 2.246 . 0 0 "[ . 1 . 2]" 1
1027 1 40 ALA MB 1 57 HIS HE1 . . 5.500 5.286 4.772 5.503 0.003 9 0 "[ . 1 . 2]" 1
1028 1 40 ALA MB 1 58 LEU H . . 4.590 4.582 4.349 4.777 0.187 7 0 "[ . 1 . 2]" 1
1029 1 40 ALA MB 1 58 LEU HA . . 4.950 3.121 2.910 3.337 . 0 0 "[ . 1 . 2]" 1
1030 1 40 ALA MB 1 58 LEU HB3 . . 4.970 4.193 3.899 4.490 . 0 0 "[ . 1 . 2]" 1
1031 1 40 ALA MB 1 58 LEU MD2 . . 3.140 1.745 1.650 1.815 . 0 0 "[ . 1 . 2]" 1
1032 1 40 ALA MB 1 58 LEU HG . . 5.310 3.472 2.974 3.834 . 0 0 "[ . 1 . 2]" 1
1033 1 40 ALA MB 1 61 PHE QD . . 3.660 2.247 1.921 2.640 . 0 0 "[ . 1 . 2]" 1
1034 1 40 ALA MB 1 61 PHE QE . . 4.220 2.483 2.039 2.986 . 0 0 "[ . 1 . 2]" 1
1035 1 41 ALA H 1 41 ALA MB . . 3.020 2.178 2.116 2.271 . 0 0 "[ . 1 . 2]" 1
1036 1 41 ALA H 1 42 LEU H . . 3.080 2.475 2.318 2.582 . 0 0 "[ . 1 . 2]" 1
1037 1 41 ALA H 1 42 LEU HB2 . . 4.930 4.388 4.233 4.535 . 0 0 "[ . 1 . 2]" 1
1038 1 41 ALA H 1 42 LEU MD1 . . 5.500 4.669 4.364 4.882 . 0 0 "[ . 1 . 2]" 1
1039 1 41 ALA H 1 43 ASN H . . 4.070 3.794 3.659 3.894 . 0 0 "[ . 1 . 2]" 1
1040 1 41 ALA H 1 58 LEU MD2 . . 3.690 3.202 2.938 3.469 . 0 0 "[ . 1 . 2]" 1
1041 1 41 ALA H 1 73 LEU MD2 . . 5.500 4.638 4.373 5.003 . 0 0 "[ . 1 . 2]" 1
1042 1 41 ALA HA 1 43 ASN H . . 4.300 4.170 4.048 4.264 . 0 0 "[ . 1 . 2]" 1
1043 1 41 ALA HA 1 44 CYS H . . 5.010 3.348 3.283 3.420 . 0 0 "[ . 1 . 2]" 1
1044 1 41 ALA HA 1 44 CYS QB . . 4.190 2.644 2.405 2.899 . 0 0 "[ . 1 . 2]" 1
1045 1 41 ALA HA 1 45 VAL H . . 5.500 4.174 4.005 4.311 . 0 0 "[ . 1 . 2]" 1
1046 1 41 ALA HA 1 45 VAL MG2 . . 4.430 4.315 4.134 4.434 0.004 7 0 "[ . 1 . 2]" 1
1047 1 41 ALA HA 1 58 LEU MD1 . . 3.930 3.207 2.944 3.425 . 0 0 "[ . 1 . 2]" 1
1048 1 41 ALA HA 1 58 LEU MD2 . . 3.380 2.816 2.526 3.280 . 0 0 "[ . 1 . 2]" 1
1049 1 41 ALA HA 1 69 PHE QE . . 5.070 3.500 3.334 3.790 . 0 0 "[ . 1 . 2]" 1
1050 1 41 ALA HA 1 73 LEU MD2 . . 3.750 2.553 2.296 2.871 . 0 0 "[ . 1 . 2]" 1
1051 1 41 ALA MB 1 42 LEU H . . 3.020 2.456 2.261 2.590 . 0 0 "[ . 1 . 2]" 1
1052 1 41 ALA MB 1 42 LEU HA . . 4.410 3.733 3.649 3.800 . 0 0 "[ . 1 . 2]" 1
1053 1 41 ALA MB 1 43 ASN H . . 5.500 4.345 4.296 4.396 . 0 0 "[ . 1 . 2]" 1
1054 1 41 ALA MB 1 44 CYS H . . 5.500 4.524 4.472 4.602 . 0 0 "[ . 1 . 2]" 1
1055 1 41 ALA MB 1 45 VAL MG2 . . 5.500 3.789 3.580 3.979 . 0 0 "[ . 1 . 2]" 1
1056 1 41 ALA MB 1 58 LEU MD1 . . 3.470 3.059 2.840 3.260 . 0 0 "[ . 1 . 2]" 1
1057 1 41 ALA MB 1 58 LEU MD2 . . 3.100 2.808 2.378 3.088 . 0 0 "[ . 1 . 2]" 1
1058 1 41 ALA MB 1 69 PHE QD . . 4.860 4.134 4.024 4.222 . 0 0 "[ . 1 . 2]" 1
1059 1 41 ALA MB 1 69 PHE QE . . 3.290 2.073 1.970 2.295 . 0 0 "[ . 1 . 2]" 1
1060 1 41 ALA MB 1 69 PHE HZ . . 3.390 2.220 2.031 2.552 . 0 0 "[ . 1 . 2]" 1
1061 1 41 ALA MB 1 70 VAL HA . . 5.500 4.838 4.644 4.994 . 0 0 "[ . 1 . 2]" 1
1062 1 41 ALA MB 1 73 LEU HA . . 5.470 4.950 4.768 5.299 . 0 0 "[ . 1 . 2]" 1
1063 1 41 ALA MB 1 73 LEU MD1 . . 2.880 2.325 2.023 2.703 . 0 0 "[ . 1 . 2]" 1
1064 1 41 ALA MB 1 73 LEU MD2 . . 2.820 2.067 1.865 2.484 . 0 0 "[ . 1 . 2]" 1
1065 1 42 LEU H 1 42 LEU HB2 . . 3.150 2.382 2.296 2.489 . 0 0 "[ . 1 . 2]" 1
1066 1 42 LEU H 1 42 LEU MD1 . . 5.500 3.246 3.048 3.368 . 0 0 "[ . 1 . 2]" 1
1067 1 42 LEU H 1 42 LEU MD2 . . 4.540 3.848 3.736 4.040 . 0 0 "[ . 1 . 2]" 1
1068 1 42 LEU H 1 42 LEU HG . . 3.110 2.494 2.310 2.731 . 0 0 "[ . 1 . 2]" 1
1069 1 42 LEU H 1 43 ASN H . . 3.420 2.760 2.666 2.832 . 0 0 "[ . 1 . 2]" 1
1070 1 42 LEU H 1 43 ASN HA . . 5.490 5.353 5.272 5.411 . 0 0 "[ . 1 . 2]" 1
1071 1 42 LEU H 1 43 ASN HB2 . . 5.430 4.874 4.753 4.972 . 0 0 "[ . 1 . 2]" 1
1072 1 42 LEU H 1 43 ASN QB . . 4.610 4.519 4.430 4.589 . 0 0 "[ . 1 . 2]" 1
1073 1 42 LEU H 1 43 ASN HB3 . . 5.430 5.350 5.208 5.426 . 0 0 "[ . 1 . 2]" 1
1074 1 42 LEU H 1 44 CYS H . . 5.250 4.325 4.272 4.394 . 0 0 "[ . 1 . 2]" 1
1075 1 42 LEU HA 1 42 LEU MD2 . . 3.140 2.430 2.230 2.641 . 0 0 "[ . 1 . 2]" 1
1076 1 42 LEU HA 1 42 LEU HG . . 3.520 2.685 2.549 2.764 . 0 0 "[ . 1 . 2]" 1
1077 1 42 LEU HA 1 44 CYS H . . 4.630 4.580 4.473 4.626 . 0 0 "[ . 1 . 2]" 1
1078 1 42 LEU HA 1 44 CYS QB . . 5.340 5.017 4.961 5.085 . 0 0 "[ . 1 . 2]" 1
1079 1 42 LEU HA 1 45 VAL H . . 4.520 4.247 3.983 4.378 . 0 0 "[ . 1 . 2]" 1
1080 1 42 LEU HA 1 45 VAL MG2 . . 3.350 2.499 2.365 2.635 . 0 0 "[ . 1 . 2]" 1
1081 1 42 LEU HA 1 46 GLY H . . 5.300 4.141 3.929 4.409 . 0 0 "[ . 1 . 2]" 1
1082 1 42 LEU HB2 1 42 LEU MD1 . . 3.190 2.053 1.988 2.156 . 0 0 "[ . 1 . 2]" 1
1083 1 42 LEU HB2 1 43 ASN H . . 3.710 2.785 2.670 2.900 . 0 0 "[ . 1 . 2]" 1
1084 1 42 LEU HB3 1 42 LEU MD2 . . 2.980 2.140 2.008 2.267 . 0 0 "[ . 1 . 2]" 1
1085 1 42 LEU HB3 1 43 ASN H . . 3.940 3.607 3.463 3.721 . 0 0 "[ . 1 . 2]" 1
1086 1 42 LEU HB3 1 45 VAL MG2 . . 5.500 4.210 4.058 4.367 . 0 0 "[ . 1 . 2]" 1
1087 1 42 LEU HB3 1 46 GLY H . . 5.310 5.236 5.067 5.469 0.159 20 0 "[ . 1 . 2]" 1
1088 1 42 LEU HG 1 43 ASN H . . 4.770 4.630 4.517 4.738 . 0 0 "[ . 1 . 2]" 1
1089 1 43 ASN H 1 43 ASN HB2 . . 3.060 2.324 2.250 2.385 . 0 0 "[ . 1 . 2]" 1
1090 1 43 ASN H 1 43 ASN HB3 . . 3.060 2.794 2.734 2.884 . 0 0 "[ . 1 . 2]" 1
1091 1 43 ASN H 1 43 ASN HD21 . . 5.500 4.492 4.377 4.638 . 0 0 "[ . 1 . 2]" 1
1092 1 43 ASN H 1 44 CYS H . . 3.410 2.577 2.468 2.616 . 0 0 "[ . 1 . 2]" 1
1093 1 43 ASN H 1 44 CYS HA . . 5.500 5.180 5.081 5.212 . 0 0 "[ . 1 . 2]" 1
1094 1 43 ASN H 1 44 CYS QB . . 5.340 4.364 4.128 4.547 . 0 0 "[ . 1 . 2]" 1
1095 1 43 ASN H 1 45 VAL H . . 4.930 4.757 4.603 4.851 . 0 0 "[ . 1 . 2]" 1
1096 1 43 ASN H 1 45 VAL MG2 . . 4.330 4.290 4.194 4.334 0.004 17 0 "[ . 1 . 2]" 1
1097 1 43 ASN H 1 46 GLY H . . 5.500 4.691 4.580 4.803 . 0 0 "[ . 1 . 2]" 1
1098 1 43 ASN HA 1 46 GLY H . . 4.190 3.620 3.443 3.848 . 0 0 "[ . 1 . 2]" 1
1099 1 43 ASN HA 1 46 GLY HA3 . . 5.040 3.528 3.388 3.703 . 0 0 "[ . 1 . 2]" 1
1100 1 43 ASN HA 1 47 LYS H . . 4.650 3.976 3.828 4.176 . 0 0 "[ . 1 . 2]" 1
1101 1 43 ASN QB 1 44 CYS H . . 3.140 2.509 2.477 2.572 . 0 0 "[ . 1 . 2]" 1
1102 1 43 ASN QB 1 49 MET ME . . 4.710 3.077 2.771 3.302 . 0 0 "[ . 1 . 2]" 1
1103 1 43 ASN QB 1 57 HIS HE1 . . 5.140 4.621 3.987 5.000 . 0 0 "[ . 1 . 2]" 1
1104 1 43 ASN HB2 1 44 CYS H . . 3.840 3.619 3.521 3.665 . 0 0 "[ . 1 . 2]" 1
1105 1 43 ASN HB3 1 44 CYS H . . 3.840 2.559 2.525 2.629 . 0 0 "[ . 1 . 2]" 1
1106 1 43 ASN HD21 1 44 CYS H . . 5.500 5.459 5.350 5.502 0.002 6 0 "[ . 1 . 2]" 1
1107 1 43 ASN HD21 1 49 MET ME . . 5.000 4.880 4.616 4.998 . 0 0 "[ . 1 . 2]" 1
1108 1 43 ASN HD21 1 57 HIS HE1 . . 5.410 4.962 4.548 5.460 0.050 9 0 "[ . 1 . 2]" 1
1109 1 43 ASN HD22 1 49 MET ME . . 4.840 4.738 4.489 4.837 . 0 0 "[ . 1 . 2]" 1
1110 1 44 CYS H 1 44 CYS HB2 . . 3.770 2.620 2.414 2.790 . 0 0 "[ . 1 . 2]" 1
1111 1 44 CYS H 1 44 CYS QB . . 3.130 2.308 2.194 2.456 . 0 0 "[ . 1 . 2]" 1
1112 1 44 CYS H 1 44 CYS HB3 . . 3.770 2.946 2.295 3.592 . 0 0 "[ . 1 . 2]" 1
1113 1 44 CYS H 1 45 VAL H . . 3.320 3.128 2.971 3.180 . 0 0 "[ . 1 . 2]" 1
1114 1 44 CYS H 1 45 VAL MG2 . . 4.070 3.874 3.802 3.948 . 0 0 "[ . 1 . 2]" 1
1115 1 44 CYS H 1 46 GLY H . . 4.830 3.992 3.816 4.220 . 0 0 "[ . 1 . 2]" 1
1116 1 44 CYS H 1 47 LYS HB2 . . 5.190 5.049 4.919 5.180 . 0 0 "[ . 1 . 2]" 1
1117 1 44 CYS H 1 49 MET ME . . 4.590 3.444 3.100 3.672 . 0 0 "[ . 1 . 2]" 1
1118 1 44 CYS H 1 73 LEU MD2 . . 5.500 4.332 4.166 4.493 . 0 0 "[ . 1 . 2]" 1
1119 1 44 CYS HA 1 45 VAL MG1 . . 5.310 5.193 5.126 5.320 0.010 19 0 "[ . 1 . 2]" 1
1120 1 44 CYS HA 1 47 LYS H . . 4.950 3.599 3.460 3.738 . 0 0 "[ . 1 . 2]" 1
1121 1 44 CYS HA 1 47 LYS HB2 . . 4.790 3.676 3.543 3.839 . 0 0 "[ . 1 . 2]" 1
1122 1 44 CYS HA 1 47 LYS HB3 . . 4.060 3.881 3.728 4.030 . 0 0 "[ . 1 . 2]" 1
1123 1 44 CYS HA 1 49 MET H . . 3.900 3.747 3.614 3.892 . 0 0 "[ . 1 . 2]" 1
1124 1 44 CYS HA 1 49 MET QB . . 3.730 2.422 2.248 2.574 . 0 0 "[ . 1 . 2]" 1
1125 1 44 CYS HA 1 49 MET ME . . 3.230 2.078 1.966 2.233 . 0 0 "[ . 1 . 2]" 1
1126 1 44 CYS HA 1 49 MET HG3 . . 3.440 2.392 2.184 2.674 . 0 0 "[ . 1 . 2]" 1
1127 1 44 CYS HA 1 54 ALA MB . . 4.140 4.041 3.710 4.353 0.213 19 0 "[ . 1 . 2]" 1
1128 1 44 CYS QB 1 45 VAL H . . 3.280 2.157 2.008 2.289 . 0 0 "[ . 1 . 2]" 1
1129 1 44 CYS QB 1 45 VAL HA . . 5.340 4.073 3.745 4.389 . 0 0 "[ . 1 . 2]" 1
1130 1 44 CYS QB 1 45 VAL MG1 . . 4.990 3.442 3.178 3.787 . 0 0 "[ . 1 . 2]" 1
1131 1 44 CYS QB 1 45 VAL MG2 . . 4.090 3.407 3.294 3.527 . 0 0 "[ . 1 . 2]" 1
1132 1 44 CYS QB 1 49 MET QB . . 3.600 2.875 2.489 3.268 . 0 0 "[ . 1 . 2]" 1
1133 1 44 CYS QB 1 49 MET ME . . 4.150 3.284 2.743 3.729 . 0 0 "[ . 1 . 2]" 1
1134 1 44 CYS QB 1 54 ALA HA . . 4.310 3.251 3.053 3.469 . 0 0 "[ . 1 . 2]" 1
1135 1 44 CYS QB 1 54 ALA MB . . 3.510 2.464 2.011 2.957 . 0 0 "[ . 1 . 2]" 1
1136 1 44 CYS QB 1 73 LEU MD2 . . 3.540 2.577 2.402 2.749 . 0 0 "[ . 1 . 2]" 1
1137 1 44 CYS QB 1 74 PHE QE . . 5.100 3.620 2.579 4.348 . 0 0 "[ . 1 . 2]" 1
1138 1 44 CYS HB2 1 45 VAL H . . 3.840 2.894 2.042 3.722 . 0 0 "[ . 1 . 2]" 1
1139 1 44 CYS HB2 1 54 ALA HA . . 5.170 3.882 3.092 4.631 . 0 0 "[ . 1 . 2]" 1
1140 1 44 CYS HB2 1 54 ALA MB . . 4.300 3.100 2.736 3.463 . 0 0 "[ . 1 . 2]" 1
1141 1 44 CYS HB2 1 73 LEU MD2 . . 4.040 3.212 2.501 3.909 . 0 0 "[ . 1 . 2]" 1
1142 1 44 CYS HB3 1 45 VAL H . . 3.840 2.610 2.224 3.100 . 0 0 "[ . 1 . 2]" 1
1143 1 44 CYS HB3 1 54 ALA HA . . 5.170 4.119 3.265 4.942 . 0 0 "[ . 1 . 2]" 1
1144 1 44 CYS HB3 1 54 ALA MB . . 4.300 2.915 2.033 3.797 . 0 0 "[ . 1 . 2]" 1
1145 1 44 CYS HB3 1 73 LEU MD2 . . 4.040 3.024 2.439 3.723 . 0 0 "[ . 1 . 2]" 1
1146 1 45 VAL H 1 45 VAL HB . . 3.670 3.603 3.589 3.613 . 0 0 "[ . 1 . 2]" 1
1147 1 45 VAL H 1 45 VAL MG1 . . 3.490 2.495 2.397 2.642 . 0 0 "[ . 1 . 2]" 1
1148 1 45 VAL H 1 45 VAL MG2 . . 3.050 1.921 1.873 1.987 . 0 0 "[ . 1 . 2]" 1
1149 1 45 VAL H 1 46 GLY H . . 3.470 2.768 2.612 2.902 . 0 0 "[ . 1 . 2]" 1
1150 1 45 VAL H 1 54 ALA MB . . 4.740 4.761 4.435 5.023 0.283 20 0 "[ . 1 . 2]" 1
1151 1 45 VAL H 1 73 LEU MD2 . . 5.230 3.004 2.830 3.245 . 0 0 "[ . 1 . 2]" 1
1152 1 45 VAL HA 1 45 VAL MG1 . . 3.230 2.124 2.049 2.160 . 0 0 "[ . 1 . 2]" 1
1153 1 45 VAL HA 1 45 VAL MG2 . . 3.280 3.191 3.171 3.198 . 0 0 "[ . 1 . 2]" 1
1154 1 45 VAL HA 1 48 GLY H . . 4.760 3.826 3.701 3.898 . 0 0 "[ . 1 . 2]" 1
1155 1 45 VAL HA 1 74 PHE QE . . 5.500 4.408 4.227 4.802 . 0 0 "[ . 1 . 2]" 1
1156 1 45 VAL HB 1 46 GLY H . . 3.860 3.623 3.405 3.801 . 0 0 "[ . 1 . 2]" 1
1157 1 45 VAL MG1 1 46 GLY H . . 4.610 4.061 3.950 4.165 . 0 0 "[ . 1 . 2]" 1
1158 1 45 VAL MG1 1 48 GLY H . . 5.500 5.415 5.268 5.498 . 0 0 "[ . 1 . 2]" 1
1159 1 45 VAL MG1 1 74 PHE QD . . 5.500 3.306 3.110 3.537 . 0 0 "[ . 1 . 2]" 1
1160 1 45 VAL MG1 1 74 PHE QE . . 4.860 3.417 3.222 3.780 . 0 0 "[ . 1 . 2]" 1
1161 1 45 VAL MG2 1 46 GLY H . . 3.470 2.015 1.858 2.252 . 0 0 "[ . 1 . 2]" 1
1162 1 45 VAL MG2 1 48 GLY H . . 5.500 5.054 4.957 5.165 . 0 0 "[ . 1 . 2]" 1
1163 1 45 VAL MG2 1 74 PHE QE . . 5.500 5.412 5.022 5.505 0.005 9 0 "[ . 1 . 2]" 1
1164 1 46 GLY H 1 47 LYS H . . 3.660 2.620 2.477 2.827 . 0 0 "[ . 1 . 2]" 1
1165 1 46 GLY H 1 48 GLY H . . 5.230 4.128 3.949 4.229 . 0 0 "[ . 1 . 2]" 1
1166 1 46 GLY HA3 1 47 LYS H . . 3.330 2.907 2.794 2.973 . 0 0 "[ . 1 . 2]" 1
1167 1 46 GLY HA3 1 48 GLY H . . 4.430 4.275 4.155 4.345 . 0 0 "[ . 1 . 2]" 1
1168 1 47 LYS H 1 47 LYS HB2 . . 3.010 2.271 2.198 2.295 . 0 0 "[ . 1 . 2]" 1
1169 1 47 LYS H 1 47 LYS HB3 . . 3.140 3.097 3.078 3.137 . 0 0 "[ . 1 . 2]" 1
1170 1 47 LYS H 1 47 LYS HD2 . . 5.380 5.199 5.154 5.264 . 0 0 "[ . 1 . 2]" 1
1171 1 47 LYS H 1 47 LYS HD3 . . 5.380 5.298 5.221 5.379 . 0 0 "[ . 1 . 2]" 1
1172 1 47 LYS H 1 47 LYS HG2 . . 4.190 4.233 4.182 4.275 0.085 6 0 "[ . 1 . 2]" 1
1173 1 47 LYS H 1 47 LYS HG3 . . 4.340 4.276 4.194 4.320 . 0 0 "[ . 1 . 2]" 1
1174 1 47 LYS H 1 48 GLY H . . 3.270 2.694 2.575 2.827 . 0 0 "[ . 1 . 2]" 1
1175 1 47 LYS H 1 49 MET ME . . 4.310 4.114 3.893 4.238 . 0 0 "[ . 1 . 2]" 1
1176 1 47 LYS H 1 49 MET HG3 . . 4.140 3.814 3.689 3.937 . 0 0 "[ . 1 . 2]" 1
1177 1 47 LYS HA 1 47 LYS HD2 . . 4.360 4.305 4.217 4.361 0.001 20 0 "[ . 1 . 2]" 1
1178 1 47 LYS HA 1 47 LYS QD . . 3.780 3.394 3.282 3.502 . 0 0 "[ . 1 . 2]" 1
1179 1 47 LYS HA 1 47 LYS HD3 . . 4.360 3.553 3.419 3.693 . 0 0 "[ . 1 . 2]" 1
1180 1 47 LYS HA 1 47 LYS HG2 . . 3.750 2.040 2.030 2.049 . 0 0 "[ . 1 . 2]" 1
1181 1 47 LYS HA 1 47 LYS HG3 . . 4.080 3.249 3.181 3.308 . 0 0 "[ . 1 . 2]" 1
1182 1 47 LYS HA 1 49 MET H . . 4.570 4.180 4.156 4.261 . 0 0 "[ . 1 . 2]" 1
1183 1 47 LYS HB2 1 48 GLY H . . 4.690 4.251 4.150 4.317 . 0 0 "[ . 1 . 2]" 1
1184 1 47 LYS HB2 1 49 MET ME . . 4.180 2.990 2.765 3.161 . 0 0 "[ . 1 . 2]" 1
1185 1 47 LYS HB3 1 48 GLY H . . 4.370 4.034 3.929 4.091 . 0 0 "[ . 1 . 2]" 1
1186 1 47 LYS HB3 1 49 MET H . . 3.140 2.926 2.886 2.981 . 0 0 "[ . 1 . 2]" 1
1187 1 47 LYS HB3 1 49 MET HG3 . . 3.900 2.181 2.000 2.358 . 0 0 "[ . 1 . 2]" 1
1188 1 47 LYS QD 1 49 MET HG2 . . 3.650 3.352 3.193 3.506 . 0 0 "[ . 1 . 2]" 1
1189 1 47 LYS QD 1 49 MET HG3 . . 3.760 3.346 3.129 3.510 . 0 0 "[ . 1 . 2]" 1
1190 1 47 LYS QE 1 49 MET ME . . 5.500 4.547 4.102 4.980 . 0 0 "[ . 1 . 2]" 1
1191 1 47 LYS HG2 1 48 GLY H . . 5.260 4.935 4.896 4.977 . 0 0 "[ . 1 . 2]" 1
1192 1 48 GLY H 1 48 GLY HA2 . . 2.930 2.298 2.294 2.301 . 0 0 "[ . 1 . 2]" 1
1193 1 48 GLY H 1 48 GLY HA3 . . 2.930 2.768 2.748 2.799 . 0 0 "[ . 1 . 2]" 1
1194 1 48 GLY H 1 49 MET H . . 3.570 2.789 2.717 2.827 . 0 0 "[ . 1 . 2]" 1
1195 1 48 GLY H 1 49 MET HG3 . . 5.080 4.895 4.746 5.007 . 0 0 "[ . 1 . 2]" 1
1196 1 48 GLY QA 1 49 MET H . . 2.970 2.888 2.880 2.902 . 0 0 "[ . 1 . 2]" 1
1197 1 49 MET H 1 49 MET HB2 . . 3.700 2.351 2.324 2.400 . 0 0 "[ . 1 . 2]" 1
1198 1 49 MET H 1 49 MET HB3 . . 3.700 3.571 3.561 3.584 . 0 0 "[ . 1 . 2]" 1
1199 1 49 MET H 1 49 MET ME . . 4.340 4.270 4.189 4.341 0.001 4 0 "[ . 1 . 2]" 1
1200 1 49 MET H 1 49 MET HG2 . . 3.440 3.308 3.156 3.387 . 0 0 "[ . 1 . 2]" 1
1201 1 49 MET H 1 49 MET HG3 . . 3.000 2.674 2.602 2.743 . 0 0 "[ . 1 . 2]" 1
1202 1 49 MET HA 1 49 MET HG2 . . 3.380 2.211 2.182 2.239 . 0 0 "[ . 1 . 2]" 1
1203 1 49 MET HA 1 49 MET HG3 . . 3.400 3.203 3.156 3.287 . 0 0 "[ . 1 . 2]" 1
1204 1 49 MET HA 1 50 ASP H . . 3.270 2.400 2.284 2.516 . 0 0 "[ . 1 . 2]" 1
1205 1 49 MET HA 1 53 LYS HD2 . . 4.790 3.951 3.050 4.841 0.051 18 0 "[ . 1 . 2]" 1
1206 1 49 MET HA 1 53 LYS QD . . 4.160 3.377 2.740 3.795 . 0 0 "[ . 1 . 2]" 1
1207 1 49 MET HA 1 53 LYS HD3 . . 4.790 3.922 2.835 4.799 0.009 9 0 "[ . 1 . 2]" 1
1208 1 49 MET QB 1 49 MET HG3 . . 2.630 2.208 2.187 2.224 . 0 0 "[ . 1 . 2]" 1
1209 1 49 MET QB 1 50 ASP H . . 3.440 2.443 2.178 2.729 . 0 0 "[ . 1 . 2]" 1
1210 1 49 MET QB 1 54 ALA H . . 3.620 2.695 2.464 2.864 . 0 0 "[ . 1 . 2]" 1
1211 1 49 MET QB 1 54 ALA HA . . 4.720 3.277 2.965 3.492 . 0 0 "[ . 1 . 2]" 1
1212 1 49 MET HB2 1 49 MET ME . . 3.860 3.451 3.312 3.530 . 0 0 "[ . 1 . 2]" 1
1213 1 49 MET HB2 1 50 ASP H . . 4.030 3.824 3.618 4.027 . 0 0 "[ . 1 . 2]" 1
1214 1 49 MET HB2 1 54 ALA MB . . 4.030 3.243 2.947 3.429 . 0 0 "[ . 1 . 2]" 1
1215 1 49 MET HB3 1 49 MET ME . . 3.860 3.820 3.739 3.840 . 0 0 "[ . 1 . 2]" 1
1216 1 49 MET HB3 1 50 ASP H . . 4.030 2.473 2.196 2.775 . 0 0 "[ . 1 . 2]" 1
1217 1 49 MET HB3 1 54 ALA MB . . 4.030 2.748 2.522 3.025 . 0 0 "[ . 1 . 2]" 1
1218 1 49 MET ME 1 49 MET HG2 . . 3.350 3.026 2.991 3.079 . 0 0 "[ . 1 . 2]" 1
1219 1 49 MET ME 1 49 MET HG3 . . 3.030 2.028 1.988 2.234 . 0 0 "[ . 1 . 2]" 1
1220 1 49 MET ME 1 54 ALA HA . . 4.320 3.664 3.564 3.758 . 0 0 "[ . 1 . 2]" 1
1221 1 49 MET ME 1 57 HIS H . . 5.270 5.071 4.803 5.264 . 0 0 "[ . 1 . 2]" 1
1222 1 49 MET ME 1 57 HIS HB2 . . 3.880 3.192 2.917 3.399 . 0 0 "[ . 1 . 2]" 1
1223 1 49 MET ME 1 57 HIS HB3 . . 3.810 3.498 3.358 3.661 . 0 0 "[ . 1 . 2]" 1
1224 1 49 MET ME 1 57 HIS HD2 . . 4.710 4.247 3.470 4.710 0.000 10 0 "[ . 1 . 2]" 1
1225 1 49 MET ME 1 57 HIS HE1 . . 4.360 3.456 2.661 4.332 . 0 0 "[ . 1 . 2]" 1
1226 1 49 MET HG2 1 50 ASP H . . 3.860 3.701 3.587 3.843 . 0 0 "[ . 1 . 2]" 1
1227 1 49 MET HG2 1 53 LYS QB . . 3.870 3.377 3.185 3.596 . 0 0 "[ . 1 . 2]" 1
1228 1 49 MET HG2 1 53 LYS HD2 . . 5.500 4.237 3.063 5.188 . 0 0 "[ . 1 . 2]" 1
1229 1 49 MET HG2 1 53 LYS QD . . 4.760 3.246 2.712 3.737 . 0 0 "[ . 1 . 2]" 1
1230 1 49 MET HG2 1 53 LYS HD3 . . 5.500 3.495 2.749 4.502 . 0 0 "[ . 1 . 2]" 1
1231 1 49 MET HG2 1 54 ALA H . . 5.320 4.821 4.709 5.070 . 0 0 "[ . 1 . 2]" 1
1232 1 49 MET HG3 1 54 ALA H . . 5.500 5.436 5.289 5.503 0.003 11 0 "[ . 1 . 2]" 1
1233 1 50 ASP H 1 50 ASP QB . . 3.350 2.674 2.516 3.074 . 0 0 "[ . 1 . 2]" 1
1234 1 50 ASP H 1 51 LYS H . . 4.800 4.518 4.486 4.575 . 0 0 "[ . 1 . 2]" 1
1235 1 50 ASP H 1 53 LYS H . . 4.040 3.420 3.246 3.599 . 0 0 "[ . 1 . 2]" 1
1236 1 50 ASP H 1 53 LYS HB2 . . 3.830 2.122 1.899 2.334 . 0 0 "[ . 1 . 2]" 1
1237 1 50 ASP H 1 53 LYS QB . . 3.190 2.103 1.890 2.286 . 0 0 "[ . 1 . 2]" 1
1238 1 50 ASP H 1 53 LYS HB3 . . 3.830 3.499 3.213 3.769 . 0 0 "[ . 1 . 2]" 1
1239 1 50 ASP H 1 53 LYS QD . . 3.950 3.044 2.367 3.909 . 0 0 "[ . 1 . 2]" 1
1240 1 50 ASP H 1 54 ALA H . . 4.850 3.119 2.880 3.383 . 0 0 "[ . 1 . 2]" 1
1241 1 50 ASP HA 1 51 LYS H . . 3.250 2.282 2.223 2.361 . 0 0 "[ . 1 . 2]" 1
1242 1 50 ASP HA 1 51 LYS HA . . 4.930 4.296 4.291 4.306 . 0 0 "[ . 1 . 2]" 1
1243 1 50 ASP HA 1 52 LYS H . . 4.400 4.168 3.918 4.336 . 0 0 "[ . 1 . 2]" 1
1244 1 50 ASP HA 1 74 PHE QE . . 5.420 2.805 2.146 3.439 . 0 0 "[ . 1 . 2]" 1
1245 1 50 ASP QB 1 51 LYS H . . 3.090 2.715 2.547 2.895 . 0 0 "[ . 1 . 2]" 1
1246 1 50 ASP QB 1 52 LYS H . . 3.620 2.700 2.392 2.764 . 0 0 "[ . 1 . 2]" 1
1247 1 50 ASP QB 1 53 LYS H . . 4.830 2.633 2.503 3.300 . 0 0 "[ . 1 . 2]" 1
1248 1 50 ASP QB 1 74 PHE QE . . 4.900 4.195 3.701 4.705 . 0 0 "[ . 1 . 2]" 1
1249 1 50 ASP HB2 1 51 LYS H . . 3.790 3.645 3.020 3.783 . 0 0 "[ . 1 . 2]" 1
1250 1 50 ASP HB2 1 52 LYS H . . 4.160 2.953 2.408 3.291 . 0 0 "[ . 1 . 2]" 1
1251 1 50 ASP HB3 1 51 LYS H . . 3.790 2.832 2.591 3.717 . 0 0 "[ . 1 . 2]" 1
1252 1 50 ASP HB3 1 52 LYS H . . 4.160 3.200 2.969 4.098 . 0 0 "[ . 1 . 2]" 1
1253 1 51 LYS H 1 51 LYS HB2 . . 3.170 2.649 2.574 2.719 . 0 0 "[ . 1 . 2]" 1
1254 1 51 LYS H 1 51 LYS HB3 . . 3.720 3.607 3.600 3.618 . 0 0 "[ . 1 . 2]" 1
1255 1 51 LYS H 1 51 LYS HD2 . . 5.500 4.542 4.433 4.666 . 0 0 "[ . 1 . 2]" 1
1256 1 51 LYS H 1 51 LYS HD3 . . 5.390 4.679 4.615 4.764 . 0 0 "[ . 1 . 2]" 1
1257 1 51 LYS H 1 51 LYS HG2 . . 4.260 2.674 2.477 2.870 . 0 0 "[ . 1 . 2]" 1
1258 1 51 LYS H 1 51 LYS HG3 . . 3.520 2.386 2.247 2.536 . 0 0 "[ . 1 . 2]" 1
1259 1 51 LYS H 1 52 LYS H . . 3.440 2.939 2.905 2.951 . 0 0 "[ . 1 . 2]" 1
1260 1 51 LYS H 1 52 LYS HA . . 5.500 5.493 5.466 5.502 0.002 18 0 "[ . 1 . 2]" 1
1261 1 51 LYS H 1 52 LYS QB . . 5.500 4.943 4.607 5.045 . 0 0 "[ . 1 . 2]" 1
1262 1 51 LYS H 1 53 LYS H . . 5.080 4.691 4.407 4.999 . 0 0 "[ . 1 . 2]" 1
1263 1 51 LYS H 1 74 PHE QE . . 4.450 2.681 2.013 3.142 . 0 0 "[ . 1 . 2]" 1
1264 1 51 LYS HA 1 51 LYS HD2 . . 5.330 4.726 4.593 4.821 . 0 0 "[ . 1 . 2]" 1
1265 1 51 LYS HA 1 51 LYS HD3 . . 5.310 3.863 3.659 4.019 . 0 0 "[ . 1 . 2]" 1
1266 1 51 LYS HA 1 51 LYS HG2 . . 3.720 2.396 2.333 2.448 . 0 0 "[ . 1 . 2]" 1
1267 1 51 LYS HA 1 51 LYS HG3 . . 3.950 3.468 3.365 3.570 . 0 0 "[ . 1 . 2]" 1
1268 1 51 LYS HA 1 52 LYS HA . . 5.500 4.778 4.750 4.806 . 0 0 "[ . 1 . 2]" 1
1269 1 51 LYS HA 1 54 ALA H . . 4.320 4.142 3.926 4.285 . 0 0 "[ . 1 . 2]" 1
1270 1 51 LYS HA 1 54 ALA MB . . 3.310 2.722 2.566 2.838 . 0 0 "[ . 1 . 2]" 1
1271 1 51 LYS HA 1 55 ALA H . . 4.780 3.811 3.470 4.038 . 0 0 "[ . 1 . 2]" 1
1272 1 51 LYS HA 1 70 VAL MG1 . . 5.500 3.967 3.745 4.143 . 0 0 "[ . 1 . 2]" 1
1273 1 51 LYS HA 1 70 VAL MG2 . . 3.570 2.474 2.235 2.611 . 0 0 "[ . 1 . 2]" 1
1274 1 51 LYS HA 1 74 PHE QD . . 5.500 4.370 4.096 4.653 . 0 0 "[ . 1 . 2]" 1
1275 1 51 LYS HA 1 74 PHE QE . . 4.000 3.459 3.250 3.702 . 0 0 "[ . 1 . 2]" 1
1276 1 51 LYS HB2 1 52 LYS H . . 3.480 2.680 2.581 2.874 . 0 0 "[ . 1 . 2]" 1
1277 1 51 LYS HB3 1 52 LYS H . . 4.130 3.718 3.598 3.908 . 0 0 "[ . 1 . 2]" 1
1278 1 51 LYS HB3 1 70 VAL MG2 . . 3.460 3.264 2.943 3.449 . 0 0 "[ . 1 . 2]" 1
1279 1 51 LYS HD2 1 71 ASP HA . . 5.360 5.040 4.360 5.333 . 0 0 "[ . 1 . 2]" 1
1280 1 51 LYS HD3 1 70 VAL MG1 . . 4.580 4.136 3.734 4.572 . 0 0 "[ . 1 . 2]" 1
1281 1 51 LYS HD3 1 70 VAL MG2 . . 4.410 3.636 3.224 4.271 . 0 0 "[ . 1 . 2]" 1
1282 1 51 LYS HD3 1 71 ASP HA . . 5.500 3.917 3.070 4.647 . 0 0 "[ . 1 . 2]" 1
1283 1 51 LYS QE 1 51 LYS HG2 . . 3.680 2.148 2.010 2.417 . 0 0 "[ . 1 . 2]" 1
1284 1 51 LYS QE 1 51 LYS HG3 . . 3.560 2.830 2.602 3.151 . 0 0 "[ . 1 . 2]" 1
1285 1 51 LYS QE 1 70 VAL MG2 . . 4.300 3.381 2.785 3.798 . 0 0 "[ . 1 . 2]" 1
1286 1 51 LYS QE 1 71 ASP HA . . 3.640 2.581 2.172 2.869 . 0 0 "[ . 1 . 2]" 1
1287 1 51 LYS QE 1 74 PHE H . . 5.340 4.022 3.704 4.348 . 0 0 "[ . 1 . 2]" 1
1288 1 51 LYS QE 1 74 PHE HB2 . . 3.610 2.288 1.948 2.652 . 0 0 "[ . 1 . 2]" 1
1289 1 51 LYS QE 1 74 PHE QD . . 4.300 2.469 2.122 2.842 . 0 0 "[ . 1 . 2]" 1
1290 1 51 LYS HE2 1 51 LYS HG3 . . 4.200 3.751 3.228 3.994 . 0 0 "[ . 1 . 2]" 1
1291 1 51 LYS HE2 1 74 PHE HB2 . . 4.350 2.716 2.161 3.140 . 0 0 "[ . 1 . 2]" 1
1292 1 51 LYS HE2 1 74 PHE HB3 . . 4.540 3.542 2.614 4.011 . 0 0 "[ . 1 . 2]" 1
1293 1 51 LYS HE2 1 74 PHE QD . . 5.120 3.669 2.300 4.135 . 0 0 "[ . 1 . 2]" 1
1294 1 51 LYS HE3 1 51 LYS HG3 . . 4.200 3.039 2.651 4.097 . 0 0 "[ . 1 . 2]" 1
1295 1 51 LYS HE3 1 74 PHE HB2 . . 4.350 2.562 2.161 3.125 . 0 0 "[ . 1 . 2]" 1
1296 1 51 LYS HE3 1 74 PHE HB3 . . 4.540 2.880 2.141 3.853 . 0 0 "[ . 1 . 2]" 1
1297 1 51 LYS HE3 1 74 PHE QD . . 5.120 2.732 2.138 4.036 . 0 0 "[ . 1 . 2]" 1
1298 1 51 LYS HG2 1 52 LYS H . . 5.500 4.747 4.641 4.837 . 0 0 "[ . 1 . 2]" 1
1299 1 51 LYS HG2 1 54 ALA MB . . 5.270 4.497 4.389 4.632 . 0 0 "[ . 1 . 2]" 1
1300 1 51 LYS HG2 1 70 VAL MG1 . . 5.490 4.779 4.303 5.082 . 0 0 "[ . 1 . 2]" 1
1301 1 51 LYS HG2 1 70 VAL MG2 . . 3.730 3.239 2.728 3.579 . 0 0 "[ . 1 . 2]" 1
1302 1 51 LYS HG2 1 74 PHE QD . . 4.990 3.053 2.643 3.418 . 0 0 "[ . 1 . 2]" 1
1303 1 51 LYS HG2 1 74 PHE QE . . 4.790 3.024 2.590 3.440 . 0 0 "[ . 1 . 2]" 1
1304 1 51 LYS HG3 1 52 LYS H . . 4.850 4.360 4.229 4.512 . 0 0 "[ . 1 . 2]" 1
1305 1 51 LYS HG3 1 74 PHE HB3 . . 5.500 5.097 4.590 5.442 . 0 0 "[ . 1 . 2]" 1
1306 1 51 LYS HG3 1 74 PHE QD . . 4.990 3.458 3.047 3.832 . 0 0 "[ . 1 . 2]" 1
1307 1 51 LYS HG3 1 74 PHE QE . . 3.970 3.142 2.591 3.857 . 0 0 "[ . 1 . 2]" 1
1308 1 52 LYS H 1 52 LYS QB . . 2.810 2.411 2.045 2.554 . 0 0 "[ . 1 . 2]" 1
1309 1 52 LYS H 1 52 LYS QD . . 3.820 3.587 2.908 3.820 0.000 9 0 "[ . 1 . 2]" 1
1310 1 52 LYS H 1 52 LYS QG . . 3.640 2.328 1.943 3.634 . 0 0 "[ . 1 . 2]" 1
1311 1 52 LYS H 1 53 LYS H . . 3.200 2.775 2.629 2.985 . 0 0 "[ . 1 . 2]" 1
1312 1 52 LYS H 1 54 ALA H . . 4.590 4.408 4.188 4.563 . 0 0 "[ . 1 . 2]" 1
1313 1 52 LYS HA 1 52 LYS QD . . 4.270 3.360 2.143 4.156 . 0 0 "[ . 1 . 2]" 1
1314 1 52 LYS HA 1 52 LYS QG . . 3.180 2.577 2.098 2.867 . 0 0 "[ . 1 . 2]" 1
1315 1 52 LYS HA 1 54 ALA H . . 5.340 5.139 5.003 5.295 . 0 0 "[ . 1 . 2]" 1
1316 1 52 LYS HA 1 55 ALA H . . 4.290 4.193 4.006 4.294 0.004 1 0 "[ . 1 . 2]" 1
1317 1 52 LYS HA 1 55 ALA MB . . 3.330 3.220 3.058 3.330 0.000 5 0 "[ . 1 . 2]" 1
1318 1 52 LYS HA 1 56 ASP H . . 4.890 4.862 4.444 5.053 0.163 13 0 "[ . 1 . 2]" 1
1319 1 52 LYS QB 1 52 LYS QD . . 3.100 2.111 1.948 2.450 . 0 0 "[ . 1 . 2]" 1
1320 1 52 LYS QB 1 53 LYS H . . 2.830 2.264 1.944 2.479 . 0 0 "[ . 1 . 2]" 1
1321 1 52 LYS QB 1 53 LYS HA . . 4.010 3.811 3.643 3.886 . 0 0 "[ . 1 . 2]" 1
1322 1 52 LYS QB 1 55 ALA H . . 5.500 5.303 5.096 5.426 . 0 0 "[ . 1 . 2]" 1
1323 1 52 LYS QG 1 53 LYS H . . 4.030 3.958 3.810 4.029 . 0 0 "[ . 1 . 2]" 1
1324 1 53 LYS H 1 53 LYS HB2 . . 3.750 2.270 2.124 2.422 . 0 0 "[ . 1 . 2]" 1
1325 1 53 LYS H 1 53 LYS QB . . 3.050 2.244 2.105 2.386 . 0 0 "[ . 1 . 2]" 1
1326 1 53 LYS H 1 53 LYS HB3 . . 3.750 3.526 3.426 3.588 . 0 0 "[ . 1 . 2]" 1
1327 1 53 LYS H 1 53 LYS HD2 . . 5.220 4.248 3.045 5.142 . 0 0 "[ . 1 . 2]" 1
1328 1 53 LYS H 1 53 LYS HD3 . . 5.220 4.707 3.822 5.064 . 0 0 "[ . 1 . 2]" 1
1329 1 53 LYS H 1 53 LYS HG2 . . 4.190 3.773 3.023 4.139 . 0 0 "[ . 1 . 2]" 1
1330 1 53 LYS H 1 53 LYS QG . . 3.510 2.696 2.382 3.092 . 0 0 "[ . 1 . 2]" 1
1331 1 53 LYS H 1 53 LYS HG3 . . 4.190 2.779 2.414 3.329 . 0 0 "[ . 1 . 2]" 1
1332 1 53 LYS H 1 54 ALA H . . 3.400 2.872 2.713 3.011 . 0 0 "[ . 1 . 2]" 1
1333 1 53 LYS H 1 54 ALA MB . . 4.560 4.349 4.169 4.512 . 0 0 "[ . 1 . 2]" 1
1334 1 53 LYS H 1 55 ALA H . . 4.700 4.443 4.226 4.617 . 0 0 "[ . 1 . 2]" 1
1335 1 53 LYS H 1 56 ASP H . . 5.360 5.106 4.826 5.241 . 0 0 "[ . 1 . 2]" 1
1336 1 53 LYS HA 1 53 LYS HD2 . . 5.220 4.581 4.285 4.749 . 0 0 "[ . 1 . 2]" 1
1337 1 53 LYS HA 1 53 LYS HD3 . . 5.220 4.338 3.781 4.687 . 0 0 "[ . 1 . 2]" 1
1338 1 53 LYS HA 1 53 LYS HG2 . . 3.970 2.471 2.078 2.977 . 0 0 "[ . 1 . 2]" 1
1339 1 53 LYS HA 1 53 LYS QG . . 3.330 2.281 2.055 2.450 . 0 0 "[ . 1 . 2]" 1
1340 1 53 LYS HA 1 53 LYS HG3 . . 3.970 2.865 2.422 3.456 . 0 0 "[ . 1 . 2]" 1
1341 1 53 LYS HA 1 55 ALA H . . 4.670 4.610 4.525 4.664 . 0 0 "[ . 1 . 2]" 1
1342 1 53 LYS HA 1 56 ASP H . . 4.360 3.567 3.463 3.675 . 0 0 "[ . 1 . 2]" 1
1343 1 53 LYS HA 1 56 ASP HB2 . . 3.680 3.485 3.215 3.679 . 0 0 "[ . 1 . 2]" 1
1344 1 53 LYS HA 1 56 ASP HB3 . . 3.680 3.347 2.992 3.591 . 0 0 "[ . 1 . 2]" 1
1345 1 53 LYS HA 1 57 HIS H . . 4.940 4.668 4.124 4.909 . 0 0 "[ . 1 . 2]" 1
1346 1 53 LYS QB 1 54 ALA H . . 2.970 2.283 2.125 2.419 . 0 0 "[ . 1 . 2]" 1
1347 1 53 LYS QB 1 54 ALA HA . . 5.080 3.718 3.652 3.761 . 0 0 "[ . 1 . 2]" 1
1348 1 53 LYS QB 1 55 ALA H . . 5.340 4.716 4.624 4.829 . 0 0 "[ . 1 . 2]" 1
1349 1 53 LYS HB2 1 54 ALA H . . 3.400 2.402 2.164 2.676 . 0 0 "[ . 1 . 2]" 1
1350 1 53 LYS HB3 1 54 ALA H . . 3.400 2.941 2.680 3.184 . 0 0 "[ . 1 . 2]" 1
1351 1 54 ALA H 1 54 ALA MB . . 3.090 2.225 2.115 2.271 . 0 0 "[ . 1 . 2]" 1
1352 1 54 ALA H 1 55 ALA H . . 3.380 3.132 3.053 3.189 . 0 0 "[ . 1 . 2]" 1
1353 1 54 ALA H 1 56 ASP H . . 4.410 4.566 4.366 4.690 0.280 14 0 "[ . 1 . 2]" 1
1354 1 54 ALA H 1 57 HIS H . . 5.500 4.863 4.650 5.018 . 0 0 "[ . 1 . 2]" 1
1355 1 54 ALA H 1 70 VAL MG2 . . 5.050 4.500 4.291 4.672 . 0 0 "[ . 1 . 2]" 1
1356 1 54 ALA H 1 74 PHE QE . . 5.150 4.757 4.392 5.110 . 0 0 "[ . 1 . 2]" 1
1357 1 54 ALA HA 1 56 ASP H . . 5.500 4.562 4.298 4.822 . 0 0 "[ . 1 . 2]" 1
1358 1 54 ALA HA 1 57 HIS H . . 3.940 3.386 3.220 3.523 . 0 0 "[ . 1 . 2]" 1
1359 1 54 ALA HA 1 57 HIS HB2 . . 4.220 3.101 2.816 3.447 . 0 0 "[ . 1 . 2]" 1
1360 1 54 ALA HA 1 57 HIS HB3 . . 4.030 3.047 2.728 3.373 . 0 0 "[ . 1 . 2]" 1
1361 1 54 ALA HA 1 58 LEU H . . 4.840 4.392 4.151 4.554 . 0 0 "[ . 1 . 2]" 1
1362 1 54 ALA HA 1 58 LEU MD1 . . 5.500 4.376 4.103 4.678 . 0 0 "[ . 1 . 2]" 1
1363 1 54 ALA HA 1 58 LEU HG . . 5.480 4.052 3.636 4.269 . 0 0 "[ . 1 . 2]" 1
1364 1 54 ALA MB 1 55 ALA H . . 3.200 2.268 2.157 2.465 . 0 0 "[ . 1 . 2]" 1
1365 1 54 ALA MB 1 57 HIS H . . 4.940 4.382 4.303 4.484 . 0 0 "[ . 1 . 2]" 1
1366 1 54 ALA MB 1 57 HIS HB2 . . 5.120 4.587 4.335 4.894 . 0 0 "[ . 1 . 2]" 1
1367 1 54 ALA MB 1 57 HIS HB3 . . 5.220 4.111 3.958 4.314 . 0 0 "[ . 1 . 2]" 1
1368 1 54 ALA MB 1 58 LEU MD1 . . 3.670 2.880 2.457 3.252 . 0 0 "[ . 1 . 2]" 1
1369 1 54 ALA MB 1 70 VAL HB . . 4.720 3.350 3.073 3.656 . 0 0 "[ . 1 . 2]" 1
1370 1 54 ALA MB 1 70 VAL MG2 . . 3.410 2.015 1.860 2.293 . 0 0 "[ . 1 . 2]" 1
1371 1 54 ALA MB 1 74 PHE QD . . 4.900 4.129 3.745 4.370 . 0 0 "[ . 1 . 2]" 1
1372 1 54 ALA MB 1 74 PHE QE . . 3.240 2.562 2.092 2.918 . 0 0 "[ . 1 . 2]" 1
1373 1 55 ALA H 1 55 ALA MB . . 3.320 2.154 2.044 2.225 . 0 0 "[ . 1 . 2]" 1
1374 1 55 ALA H 1 56 ASP H . . 3.440 3.002 2.834 3.076 . 0 0 "[ . 1 . 2]" 1
1375 1 55 ALA H 1 56 ASP QB . . 5.340 4.701 4.575 4.754 . 0 0 "[ . 1 . 2]" 1
1376 1 55 ALA H 1 58 LEU MD1 . . 4.570 4.451 4.154 4.572 0.002 14 0 "[ . 1 . 2]" 1
1377 1 55 ALA H 1 66 THR MG . . 4.850 3.971 3.822 4.276 . 0 0 "[ . 1 . 2]" 1
1378 1 55 ALA H 1 70 VAL MG1 . . 4.130 3.948 3.676 4.098 . 0 0 "[ . 1 . 2]" 1
1379 1 55 ALA H 1 70 VAL MG2 . . 4.190 3.225 2.889 3.430 . 0 0 "[ . 1 . 2]" 1
1380 1 55 ALA HA 1 58 LEU H . . 4.370 3.277 3.141 3.446 . 0 0 "[ . 1 . 2]" 1
1381 1 55 ALA HA 1 58 LEU HB2 . . 4.240 2.805 2.454 3.261 . 0 0 "[ . 1 . 2]" 1
1382 1 55 ALA HA 1 58 LEU MD1 . . 3.550 3.270 2.938 3.473 . 0 0 "[ . 1 . 2]" 1
1383 1 55 ALA HA 1 59 LYS H . . 5.280 4.443 4.063 4.690 . 0 0 "[ . 1 . 2]" 1
1384 1 55 ALA HA 1 66 THR HB . . 5.500 4.492 4.360 4.811 . 0 0 "[ . 1 . 2]" 1
1385 1 55 ALA HA 1 66 THR MG . . 3.220 1.907 1.837 2.132 . 0 0 "[ . 1 . 2]" 1
1386 1 55 ALA HA 1 69 PHE QD . . 5.500 5.536 5.127 5.837 0.337 10 0 "[ . 1 . 2]" 1
1387 1 55 ALA HA 1 70 VAL HB . . 3.630 3.472 2.972 3.631 0.001 10 0 "[ . 1 . 2]" 1
1388 1 55 ALA HA 1 70 VAL MG1 . . 3.410 3.093 2.690 3.380 . 0 0 "[ . 1 . 2]" 1
1389 1 55 ALA HA 1 70 VAL MG2 . . 4.060 3.845 3.495 4.027 . 0 0 "[ . 1 . 2]" 1
1390 1 55 ALA MB 1 56 ASP H . . 3.550 2.426 2.177 2.646 . 0 0 "[ . 1 . 2]" 1
1391 1 55 ALA MB 1 56 ASP HA . . 4.740 3.714 3.653 3.785 . 0 0 "[ . 1 . 2]" 1
1392 1 55 ALA MB 1 56 ASP HB2 . . 5.500 3.955 3.755 4.129 . 0 0 "[ . 1 . 2]" 1
1393 1 55 ALA MB 1 56 ASP HB3 . . 5.500 4.714 4.570 4.807 . 0 0 "[ . 1 . 2]" 1
1394 1 55 ALA MB 1 57 HIS H . . 5.290 4.302 4.158 4.432 . 0 0 "[ . 1 . 2]" 1
1395 1 55 ALA MB 1 66 THR HB . . 4.420 3.850 3.640 4.038 . 0 0 "[ . 1 . 2]" 1
1396 1 55 ALA MB 1 66 THR MG . . 3.060 2.026 1.850 2.205 . 0 0 "[ . 1 . 2]" 1
1397 1 55 ALA MB 1 67 LEU QD . . 3.210 2.601 2.085 3.019 . 0 0 "[ . 1 . 2]" 1
1398 1 55 ALA MB 1 70 VAL HB . . 5.260 4.064 3.614 4.330 . 0 0 "[ . 1 . 2]" 1
1399 1 55 ALA MB 1 70 VAL MG1 . . 3.060 2.768 2.369 2.997 . 0 0 "[ . 1 . 2]" 1
1400 1 56 ASP H 1 56 ASP HB2 . . 3.780 2.360 2.231 2.522 . 0 0 "[ . 1 . 2]" 1
1401 1 56 ASP H 1 56 ASP QB . . 3.200 2.219 2.160 2.254 . 0 0 "[ . 1 . 2]" 1
1402 1 56 ASP H 1 56 ASP HB3 . . 3.780 2.719 2.539 2.885 . 0 0 "[ . 1 . 2]" 1
1403 1 56 ASP H 1 57 HIS H . . 3.490 2.717 2.620 2.817 . 0 0 "[ . 1 . 2]" 1
1404 1 56 ASP H 1 58 LEU H . . 4.510 4.072 3.920 4.179 . 0 0 "[ . 1 . 2]" 1
1405 1 56 ASP H 1 59 LYS H . . 4.850 4.817 4.568 4.858 0.008 10 0 "[ . 1 . 2]" 1
1406 1 56 ASP H 1 66 THR MG . . 5.500 4.192 4.067 4.359 . 0 0 "[ . 1 . 2]" 1
1407 1 56 ASP HA 1 58 LEU H . . 5.210 4.193 4.006 4.281 . 0 0 "[ . 1 . 2]" 1
1408 1 56 ASP HA 1 59 LYS H . . 4.820 3.455 3.302 3.586 . 0 0 "[ . 1 . 2]" 1
1409 1 56 ASP HA 1 59 LYS HB2 . . 4.110 2.409 2.197 2.671 . 0 0 "[ . 1 . 2]" 1
1410 1 56 ASP HA 1 59 LYS QD . . 5.070 2.546 1.924 3.998 . 0 0 "[ . 1 . 2]" 1
1411 1 56 ASP QB 1 57 HIS H . . 3.450 2.737 2.665 2.881 . 0 0 "[ . 1 . 2]" 1
1412 1 56 ASP QB 1 58 LEU H . . 5.340 4.662 4.558 4.765 . 0 0 "[ . 1 . 2]" 1
1413 1 56 ASP HB2 1 57 HIS H . . 4.110 3.873 3.739 4.052 . 0 0 "[ . 1 . 2]" 1
1414 1 56 ASP HB3 1 57 HIS H . . 4.110 2.799 2.720 2.955 . 0 0 "[ . 1 . 2]" 1
1415 1 57 HIS H 1 57 HIS HB2 . . 3.050 2.365 2.255 2.500 . 0 0 "[ . 1 . 2]" 1
1416 1 57 HIS H 1 57 HIS HB3 . . 3.050 2.780 2.691 2.874 . 0 0 "[ . 1 . 2]" 1
1417 1 57 HIS H 1 57 HIS HD2 . . 5.500 5.271 5.141 5.438 . 0 0 "[ . 1 . 2]" 1
1418 1 57 HIS H 1 58 LEU H . . 2.560 2.438 2.319 2.545 . 0 0 "[ . 1 . 2]" 1
1419 1 57 HIS H 1 58 LEU HB2 . . 5.050 4.736 4.519 5.009 . 0 0 "[ . 1 . 2]" 1
1420 1 57 HIS H 1 58 LEU MD1 . . 5.500 5.127 4.951 5.302 . 0 0 "[ . 1 . 2]" 1
1421 1 57 HIS H 1 58 LEU MD2 . . 5.500 5.201 4.784 5.434 . 0 0 "[ . 1 . 2]" 1
1422 1 57 HIS H 1 58 LEU HG . . 4.280 4.216 3.977 4.463 0.183 14 0 "[ . 1 . 2]" 1
1423 1 57 HIS HA 1 59 LYS H . . 5.450 3.831 3.748 4.048 . 0 0 "[ . 1 . 2]" 1
1424 1 57 HIS HA 1 60 PRO HD2 . . 4.610 3.646 3.434 3.813 . 0 0 "[ . 1 . 2]" 1
1425 1 57 HIS HA 1 60 PRO HD3 . . 5.210 4.521 4.264 4.731 . 0 0 "[ . 1 . 2]" 1
1426 1 57 HIS HA 1 60 PRO QG . . 4.280 3.977 3.743 4.209 . 0 0 "[ . 1 . 2]" 1
1427 1 57 HIS HB2 1 58 LEU H . . 3.920 3.822 3.693 3.916 . 0 0 "[ . 1 . 2]" 1
1428 1 57 HIS HB2 1 58 LEU MD2 . . 5.500 5.022 4.622 5.320 . 0 0 "[ . 1 . 2]" 1
1429 1 57 HIS HB2 1 58 LEU HG . . 4.730 4.537 4.262 4.774 0.044 3 0 "[ . 1 . 2]" 1
1430 1 57 HIS HB3 1 58 LEU H . . 3.580 2.937 2.771 3.150 . 0 0 "[ . 1 . 2]" 1
1431 1 57 HIS HB3 1 58 LEU HB2 . . 4.930 4.757 4.648 4.902 . 0 0 "[ . 1 . 2]" 1
1432 1 57 HIS HB3 1 58 LEU MD2 . . 5.500 3.523 3.061 3.861 . 0 0 "[ . 1 . 2]" 1
1433 1 57 HIS HB3 1 58 LEU HG . . 4.650 2.923 2.663 3.217 . 0 0 "[ . 1 . 2]" 1
1434 1 57 HIS HD2 1 58 LEU MD2 . . 3.900 3.269 2.875 3.697 . 0 0 "[ . 1 . 2]" 1
1435 1 57 HIS HD2 1 58 LEU HG . . 4.850 4.339 4.037 4.816 . 0 0 "[ . 1 . 2]" 1
1436 1 57 HIS HE1 1 61 PHE QE . . 5.500 5.069 4.582 5.504 0.004 6 0 "[ . 1 . 2]" 1
1437 1 58 LEU H 1 58 LEU HB2 . . 3.140 2.516 2.421 2.644 . 0 0 "[ . 1 . 2]" 1
1438 1 58 LEU H 1 58 LEU HB3 . . 3.680 3.666 3.624 3.692 0.012 20 0 "[ . 1 . 2]" 1
1439 1 58 LEU H 1 58 LEU MD1 . . 4.110 3.742 3.575 3.886 . 0 0 "[ . 1 . 2]" 1
1440 1 58 LEU H 1 58 LEU MD2 . . 4.350 3.654 3.416 3.871 . 0 0 "[ . 1 . 2]" 1
1441 1 58 LEU H 1 58 LEU HG . . 3.240 2.605 2.375 2.905 . 0 0 "[ . 1 . 2]" 1
1442 1 58 LEU H 1 59 LYS H . . 2.560 2.330 2.192 2.409 . 0 0 "[ . 1 . 2]" 1
1443 1 58 LEU H 1 59 LYS HB2 . . 4.340 4.040 3.872 4.105 . 0 0 "[ . 1 . 2]" 1
1444 1 58 LEU H 1 60 PRO HD2 . . 4.520 3.823 3.699 3.947 . 0 0 "[ . 1 . 2]" 1
1445 1 58 LEU H 1 60 PRO HD3 . . 5.260 5.158 5.015 5.270 0.010 20 0 "[ . 1 . 2]" 1
1446 1 58 LEU H 1 61 PHE HB2 . . 5.500 5.178 4.922 5.338 . 0 0 "[ . 1 . 2]" 1
1447 1 58 LEU H 1 66 THR MG . . 3.940 3.417 3.217 3.603 . 0 0 "[ . 1 . 2]" 1
1448 1 58 LEU HA 1 58 LEU MD2 . . 3.100 2.103 1.960 2.408 . 0 0 "[ . 1 . 2]" 1
1449 1 58 LEU HA 1 58 LEU HG . . 4.020 3.108 3.004 3.248 . 0 0 "[ . 1 . 2]" 1
1450 1 58 LEU HA 1 60 PRO HD2 . . 4.510 3.557 3.493 3.612 . 0 0 "[ . 1 . 2]" 1
1451 1 58 LEU HA 1 60 PRO HD3 . . 5.500 5.309 5.255 5.359 . 0 0 "[ . 1 . 2]" 1
1452 1 58 LEU HA 1 61 PHE H . . 3.800 3.297 3.199 3.344 . 0 0 "[ . 1 . 2]" 1
1453 1 58 LEU HA 1 61 PHE QD . . 3.290 2.137 1.996 2.355 . 0 0 "[ . 1 . 2]" 1
1454 1 58 LEU HA 1 66 THR MG . . 5.100 4.458 4.285 4.681 . 0 0 "[ . 1 . 2]" 1
1455 1 58 LEU HB2 1 58 LEU MD1 . . 3.410 2.232 2.070 2.391 . 0 0 "[ . 1 . 2]" 1
1456 1 58 LEU HB2 1 59 LYS H . . 4.140 3.581 3.220 3.720 . 0 0 "[ . 1 . 2]" 1
1457 1 58 LEU HB2 1 62 LEU MD1 . . 4.410 3.261 2.883 3.582 . 0 0 "[ . 1 . 2]" 1
1458 1 58 LEU HB2 1 66 THR HB . . 5.500 4.799 4.506 5.061 . 0 0 "[ . 1 . 2]" 1
1459 1 58 LEU HB2 1 66 THR MG . . 3.480 2.097 1.942 2.361 . 0 0 "[ . 1 . 2]" 1
1460 1 58 LEU HB2 1 69 PHE QD . . 5.020 4.295 3.923 4.565 . 0 0 "[ . 1 . 2]" 1
1461 1 58 LEU HB2 1 70 VAL MG1 . . 4.090 4.268 4.157 4.323 0.233 19 0 "[ . 1 . 2]" 1
1462 1 58 LEU HB3 1 58 LEU MD1 . . 3.410 2.447 2.273 2.563 . 0 0 "[ . 1 . 2]" 1
1463 1 58 LEU HB3 1 58 LEU MD2 . . 2.940 2.311 2.174 2.384 . 0 0 "[ . 1 . 2]" 1
1464 1 58 LEU HB3 1 59 LYS H . . 4.740 4.304 4.098 4.431 . 0 0 "[ . 1 . 2]" 1
1465 1 58 LEU HB3 1 61 PHE HB2 . . 5.500 3.461 3.159 3.677 . 0 0 "[ . 1 . 2]" 1
1466 1 58 LEU HB3 1 61 PHE QD . . 5.240 4.282 4.086 4.623 . 0 0 "[ . 1 . 2]" 1
1467 1 58 LEU HB3 1 62 LEU HB2 . . 5.500 3.024 2.688 3.396 . 0 0 "[ . 1 . 2]" 1
1468 1 58 LEU HB3 1 62 LEU MD1 . . 3.850 2.263 2.021 2.489 . 0 0 "[ . 1 . 2]" 1
1469 1 58 LEU HB3 1 62 LEU MD2 . . 5.500 4.270 3.955 4.475 . 0 0 "[ . 1 . 2]" 1
1470 1 58 LEU HB3 1 62 LEU HG . . 3.180 2.876 2.543 3.108 . 0 0 "[ . 1 . 2]" 1
1471 1 58 LEU HB3 1 66 THR MG . . 3.600 3.224 2.908 3.564 . 0 0 "[ . 1 . 2]" 1
1472 1 58 LEU MD1 1 59 LYS H . . 5.500 5.177 4.920 5.290 . 0 0 "[ . 1 . 2]" 1
1473 1 58 LEU MD1 1 62 LEU MD1 . . 3.440 2.490 2.220 2.747 . 0 0 "[ . 1 . 2]" 1
1474 1 58 LEU MD1 1 66 THR MG . . 3.200 2.892 2.503 3.204 0.004 6 0 "[ . 1 . 2]" 1
1475 1 58 LEU MD1 1 69 PHE H . . 5.500 5.153 4.843 5.353 . 0 0 "[ . 1 . 2]" 1
1476 1 58 LEU MD1 1 69 PHE HB2 . . 5.500 4.694 4.455 4.827 . 0 0 "[ . 1 . 2]" 1
1477 1 58 LEU MD1 1 69 PHE HB3 . . 4.480 3.491 3.132 3.635 . 0 0 "[ . 1 . 2]" 1
1478 1 58 LEU MD1 1 69 PHE QD . . 3.190 1.937 1.874 2.058 . 0 0 "[ . 1 . 2]" 1
1479 1 58 LEU MD1 1 69 PHE QE . . 3.070 2.064 1.922 2.273 . 0 0 "[ . 1 . 2]" 1
1480 1 58 LEU MD1 1 70 VAL H . . 3.680 3.090 2.901 3.227 . 0 0 "[ . 1 . 2]" 1
1481 1 58 LEU MD1 1 70 VAL HA . . 4.660 3.010 2.795 3.151 . 0 0 "[ . 1 . 2]" 1
1482 1 58 LEU MD1 1 70 VAL HB . . 3.080 2.115 1.961 2.279 . 0 0 "[ . 1 . 2]" 1
1483 1 58 LEU MD2 1 61 PHE HB2 . . 4.730 2.955 2.617 3.266 . 0 0 "[ . 1 . 2]" 1
1484 1 58 LEU MD2 1 61 PHE QD . . 3.480 2.626 2.212 2.915 . 0 0 "[ . 1 . 2]" 1
1485 1 58 LEU MD2 1 62 LEU H . . 5.320 4.863 4.611 5.041 . 0 0 "[ . 1 . 2]" 1
1486 1 58 LEU MD2 1 62 LEU MD1 . . 3.460 2.725 2.228 3.183 . 0 0 "[ . 1 . 2]" 1
1487 1 58 LEU MD2 1 69 PHE QD . . 4.370 3.769 3.412 4.104 . 0 0 "[ . 1 . 2]" 1
1488 1 58 LEU MD2 1 69 PHE QE . . 3.360 2.989 2.747 3.215 . 0 0 "[ . 1 . 2]" 1
1489 1 58 LEU MD2 1 69 PHE HZ . . 4.540 4.181 3.977 4.464 . 0 0 "[ . 1 . 2]" 1
1490 1 58 LEU HG 1 61 PHE QD . . 4.720 4.474 4.160 4.726 0.006 12 0 "[ . 1 . 2]" 1
1491 1 58 LEU HG 1 66 THR MG . . 4.570 4.075 3.804 4.270 . 0 0 "[ . 1 . 2]" 1
1492 1 58 LEU HG 1 70 VAL MG1 . . 5.500 5.354 5.168 5.500 0.000 10 0 "[ . 1 . 2]" 1
1493 1 59 LYS H 1 59 LYS HB2 . . 3.310 2.068 2.059 2.097 . 0 0 "[ . 1 . 2]" 1
1494 1 59 LYS H 1 59 LYS HB3 . . 3.440 3.257 3.201 3.372 . 0 0 "[ . 1 . 2]" 1
1495 1 59 LYS H 1 59 LYS QD . . 5.190 3.582 2.825 4.822 . 0 0 "[ . 1 . 2]" 1
1496 1 59 LYS H 1 59 LYS QG . . 4.270 3.670 3.228 3.880 . 0 0 "[ . 1 . 2]" 1
1497 1 59 LYS H 1 60 PRO HD2 . . 3.940 2.031 1.924 2.305 . 0 0 "[ . 1 . 2]" 1
1498 1 59 LYS H 1 60 PRO HD3 . . 3.830 3.093 3.001 3.328 . 0 0 "[ . 1 . 2]" 1
1499 1 59 LYS H 1 60 PRO QG . . 5.350 3.941 3.847 4.184 . 0 0 "[ . 1 . 2]" 1
1500 1 59 LYS H 1 61 PHE H . . 5.270 3.727 3.670 3.864 . 0 0 "[ . 1 . 2]" 1
1501 1 59 LYS H 1 66 THR MG . . 3.880 3.537 2.987 3.877 . 0 0 "[ . 1 . 2]" 1
1502 1 59 LYS HA 1 59 LYS HD2 . . 4.830 3.639 3.017 4.366 . 0 0 "[ . 1 . 2]" 1
1503 1 59 LYS HA 1 59 LYS QD . . 4.250 3.238 2.929 3.828 . 0 0 "[ . 1 . 2]" 1
1504 1 59 LYS HA 1 59 LYS HD3 . . 4.830 3.805 3.226 4.431 . 0 0 "[ . 1 . 2]" 1
1505 1 59 LYS HA 1 59 LYS QG . . 3.920 2.087 2.005 2.230 . 0 0 "[ . 1 . 2]" 1
1506 1 59 LYS HA 1 61 PHE H . . 4.580 3.824 3.810 3.836 . 0 0 "[ . 1 . 2]" 1
1507 1 59 LYS HA 1 62 LEU H . . 4.440 3.498 3.432 3.580 . 0 0 "[ . 1 . 2]" 1
1508 1 59 LYS HA 1 62 LEU HB2 . . 5.500 4.023 3.888 4.128 . 0 0 "[ . 1 . 2]" 1
1509 1 59 LYS HA 1 63 ASP H . . 4.890 2.286 2.141 2.459 . 0 0 "[ . 1 . 2]" 1
1510 1 59 LYS HA 1 66 THR MG . . 3.730 3.154 2.643 3.470 . 0 0 "[ . 1 . 2]" 1
1511 1 59 LYS HB2 1 59 LYS QD . . 3.240 2.420 2.046 3.216 . 0 0 "[ . 1 . 2]" 1
1512 1 59 LYS HB2 1 60 PRO HD2 . . 4.210 2.751 2.650 2.832 . 0 0 "[ . 1 . 2]" 1
1513 1 59 LYS HB2 1 60 PRO HD3 . . 3.990 2.421 2.303 2.506 . 0 0 "[ . 1 . 2]" 1
1514 1 59 LYS HB2 1 66 THR MG . . 4.120 4.136 3.715 4.360 0.240 16 0 "[ . 1 . 2]" 1
1515 1 59 LYS HB3 1 60 PRO HD2 . . 3.590 3.067 3.039 3.143 . 0 0 "[ . 1 . 2]" 1
1516 1 59 LYS HB3 1 60 PRO HD3 . . 3.300 2.012 1.981 2.099 . 0 0 "[ . 1 . 2]" 1
1517 1 59 LYS QD 1 63 ASP HA . . 4.280 4.065 3.807 4.193 . 0 0 "[ . 1 . 2]" 1
1518 1 59 LYS QD 1 66 THR HB . . 5.340 4.476 3.549 5.242 . 0 0 "[ . 1 . 2]" 1
1519 1 59 LYS QD 1 66 THR MG . . 4.300 3.361 2.386 4.337 0.037 11 0 "[ . 1 . 2]" 1
1520 1 59 LYS HD2 1 63 ASP HA . . 5.150 4.397 4.100 4.612 . 0 0 "[ . 1 . 2]" 1
1521 1 59 LYS HD3 1 63 ASP HA . . 5.150 4.795 4.479 4.865 . 0 0 "[ . 1 . 2]" 1
1522 1 59 LYS QE 1 66 THR MG . . 5.210 3.953 1.845 4.951 . 0 0 "[ . 1 . 2]" 1
1523 1 59 LYS QG 1 60 PRO HD3 . . 4.280 3.886 3.801 4.022 . 0 0 "[ . 1 . 2]" 1
1524 1 59 LYS QG 1 63 ASP H . . 5.500 3.874 3.766 3.994 . 0 0 "[ . 1 . 2]" 1
1525 1 59 LYS QG 1 63 ASP HA . . 4.060 2.615 2.357 3.077 . 0 0 "[ . 1 . 2]" 1
1526 1 59 LYS QG 1 63 ASP QB . . 5.340 4.329 3.918 4.977 . 0 0 "[ . 1 . 2]" 1
1527 1 60 PRO HA 1 62 LEU H . . 4.790 4.386 4.156 4.606 . 0 0 "[ . 1 . 2]" 1
1528 1 60 PRO HB2 1 61 PHE H . . 4.060 3.851 3.842 3.853 . 0 0 "[ . 1 . 2]" 1
1529 1 60 PRO HB2 1 61 PHE QD . . 4.800 4.205 3.447 4.521 . 0 0 "[ . 1 . 2]" 1
1530 1 60 PRO HD2 1 61 PHE H . . 4.070 2.891 2.884 2.894 . 0 0 "[ . 1 . 2]" 1
1531 1 60 PRO HD2 1 61 PHE QD . . 4.300 4.013 3.948 4.212 . 0 0 "[ . 1 . 2]" 1
1532 1 60 PRO HD3 1 61 PHE H . . 4.390 3.971 3.967 3.973 . 0 0 "[ . 1 . 2]" 1
1533 1 60 PRO HD3 1 61 PHE QD . . 5.500 5.509 5.481 5.521 0.021 8 0 "[ . 1 . 2]" 1
1534 1 60 PRO QG 1 61 PHE QD . . 4.370 3.453 3.340 3.523 . 0 0 "[ . 1 . 2]" 1
1535 1 60 PRO HG2 1 61 PHE H . . 4.950 3.136 3.124 3.141 . 0 0 "[ . 1 . 2]" 1
1536 1 60 PRO HG2 1 61 PHE QD . . 5.050 3.522 3.399 3.595 . 0 0 "[ . 1 . 2]" 1
1537 1 60 PRO HG3 1 61 PHE H . . 4.950 4.457 4.447 4.460 . 0 0 "[ . 1 . 2]" 1
1538 1 60 PRO HG3 1 61 PHE QD . . 5.050 4.975 4.843 5.051 0.001 11 0 "[ . 1 . 2]" 1
1539 1 61 PHE H 1 61 PHE HB2 . . 3.550 2.531 2.435 2.693 . 0 0 "[ . 1 . 2]" 1
1540 1 61 PHE H 1 61 PHE HB3 . . 3.920 3.702 3.655 3.752 . 0 0 "[ . 1 . 2]" 1
1541 1 61 PHE H 1 61 PHE QD . . 3.590 3.471 3.382 3.513 . 0 0 "[ . 1 . 2]" 1
1542 1 61 PHE H 1 62 LEU HB2 . . 4.650 4.426 4.323 4.544 . 0 0 "[ . 1 . 2]" 1
1543 1 61 PHE H 1 62 LEU MD2 . . 5.500 5.217 5.051 5.374 . 0 0 "[ . 1 . 2]" 1
1544 1 61 PHE H 1 62 LEU HG . . 5.320 4.341 4.185 4.505 . 0 0 "[ . 1 . 2]" 1
1545 1 61 PHE H 1 63 ASP H . . 4.730 3.538 3.404 3.756 . 0 0 "[ . 1 . 2]" 1
1546 1 61 PHE H 1 66 THR MG . . 5.500 5.476 5.057 5.799 0.299 8 0 "[ . 1 . 2]" 1
1547 1 61 PHE HA 1 61 PHE QD . . 3.370 2.144 2.129 2.166 . 0 0 "[ . 1 . 2]" 1
1548 1 61 PHE HB2 1 62 LEU H . . 3.850 2.995 2.771 3.233 . 0 0 "[ . 1 . 2]" 1
1549 1 61 PHE HB2 1 62 LEU MD1 . . 4.800 4.092 3.913 4.240 . 0 0 "[ . 1 . 2]" 1
1550 1 61 PHE HB2 1 62 LEU MD2 . . 4.520 4.196 3.841 4.518 . 0 0 "[ . 1 . 2]" 1
1551 1 61 PHE HB2 1 62 LEU HG . . 4.290 2.966 2.747 3.215 . 0 0 "[ . 1 . 2]" 1
1552 1 61 PHE HB3 1 62 LEU H . . 4.400 3.933 3.713 4.143 . 0 0 "[ . 1 . 2]" 1
1553 1 61 PHE HB3 1 62 LEU MD2 . . 4.470 3.810 3.569 4.032 . 0 0 "[ . 1 . 2]" 1
1554 1 61 PHE HB3 1 62 LEU HG . . 4.520 3.310 3.118 3.612 . 0 0 "[ . 1 . 2]" 1
1555 1 61 PHE QD 1 62 LEU H . . 4.660 4.518 4.342 4.677 0.017 9 0 "[ . 1 . 2]" 1
1556 1 61 PHE QD 1 62 LEU MD1 . . 5.320 5.142 4.893 5.321 0.001 9 0 "[ . 1 . 2]" 1
1557 1 61 PHE QD 1 62 LEU MD2 . . 5.500 5.259 5.103 5.435 . 0 0 "[ . 1 . 2]" 1
1558 1 62 LEU H 1 62 LEU HB2 . . 3.220 2.705 2.570 2.851 . 0 0 "[ . 1 . 2]" 1
1559 1 62 LEU H 1 62 LEU MD1 . . 4.370 4.124 3.965 4.273 . 0 0 "[ . 1 . 2]" 1
1560 1 62 LEU H 1 62 LEU MD2 . . 4.350 3.914 3.798 4.030 . 0 0 "[ . 1 . 2]" 1
1561 1 62 LEU H 1 62 LEU HG . . 3.880 3.111 2.937 3.296 . 0 0 "[ . 1 . 2]" 1
1562 1 62 LEU H 1 63 ASP H . . 3.310 2.085 1.980 2.256 . 0 0 "[ . 1 . 2]" 1
1563 1 62 LEU H 1 63 ASP HA . . 5.100 4.180 4.088 4.263 . 0 0 "[ . 1 . 2]" 1
1564 1 62 LEU H 1 66 THR MG . . 5.500 4.890 4.552 5.113 . 0 0 "[ . 1 . 2]" 1
1565 1 62 LEU HA 1 62 LEU MD1 . . 4.460 3.894 3.859 3.917 . 0 0 "[ . 1 . 2]" 1
1566 1 62 LEU HA 1 62 LEU MD2 . . 3.140 2.003 1.976 2.234 . 0 0 "[ . 1 . 2]" 1
1567 1 62 LEU HA 1 62 LEU HG . . 4.260 3.087 3.005 3.149 . 0 0 "[ . 1 . 2]" 1
1568 1 62 LEU HB2 1 62 LEU MD1 . . 3.440 2.175 2.131 2.242 . 0 0 "[ . 1 . 2]" 1
1569 1 62 LEU HB2 1 63 ASP H . . 4.960 2.378 2.173 2.503 . 0 0 "[ . 1 . 2]" 1
1570 1 62 LEU HB2 1 65 SER H . . 5.230 3.673 3.559 3.813 . 0 0 "[ . 1 . 2]" 1
1571 1 62 LEU HB2 1 65 SER QB . . 4.670 3.752 3.634 3.885 . 0 0 "[ . 1 . 2]" 1
1572 1 62 LEU HB2 1 66 THR H . . 4.640 3.735 3.497 3.879 . 0 0 "[ . 1 . 2]" 1
1573 1 62 LEU HB2 1 66 THR HA . . 4.120 2.660 2.421 2.838 . 0 0 "[ . 1 . 2]" 1
1574 1 62 LEU HB2 1 66 THR HB . . 5.500 4.210 4.102 4.477 . 0 0 "[ . 1 . 2]" 1
1575 1 62 LEU HB3 1 62 LEU MD1 . . 3.320 2.466 2.393 2.502 . 0 0 "[ . 1 . 2]" 1
1576 1 62 LEU HB3 1 62 LEU MD2 . . 3.290 2.358 2.236 2.391 . 0 0 "[ . 1 . 2]" 1
1577 1 62 LEU HB3 1 63 ASP H . . 5.500 3.463 3.324 3.614 . 0 0 "[ . 1 . 2]" 1
1578 1 62 LEU HB3 1 65 SER H . . 4.730 2.678 2.477 2.768 . 0 0 "[ . 1 . 2]" 1
1579 1 62 LEU HB3 1 65 SER QB . . 4.010 2.130 1.981 2.278 . 0 0 "[ . 1 . 2]" 1
1580 1 62 LEU HB3 1 66 THR H . . 4.640 3.471 3.291 3.645 . 0 0 "[ . 1 . 2]" 1
1581 1 62 LEU HB3 1 66 THR HA . . 4.220 3.204 3.009 3.337 . 0 0 "[ . 1 . 2]" 1
1582 1 62 LEU MD1 1 63 ASP H . . 5.500 4.223 4.030 4.323 . 0 0 "[ . 1 . 2]" 1
1583 1 62 LEU MD1 1 65 SER QB . . 5.340 3.158 2.964 3.294 . 0 0 "[ . 1 . 2]" 1
1584 1 62 LEU MD1 1 66 THR H . . 5.180 4.161 4.034 4.311 . 0 0 "[ . 1 . 2]" 1
1585 1 62 LEU MD1 1 66 THR HA . . 3.940 2.055 1.974 2.216 . 0 0 "[ . 1 . 2]" 1
1586 1 62 LEU MD1 1 66 THR HB . . 5.280 4.652 4.537 4.904 . 0 0 "[ . 1 . 2]" 1
1587 1 62 LEU MD1 1 66 THR MG . . 4.150 3.367 3.218 3.561 . 0 0 "[ . 1 . 2]" 1
1588 1 62 LEU MD1 1 69 PHE H . . 5.260 3.783 3.601 4.003 . 0 0 "[ . 1 . 2]" 1
1589 1 62 LEU MD1 1 69 PHE HA . . 4.800 4.202 4.032 4.529 . 0 0 "[ . 1 . 2]" 1
1590 1 62 LEU MD1 1 69 PHE HB2 . . 3.960 2.299 2.063 2.701 . 0 0 "[ . 1 . 2]" 1
1591 1 62 LEU MD1 1 69 PHE HB3 . . 4.010 2.106 1.961 2.328 . 0 0 "[ . 1 . 2]" 1
1592 1 62 LEU MD1 1 69 PHE QD . . 3.610 2.566 2.424 2.731 . 0 0 "[ . 1 . 2]" 1
1593 1 62 LEU MD1 1 69 PHE QE . . 4.800 3.395 3.252 3.536 . 0 0 "[ . 1 . 2]" 1
1594 1 62 LEU MD1 1 70 VAL H . . 5.500 3.443 3.289 3.609 . 0 0 "[ . 1 . 2]" 1
1595 1 62 LEU MD1 1 70 VAL MG1 . . 4.440 4.357 4.194 4.548 0.108 4 0 "[ . 1 . 2]" 1
1596 1 62 LEU MD2 1 63 ASP H . . 5.500 4.617 4.547 4.669 . 0 0 "[ . 1 . 2]" 1
1597 1 62 LEU MD2 1 65 SER H . . 5.500 4.193 3.969 4.385 . 0 0 "[ . 1 . 2]" 1
1598 1 62 LEU MD2 1 65 SER QB . . 3.960 2.422 1.965 2.701 . 0 0 "[ . 1 . 2]" 1
1599 1 62 LEU MD2 1 66 THR HA . . 5.370 4.431 4.316 4.540 . 0 0 "[ . 1 . 2]" 1
1600 1 62 LEU MD2 1 69 PHE H . . 5.500 5.343 5.174 5.499 . 0 0 "[ . 1 . 2]" 1
1601 1 62 LEU MD2 1 69 PHE HB2 . . 4.440 3.516 3.321 3.762 . 0 0 "[ . 1 . 2]" 1
1602 1 62 LEU MD2 1 69 PHE HB3 . . 5.130 4.044 3.933 4.182 . 0 0 "[ . 1 . 2]" 1
1603 1 62 LEU MD2 1 69 PHE QD . . 4.180 3.748 3.496 4.021 . 0 0 "[ . 1 . 2]" 1
1604 1 62 LEU HG 1 66 THR HA . . 5.460 4.419 4.238 4.612 . 0 0 "[ . 1 . 2]" 1
1605 1 62 LEU HG 1 69 PHE HB3 . . 5.500 4.886 4.711 5.170 . 0 0 "[ . 1 . 2]" 1
1606 1 62 LEU HG 1 69 PHE QD . . 5.250 4.943 4.772 5.247 . 0 0 "[ . 1 . 2]" 1
1607 1 63 ASP H 1 66 THR H . . 5.500 4.167 3.828 4.280 . 0 0 "[ . 1 . 2]" 1
1608 1 63 ASP H 1 66 THR HG1 . . 5.500 1.986 1.899 2.267 . 0 0 "[ . 1 . 2]" 1
1609 1 63 ASP H 1 66 THR MG . . 5.500 3.926 3.792 4.090 . 0 0 "[ . 1 . 2]" 1
1610 1 63 ASP HA 1 65 SER H . . 4.640 4.224 4.076 4.370 . 0 0 "[ . 1 . 2]" 1
1611 1 63 ASP QB 1 64 ASP H . . 3.960 1.898 1.850 2.046 . 0 0 "[ . 1 . 2]" 1
1612 1 63 ASP QB 1 65 SER H . . 4.110 3.780 3.713 3.866 . 0 0 "[ . 1 . 2]" 1
1613 1 63 ASP HB2 1 64 ASP H . . 4.620 2.603 2.489 2.730 . 0 0 "[ . 1 . 2]" 1
1614 1 63 ASP HB2 1 65 SER H . . 4.790 4.290 4.199 4.413 . 0 0 "[ . 1 . 2]" 1
1615 1 63 ASP HB3 1 64 ASP H . . 4.620 1.952 1.896 2.128 . 0 0 "[ . 1 . 2]" 1
1616 1 63 ASP HB3 1 65 SER H . . 4.790 4.201 4.139 4.317 . 0 0 "[ . 1 . 2]" 1
1617 1 64 ASP H 1 65 SER H . . 4.490 2.527 2.448 2.626 . 0 0 "[ . 1 . 2]" 1
1618 1 64 ASP HA 1 66 THR H . . 4.210 3.905 3.807 3.971 . 0 0 "[ . 1 . 2]" 1
1619 1 64 ASP QB 1 65 SER H . . 4.130 3.195 3.040 3.729 . 0 0 "[ . 1 . 2]" 1
1620 1 65 SER H 1 65 SER QB . . 3.120 2.544 2.427 2.687 . 0 0 "[ . 1 . 2]" 1
1621 1 65 SER H 1 66 THR H . . 3.350 2.587 2.388 2.703 . 0 0 "[ . 1 . 2]" 1
1622 1 65 SER H 1 66 THR HA . . 5.500 4.481 4.375 4.555 . 0 0 "[ . 1 . 2]" 1
1623 1 65 SER H 1 66 THR HB . . 4.960 4.631 4.519 4.710 . 0 0 "[ . 1 . 2]" 1
1624 1 65 SER H 1 66 THR HG1 . . 5.140 3.666 3.082 4.594 . 0 0 "[ . 1 . 2]" 1
1625 1 65 SER H 1 66 THR MG . . 5.500 5.402 5.342 5.486 . 0 0 "[ . 1 . 2]" 1
1626 1 65 SER HA 1 68 ARG H . . 4.060 3.729 3.592 3.990 . 0 0 "[ . 1 . 2]" 1
1627 1 65 SER QB 1 66 THR H . . 4.180 3.807 3.739 3.844 . 0 0 "[ . 1 . 2]" 1
1628 1 66 THR H 1 66 THR HB . . 3.380 2.489 2.444 2.541 . 0 0 "[ . 1 . 2]" 1
1629 1 66 THR H 1 66 THR HG1 . . 3.620 2.860 2.297 3.622 0.002 8 0 "[ . 1 . 2]" 1
1630 1 66 THR H 1 66 THR MG . . 4.250 3.783 3.760 3.800 . 0 0 "[ . 1 . 2]" 1
1631 1 66 THR H 1 67 LEU H . . 3.830 2.802 2.739 2.888 . 0 0 "[ . 1 . 2]" 1
1632 1 66 THR H 1 69 PHE H . . 5.380 4.146 4.051 4.276 . 0 0 "[ . 1 . 2]" 1
1633 1 66 THR H 1 70 VAL MG1 . . 5.500 5.123 4.915 5.271 . 0 0 "[ . 1 . 2]" 1
1634 1 66 THR HA 1 66 THR MG . . 3.510 2.378 2.279 2.443 . 0 0 "[ . 1 . 2]" 1
1635 1 66 THR HA 1 68 ARG H . . 5.500 4.248 3.917 4.862 . 0 0 "[ . 1 . 2]" 1
1636 1 66 THR HA 1 69 PHE H . . 4.310 3.412 3.240 3.739 . 0 0 "[ . 1 . 2]" 1
1637 1 66 THR HA 1 69 PHE HB2 . . 4.600 3.984 3.825 4.113 . 0 0 "[ . 1 . 2]" 1
1638 1 66 THR HA 1 69 PHE HB3 . . 4.340 2.626 2.477 2.810 . 0 0 "[ . 1 . 2]" 1
1639 1 66 THR HA 1 70 VAL H . . 4.390 3.291 3.119 3.527 . 0 0 "[ . 1 . 2]" 1
1640 1 66 THR HA 1 70 VAL MG1 . . 5.030 3.623 3.363 3.833 . 0 0 "[ . 1 . 2]" 1
1641 1 66 THR HB 1 67 LEU H . . 3.700 1.950 1.900 2.001 . 0 0 "[ . 1 . 2]" 1
1642 1 66 THR HB 1 67 LEU HA . . 5.500 4.224 4.140 4.289 . 0 0 "[ . 1 . 2]" 1
1643 1 66 THR HB 1 67 LEU QB . . 5.340 4.254 4.039 4.352 . 0 0 "[ . 1 . 2]" 1
1644 1 66 THR HB 1 67 LEU MD1 . . 5.490 4.166 2.411 4.510 . 0 0 "[ . 1 . 2]" 1
1645 1 66 THR HB 1 67 LEU QD . . 4.810 3.624 2.407 3.900 . 0 0 "[ . 1 . 2]" 1
1646 1 66 THR HB 1 67 LEU MD2 . . 5.490 4.219 3.670 5.164 . 0 0 "[ . 1 . 2]" 1
1647 1 66 THR HB 1 67 LEU HG . . 5.500 3.239 2.950 4.616 . 0 0 "[ . 1 . 2]" 1
1648 1 66 THR HB 1 69 PHE HB3 . . 5.500 5.471 5.362 5.507 0.007 17 0 "[ . 1 . 2]" 1
1649 1 66 THR HB 1 70 VAL MG1 . . 4.920 4.193 3.953 4.463 . 0 0 "[ . 1 . 2]" 1
1650 1 66 THR HG1 1 67 LEU H . . 5.500 4.094 3.867 4.520 . 0 0 "[ . 1 . 2]" 1
1651 1 66 THR MG 1 67 LEU H . . 4.680 2.672 2.538 2.808 . 0 0 "[ . 1 . 2]" 1
1652 1 66 THR MG 1 67 LEU HA . . 4.600 3.104 2.974 3.293 . 0 0 "[ . 1 . 2]" 1
1653 1 66 THR MG 1 67 LEU QD . . 3.440 3.047 2.655 3.393 . 0 0 "[ . 1 . 2]" 1
1654 1 66 THR MG 1 67 LEU HG . . 3.880 3.336 3.109 3.757 . 0 0 "[ . 1 . 2]" 1
1655 1 66 THR MG 1 69 PHE HB3 . . 4.930 4.133 3.983 4.304 . 0 0 "[ . 1 . 2]" 1
1656 1 66 THR MG 1 69 PHE QD . . 5.030 4.237 4.038 4.511 . 0 0 "[ . 1 . 2]" 1
1657 1 66 THR MG 1 70 VAL H . . 4.270 3.626 3.349 3.913 . 0 0 "[ . 1 . 2]" 1
1658 1 67 LEU H 1 67 LEU QB . . 3.210 2.534 2.358 2.625 . 0 0 "[ . 1 . 2]" 1
1659 1 67 LEU H 1 67 LEU MD1 . . 4.810 3.261 1.964 3.551 . 0 0 "[ . 1 . 2]" 1
1660 1 67 LEU H 1 67 LEU MD2 . . 4.810 3.373 2.999 4.010 . 0 0 "[ . 1 . 2]" 1
1661 1 67 LEU H 1 67 LEU HG . . 3.540 2.176 1.914 3.347 . 0 0 "[ . 1 . 2]" 1
1662 1 67 LEU H 1 69 PHE H . . 5.500 4.318 4.206 4.391 . 0 0 "[ . 1 . 2]" 1
1663 1 67 LEU H 1 70 VAL H . . 5.500 5.034 4.908 5.180 . 0 0 "[ . 1 . 2]" 1
1664 1 67 LEU HA 1 67 LEU MD1 . . 4.090 3.832 3.055 3.948 . 0 0 "[ . 1 . 2]" 1
1665 1 67 LEU HA 1 67 LEU QD . . 2.900 2.351 1.993 2.914 0.014 17 0 "[ . 1 . 2]" 1
1666 1 67 LEU HA 1 67 LEU MD2 . . 4.090 2.439 1.999 3.645 . 0 0 "[ . 1 . 2]" 1
1667 1 67 LEU HA 1 67 LEU HG . . 3.630 2.948 2.348 3.179 . 0 0 "[ . 1 . 2]" 1
1668 1 67 LEU HA 1 69 PHE H . . 4.960 4.575 4.387 4.707 . 0 0 "[ . 1 . 2]" 1
1669 1 67 LEU HA 1 70 VAL H . . 4.710 4.365 4.140 4.434 . 0 0 "[ . 1 . 2]" 1
1670 1 67 LEU HA 1 70 VAL MG1 . . 3.190 2.189 2.017 2.310 . 0 0 "[ . 1 . 2]" 1
1671 1 67 LEU HA 1 71 ASP H . . 5.100 4.158 3.826 4.412 . 0 0 "[ . 1 . 2]" 1
1672 1 67 LEU QB 1 67 LEU QD . . 2.740 1.861 1.742 1.940 . 0 0 "[ . 1 . 2]" 1
1673 1 67 LEU QB 1 68 ARG H . . 2.990 2.678 2.297 2.916 . 0 0 "[ . 1 . 2]" 1
1674 1 67 LEU HB2 1 67 LEU MD1 . . 3.550 2.175 1.987 2.326 . 0 0 "[ . 1 . 2]" 1
1675 1 67 LEU HB2 1 67 LEU MD2 . . 3.550 3.110 2.584 3.185 . 0 0 "[ . 1 . 2]" 1
1676 1 67 LEU HB2 1 68 ARG HA . . 5.500 4.338 4.160 4.620 . 0 0 "[ . 1 . 2]" 1
1677 1 67 LEU HB3 1 67 LEU MD1 . . 3.550 2.557 2.344 3.151 . 0 0 "[ . 1 . 2]" 1
1678 1 67 LEU HB3 1 67 LEU MD2 . . 3.550 2.188 1.993 2.341 . 0 0 "[ . 1 . 2]" 1
1679 1 67 LEU HB3 1 68 ARG HA . . 5.500 4.465 4.259 4.618 . 0 0 "[ . 1 . 2]" 1
1680 1 67 LEU MD1 1 68 ARG H . . 5.190 4.403 3.875 4.793 . 0 0 "[ . 1 . 2]" 1
1681 1 67 LEU MD2 1 68 ARG H . . 5.190 4.785 4.636 4.954 . 0 0 "[ . 1 . 2]" 1
1682 1 68 ARG H 1 68 ARG HB2 . . 3.470 2.862 2.555 3.471 0.001 1 0 "[ . 1 . 2]" 1
1683 1 68 ARG H 1 68 ARG QB . . 2.860 2.230 2.128 2.274 . 0 0 "[ . 1 . 2]" 1
1684 1 68 ARG H 1 68 ARG HB3 . . 3.470 2.353 2.147 2.517 . 0 0 "[ . 1 . 2]" 1
1685 1 68 ARG H 1 68 ARG QD . . 5.170 4.342 3.771 4.474 . 0 0 "[ . 1 . 2]" 1
1686 1 68 ARG H 1 68 ARG QG . . 4.380 3.791 2.897 3.979 . 0 0 "[ . 1 . 2]" 1
1687 1 68 ARG H 1 69 PHE H . . 3.460 2.499 2.341 2.768 . 0 0 "[ . 1 . 2]" 1
1688 1 68 ARG H 1 69 PHE HA . . 5.500 5.144 5.013 5.363 . 0 0 "[ . 1 . 2]" 1
1689 1 68 ARG H 1 69 PHE HB2 . . 5.500 5.113 4.956 5.373 . 0 0 "[ . 1 . 2]" 1
1690 1 68 ARG H 1 69 PHE HB3 . . 5.500 4.569 4.398 4.901 . 0 0 "[ . 1 . 2]" 1
1691 1 68 ARG H 1 70 VAL H . . 5.000 4.575 4.355 4.997 . 0 0 "[ . 1 . 2]" 1
1692 1 68 ARG H 1 70 VAL MG1 . . 5.500 3.923 3.830 4.128 . 0 0 "[ . 1 . 2]" 1
1693 1 68 ARG HA 1 68 ARG QD . . 4.780 3.704 2.500 4.467 . 0 0 "[ . 1 . 2]" 1
1694 1 68 ARG HA 1 68 ARG HG2 . . 3.900 3.583 3.364 3.900 . 0 0 "[ . 1 . 2]" 1
1695 1 68 ARG HA 1 68 ARG HG3 . . 3.900 2.780 2.403 3.583 . 0 0 "[ . 1 . 2]" 1
1696 1 68 ARG HA 1 71 ASP H . . 4.640 3.992 3.856 4.110 . 0 0 "[ . 1 . 2]" 1
1697 1 68 ARG HA 1 71 ASP HB2 . . 3.980 3.166 2.685 3.621 . 0 0 "[ . 1 . 2]" 1
1698 1 68 ARG HA 1 71 ASP HB3 . . 3.980 3.450 2.792 3.942 . 0 0 "[ . 1 . 2]" 1
1699 1 68 ARG HA 1 72 LYS H . . 5.500 4.955 4.778 5.072 . 0 0 "[ . 1 . 2]" 1
1700 1 68 ARG QB 1 68 ARG QD . . 2.990 2.048 1.945 2.195 . 0 0 "[ . 1 . 2]" 1
1701 1 68 ARG QB 1 71 ASP QB . . 5.180 4.501 4.202 4.646 . 0 0 "[ . 1 . 2]" 1
1702 1 68 ARG HB2 1 69 PHE H . . 4.070 3.959 3.834 4.029 . 0 0 "[ . 1 . 2]" 1
1703 1 68 ARG HB3 1 69 PHE H . . 4.070 2.768 2.540 3.525 . 0 0 "[ . 1 . 2]" 1
1704 1 68 ARG HD2 1 69 PHE H . . 5.500 5.200 4.405 5.485 . 0 0 "[ . 1 . 2]" 1
1705 1 68 ARG HD3 1 69 PHE H . . 5.500 5.226 4.135 5.503 0.003 11 0 "[ . 1 . 2]" 1
1706 1 68 ARG QG 1 69 PHE H . . 3.490 3.239 1.922 3.624 0.134 11 0 "[ . 1 . 2]" 1
1707 1 68 ARG QG 1 69 PHE HA . . 3.770 3.414 2.915 3.735 . 0 0 "[ . 1 . 2]" 1
1708 1 68 ARG HG2 1 69 PHE H . . 4.240 3.551 1.943 4.411 0.171 16 0 "[ . 1 . 2]" 1
1709 1 68 ARG HG3 1 69 PHE H . . 4.240 4.017 2.844 4.500 0.260 17 0 "[ . 1 . 2]" 1
1710 1 69 PHE H 1 69 PHE HB2 . . 3.380 2.747 2.687 2.810 . 0 0 "[ . 1 . 2]" 1
1711 1 69 PHE H 1 69 PHE HB3 . . 3.280 2.359 2.316 2.411 . 0 0 "[ . 1 . 2]" 1
1712 1 69 PHE H 1 69 PHE QD . . 4.320 4.118 4.074 4.162 . 0 0 "[ . 1 . 2]" 1
1713 1 69 PHE H 1 70 VAL H . . 3.630 2.886 2.795 3.007 . 0 0 "[ . 1 . 2]" 1
1714 1 69 PHE H 1 70 VAL HB . . 5.500 5.329 5.185 5.470 . 0 0 "[ . 1 . 2]" 1
1715 1 69 PHE H 1 70 VAL MG1 . . 3.950 3.587 3.480 3.695 . 0 0 "[ . 1 . 2]" 1
1716 1 69 PHE H 1 72 LYS H . . 5.060 5.022 4.896 5.067 0.007 11 0 "[ . 1 . 2]" 1
1717 1 69 PHE HA 1 69 PHE QD . . 3.870 3.018 2.880 3.115 . 0 0 "[ . 1 . 2]" 1
1718 1 69 PHE HA 1 70 VAL MG1 . . 5.270 4.711 4.609 4.814 . 0 0 "[ . 1 . 2]" 1
1719 1 69 PHE HA 1 71 ASP H . . 4.800 3.953 3.732 4.102 . 0 0 "[ . 1 . 2]" 1
1720 1 69 PHE HA 1 72 LYS H . . 3.820 3.453 3.250 3.564 . 0 0 "[ . 1 . 2]" 1
1721 1 69 PHE HA 1 72 LYS QB . . 3.860 3.366 3.101 3.575 . 0 0 "[ . 1 . 2]" 1
1722 1 69 PHE HA 1 72 LYS HG3 . . 4.260 3.560 3.127 3.843 . 0 0 "[ . 1 . 2]" 1
1723 1 69 PHE HA 1 73 LEU H . . 4.770 4.401 4.242 4.573 . 0 0 "[ . 1 . 2]" 1
1724 1 69 PHE HB2 1 70 VAL H . . 4.490 3.641 3.552 3.692 . 0 0 "[ . 1 . 2]" 1
1725 1 69 PHE HB2 1 70 VAL HA . . 5.500 5.524 5.513 5.536 0.036 14 0 "[ . 1 . 2]" 1
1726 1 69 PHE HB2 1 70 VAL MG1 . . 5.500 5.119 5.002 5.270 . 0 0 "[ . 1 . 2]" 1
1727 1 69 PHE HB3 1 70 VAL H . . 3.910 2.140 2.021 2.212 . 0 0 "[ . 1 . 2]" 1
1728 1 69 PHE HB3 1 70 VAL HB . . 4.630 4.367 4.215 4.483 . 0 0 "[ . 1 . 2]" 1
1729 1 69 PHE HB3 1 70 VAL MG1 . . 3.810 3.842 3.726 4.002 0.192 4 0 "[ . 1 . 2]" 1
1730 1 69 PHE QD 1 70 VAL H . . 4.510 2.169 2.049 2.364 . 0 0 "[ . 1 . 2]" 1
1731 1 69 PHE QD 1 70 VAL HA . . 3.990 2.587 2.426 2.766 . 0 0 "[ . 1 . 2]" 1
1732 1 69 PHE QD 1 70 VAL MG1 . . 3.840 3.763 3.613 4.012 0.172 17 0 "[ . 1 . 2]" 1
1733 1 69 PHE QD 1 72 LYS QB . . 4.810 4.560 4.188 4.754 . 0 0 "[ . 1 . 2]" 1
1734 1 69 PHE QD 1 73 LEU H . . 4.720 4.574 4.445 4.723 0.003 17 0 "[ . 1 . 2]" 1
1735 1 69 PHE QD 1 73 LEU HB2 . . 4.310 4.008 3.763 4.160 . 0 0 "[ . 1 . 2]" 1
1736 1 69 PHE QD 1 73 LEU HB3 . . 5.160 4.205 4.005 4.417 . 0 0 "[ . 1 . 2]" 1
1737 1 69 PHE QD 1 73 LEU MD2 . . 4.620 3.749 3.449 3.993 . 0 0 "[ . 1 . 2]" 1
1738 1 69 PHE QE 1 73 LEU HB3 . . 5.480 3.914 3.723 4.192 . 0 0 "[ . 1 . 2]" 1
1739 1 69 PHE QE 1 73 LEU MD1 . . 3.980 3.757 3.511 3.973 . 0 0 "[ . 1 . 2]" 1
1740 1 69 PHE QE 1 73 LEU MD2 . . 3.330 2.357 1.981 2.800 . 0 0 "[ . 1 . 2]" 1
1741 1 69 PHE HZ 1 73 LEU HB2 . . 4.760 3.693 3.543 3.883 . 0 0 "[ . 1 . 2]" 1
1742 1 69 PHE HZ 1 73 LEU HB3 . . 5.500 5.217 5.021 5.429 . 0 0 "[ . 1 . 2]" 1
1743 1 69 PHE HZ 1 73 LEU MD1 . . 4.570 3.668 3.423 4.054 . 0 0 "[ . 1 . 2]" 1
1744 1 69 PHE HZ 1 73 LEU MD2 . . 4.090 3.608 3.175 4.050 . 0 0 "[ . 1 . 2]" 1
1745 1 70 VAL H 1 70 VAL HB . . 3.480 2.592 2.499 2.680 . 0 0 "[ . 1 . 2]" 1
1746 1 70 VAL H 1 70 VAL MG1 . . 3.310 2.217 2.133 2.312 . 0 0 "[ . 1 . 2]" 1
1747 1 70 VAL H 1 70 VAL MG2 . . 4.260 3.775 3.767 3.783 . 0 0 "[ . 1 . 2]" 1
1748 1 70 VAL H 1 71 ASP H . . 3.770 2.887 2.834 2.958 . 0 0 "[ . 1 . 2]" 1
1749 1 70 VAL H 1 72 LYS H . . 4.770 4.548 4.474 4.634 . 0 0 "[ . 1 . 2]" 1
1750 1 70 VAL HA 1 70 VAL MG1 . . 3.220 3.179 3.166 3.188 . 0 0 "[ . 1 . 2]" 1
1751 1 70 VAL HA 1 70 VAL MG2 . . 3.730 2.364 2.277 2.441 . 0 0 "[ . 1 . 2]" 1
1752 1 70 VAL HA 1 72 LYS H . . 4.500 4.345 4.247 4.479 . 0 0 "[ . 1 . 2]" 1
1753 1 70 VAL HA 1 73 LEU H . . 3.980 3.278 3.141 3.499 . 0 0 "[ . 1 . 2]" 1
1754 1 70 VAL HA 1 73 LEU HA . . 5.410 4.991 4.807 5.243 . 0 0 "[ . 1 . 2]" 1
1755 1 70 VAL HA 1 73 LEU HB2 . . 3.950 3.174 3.017 3.486 . 0 0 "[ . 1 . 2]" 1
1756 1 70 VAL HA 1 73 LEU HB3 . . 3.130 2.253 2.017 2.481 . 0 0 "[ . 1 . 2]" 1
1757 1 70 VAL HA 1 73 LEU MD2 . . 3.990 2.834 2.585 3.098 . 0 0 "[ . 1 . 2]" 1
1758 1 70 VAL HA 1 73 LEU HG . . 5.030 4.415 4.133 4.611 . 0 0 "[ . 1 . 2]" 1
1759 1 70 VAL HA 1 74 PHE H . . 4.500 3.827 3.609 4.045 . 0 0 "[ . 1 . 2]" 1
1760 1 70 VAL HA 1 74 PHE QD . . 4.420 4.022 3.555 4.301 . 0 0 "[ . 1 . 2]" 1
1761 1 70 VAL HB 1 71 ASP H . . 4.320 4.107 4.019 4.188 . 0 0 "[ . 1 . 2]" 1
1762 1 70 VAL MG1 1 71 ASP H . . 4.370 2.013 1.902 2.201 . 0 0 "[ . 1 . 2]" 1
1763 1 70 VAL MG1 1 71 ASP HA . . 5.170 3.555 3.398 3.685 . 0 0 "[ . 1 . 2]" 1
1764 1 70 VAL MG1 1 72 LYS H . . 5.500 4.408 4.339 4.524 . 0 0 "[ . 1 . 2]" 1
1765 1 70 VAL MG1 1 73 LEU HB3 . . 5.500 4.811 4.630 4.970 . 0 0 "[ . 1 . 2]" 1
1766 1 70 VAL MG1 1 74 PHE QD . . 5.500 5.023 4.776 5.236 . 0 0 "[ . 1 . 2]" 1
1767 1 70 VAL MG2 1 71 ASP H . . 4.430 3.622 3.398 3.848 . 0 0 "[ . 1 . 2]" 1
1768 1 70 VAL MG2 1 71 ASP HA . . 4.520 3.623 3.419 3.840 . 0 0 "[ . 1 . 2]" 1
1769 1 70 VAL MG2 1 72 LYS H . . 5.500 5.021 4.910 5.167 . 0 0 "[ . 1 . 2]" 1
1770 1 70 VAL MG2 1 74 PHE H . . 4.140 3.358 3.030 3.614 . 0 0 "[ . 1 . 2]" 1
1771 1 70 VAL MG2 1 74 PHE HB2 . . 5.280 3.724 3.454 3.998 . 0 0 "[ . 1 . 2]" 1
1772 1 70 VAL MG2 1 74 PHE HB3 . . 5.500 4.946 4.627 5.261 . 0 0 "[ . 1 . 2]" 1
1773 1 70 VAL MG2 1 74 PHE QD . . 3.810 2.561 2.185 2.809 . 0 0 "[ . 1 . 2]" 1
1774 1 70 VAL MG2 1 74 PHE QE . . 3.800 2.842 2.309 3.135 . 0 0 "[ . 1 . 2]" 1
1775 1 71 ASP H 1 71 ASP HB2 . . 3.720 2.325 2.072 2.897 . 0 0 "[ . 1 . 2]" 1
1776 1 71 ASP H 1 71 ASP HB3 . . 3.720 2.832 2.228 3.379 . 0 0 "[ . 1 . 2]" 1
1777 1 71 ASP H 1 72 LYS H . . 3.520 2.707 2.494 2.805 . 0 0 "[ . 1 . 2]" 1
1778 1 71 ASP H 1 72 LYS HG2 . . 5.500 5.053 4.712 5.408 . 0 0 "[ . 1 . 2]" 1
1779 1 71 ASP H 1 72 LYS HG3 . . 5.500 5.273 4.970 5.502 0.002 8 0 "[ . 1 . 2]" 1
1780 1 71 ASP H 1 73 LEU H . . 5.500 3.977 3.761 4.215 . 0 0 "[ . 1 . 2]" 1
1781 1 71 ASP HA 1 73 LEU H . . 5.390 4.491 4.137 4.790 . 0 0 "[ . 1 . 2]" 1
1782 1 71 ASP HA 1 74 PHE H . . 4.640 4.225 3.797 4.555 . 0 0 "[ . 1 . 2]" 1
1783 1 71 ASP HA 1 74 PHE HB2 . . 4.520 3.614 3.216 3.984 . 0 0 "[ . 1 . 2]" 1
1784 1 71 ASP HA 1 74 PHE HB3 . . 5.500 5.139 4.726 5.445 . 0 0 "[ . 1 . 2]" 1
1785 1 71 ASP QB 1 72 LYS H . . 3.240 2.560 2.407 2.701 . 0 0 "[ . 1 . 2]" 1
1786 1 71 ASP QB 1 72 LYS QB . . 5.340 4.296 4.209 4.486 . 0 0 "[ . 1 . 2]" 1
1787 1 71 ASP QB 1 72 LYS HG2 . . 5.340 3.256 3.010 3.716 . 0 0 "[ . 1 . 2]" 1
1788 1 71 ASP QB 1 72 LYS HG3 . . 4.480 4.082 3.768 4.345 . 0 0 "[ . 1 . 2]" 1
1789 1 71 ASP HB2 1 72 LYS H . . 4.030 3.583 3.001 4.021 . 0 0 "[ . 1 . 2]" 1
1790 1 71 ASP HB3 1 72 LYS H . . 4.030 2.649 2.442 3.066 . 0 0 "[ . 1 . 2]" 1
1791 1 72 LYS H 1 72 LYS QB . . 3.540 2.380 2.333 2.417 . 0 0 "[ . 1 . 2]" 1
1792 1 72 LYS H 1 72 LYS QD . . 5.180 4.325 4.071 4.451 . 0 0 "[ . 1 . 2]" 1
1793 1 72 LYS H 1 72 LYS HG2 . . 4.220 2.741 2.422 2.982 . 0 0 "[ . 1 . 2]" 1
1794 1 72 LYS H 1 72 LYS HG3 . . 3.400 3.085 2.802 3.293 . 0 0 "[ . 1 . 2]" 1
1795 1 72 LYS H 1 73 LEU H . . 3.480 2.472 2.350 2.652 . 0 0 "[ . 1 . 2]" 1
1796 1 72 LYS H 1 73 LEU HA . . 5.500 5.081 4.971 5.229 . 0 0 "[ . 1 . 2]" 1
1797 1 72 LYS H 1 73 LEU HB2 . . 5.500 4.969 4.759 5.197 . 0 0 "[ . 1 . 2]" 1
1798 1 72 LYS H 1 73 LEU HB3 . . 5.500 4.479 4.395 4.572 . 0 0 "[ . 1 . 2]" 1
1799 1 72 LYS H 1 74 PHE H . . 5.070 4.615 4.367 4.786 . 0 0 "[ . 1 . 2]" 1
1800 1 72 LYS HA 1 72 LYS QD . . 3.580 3.065 2.787 3.394 . 0 0 "[ . 1 . 2]" 1
1801 1 72 LYS HA 1 72 LYS QE . . 4.610 4.115 3.028 4.649 0.039 13 0 "[ . 1 . 2]" 1
1802 1 72 LYS HA 1 72 LYS HG2 . . 3.380 2.452 2.345 2.613 . 0 0 "[ . 1 . 2]" 1
1803 1 72 LYS HA 1 72 LYS HG3 . . 3.660 3.669 3.577 3.757 0.097 10 0 "[ . 1 . 2]" 1
1804 1 72 LYS HA 1 74 PHE H . . 5.230 4.877 4.550 5.112 . 0 0 "[ . 1 . 2]" 1
1805 1 72 LYS HA 1 75 GLU QB . . 3.430 2.729 2.376 3.329 . 0 0 "[ . 1 . 2]" 1
1806 1 72 LYS HA 1 76 ALA H . . 5.040 4.310 4.191 4.500 . 0 0 "[ . 1 . 2]" 1
1807 1 72 LYS QB 1 72 LYS QD . . 3.090 2.005 1.946 2.113 . 0 0 "[ . 1 . 2]" 1
1808 1 72 LYS QB 1 73 LEU H . . 3.540 2.696 2.410 2.908 . 0 0 "[ . 1 . 2]" 1
1809 1 72 LYS QB 1 73 LEU HA . . 5.050 3.890 3.811 3.961 . 0 0 "[ . 1 . 2]" 1
1810 1 72 LYS HG2 1 73 LEU H . . 5.290 4.588 4.402 4.728 . 0 0 "[ . 1 . 2]" 1
1811 1 72 LYS HG3 1 73 LEU H . . 5.130 4.679 4.488 4.849 . 0 0 "[ . 1 . 2]" 1
1812 1 73 LEU H 1 73 LEU HB2 . . 3.170 2.677 2.545 2.797 . 0 0 "[ . 1 . 2]" 1
1813 1 73 LEU H 1 73 LEU HB3 . . 3.290 2.353 2.272 2.463 . 0 0 "[ . 1 . 2]" 1
1814 1 73 LEU H 1 73 LEU MD1 . . 5.110 4.174 4.100 4.244 . 0 0 "[ . 1 . 2]" 1
1815 1 73 LEU H 1 73 LEU MD2 . . 5.500 4.197 4.137 4.234 . 0 0 "[ . 1 . 2]" 1
1816 1 73 LEU H 1 73 LEU HG . . 4.610 4.372 4.284 4.462 . 0 0 "[ . 1 . 2]" 1
1817 1 73 LEU H 1 74 PHE H . . 3.650 2.973 2.691 3.184 . 0 0 "[ . 1 . 2]" 1
1818 1 73 LEU H 1 74 PHE HB2 . . 5.440 4.731 4.486 4.899 . 0 0 "[ . 1 . 2]" 1
1819 1 73 LEU H 1 74 PHE QD . . 5.140 4.728 4.400 5.087 . 0 0 "[ . 1 . 2]" 1
1820 1 73 LEU H 1 75 GLU H . . 5.020 4.189 3.861 4.611 . 0 0 "[ . 1 . 2]" 1
1821 1 73 LEU H 1 76 ALA H . . 5.500 4.586 4.486 4.697 . 0 0 "[ . 1 . 2]" 1
1822 1 73 LEU HA 1 73 LEU HB2 . . 2.870 2.352 2.315 2.406 . 0 0 "[ . 1 . 2]" 1
1823 1 73 LEU HA 1 73 LEU MD1 . . 2.920 2.195 1.993 2.469 . 0 0 "[ . 1 . 2]" 1
1824 1 73 LEU HA 1 73 LEU HG . . 4.080 3.328 3.257 3.378 . 0 0 "[ . 1 . 2]" 1
1825 1 73 LEU HA 1 74 PHE QD . . 5.500 5.064 4.784 5.284 . 0 0 "[ . 1 . 2]" 1
1826 1 73 LEU HA 1 75 GLU H . . 5.140 4.491 4.165 4.815 . 0 0 "[ . 1 . 2]" 1
1827 1 73 LEU HA 1 76 ALA H . . 4.230 3.362 3.250 3.439 . 0 0 "[ . 1 . 2]" 1
1828 1 73 LEU HA 1 76 ALA MB . . 3.260 2.323 2.176 2.428 . 0 0 "[ . 1 . 2]" 1
1829 1 73 LEU HA 1 77 VAL H . . 5.000 4.822 4.615 4.967 . 0 0 "[ . 1 . 2]" 1
1830 1 73 LEU HB2 1 74 PHE H . . 4.360 3.731 3.634 3.866 . 0 0 "[ . 1 . 2]" 1
1831 1 73 LEU HB2 1 74 PHE QD . . 5.050 4.573 4.231 4.820 . 0 0 "[ . 1 . 2]" 1
1832 1 73 LEU HB2 1 75 GLU H . . 5.500 5.814 5.505 6.131 0.631 6 3 "[ .+ * - . 2]" 1
1833 1 73 LEU HB2 1 76 ALA H . . 5.500 5.455 5.388 5.499 . 0 0 "[ . 1 . 2]" 1
1834 1 73 LEU HB3 1 73 LEU MD2 . . 3.300 2.295 2.154 2.402 . 0 0 "[ . 1 . 2]" 1
1835 1 73 LEU HB3 1 74 PHE H . . 3.440 2.271 2.134 2.474 . 0 0 "[ . 1 . 2]" 1
1836 1 73 LEU HB3 1 74 PHE QD . . 4.490 3.018 2.549 3.343 . 0 0 "[ . 1 . 2]" 1
1837 1 73 LEU HB3 1 75 GLU H . . 5.500 4.830 4.592 5.115 . 0 0 "[ . 1 . 2]" 1
1838 1 73 LEU MD1 1 74 PHE H . . 3.990 3.999 3.829 4.194 0.204 20 0 "[ . 1 . 2]" 1
1839 1 73 LEU MD1 1 74 PHE QD . . 4.120 4.269 3.961 4.350 0.230 17 0 "[ . 1 . 2]" 1
1840 1 73 LEU MD1 1 75 GLU H . . 5.500 5.341 5.040 5.563 0.063 6 0 "[ . 1 . 2]" 1
1841 1 73 LEU MD1 1 76 ALA H . . 4.800 4.236 3.968 4.419 . 0 0 "[ . 1 . 2]" 1
1842 1 73 LEU MD1 1 76 ALA MB . . 3.220 2.748 2.485 2.908 . 0 0 "[ . 1 . 2]" 1
1843 1 73 LEU MD1 1 77 VAL H . . 5.500 4.252 4.030 4.485 . 0 0 "[ . 1 . 2]" 1
1844 1 73 LEU MD2 1 74 PHE H . . 4.570 3.671 3.450 4.160 . 0 0 "[ . 1 . 2]" 1
1845 1 73 LEU MD2 1 74 PHE HA . . 4.400 4.423 4.216 4.756 0.356 20 0 "[ . 1 . 2]" 1
1846 1 73 LEU MD2 1 74 PHE QD . . 3.860 2.935 2.694 3.433 . 0 0 "[ . 1 . 2]" 1
1847 1 73 LEU MD2 1 74 PHE QE . . 4.100 3.188 2.700 3.667 . 0 0 "[ . 1 . 2]" 1
1848 1 73 LEU HG 1 74 PHE H . . 4.330 2.869 2.571 3.392 . 0 0 "[ . 1 . 2]" 1
1849 1 73 LEU HG 1 74 PHE HA . . 4.550 3.120 2.944 3.429 . 0 0 "[ . 1 . 2]" 1
1850 1 73 LEU HG 1 74 PHE QD . . 4.680 2.690 2.302 2.838 . 0 0 "[ . 1 . 2]" 1
1851 1 73 LEU HG 1 74 PHE QE . . 5.390 4.146 3.701 4.388 . 0 0 "[ . 1 . 2]" 1
1852 1 73 LEU HG 1 76 ALA H . . 5.500 4.899 4.776 5.074 . 0 0 "[ . 1 . 2]" 1
1853 1 73 LEU HG 1 77 VAL H . . 5.280 5.110 4.860 5.210 . 0 0 "[ . 1 . 2]" 1
1854 1 74 PHE H 1 74 PHE HB2 . . 3.050 2.237 2.167 2.329 . 0 0 "[ . 1 . 2]" 1
1855 1 74 PHE H 1 74 PHE HB3 . . 3.650 3.523 3.479 3.570 . 0 0 "[ . 1 . 2]" 1
1856 1 74 PHE H 1 74 PHE QD . . 3.430 2.207 1.909 2.520 . 0 0 "[ . 1 . 2]" 1
1857 1 74 PHE H 1 74 PHE QE . . 4.870 4.546 4.276 4.778 . 0 0 "[ . 1 . 2]" 1
1858 1 74 PHE H 1 75 GLU H . . 3.410 2.888 2.687 3.116 . 0 0 "[ . 1 . 2]" 1
1859 1 74 PHE H 1 76 ALA H . . 4.540 3.970 3.852 4.070 . 0 0 "[ . 1 . 2]" 1
1860 1 74 PHE H 1 77 VAL H . . 5.460 5.354 5.156 5.459 . 0 0 "[ . 1 . 2]" 1
1861 1 74 PHE HA 1 74 PHE QD . . 4.090 2.688 2.380 2.868 . 0 0 "[ . 1 . 2]" 1
1862 1 74 PHE HA 1 74 PHE QE . . 5.500 4.382 4.261 4.479 . 0 0 "[ . 1 . 2]" 1
1863 1 74 PHE HA 1 76 ALA H . . 4.170 4.007 3.853 4.177 0.007 14 0 "[ . 1 . 2]" 1
1864 1 74 PHE HA 1 77 VAL H . . 3.940 3.857 3.732 3.941 0.001 7 0 "[ . 1 . 2]" 1
1865 1 74 PHE HA 1 77 VAL QG . . 3.520 3.028 2.610 3.291 . 0 0 "[ . 1 . 2]" 1
1866 1 74 PHE HB2 1 75 GLU H . . 3.640 2.776 2.575 2.986 . 0 0 "[ . 1 . 2]" 1
1867 1 74 PHE HB2 1 76 ALA H . . 5.500 4.858 4.706 4.981 . 0 0 "[ . 1 . 2]" 1
1868 1 74 PHE HB3 1 75 GLU H . . 3.720 3.184 2.798 3.594 . 0 0 "[ . 1 . 2]" 1
1869 1 74 PHE HB3 1 76 ALA H . . 5.360 5.019 4.797 5.157 . 0 0 "[ . 1 . 2]" 1
1870 1 75 GLU H 1 75 GLU HB2 . . 3.540 2.279 2.076 3.500 . 0 0 "[ . 1 . 2]" 1
1871 1 75 GLU H 1 75 GLU QB . . 2.810 2.125 2.056 2.215 . 0 0 "[ . 1 . 2]" 1
1872 1 75 GLU H 1 75 GLU HB3 . . 3.540 3.250 2.178 3.526 . 0 0 "[ . 1 . 2]" 1
1873 1 75 GLU H 1 75 GLU HG2 . . 4.380 3.623 2.885 4.296 . 0 0 "[ . 1 . 2]" 1
1874 1 75 GLU H 1 75 GLU QG . . 3.640 3.159 2.748 3.622 . 0 0 "[ . 1 . 2]" 1
1875 1 75 GLU H 1 75 GLU HG3 . . 4.380 3.667 2.808 4.299 . 0 0 "[ . 1 . 2]" 1
1876 1 75 GLU H 1 76 ALA H . . 3.320 2.539 2.352 2.686 . 0 0 "[ . 1 . 2]" 1
1877 1 75 GLU H 1 76 ALA MB . . 4.680 4.160 3.919 4.304 . 0 0 "[ . 1 . 2]" 1
1878 1 75 GLU H 1 77 VAL H . . 4.600 4.533 4.356 4.595 . 0 0 "[ . 1 . 2]" 1
1879 1 75 GLU H 1 77 VAL QG . . 5.440 5.025 4.717 5.200 . 0 0 "[ . 1 . 2]" 1
1880 1 75 GLU HA 1 75 GLU HG2 . . 3.870 2.436 2.031 3.827 . 0 0 "[ . 1 . 2]" 1
1881 1 75 GLU HA 1 75 GLU QG . . 3.350 2.296 2.013 3.241 . 0 0 "[ . 1 . 2]" 1
1882 1 75 GLU HA 1 75 GLU HG3 . . 3.870 3.244 2.214 3.648 . 0 0 "[ . 1 . 2]" 1
1883 1 75 GLU HA 1 78 GLU H . . 4.070 3.675 3.506 3.843 . 0 0 "[ . 1 . 2]" 1
1884 1 75 GLU HA 1 78 GLU QB . . 4.050 3.539 3.245 3.807 . 0 0 "[ . 1 . 2]" 1
1885 1 75 GLU HA 1 78 GLU QG . . 4.780 4.579 4.437 4.753 . 0 0 "[ . 1 . 2]" 1
1886 1 75 GLU QB 1 76 ALA H . . 3.440 3.082 2.906 3.456 0.016 14 0 "[ . 1 . 2]" 1
1887 1 75 GLU QB 1 76 ALA MB . . 4.990 4.211 4.107 4.734 . 0 0 "[ . 1 . 2]" 1
1888 1 75 GLU QG 1 76 ALA H . . 4.770 4.345 2.397 4.704 . 0 0 "[ . 1 . 2]" 1
1889 1 75 GLU HG2 1 76 ALA H . . 5.440 4.769 2.504 5.378 . 0 0 "[ . 1 . 2]" 1
1890 1 75 GLU HG3 1 76 ALA H . . 5.440 5.054 3.063 5.493 0.053 18 0 "[ . 1 . 2]" 1
1891 1 76 ALA H 1 76 ALA MB . . 3.030 2.148 2.055 2.230 . 0 0 "[ . 1 . 2]" 1
1892 1 76 ALA H 1 77 VAL HA . . 5.500 5.307 5.143 5.441 . 0 0 "[ . 1 . 2]" 1
1893 1 76 ALA H 1 77 VAL QG . . 5.050 4.126 3.938 4.308 . 0 0 "[ . 1 . 2]" 1
1894 1 76 ALA H 1 78 GLU H . . 4.770 4.330 4.195 4.519 . 0 0 "[ . 1 . 2]" 1
1895 1 76 ALA H 1 79 GLU HB2 . . 4.480 4.475 4.193 4.755 0.275 18 0 "[ . 1 . 2]" 1
1896 1 76 ALA HA 1 77 VAL QG . . 5.440 4.895 4.833 4.986 . 0 0 "[ . 1 . 2]" 1
1897 1 76 ALA HA 1 78 GLU H . . 5.230 4.068 3.911 4.380 . 0 0 "[ . 1 . 2]" 1
1898 1 76 ALA HA 1 79 GLU H . . 3.420 2.886 2.807 2.987 . 0 0 "[ . 1 . 2]" 1
1899 1 76 ALA HA 1 79 GLU HB2 . . 3.470 2.311 2.073 2.545 . 0 0 "[ . 1 . 2]" 1
1900 1 76 ALA HA 1 79 GLU HB3 . . 3.510 2.296 2.086 2.579 . 0 0 "[ . 1 . 2]" 1
1901 1 76 ALA HA 1 79 GLU QG . . 4.060 3.723 3.366 3.981 . 0 0 "[ . 1 . 2]" 1
1902 1 76 ALA HA 1 80 GLY H . . 3.970 3.237 2.910 3.803 . 0 0 "[ . 1 . 2]" 1
1903 1 76 ALA MB 1 77 VAL H . . 3.440 2.477 2.362 2.616 . 0 0 "[ . 1 . 2]" 1
1904 1 76 ALA MB 1 77 VAL HA . . 4.430 3.702 3.640 3.821 . 0 0 "[ . 1 . 2]" 1
1905 1 76 ALA MB 1 79 GLU H . . 5.500 4.072 3.983 4.171 . 0 0 "[ . 1 . 2]" 1
1906 1 76 ALA MB 1 79 GLU HB2 . . 4.380 3.969 3.729 4.178 . 0 0 "[ . 1 . 2]" 1
1907 1 76 ALA MB 1 79 GLU QG . . 5.340 4.558 4.313 4.735 . 0 0 "[ . 1 . 2]" 1
1908 1 76 ALA MB 1 80 GLY H . . 5.500 3.613 3.292 4.153 . 0 0 "[ . 1 . 2]" 1
1909 1 77 VAL H 1 77 VAL HB . . 3.060 2.570 2.489 2.663 . 0 0 "[ . 1 . 2]" 1
1910 1 77 VAL H 1 77 VAL MG1 . . 3.980 3.774 3.764 3.782 . 0 0 "[ . 1 . 2]" 1
1911 1 77 VAL H 1 77 VAL QG . . 2.880 2.143 1.898 2.405 . 0 0 "[ . 1 . 2]" 1
1912 1 77 VAL H 1 77 VAL MG2 . . 3.980 2.156 1.903 2.433 . 0 0 "[ . 1 . 2]" 1
1913 1 77 VAL H 1 78 GLU H . . 3.270 2.934 2.873 3.084 . 0 0 "[ . 1 . 2]" 1
1914 1 77 VAL H 1 78 GLU QG . . 5.500 5.394 5.246 5.468 . 0 0 "[ . 1 . 2]" 1
1915 1 77 VAL HA 1 77 VAL MG1 . . 3.290 2.449 2.385 2.528 . 0 0 "[ . 1 . 2]" 1
1916 1 77 VAL HA 1 77 VAL QG . . 2.780 2.099 2.034 2.173 . 0 0 "[ . 1 . 2]" 1
1917 1 77 VAL HA 1 77 VAL MG2 . . 3.290 2.287 2.145 2.404 . 0 0 "[ . 1 . 2]" 1
1918 1 77 VAL HA 1 78 GLU HA . . 4.780 4.638 4.629 4.651 . 0 0 "[ . 1 . 2]" 1
1919 1 77 VAL HA 1 79 GLU H . . 4.440 4.284 4.189 4.421 . 0 0 "[ . 1 . 2]" 1
1920 1 77 VAL HA 1 80 GLY H . . 4.680 4.306 3.987 4.423 . 0 0 "[ . 1 . 2]" 1
1921 1 77 VAL HA 1 80 GLY HA3 . . 5.470 5.066 4.992 5.223 . 0 0 "[ . 1 . 2]" 1
1922 1 77 VAL HA 1 81 ARG H . . 4.910 3.934 3.737 4.149 . 0 0 "[ . 1 . 2]" 1
1923 1 77 VAL HA 1 81 ARG HB2 . . 5.480 4.442 4.278 4.814 . 0 0 "[ . 1 . 2]" 1
1924 1 77 VAL HA 1 81 ARG QD . . 4.950 3.209 2.717 3.914 . 0 0 "[ . 1 . 2]" 1
1925 1 77 VAL HA 1 81 ARG HG2 . . 5.500 4.492 4.099 5.085 . 0 0 "[ . 1 . 2]" 1
1926 1 77 VAL HA 1 81 ARG HG3 . . 5.050 2.909 2.586 3.419 . 0 0 "[ . 1 . 2]" 1
1927 1 77 VAL HB 1 78 GLU H . . 2.940 2.661 2.385 2.764 . 0 0 "[ . 1 . 2]" 1
1928 1 77 VAL QG 1 78 GLU H . . 3.420 3.142 3.009 3.231 . 0 0 "[ . 1 . 2]" 1
1929 1 77 VAL QG 1 78 GLU HA . . 4.130 3.315 3.170 3.479 . 0 0 "[ . 1 . 2]" 1
1930 1 77 VAL QG 1 78 GLU QB . . 4.100 4.013 3.856 4.090 . 0 0 "[ . 1 . 2]" 1
1931 1 77 VAL QG 1 78 GLU QG . . 4.610 3.016 2.708 3.192 . 0 0 "[ . 1 . 2]" 1
1932 1 77 VAL QG 1 79 GLU H . . 5.230 4.419 4.285 4.513 . 0 0 "[ . 1 . 2]" 1
1933 1 77 VAL QG 1 81 ARG H . . 5.260 4.378 4.204 4.493 . 0 0 "[ . 1 . 2]" 1
1934 1 77 VAL QG 1 81 ARG HB2 . . 4.050 3.607 3.494 3.647 . 0 0 "[ . 1 . 2]" 1
1935 1 77 VAL QG 1 81 ARG HB3 . . 5.440 4.474 4.410 4.530 . 0 0 "[ . 1 . 2]" 1
1936 1 77 VAL QG 1 81 ARG QD . . 3.920 2.101 1.853 2.373 . 0 0 "[ . 1 . 2]" 1
1937 1 77 VAL QG 1 81 ARG HG2 . . 4.890 4.240 4.108 4.381 . 0 0 "[ . 1 . 2]" 1
1938 1 77 VAL QG 1 81 ARG HG3 . . 3.970 3.260 3.028 3.448 . 0 0 "[ . 1 . 2]" 1
1939 1 77 VAL QG 1 82 SER QB . . 4.670 6.433 5.452 6.749 2.079 17 20 [****************+*-*] 1
1940 1 77 VAL MG1 1 78 GLU H . . 4.140 3.308 3.112 3.437 . 0 0 "[ . 1 . 2]" 1
1941 1 77 VAL MG1 1 81 ARG QD . . 5.330 2.113 1.862 2.389 . 0 0 "[ . 1 . 2]" 1
1942 1 77 VAL MG2 1 78 GLU H . . 4.140 3.929 3.783 4.020 . 0 0 "[ . 1 . 2]" 1
1943 1 77 VAL MG2 1 81 ARG QD . . 5.330 3.735 3.381 4.261 . 0 0 "[ . 1 . 2]" 1
1944 1 78 GLU H 1 78 GLU QB . . 2.880 2.200 2.179 2.253 . 0 0 "[ . 1 . 2]" 1
1945 1 78 GLU H 1 78 GLU QG . . 3.500 3.135 2.974 3.218 . 0 0 "[ . 1 . 2]" 1
1946 1 78 GLU H 1 79 GLU H . . 3.380 2.263 2.220 2.358 . 0 0 "[ . 1 . 2]" 1
1947 1 78 GLU H 1 80 GLY H . . 4.640 4.418 4.134 4.577 . 0 0 "[ . 1 . 2]" 1
1948 1 78 GLU H 1 81 ARG QD . . 5.340 5.132 4.824 5.341 0.001 19 0 "[ . 1 . 2]" 1
1949 1 78 GLU HA 1 78 GLU QG . . 3.160 2.185 2.078 2.326 . 0 0 "[ . 1 . 2]" 1
1950 1 78 GLU HA 1 81 ARG QD . . 4.200 4.242 3.938 4.429 0.229 1 0 "[ . 1 . 2]" 1
1951 1 78 GLU QB 1 79 GLU H . . 3.100 3.046 2.939 3.101 0.001 11 0 "[ . 1 . 2]" 1
1952 1 78 GLU QB 1 81 ARG H . . 5.370 5.318 5.118 5.498 0.128 17 0 "[ . 1 . 2]" 1
1953 1 78 GLU QB 1 82 SER H . . 4.490 4.206 3.980 4.491 0.001 11 0 "[ . 1 . 2]" 1
1954 1 78 GLU QG 1 79 GLU H . . 4.850 4.491 4.418 4.536 . 0 0 "[ . 1 . 2]" 1
1955 1 78 GLU QG 1 81 ARG QD . . 5.060 4.812 4.202 5.012 . 0 0 "[ . 1 . 2]" 1
1956 1 78 GLU QG 1 82 SER H . . 5.500 4.525 4.003 5.201 . 0 0 "[ . 1 . 2]" 1
1957 1 79 GLU H 1 79 GLU HB2 . . 2.940 2.314 2.183 2.449 . 0 0 "[ . 1 . 2]" 1
1958 1 79 GLU H 1 79 GLU HB3 . . 3.070 2.838 2.690 3.052 . 0 0 "[ . 1 . 2]" 1
1959 1 79 GLU H 1 79 GLU HG2 . . 4.940 4.575 4.199 4.699 . 0 0 "[ . 1 . 2]" 1
1960 1 79 GLU H 1 79 GLU QG . . 4.220 4.003 3.885 4.085 . 0 0 "[ . 1 . 2]" 1
1961 1 79 GLU H 1 79 GLU HG3 . . 4.940 4.439 4.283 4.581 . 0 0 "[ . 1 . 2]" 1
1962 1 79 GLU H 1 80 GLY H . . 3.180 2.667 2.471 2.744 . 0 0 "[ . 1 . 2]" 1
1963 1 79 GLU H 1 80 GLY HA2 . . 5.380 5.245 5.146 5.310 . 0 0 "[ . 1 . 2]" 1
1964 1 79 GLU H 1 80 GLY HA3 . . 5.230 4.889 4.820 4.972 . 0 0 "[ . 1 . 2]" 1
1965 1 79 GLU H 1 81 ARG H . . 4.590 3.838 3.735 4.059 . 0 0 "[ . 1 . 2]" 1
1966 1 79 GLU HA 1 79 GLU HG2 . . 3.640 3.293 2.193 3.667 0.027 5 0 "[ . 1 . 2]" 1
1967 1 79 GLU HA 1 79 GLU QG . . 3.160 2.306 2.081 2.561 . 0 0 "[ . 1 . 2]" 1
1968 1 79 GLU HA 1 79 GLU HG3 . . 3.640 2.585 2.099 3.628 . 0 0 "[ . 1 . 2]" 1
1969 1 79 GLU HA 1 80 GLY HA2 . . 5.310 4.725 4.609 4.761 . 0 0 "[ . 1 . 2]" 1
1970 1 79 GLU HB2 1 80 GLY H . . 3.500 3.385 3.115 3.693 0.193 19 0 "[ . 1 . 2]" 1
1971 1 79 GLU HB3 1 80 GLY H . . 3.450 2.232 2.032 2.814 . 0 0 "[ . 1 . 2]" 1
1972 1 79 GLU QG 1 80 GLY H . . 4.210 3.865 3.486 4.208 . 0 0 "[ . 1 . 2]" 1
1973 1 80 GLY H 1 81 ARG H . . 3.040 2.650 2.323 2.801 . 0 0 "[ . 1 . 2]" 1
1974 1 80 GLY H 1 81 ARG HG2 . . 5.500 5.469 5.376 5.503 0.003 11 0 "[ . 1 . 2]" 1
1975 1 80 GLY H 1 81 ARG HG3 . . 4.160 4.214 4.036 4.393 0.233 17 0 "[ . 1 . 2]" 1
1976 1 81 ARG H 1 81 ARG HB2 . . 3.920 2.600 2.416 2.707 . 0 0 "[ . 1 . 2]" 1
1977 1 81 ARG H 1 81 ARG HB3 . . 3.790 3.622 3.578 3.650 . 0 0 "[ . 1 . 2]" 1
1978 1 81 ARG H 1 81 ARG QD . . 4.270 3.896 3.726 4.031 . 0 0 "[ . 1 . 2]" 1
1979 1 81 ARG H 1 81 ARG HG2 . . 3.680 3.211 2.998 3.386 . 0 0 "[ . 1 . 2]" 1
1980 1 81 ARG H 1 81 ARG HG3 . . 2.920 2.200 2.028 2.419 . 0 0 "[ . 1 . 2]" 1
1981 1 81 ARG H 1 82 SER H . . 3.500 2.617 2.497 2.727 . 0 0 "[ . 1 . 2]" 1
1982 1 81 ARG H 1 82 SER HA . . 5.350 4.819 4.674 5.304 . 0 0 "[ . 1 . 2]" 1
1983 1 81 ARG HA 1 81 ARG QD . . 4.620 4.221 3.973 4.318 . 0 0 "[ . 1 . 2]" 1
1984 1 81 ARG HA 1 81 ARG HG2 . . 3.720 2.602 2.372 2.739 . 0 0 "[ . 1 . 2]" 1
1985 1 81 ARG HA 1 81 ARG HG3 . . 4.140 3.309 3.176 3.392 . 0 0 "[ . 1 . 2]" 1
1986 1 81 ARG HB2 1 81 ARG QD . . 2.980 2.488 2.265 2.635 . 0 0 "[ . 1 . 2]" 1
1987 1 81 ARG HB2 1 82 SER H . . 3.910 2.242 2.018 2.902 . 0 0 "[ . 1 . 2]" 1
1988 1 81 ARG HB3 1 81 ARG QD . . 3.530 2.706 2.176 2.881 . 0 0 "[ . 1 . 2]" 1
1989 1 81 ARG HB3 1 81 ARG HG2 . . 2.880 2.495 2.418 2.555 . 0 0 "[ . 1 . 2]" 1
1990 1 81 ARG HB3 1 82 SER H . . 4.070 3.478 3.278 3.819 . 0 0 "[ . 1 . 2]" 1
1991 1 81 ARG QD 1 82 SER H . . 5.110 4.465 4.075 5.092 . 0 0 "[ . 1 . 2]" 1
1992 1 81 ARG HG2 1 82 SER H . . 5.500 4.704 4.624 5.020 . 0 0 "[ . 1 . 2]" 1
1993 1 81 ARG HG3 1 82 SER H . . 4.550 3.929 3.754 4.478 . 0 0 "[ . 1 . 2]" 1
1994 1 82 SER H 1 82 SER QB . . 3.450 2.922 2.107 3.153 . 0 0 "[ . 1 . 2]" 1
1995 1 83 SER QB 1 84 ARG H . . 5.230 2.971 2.177 3.916 . 0 0 "[ . 1 . 2]" 1
1996 1 84 ARG H 1 84 ARG QG . . 4.440 3.504 2.172 4.253 . 0 0 "[ . 1 . 2]" 1
1997 1 84 ARG HA 1 84 ARG QD . . 4.990 3.449 2.275 4.206 . 0 0 "[ . 1 . 2]" 1
1998 1 84 ARG HA 1 84 ARG QG . . 3.820 2.314 2.027 3.335 . 0 0 "[ . 1 . 2]" 1
1999 1 84 ARG QB 1 84 ARG QD . . 3.100 2.099 1.941 2.457 . 0 0 "[ . 1 . 2]" 1
2000 1 84 ARG HB2 1 84 ARG QD . . 3.670 2.596 1.977 3.471 . 0 0 "[ . 1 . 2]" 1
2001 1 84 ARG HB3 1 84 ARG QD . . 3.670 2.522 2.006 3.364 . 0 0 "[ . 1 . 2]" 1
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