Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
556049 | 2lvs RC | 18589 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lvs
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 1373
_Distance_constraint_stats_list.Viol_count 1208
_Distance_constraint_stats_list.Viol_total 379.053
_Distance_constraint_stats_list.Viol_max 0.212
_Distance_constraint_stats_list.Viol_rms 0.0059
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0007
_Distance_constraint_stats_list.Viol_average_violations_only 0.0157
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 3 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 ASN 0.007 0.007 20 0 "[ . 1 . 2]"
1 6 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 SER 0.044 0.019 20 0 "[ . 1 . 2]"
1 8 LEU 0.105 0.019 10 0 "[ . 1 . 2]"
1 9 ASP 0.408 0.131 1 0 "[ . 1 . 2]"
1 10 ILE 0.727 0.131 1 0 "[ . 1 . 2]"
1 11 VAL 0.022 0.019 20 0 "[ . 1 . 2]"
1 12 GLU 0.131 0.017 18 0 "[ . 1 . 2]"
1 13 LYS 0.778 0.044 19 0 "[ . 1 . 2]"
1 14 LEU 1.498 0.119 9 0 "[ . 1 . 2]"
1 15 TYR 0.565 0.042 10 0 "[ . 1 . 2]"
1 16 LYS 2.310 0.139 9 0 "[ . 1 . 2]"
1 17 ASP 0.438 0.057 9 0 "[ . 1 . 2]"
1 18 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 VAL 0.945 0.119 9 0 "[ . 1 . 2]"
1 20 PRO 1.190 0.081 9 0 "[ . 1 . 2]"
1 21 VAL 0.004 0.002 9 0 "[ . 1 . 2]"
1 22 LYS 0.706 0.081 9 0 "[ . 1 . 2]"
1 23 GLU 0.008 0.005 12 0 "[ . 1 . 2]"
1 24 ILE 1.445 0.093 9 0 "[ . 1 . 2]"
1 25 ALA 0.629 0.041 12 0 "[ . 1 . 2]"
1 26 LYS 0.279 0.021 17 0 "[ . 1 . 2]"
1 27 ARG 0.388 0.030 17 0 "[ . 1 . 2]"
1 28 SER 0.011 0.009 12 0 "[ . 1 . 2]"
1 29 ASN 0.226 0.021 17 0 "[ . 1 . 2]"
1 30 ASN 0.498 0.020 12 0 "[ . 1 . 2]"
1 31 SER 0.008 0.003 17 0 "[ . 1 . 2]"
1 32 MET 0.065 0.016 9 0 "[ . 1 . 2]"
1 33 SER 0.170 0.017 18 0 "[ . 1 . 2]"
1 34 THR 2.346 0.081 18 0 "[ . 1 . 2]"
1 35 VAL 3.275 0.085 12 0 "[ . 1 . 2]"
1 36 TYR 2.713 0.085 12 0 "[ . 1 . 2]"
1 37 LYS 0.067 0.025 8 0 "[ . 1 . 2]"
1 38 ALA 0.577 0.071 8 0 "[ . 1 . 2]"
1 39 LEU 0.669 0.030 15 0 "[ . 1 . 2]"
1 40 GLU 0.165 0.025 8 0 "[ . 1 . 2]"
1 41 LYS 0.420 0.110 8 0 "[ . 1 . 2]"
1 42 LEU 0.664 0.026 8 0 "[ . 1 . 2]"
1 43 GLU 0.081 0.011 6 0 "[ . 1 . 2]"
1 44 ALA 0.037 0.012 10 0 "[ . 1 . 2]"
1 45 MET 0.235 0.019 8 0 "[ . 1 . 2]"
1 46 GLY 0.022 0.004 11 0 "[ . 1 . 2]"
1 47 ARG 0.357 0.026 8 0 "[ . 1 . 2]"
1 48 ILE 1.322 0.041 7 0 "[ . 1 . 2]"
1 49 LYS 0.011 0.004 15 0 "[ . 1 . 2]"
1 50 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 LEU 0.687 0.065 14 0 "[ . 1 . 2]"
1 62 THR 0.663 0.212 20 0 "[ . 1 . 2]"
1 63 GLU 0.258 0.153 20 0 "[ . 1 . 2]"
1 64 GLU 0.302 0.212 20 0 "[ . 1 . 2]"
1 65 GLU 0.490 0.065 14 0 "[ . 1 . 2]"
1 66 LEU 0.151 0.052 3 0 "[ . 1 . 2]"
1 67 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 THR 0.125 0.020 3 0 "[ . 1 . 2]"
1 69 ILE 0.145 0.033 3 0 "[ . 1 . 2]"
1 70 ARG 0.195 0.019 2 0 "[ . 1 . 2]"
1 71 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 LEU 0.094 0.011 9 0 "[ . 1 . 2]"
1 73 TYR 0.042 0.014 14 0 "[ . 1 . 2]"
1 74 LEU 0.211 0.019 2 0 "[ . 1 . 2]"
1 75 LYS 0.008 0.005 4 0 "[ . 1 . 2]"
1 76 GLY 0.003 0.003 4 0 "[ . 1 . 2]"
1 77 ALA 0.082 0.011 9 0 "[ . 1 . 2]"
1 78 THR 0.005 0.005 13 0 "[ . 1 . 2]"
1 79 VAL 0.008 0.002 7 0 "[ . 1 . 2]"
1 80 TYR 0.010 0.005 13 0 "[ . 1 . 2]"
1 81 GLU 0.041 0.015 12 0 "[ . 1 . 2]"
1 82 ILE 0.393 0.043 14 0 "[ . 1 . 2]"
1 83 ALA 0.266 0.029 15 0 "[ . 1 . 2]"
1 84 ARG 0.013 0.003 18 0 "[ . 1 . 2]"
1 85 GLN 0.053 0.004 14 0 "[ . 1 . 2]"
1 86 LEU 0.373 0.045 7 0 "[ . 1 . 2]"
1 87 GLY 0.235 0.021 15 0 "[ . 1 . 2]"
1 88 ARG 0.535 0.048 13 0 "[ . 1 . 2]"
1 91 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 THR 0.226 0.048 13 0 "[ . 1 . 2]"
1 93 ILE 0.602 0.043 14 0 "[ . 1 . 2]"
1 94 TYR 0.051 0.014 5 0 "[ . 1 . 2]"
1 95 TYR 0.478 0.126 16 0 "[ . 1 . 2]"
1 96 ALA 0.238 0.033 3 0 "[ . 1 . 2]"
1 97 LEU 0.148 0.063 7 0 "[ . 1 . 2]"
1 98 LYS 0.298 0.073 5 0 "[ . 1 . 2]"
1 99 LYS 0.433 0.126 16 0 "[ . 1 . 2]"
1 100 LEU 0.408 0.122 5 0 "[ . 1 . 2]"
1 101 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 LEU 0.506 0.122 5 0 "[ . 1 . 2]"
1 103 LYS 0.112 0.027 5 0 "[ . 1 . 2]"
1 104 LEU 0.430 0.073 5 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 PRO HB2 1 4 VAL QG . . 3.160 2.967 2.653 3.156 . 0 0 "[ . 1 . 2]" 1
2 1 2 PRO HB2 1 5 ASN HA . . 4.820 4.617 4.292 4.820 . 0 0 "[ . 1 . 2]" 1
3 1 2 PRO HB2 1 5 ASN HB2 . . 4.530 2.514 2.022 3.180 . 0 0 "[ . 1 . 2]" 1
4 1 2 PRO HB2 1 5 ASN QB . . 3.980 2.341 1.991 2.645 . 0 0 "[ . 1 . 2]" 1
5 1 2 PRO HB2 1 5 ASN HB3 . . 4.530 3.019 2.463 3.593 . 0 0 "[ . 1 . 2]" 1
6 1 2 PRO HB2 1 6 ASP H . . 4.600 4.275 3.777 4.555 . 0 0 "[ . 1 . 2]" 1
7 1 2 PRO HB3 1 4 VAL QG . . 4.530 3.784 3.605 4.014 . 0 0 "[ . 1 . 2]" 1
8 1 2 PRO HB3 1 5 ASN HB2 . . 4.990 3.698 3.342 4.267 . 0 0 "[ . 1 . 2]" 1
9 1 2 PRO HB3 1 5 ASN QB . . 4.190 3.497 3.214 3.841 . 0 0 "[ . 1 . 2]" 1
10 1 2 PRO HB3 1 5 ASN HB3 . . 4.990 4.420 4.006 4.931 . 0 0 "[ . 1 . 2]" 1
11 1 2 PRO QD 1 5 ASN QB . . 4.740 3.958 3.652 4.466 . 0 0 "[ . 1 . 2]" 1
12 1 2 PRO QG 1 5 ASN QB . . 4.020 2.194 1.893 2.749 . 0 0 "[ . 1 . 2]" 1
13 1 3 SER H 1 4 VAL HA . . 5.030 4.807 4.633 4.980 . 0 0 "[ . 1 . 2]" 1
14 1 3 SER H 1 5 ASN H . . 4.040 3.463 3.165 3.831 . 0 0 "[ . 1 . 2]" 1
15 1 3 SER H 1 5 ASN QB . . 4.920 4.443 4.161 4.834 . 0 0 "[ . 1 . 2]" 1
16 1 4 VAL HA 1 4 VAL QG . . 3.110 2.237 2.163 2.322 . 0 0 "[ . 1 . 2]" 1
17 1 4 VAL HA 1 6 ASP H . . 4.500 4.000 3.724 4.253 . 0 0 "[ . 1 . 2]" 1
18 1 4 VAL HB 1 5 ASN H . . 5.110 3.938 3.799 4.057 . 0 0 "[ . 1 . 2]" 1
19 1 4 VAL QG 1 5 ASN H . . 5.120 2.092 1.920 2.264 . 0 0 "[ . 1 . 2]" 1
20 1 4 VAL QG 1 5 ASN HA . . 4.130 3.173 3.060 3.348 . 0 0 "[ . 1 . 2]" 1
21 1 4 VAL QG 1 5 ASN QB . . 3.890 3.092 2.899 3.239 . 0 0 "[ . 1 . 2]" 1
22 1 4 VAL QG 1 6 ASP H . . 4.670 4.049 3.906 4.302 . 0 0 "[ . 1 . 2]" 1
23 1 5 ASN HA 1 8 LEU H . . 3.760 3.308 3.141 3.530 . 0 0 "[ . 1 . 2]" 1
24 1 5 ASN HA 1 8 LEU HB3 . . 4.750 3.450 2.903 4.058 . 0 0 "[ . 1 . 2]" 1
25 1 5 ASN HA 1 8 LEU QD . . 4.400 3.498 2.745 4.119 . 0 0 "[ . 1 . 2]" 1
26 1 5 ASN HA 1 8 LEU HG . . 4.440 4.173 3.786 4.447 0.007 20 0 "[ . 1 . 2]" 1
27 1 5 ASN QB 1 8 LEU H . . 5.340 4.902 4.733 5.105 . 0 0 "[ . 1 . 2]" 1
28 1 5 ASN QB 1 8 LEU QD . . 5.240 4.793 3.940 5.234 . 0 0 "[ . 1 . 2]" 1
29 1 6 ASP H 1 7 SER H . . 4.270 2.800 2.575 2.919 . 0 0 "[ . 1 . 2]" 1
30 1 6 ASP H 1 8 LEU H . . 5.190 4.062 3.926 4.213 . 0 0 "[ . 1 . 2]" 1
31 1 7 SER H 1 7 SER QB . . 3.460 2.375 2.064 2.884 . 0 0 "[ . 1 . 2]" 1
32 1 7 SER H 1 8 LEU H . . 4.110 2.627 2.533 2.752 . 0 0 "[ . 1 . 2]" 1
33 1 7 SER H 1 8 LEU HB3 . . 5.500 5.472 5.355 5.510 0.010 20 0 "[ . 1 . 2]" 1
34 1 7 SER H 1 10 ILE MD . . 4.440 3.878 3.744 4.041 . 0 0 "[ . 1 . 2]" 1
35 1 7 SER HA 1 9 ASP H . . 4.270 4.053 3.883 4.191 . 0 0 "[ . 1 . 2]" 1
36 1 7 SER HA 1 10 ILE H . . 4.220 3.399 3.152 3.563 . 0 0 "[ . 1 . 2]" 1
37 1 7 SER HA 1 10 ILE HB . . 4.480 3.313 2.857 3.563 . 0 0 "[ . 1 . 2]" 1
38 1 7 SER HA 1 10 ILE MG . . 4.830 4.633 4.273 4.830 0.000 8 0 "[ . 1 . 2]" 1
39 1 7 SER HA 1 11 VAL H . . 4.670 4.375 3.981 4.689 0.019 20 0 "[ . 1 . 2]" 1
40 1 8 LEU H 1 8 LEU HB2 . . 3.540 2.087 2.051 2.179 . 0 0 "[ . 1 . 2]" 1
41 1 8 LEU H 1 8 LEU HB3 . . 3.170 3.067 2.893 3.157 . 0 0 "[ . 1 . 2]" 1
42 1 8 LEU H 1 9 ASP H . . 3.400 2.711 2.584 2.745 . 0 0 "[ . 1 . 2]" 1
43 1 8 LEU H 1 9 ASP HA . . 5.500 5.299 5.184 5.329 . 0 0 "[ . 1 . 2]" 1
44 1 8 LEU H 1 9 ASP HB3 . . 5.500 5.203 4.943 5.477 . 0 0 "[ . 1 . 2]" 1
45 1 8 LEU H 1 10 ILE H . . 4.260 4.193 4.144 4.248 . 0 0 "[ . 1 . 2]" 1
46 1 8 LEU H 1 10 ILE MD . . 4.140 4.121 3.995 4.159 0.019 10 0 "[ . 1 . 2]" 1
47 1 8 LEU HA 1 8 LEU QD . . 3.060 2.085 1.912 2.468 . 0 0 "[ . 1 . 2]" 1
48 1 8 LEU HA 1 10 ILE H . . 4.260 4.023 3.936 4.166 . 0 0 "[ . 1 . 2]" 1
49 1 8 LEU HA 1 11 VAL H . . 3.920 3.378 3.163 3.730 . 0 0 "[ . 1 . 2]" 1
50 1 8 LEU HA 1 12 GLU H . . 4.080 3.718 3.625 3.926 . 0 0 "[ . 1 . 2]" 1
51 1 8 LEU HB2 1 8 LEU QD . . 3.000 2.241 2.130 2.371 . 0 0 "[ . 1 . 2]" 1
52 1 8 LEU HB2 1 9 ASP H . . 3.710 3.484 3.335 3.613 . 0 0 "[ . 1 . 2]" 1
53 1 8 LEU HB2 1 9 ASP HA . . 5.500 5.337 5.232 5.444 . 0 0 "[ . 1 . 2]" 1
54 1 8 LEU HB3 1 8 LEU QD . . 3.100 2.225 2.043 2.330 . 0 0 "[ . 1 . 2]" 1
55 1 8 LEU HB3 1 9 ASP H . . 3.010 2.868 2.749 2.980 . 0 0 "[ . 1 . 2]" 1
56 1 8 LEU HB3 1 9 ASP HB2 . . 4.500 4.360 4.181 4.474 . 0 0 "[ . 1 . 2]" 1
57 1 8 LEU QD 1 12 GLU H . . 3.400 3.062 2.704 3.367 . 0 0 "[ . 1 . 2]" 1
58 1 8 LEU QD 1 12 GLU HA . . 4.660 4.071 3.820 4.442 . 0 0 "[ . 1 . 2]" 1
59 1 8 LEU QD 1 12 GLU QB . . 3.870 2.456 2.253 2.718 . 0 0 "[ . 1 . 2]" 1
60 1 8 LEU QD 1 12 GLU HG2 . . 3.480 2.979 2.308 3.365 . 0 0 "[ . 1 . 2]" 1
61 1 8 LEU QD 1 12 GLU HG3 . . 3.960 3.799 3.174 3.962 0.002 19 0 "[ . 1 . 2]" 1
62 1 9 ASP H 1 9 ASP HB3 . . 2.930 2.753 2.443 2.913 . 0 0 "[ . 1 . 2]" 1
63 1 9 ASP H 1 10 ILE H . . 3.090 2.646 2.496 2.722 . 0 0 "[ . 1 . 2]" 1
64 1 9 ASP H 1 11 VAL H . . 4.750 4.361 4.208 4.628 . 0 0 "[ . 1 . 2]" 1
65 1 9 ASP HA 1 10 ILE QG . . 5.340 5.293 5.179 5.471 0.131 1 0 "[ . 1 . 2]" 1
66 1 9 ASP HA 1 11 VAL H . . 5.230 4.877 4.665 5.072 . 0 0 "[ . 1 . 2]" 1
67 1 9 ASP HA 1 12 GLU H . . 4.160 4.022 3.926 4.139 . 0 0 "[ . 1 . 2]" 1
68 1 9 ASP HA 1 12 GLU HG2 . . 3.370 2.437 2.218 2.661 . 0 0 "[ . 1 . 2]" 1
69 1 9 ASP HA 1 12 GLU HG3 . . 4.160 2.673 2.308 2.838 . 0 0 "[ . 1 . 2]" 1
70 1 9 ASP HA 1 13 LYS H . . 4.620 4.227 3.990 4.414 . 0 0 "[ . 1 . 2]" 1
71 1 9 ASP HB2 1 10 ILE MD . . 4.450 4.048 3.615 4.355 . 0 0 "[ . 1 . 2]" 1
72 1 9 ASP HB3 1 10 ILE H . . 3.310 2.846 2.788 2.958 . 0 0 "[ . 1 . 2]" 1
73 1 9 ASP HB3 1 10 ILE HB . . 5.070 4.943 4.888 4.992 . 0 0 "[ . 1 . 2]" 1
74 1 9 ASP HB3 1 10 ILE MD . . 4.490 2.874 2.329 3.172 . 0 0 "[ . 1 . 2]" 1
75 1 9 ASP HB3 1 11 VAL H . . 5.500 5.297 5.119 5.502 0.002 20 0 "[ . 1 . 2]" 1
76 1 10 ILE H 1 10 ILE HB . . 3.000 2.484 2.408 2.516 . 0 0 "[ . 1 . 2]" 1
77 1 10 ILE H 1 10 ILE HG12 . . 4.090 3.981 3.931 4.049 . 0 0 "[ . 1 . 2]" 1
78 1 10 ILE H 1 10 ILE QG . . 3.390 2.931 2.838 3.065 . 0 0 "[ . 1 . 2]" 1
79 1 10 ILE H 1 10 ILE HG13 . . 4.090 3.019 2.905 3.176 . 0 0 "[ . 1 . 2]" 1
80 1 10 ILE H 1 10 ILE MG . . 3.860 3.769 3.743 3.779 . 0 0 "[ . 1 . 2]" 1
81 1 10 ILE H 1 11 VAL H . . 3.320 2.519 2.416 2.692 . 0 0 "[ . 1 . 2]" 1
82 1 10 ILE H 1 12 GLU H . . 4.190 4.039 3.838 4.197 0.007 8 0 "[ . 1 . 2]" 1
83 1 10 ILE H 1 12 GLU HG2 . . 5.130 5.091 4.876 5.147 0.017 18 0 "[ . 1 . 2]" 1
84 1 10 ILE HA 1 10 ILE MD . . 3.630 3.459 3.343 3.542 . 0 0 "[ . 1 . 2]" 1
85 1 10 ILE HA 1 10 ILE HG12 . . 3.660 3.433 3.358 3.540 . 0 0 "[ . 1 . 2]" 1
86 1 10 ILE HA 1 10 ILE QG . . 3.210 2.285 2.209 2.320 . 0 0 "[ . 1 . 2]" 1
87 1 10 ILE HA 1 10 ILE HG13 . . 3.660 2.320 2.238 2.353 . 0 0 "[ . 1 . 2]" 1
88 1 10 ILE HA 1 10 ILE MG . . 3.350 2.347 2.287 2.404 . 0 0 "[ . 1 . 2]" 1
89 1 10 ILE HA 1 13 LYS H . . 3.610 3.402 3.364 3.506 . 0 0 "[ . 1 . 2]" 1
90 1 10 ILE HA 1 13 LYS QB . . 3.370 2.315 2.124 2.497 . 0 0 "[ . 1 . 2]" 1
91 1 10 ILE HA 1 13 LYS QD . . 4.310 2.752 2.221 3.172 . 0 0 "[ . 1 . 2]" 1
92 1 10 ILE HB 1 10 ILE MD . . 3.480 2.178 2.108 2.204 . 0 0 "[ . 1 . 2]" 1
93 1 10 ILE HB 1 11 VAL H . . 3.220 2.431 2.247 2.619 . 0 0 "[ . 1 . 2]" 1
94 1 10 ILE MD 1 13 LYS HD2 . . 5.500 5.358 4.896 5.543 0.043 1 0 "[ . 1 . 2]" 1
95 1 10 ILE MD 1 13 LYS HD3 . . 5.500 5.219 4.709 5.542 0.042 1 0 "[ . 1 . 2]" 1
96 1 10 ILE QG 1 11 VAL H . . 4.410 4.267 4.201 4.365 . 0 0 "[ . 1 . 2]" 1
97 1 10 ILE HG12 1 11 VAL H . . 5.110 5.006 4.886 5.101 . 0 0 "[ . 1 . 2]" 1
98 1 10 ILE HG13 1 11 VAL H . . 5.110 4.627 4.561 4.744 . 0 0 "[ . 1 . 2]" 1
99 1 10 ILE MG 1 13 LYS H . . 4.690 4.495 4.412 4.629 . 0 0 "[ . 1 . 2]" 1
100 1 10 ILE MG 1 13 LYS QB . . 3.820 3.465 3.170 3.767 . 0 0 "[ . 1 . 2]" 1
101 1 10 ILE MG 1 13 LYS QD . . 4.310 3.733 1.978 4.311 0.001 14 0 "[ . 1 . 2]" 1
102 1 11 VAL H 1 12 GLU H . . 3.590 2.822 2.782 2.891 . 0 0 "[ . 1 . 2]" 1
103 1 12 GLU H 1 12 GLU QB . . 2.900 2.446 2.356 2.577 . 0 0 "[ . 1 . 2]" 1
104 1 12 GLU H 1 12 GLU HG2 . . 3.390 3.202 2.847 3.403 0.013 20 0 "[ . 1 . 2]" 1
105 1 12 GLU H 1 12 GLU HG3 . . 2.960 2.330 2.022 2.492 . 0 0 "[ . 1 . 2]" 1
106 1 12 GLU H 1 13 LYS H . . 3.150 2.567 2.524 2.660 . 0 0 "[ . 1 . 2]" 1
107 1 12 GLU H 1 14 LEU H . . 4.510 4.124 4.015 4.273 . 0 0 "[ . 1 . 2]" 1
108 1 12 GLU H 1 14 LEU HB2 . . 5.500 5.163 4.999 5.380 . 0 0 "[ . 1 . 2]" 1
109 1 12 GLU H 1 15 TYR H . . 5.500 5.094 4.944 5.243 . 0 0 "[ . 1 . 2]" 1
110 1 12 GLU H 1 39 LEU MD2 . . 4.960 4.708 4.351 4.966 0.006 18 0 "[ . 1 . 2]" 1
111 1 12 GLU H 1 48 ILE MG . . 5.380 4.618 4.259 5.027 . 0 0 "[ . 1 . 2]" 1
112 1 12 GLU HA 1 12 GLU HG3 . . 3.740 3.607 3.563 3.648 . 0 0 "[ . 1 . 2]" 1
113 1 12 GLU HA 1 13 LYS HA . . 5.100 4.808 4.742 4.883 . 0 0 "[ . 1 . 2]" 1
114 1 12 GLU HA 1 15 TYR HB3 . . 3.830 3.062 2.922 3.161 . 0 0 "[ . 1 . 2]" 1
115 1 12 GLU HA 1 16 LYS H . . 4.450 3.949 3.623 4.429 . 0 0 "[ . 1 . 2]" 1
116 1 12 GLU HA 1 39 LEU MD2 . . 4.760 2.913 2.369 3.218 . 0 0 "[ . 1 . 2]" 1
117 1 12 GLU HA 1 42 LEU QD . . 3.930 2.747 2.128 3.579 . 0 0 "[ . 1 . 2]" 1
118 1 12 GLU HA 1 48 ILE MG . . 4.760 2.762 2.079 3.574 . 0 0 "[ . 1 . 2]" 1
119 1 12 GLU QB 1 42 LEU QD . . 3.280 1.694 1.624 1.798 . 0 0 "[ . 1 . 2]" 1
120 1 12 GLU QB 1 48 ILE MG . . 4.310 1.962 1.883 2.185 . 0 0 "[ . 1 . 2]" 1
121 1 12 GLU HG2 1 42 LEU HB3 . . 5.300 5.056 4.536 5.306 0.006 17 0 "[ . 1 . 2]" 1
122 1 12 GLU HG2 1 48 ILE MG . . 5.050 3.972 3.611 4.243 . 0 0 "[ . 1 . 2]" 1
123 1 13 LYS H 1 13 LYS HB2 . . 3.420 2.281 2.063 3.410 . 0 0 "[ . 1 . 2]" 1
124 1 13 LYS H 1 13 LYS QB . . 2.820 2.107 2.041 2.232 . 0 0 "[ . 1 . 2]" 1
125 1 13 LYS H 1 13 LYS HB3 . . 3.420 3.108 2.102 3.426 0.006 9 0 "[ . 1 . 2]" 1
126 1 13 LYS H 1 13 LYS QG . . 4.250 3.397 3.074 3.956 . 0 0 "[ . 1 . 2]" 1
127 1 13 LYS H 1 14 LEU H . . 3.320 2.625 2.494 2.763 . 0 0 "[ . 1 . 2]" 1
128 1 13 LYS H 1 14 LEU HA . . 5.500 5.237 5.130 5.350 . 0 0 "[ . 1 . 2]" 1
129 1 13 LYS H 1 14 LEU HB2 . . 4.900 4.516 4.311 4.759 . 0 0 "[ . 1 . 2]" 1
130 1 13 LYS H 1 14 LEU QD . . 4.000 3.856 3.603 4.036 0.036 17 0 "[ . 1 . 2]" 1
131 1 13 LYS H 1 15 TYR H . . 4.920 4.430 4.294 4.529 . 0 0 "[ . 1 . 2]" 1
132 1 13 LYS H 1 15 TYR HB3 . . 5.500 5.513 5.463 5.542 0.042 10 0 "[ . 1 . 2]" 1
133 1 13 LYS HA 1 13 LYS HD2 . . 5.500 4.349 3.681 4.591 . 0 0 "[ . 1 . 2]" 1
134 1 13 LYS HA 1 13 LYS QD . . 4.760 3.932 3.494 4.283 . 0 0 "[ . 1 . 2]" 1
135 1 13 LYS HA 1 13 LYS HD3 . . 5.500 4.514 4.269 5.218 . 0 0 "[ . 1 . 2]" 1
136 1 13 LYS HA 1 13 LYS HG2 . . 3.640 2.897 2.463 3.684 0.044 19 0 "[ . 1 . 2]" 1
137 1 13 LYS HA 1 13 LYS HG3 . . 3.640 2.459 2.043 3.508 . 0 0 "[ . 1 . 2]" 1
138 1 13 LYS QB 1 13 LYS QD . . 2.900 2.091 1.989 2.130 . 0 0 "[ . 1 . 2]" 1
139 1 13 LYS QB 1 14 LEU QD . . 3.460 2.837 2.537 3.502 0.042 19 0 "[ . 1 . 2]" 1
140 1 13 LYS QE 1 13 LYS QG . . 3.250 2.103 1.986 2.194 . 0 0 "[ . 1 . 2]" 1
141 1 14 LEU H 1 14 LEU HB2 . . 3.590 2.146 2.082 2.246 . 0 0 "[ . 1 . 2]" 1
142 1 14 LEU H 1 14 LEU QD . . 2.860 2.270 1.944 2.484 . 0 0 "[ . 1 . 2]" 1
143 1 14 LEU H 1 15 TYR H . . 3.580 2.651 2.572 2.690 . 0 0 "[ . 1 . 2]" 1
144 1 14 LEU H 1 16 LYS H . . 5.050 4.258 4.121 4.412 . 0 0 "[ . 1 . 2]" 1
145 1 14 LEU H 1 17 ASP H . . 5.060 4.586 4.516 4.650 . 0 0 "[ . 1 . 2]" 1
146 1 14 LEU H 1 39 LEU MD2 . . 5.500 5.324 5.002 5.504 0.004 20 0 "[ . 1 . 2]" 1
147 1 14 LEU HA 1 14 LEU MD1 . . 3.890 2.062 1.949 2.274 . 0 0 "[ . 1 . 2]" 1
148 1 14 LEU HA 1 14 LEU QD . . 2.820 1.994 1.857 2.257 . 0 0 "[ . 1 . 2]" 1
149 1 14 LEU HA 1 14 LEU MD2 . . 3.890 2.807 2.270 3.790 . 0 0 "[ . 1 . 2]" 1
150 1 14 LEU HA 1 14 LEU HG . . 3.890 3.411 2.606 3.696 . 0 0 "[ . 1 . 2]" 1
151 1 14 LEU HA 1 18 GLY H . . 5.500 4.551 4.452 4.692 . 0 0 "[ . 1 . 2]" 1
152 1 14 LEU HA 1 24 ILE HG12 . . 5.070 4.791 4.603 5.057 . 0 0 "[ . 1 . 2]" 1
153 1 14 LEU HB2 1 15 TYR H . . 4.050 2.670 2.592 2.740 . 0 0 "[ . 1 . 2]" 1
154 1 14 LEU HB2 1 17 ASP H . . 5.500 5.420 5.318 5.483 . 0 0 "[ . 1 . 2]" 1
155 1 14 LEU HB2 1 19 VAL HB . . 4.090 3.796 3.469 4.056 . 0 0 "[ . 1 . 2]" 1
156 1 14 LEU HB2 1 24 ILE HA . . 4.280 4.138 3.939 4.292 0.012 3 0 "[ . 1 . 2]" 1
157 1 14 LEU HB2 1 24 ILE MD . . 4.380 4.071 3.492 4.359 . 0 0 "[ . 1 . 2]" 1
158 1 14 LEU HB2 1 24 ILE HG12 . . 3.960 2.925 2.404 3.221 . 0 0 "[ . 1 . 2]" 1
159 1 14 LEU HB2 1 24 ILE HG13 . . 4.820 4.539 4.093 4.821 0.001 1 0 "[ . 1 . 2]" 1
160 1 14 LEU HB2 1 24 ILE MG . . 3.810 3.034 2.840 3.268 . 0 0 "[ . 1 . 2]" 1
161 1 14 LEU HB3 1 14 LEU MD1 . . 3.430 2.550 2.278 3.181 . 0 0 "[ . 1 . 2]" 1
162 1 14 LEU HB3 1 14 LEU MD2 . . 3.430 3.007 2.460 3.195 . 0 0 "[ . 1 . 2]" 1
163 1 14 LEU HB3 1 15 TYR H . . 3.470 3.005 2.750 3.275 . 0 0 "[ . 1 . 2]" 1
164 1 14 LEU HB3 1 15 TYR HA . . 5.210 3.930 3.806 4.092 . 0 0 "[ . 1 . 2]" 1
165 1 14 LEU HB3 1 15 TYR HB2 . . 5.170 4.630 4.354 4.961 . 0 0 "[ . 1 . 2]" 1
166 1 14 LEU HB3 1 19 VAL H . . 4.740 4.398 4.098 4.628 . 0 0 "[ . 1 . 2]" 1
167 1 14 LEU HB3 1 19 VAL HB . . 3.710 2.195 1.992 2.393 . 0 0 "[ . 1 . 2]" 1
168 1 14 LEU HB3 1 24 ILE MG . . 3.700 3.490 3.102 3.714 0.014 12 0 "[ . 1 . 2]" 1
169 1 14 LEU QD 1 17 ASP H . . 5.390 4.625 4.419 5.000 . 0 0 "[ . 1 . 2]" 1
170 1 14 LEU QD 1 19 VAL HA . . 4.940 4.762 4.451 5.059 0.119 9 0 "[ . 1 . 2]" 1
171 1 14 LEU QD 1 19 VAL HB . . 3.630 3.286 2.892 3.523 . 0 0 "[ . 1 . 2]" 1
172 1 14 LEU QD 1 27 ARG QB . . 3.250 2.907 1.825 3.279 0.029 18 0 "[ . 1 . 2]" 1
173 1 14 LEU QD 1 27 ARG QD . . 3.500 2.651 1.959 3.498 . 0 0 "[ . 1 . 2]" 1
174 1 14 LEU MD1 1 27 ARG HD2 . . 5.370 3.478 2.129 5.132 . 0 0 "[ . 1 . 2]" 1
175 1 14 LEU MD1 1 27 ARG HD3 . . 5.370 3.533 2.520 4.843 . 0 0 "[ . 1 . 2]" 1
176 1 14 LEU MD2 1 27 ARG HD2 . . 5.370 4.108 2.082 5.371 0.001 20 0 "[ . 1 . 2]" 1
177 1 14 LEU MD2 1 27 ARG HD3 . . 5.370 3.955 2.448 5.364 . 0 0 "[ . 1 . 2]" 1
178 1 14 LEU HG 1 24 ILE HA . . 4.100 3.858 3.449 4.193 0.093 9 0 "[ . 1 . 2]" 1
179 1 14 LEU HG 1 24 ILE HG12 . . 4.630 3.979 3.534 4.400 . 0 0 "[ . 1 . 2]" 1
180 1 15 TYR H 1 15 TYR HB2 . . 3.030 2.566 2.500 2.660 . 0 0 "[ . 1 . 2]" 1
181 1 15 TYR H 1 15 TYR QD . . 4.240 4.192 4.168 4.199 . 0 0 "[ . 1 . 2]" 1
182 1 15 TYR H 1 16 LYS H . . 3.660 2.844 2.754 2.933 . 0 0 "[ . 1 . 2]" 1
183 1 15 TYR H 1 17 ASP H . . 4.180 3.839 3.767 3.971 . 0 0 "[ . 1 . 2]" 1
184 1 15 TYR H 1 24 ILE MD . . 3.810 3.110 2.861 3.252 . 0 0 "[ . 1 . 2]" 1
185 1 15 TYR H 1 24 ILE MG . . 3.630 3.623 3.553 3.668 0.038 6 0 "[ . 1 . 2]" 1
186 1 15 TYR H 1 39 LEU MD2 . . 4.500 3.651 3.426 3.805 . 0 0 "[ . 1 . 2]" 1
187 1 15 TYR H 1 48 ILE MG . . 5.370 4.409 3.987 4.754 . 0 0 "[ . 1 . 2]" 1
188 1 15 TYR HA 1 15 TYR QD . . 3.490 2.958 2.755 3.073 . 0 0 "[ . 1 . 2]" 1
189 1 15 TYR HA 1 19 VAL H . . 3.110 2.516 2.300 2.817 . 0 0 "[ . 1 . 2]" 1
190 1 15 TYR HA 1 19 VAL HB . . 4.510 2.884 2.667 3.138 . 0 0 "[ . 1 . 2]" 1
191 1 15 TYR HA 1 24 ILE MD . . 3.280 2.120 1.971 2.484 . 0 0 "[ . 1 . 2]" 1
192 1 15 TYR HA 1 24 ILE HG13 . . 5.500 4.198 3.970 4.432 . 0 0 "[ . 1 . 2]" 1
193 1 15 TYR HB2 1 19 VAL HB . . 5.180 4.475 4.295 4.679 . 0 0 "[ . 1 . 2]" 1
194 1 15 TYR HB2 1 19 VAL MG1 . . 5.500 5.217 5.096 5.402 . 0 0 "[ . 1 . 2]" 1
195 1 15 TYR HB2 1 24 ILE MD . . 3.660 1.926 1.884 2.021 . 0 0 "[ . 1 . 2]" 1
196 1 15 TYR HB2 1 24 ILE HG13 . . 4.710 4.507 4.359 4.719 0.009 9 0 "[ . 1 . 2]" 1
197 1 15 TYR HB2 1 39 LEU HB3 . . 5.190 4.638 4.354 4.893 . 0 0 "[ . 1 . 2]" 1
198 1 15 TYR HB2 1 39 LEU MD2 . . 4.160 1.933 1.885 1.968 . 0 0 "[ . 1 . 2]" 1
199 1 15 TYR HB2 1 39 LEU HG . . 5.490 4.515 4.393 4.609 . 0 0 "[ . 1 . 2]" 1
200 1 15 TYR HB2 1 48 ILE MD . . 4.950 4.318 3.988 4.620 . 0 0 "[ . 1 . 2]" 1
201 1 15 TYR HB3 1 16 LYS H . . 3.360 2.341 2.269 2.412 . 0 0 "[ . 1 . 2]" 1
202 1 15 TYR HB3 1 16 LYS HA . . 4.540 4.296 4.195 4.375 . 0 0 "[ . 1 . 2]" 1
203 1 15 TYR HB3 1 16 LYS QB . . 4.760 3.902 3.795 3.984 . 0 0 "[ . 1 . 2]" 1
204 1 15 TYR HB3 1 17 ASP H . . 4.860 4.578 4.508 4.713 . 0 0 "[ . 1 . 2]" 1
205 1 15 TYR HB3 1 18 GLY H . . 5.490 5.330 5.267 5.432 . 0 0 "[ . 1 . 2]" 1
206 1 15 TYR HB3 1 19 VAL H . . 5.500 5.314 5.181 5.511 0.011 17 0 "[ . 1 . 2]" 1
207 1 15 TYR HB3 1 19 VAL HB . . 5.500 5.387 5.263 5.527 0.027 9 0 "[ . 1 . 2]" 1
208 1 15 TYR HB3 1 24 ILE MD . . 3.920 3.371 3.247 3.546 . 0 0 "[ . 1 . 2]" 1
209 1 15 TYR HB3 1 39 LEU HB3 . . 5.410 4.599 4.250 4.823 . 0 0 "[ . 1 . 2]" 1
210 1 15 TYR HB3 1 39 LEU MD1 . . 4.420 3.937 3.380 4.242 . 0 0 "[ . 1 . 2]" 1
211 1 15 TYR HB3 1 39 LEU MD2 . . 4.120 2.312 2.097 2.510 . 0 0 "[ . 1 . 2]" 1
212 1 15 TYR HB3 1 39 LEU HG . . 5.500 5.187 4.856 5.435 . 0 0 "[ . 1 . 2]" 1
213 1 15 TYR HB3 1 48 ILE HB . . 4.460 3.701 3.404 4.086 . 0 0 "[ . 1 . 2]" 1
214 1 15 TYR HB3 1 48 ILE MD . . 3.920 3.316 3.027 3.575 . 0 0 "[ . 1 . 2]" 1
215 1 15 TYR QD 1 16 LYS H . . 4.430 2.917 2.690 3.261 . 0 0 "[ . 1 . 2]" 1
216 1 15 TYR QD 1 16 LYS HA . . 4.240 2.936 2.750 3.280 . 0 0 "[ . 1 . 2]" 1
217 1 15 TYR QD 1 21 VAL QG . . 3.720 3.162 2.848 3.348 . 0 0 "[ . 1 . 2]" 1
218 1 15 TYR QD 1 24 ILE MD . . 3.500 2.175 1.995 2.573 . 0 0 "[ . 1 . 2]" 1
219 1 15 TYR QD 1 39 LEU MD2 . . 3.720 2.649 2.479 2.823 . 0 0 "[ . 1 . 2]" 1
220 1 15 TYR QD 1 48 ILE HB . . 3.720 2.170 1.995 2.425 . 0 0 "[ . 1 . 2]" 1
221 1 15 TYR QD 1 48 ILE MD . . 3.460 2.196 1.938 2.427 . 0 0 "[ . 1 . 2]" 1
222 1 16 LYS H 1 16 LYS QB . . 2.880 2.272 2.174 2.320 . 0 0 "[ . 1 . 2]" 1
223 1 16 LYS H 1 17 ASP H . . 3.430 2.643 2.579 2.667 . 0 0 "[ . 1 . 2]" 1
224 1 16 LYS H 1 18 GLY H . . 4.670 4.132 4.070 4.205 . 0 0 "[ . 1 . 2]" 1
225 1 16 LYS H 1 48 ILE MD . . 4.930 4.260 4.116 4.406 . 0 0 "[ . 1 . 2]" 1
226 1 16 LYS H 1 48 ILE MG . . 4.790 3.037 2.675 3.326 . 0 0 "[ . 1 . 2]" 1
227 1 16 LYS HA 1 16 LYS HD2 . . 4.780 4.529 3.822 4.784 0.004 2 0 "[ . 1 . 2]" 1
228 1 16 LYS HA 1 16 LYS QD . . 4.140 3.922 3.565 4.279 0.139 9 0 "[ . 1 . 2]" 1
229 1 16 LYS HA 1 16 LYS HD3 . . 4.780 4.391 3.688 4.859 0.079 1 0 "[ . 1 . 2]" 1
230 1 16 LYS HA 1 18 GLY QA . . 5.320 4.963 4.815 5.067 . 0 0 "[ . 1 . 2]" 1
231 1 16 LYS HA 1 48 ILE MD . . 4.800 4.372 4.218 4.591 . 0 0 "[ . 1 . 2]" 1
232 1 16 LYS QB 1 16 LYS QD . . 3.070 2.067 1.964 2.133 . 0 0 "[ . 1 . 2]" 1
233 1 16 LYS QB 1 48 ILE HB . . 4.370 2.102 1.969 2.410 . 0 0 "[ . 1 . 2]" 1
234 1 16 LYS QB 1 48 ILE MD . . 4.910 3.913 3.733 4.129 . 0 0 "[ . 1 . 2]" 1
235 1 16 LYS QB 1 48 ILE HG12 . . 4.800 4.497 4.461 4.643 . 0 0 "[ . 1 . 2]" 1
236 1 16 LYS QB 1 48 ILE MG . . 4.310 2.349 2.063 2.726 . 0 0 "[ . 1 . 2]" 1
237 1 16 LYS QB 1 49 LYS H . . 5.340 4.121 3.681 4.544 . 0 0 "[ . 1 . 2]" 1
238 1 16 LYS HB2 1 48 ILE HG12 . . 5.500 5.529 5.517 5.541 0.041 7 0 "[ . 1 . 2]" 1
239 1 16 LYS HB3 1 48 ILE HG12 . . 5.500 4.762 4.708 4.985 . 0 0 "[ . 1 . 2]" 1
240 1 16 LYS QD 1 17 ASP H . . 4.170 3.871 3.503 4.227 0.057 9 0 "[ . 1 . 2]" 1
241 1 17 ASP H 1 18 GLY QA . . 4.940 4.366 4.293 4.466 . 0 0 "[ . 1 . 2]" 1
242 1 17 ASP H 1 19 VAL MG2 . . 4.080 4.068 3.954 4.113 0.033 11 0 "[ . 1 . 2]" 1
243 1 18 GLY H 1 19 VAL H . . 3.160 2.029 1.884 2.175 . 0 0 "[ . 1 . 2]" 1
244 1 18 GLY H 1 19 VAL HB . . 4.640 4.199 4.133 4.261 . 0 0 "[ . 1 . 2]" 1
245 1 18 GLY H 1 19 VAL MG2 . . 3.740 3.452 3.309 3.582 . 0 0 "[ . 1 . 2]" 1
246 1 18 GLY QA 1 19 VAL H . . 3.540 2.733 2.639 2.886 . 0 0 "[ . 1 . 2]" 1
247 1 19 VAL H 1 19 VAL HB . . 3.100 2.638 2.523 2.705 . 0 0 "[ . 1 . 2]" 1
248 1 19 VAL H 1 19 VAL MG2 . . 2.780 2.677 2.405 2.794 0.014 12 0 "[ . 1 . 2]" 1
249 1 19 VAL H 1 24 ILE HG12 . . 5.120 4.859 4.805 4.971 . 0 0 "[ . 1 . 2]" 1
250 1 19 VAL HA 1 19 VAL MG1 . . 3.340 2.398 2.388 2.410 . 0 0 "[ . 1 . 2]" 1
251 1 19 VAL HA 1 19 VAL MG2 . . 2.870 2.380 2.332 2.397 . 0 0 "[ . 1 . 2]" 1
252 1 19 VAL HA 1 20 PRO HD3 . . 3.130 2.258 2.257 2.260 . 0 0 "[ . 1 . 2]" 1
253 1 19 VAL HA 1 23 GLU QB . . 4.280 3.991 3.936 4.102 . 0 0 "[ . 1 . 2]" 1
254 1 19 VAL HA 1 24 ILE HG12 . . 5.420 5.296 5.272 5.327 . 0 0 "[ . 1 . 2]" 1
255 1 19 VAL HB 1 20 PRO HA . . 5.500 5.289 5.276 5.308 . 0 0 "[ . 1 . 2]" 1
256 1 19 VAL HB 1 20 PRO HD3 . . 4.930 4.917 4.911 4.923 . 0 0 "[ . 1 . 2]" 1
257 1 19 VAL HB 1 24 ILE H . . 4.870 4.587 4.537 4.677 . 0 0 "[ . 1 . 2]" 1
258 1 19 VAL HB 1 24 ILE MD . . 3.890 2.910 2.557 3.197 . 0 0 "[ . 1 . 2]" 1
259 1 19 VAL HB 1 24 ILE HG12 . . 3.800 2.624 2.585 2.680 . 0 0 "[ . 1 . 2]" 1
260 1 19 VAL MG1 1 20 PRO HD2 . . 3.990 1.929 1.909 1.950 . 0 0 "[ . 1 . 2]" 1
261 1 19 VAL MG1 1 20 PRO HD3 . . 3.430 3.281 3.270 3.292 . 0 0 "[ . 1 . 2]" 1
262 1 19 VAL MG1 1 23 GLU H . . 3.630 3.579 3.529 3.621 . 0 0 "[ . 1 . 2]" 1
263 1 19 VAL MG1 1 23 GLU HA . . 4.460 4.144 4.117 4.198 . 0 0 "[ . 1 . 2]" 1
264 1 19 VAL MG1 1 23 GLU QB . . 2.900 1.896 1.882 1.924 . 0 0 "[ . 1 . 2]" 1
265 1 19 VAL MG1 1 23 GLU HG2 . . 3.470 2.010 1.955 2.131 . 0 0 "[ . 1 . 2]" 1
266 1 19 VAL MG1 1 23 GLU QG . . 2.990 1.911 1.849 1.981 . 0 0 "[ . 1 . 2]" 1
267 1 19 VAL MG1 1 23 GLU HG3 . . 3.470 2.648 2.126 3.349 . 0 0 "[ . 1 . 2]" 1
268 1 19 VAL MG1 1 24 ILE HA . . 4.150 2.962 2.874 3.211 . 0 0 "[ . 1 . 2]" 1
269 1 19 VAL MG1 1 24 ILE HG12 . . 3.100 2.754 2.657 2.812 . 0 0 "[ . 1 . 2]" 1
270 1 19 VAL MG1 1 24 ILE HG13 . . 3.050 1.928 1.914 1.938 . 0 0 "[ . 1 . 2]" 1
271 1 19 VAL MG1 1 27 ARG QD . . 5.340 3.755 2.343 5.161 . 0 0 "[ . 1 . 2]" 1
272 1 20 PRO HA 1 22 LYS QD . . 5.340 4.998 4.723 5.421 0.081 9 0 "[ . 1 . 2]" 1
273 1 20 PRO HA 1 22 LYS QG . . 5.250 4.345 4.135 4.414 . 0 0 "[ . 1 . 2]" 1
274 1 20 PRO HA 1 24 ILE H . . 5.310 5.010 4.976 5.096 . 0 0 "[ . 1 . 2]" 1
275 1 20 PRO HB2 1 21 VAL MG1 . . 5.500 5.285 4.884 5.501 0.001 12 0 "[ . 1 . 2]" 1
276 1 20 PRO HB2 1 21 VAL QG . . 4.690 4.070 3.409 4.476 . 0 0 "[ . 1 . 2]" 1
277 1 20 PRO HB2 1 21 VAL MG2 . . 5.500 4.254 3.479 4.744 . 0 0 "[ . 1 . 2]" 1
278 1 20 PRO HB2 1 22 LYS HB3 . . 4.190 4.156 4.025 4.250 0.060 11 0 "[ . 1 . 2]" 1
279 1 20 PRO HB2 1 22 LYS QG . . 4.310 1.949 1.868 1.984 . 0 0 "[ . 1 . 2]" 1
280 1 20 PRO HB2 1 23 GLU H . . 3.560 2.957 2.928 3.081 . 0 0 "[ . 1 . 2]" 1
281 1 20 PRO HB3 1 21 VAL QG . . 5.440 4.705 4.200 5.035 . 0 0 "[ . 1 . 2]" 1
282 1 20 PRO HD2 1 23 GLU QB . . 3.940 2.353 2.285 2.505 . 0 0 "[ . 1 . 2]" 1
283 1 20 PRO HD2 1 24 ILE HG12 . . 5.500 5.524 5.505 5.543 0.043 7 0 "[ . 1 . 2]" 1
284 1 20 PRO HD3 1 23 GLU QB . . 4.200 3.766 3.706 3.952 . 0 0 "[ . 1 . 2]" 1
285 1 20 PRO QG 1 22 LYS QG . . 5.340 2.448 2.320 2.575 . 0 0 "[ . 1 . 2]" 1
286 1 20 PRO QG 1 23 GLU H . . 3.060 2.415 2.339 2.466 . 0 0 "[ . 1 . 2]" 1
287 1 21 VAL H 1 21 VAL HB . . 4.010 2.972 2.609 3.614 . 0 0 "[ . 1 . 2]" 1
288 1 21 VAL H 1 21 VAL MG1 . . 4.670 3.275 2.293 3.768 . 0 0 "[ . 1 . 2]" 1
289 1 21 VAL H 1 21 VAL QG . . 3.860 1.965 1.826 2.183 . 0 0 "[ . 1 . 2]" 1
290 1 21 VAL H 1 21 VAL MG2 . . 4.670 1.999 1.918 2.197 . 0 0 "[ . 1 . 2]" 1
291 1 21 VAL H 1 22 LYS HB3 . . 5.400 5.257 5.149 5.401 0.001 4 0 "[ . 1 . 2]" 1
292 1 21 VAL H 1 24 ILE H . . 5.150 4.672 4.628 4.766 . 0 0 "[ . 1 . 2]" 1
293 1 21 VAL HA 1 21 VAL MG1 . . 3.400 2.318 2.159 2.392 . 0 0 "[ . 1 . 2]" 1
294 1 21 VAL HA 1 21 VAL QG . . 2.970 2.140 2.051 2.267 . 0 0 "[ . 1 . 2]" 1
295 1 21 VAL HA 1 21 VAL MG2 . . 3.400 2.657 2.307 3.197 . 0 0 "[ . 1 . 2]" 1
296 1 21 VAL HA 1 23 GLU H . . 4.320 4.246 4.222 4.272 . 0 0 "[ . 1 . 2]" 1
297 1 21 VAL HA 1 24 ILE HB . . 3.320 2.469 2.419 2.521 . 0 0 "[ . 1 . 2]" 1
298 1 21 VAL HA 1 24 ILE MD . . 3.210 2.114 1.924 2.408 . 0 0 "[ . 1 . 2]" 1
299 1 21 VAL HA 1 24 ILE HG13 . . 3.680 3.503 3.395 3.610 . 0 0 "[ . 1 . 2]" 1
300 1 21 VAL HA 1 25 ALA H . . 4.140 3.853 3.709 4.004 . 0 0 "[ . 1 . 2]" 1
301 1 21 VAL HB 1 32 MET HG2 . . 4.960 3.487 2.360 4.125 . 0 0 "[ . 1 . 2]" 1
302 1 21 VAL QG 1 22 LYS HA . . 3.790 3.354 3.225 3.529 . 0 0 "[ . 1 . 2]" 1
303 1 21 VAL QG 1 22 LYS HB3 . . 4.710 3.971 3.116 4.454 . 0 0 "[ . 1 . 2]" 1
304 1 21 VAL QG 1 23 GLU H . . 5.150 4.369 4.101 4.522 . 0 0 "[ . 1 . 2]" 1
305 1 21 VAL QG 1 24 ILE MD . . 3.320 2.759 2.529 2.965 . 0 0 "[ . 1 . 2]" 1
306 1 21 VAL QG 1 25 ALA MB . . 4.850 3.577 3.053 4.408 . 0 0 "[ . 1 . 2]" 1
307 1 21 VAL QG 1 32 MET HA . . 4.750 3.234 2.357 4.559 . 0 0 "[ . 1 . 2]" 1
308 1 21 VAL QG 1 32 MET HG2 . . 3.790 2.386 1.888 3.466 . 0 0 "[ . 1 . 2]" 1
309 1 21 VAL QG 1 32 MET HG3 . . 4.500 3.183 2.609 4.128 . 0 0 "[ . 1 . 2]" 1
310 1 21 VAL MG1 1 22 LYS H . . 4.070 3.583 3.318 3.984 . 0 0 "[ . 1 . 2]" 1
311 1 21 VAL MG1 1 32 MET HG2 . . 4.580 2.809 1.890 4.455 . 0 0 "[ . 1 . 2]" 1
312 1 21 VAL MG2 1 22 LYS H . . 4.070 3.152 1.996 3.792 . 0 0 "[ . 1 . 2]" 1
313 1 21 VAL MG2 1 32 MET HG2 . . 4.580 3.880 2.400 4.582 0.002 9 0 "[ . 1 . 2]" 1
314 1 22 LYS H 1 22 LYS HB2 . . 3.750 3.588 3.575 3.591 . 0 0 "[ . 1 . 2]" 1
315 1 22 LYS H 1 22 LYS QG . . 3.880 2.196 2.055 2.264 . 0 0 "[ . 1 . 2]" 1
316 1 22 LYS H 1 23 GLU H . . 3.590 2.778 2.713 2.805 . 0 0 "[ . 1 . 2]" 1
317 1 22 LYS H 1 24 ILE H . . 4.720 4.274 4.198 4.334 . 0 0 "[ . 1 . 2]" 1
318 1 22 LYS HA 1 25 ALA H . . 4.170 3.904 3.827 3.938 . 0 0 "[ . 1 . 2]" 1
319 1 22 LYS HA 1 25 ALA MB . . 3.190 3.018 2.853 3.193 0.003 15 0 "[ . 1 . 2]" 1
320 1 22 LYS HA 1 32 MET HG2 . . 4.850 4.301 3.753 4.767 . 0 0 "[ . 1 . 2]" 1
321 1 22 LYS HA 1 32 MET HG3 . . 4.460 3.622 3.171 4.169 . 0 0 "[ . 1 . 2]" 1
322 1 22 LYS QE 1 22 LYS QG . . 3.310 2.171 2.023 2.476 . 0 0 "[ . 1 . 2]" 1
323 1 22 LYS QG 1 23 GLU H . . 3.970 1.927 1.875 2.033 . 0 0 "[ . 1 . 2]" 1
324 1 23 GLU H 1 23 GLU QB . . 2.840 2.252 2.235 2.265 . 0 0 "[ . 1 . 2]" 1
325 1 23 GLU H 1 24 ILE H . . 3.290 2.515 2.485 2.536 . 0 0 "[ . 1 . 2]" 1
326 1 23 GLU H 1 25 ALA H . . 4.400 4.000 3.841 4.073 . 0 0 "[ . 1 . 2]" 1
327 1 23 GLU HA 1 23 GLU QG . . 3.380 2.794 2.400 3.106 . 0 0 "[ . 1 . 2]" 1
328 1 23 GLU HA 1 25 ALA H . . 4.410 4.246 4.069 4.353 . 0 0 "[ . 1 . 2]" 1
329 1 23 GLU HA 1 26 LYS H . . 3.610 3.486 3.369 3.587 . 0 0 "[ . 1 . 2]" 1
330 1 23 GLU HA 1 26 LYS HB2 . . 3.590 3.299 2.836 3.592 0.002 10 0 "[ . 1 . 2]" 1
331 1 23 GLU HA 1 26 LYS QD . . 5.190 4.982 4.584 5.191 0.001 16 0 "[ . 1 . 2]" 1
332 1 23 GLU HA 1 27 ARG H . . 4.580 4.309 4.010 4.585 0.005 12 0 "[ . 1 . 2]" 1
333 1 23 GLU QB 1 24 ILE H . . 3.310 2.503 2.461 2.560 . 0 0 "[ . 1 . 2]" 1
334 1 23 GLU QG 1 26 LYS H . . 5.010 4.803 4.469 5.001 . 0 0 "[ . 1 . 2]" 1
335 1 24 ILE H 1 24 ILE HB . . 3.580 2.596 2.563 2.615 . 0 0 "[ . 1 . 2]" 1
336 1 24 ILE H 1 24 ILE MD . . 3.290 3.172 3.113 3.303 0.013 4 0 "[ . 1 . 2]" 1
337 1 24 ILE H 1 24 ILE HG12 . . 3.600 3.483 3.375 3.522 . 0 0 "[ . 1 . 2]" 1
338 1 24 ILE H 1 24 ILE HG13 . . 3.150 1.984 1.936 2.040 . 0 0 "[ . 1 . 2]" 1
339 1 24 ILE H 1 25 ALA H . . 3.470 2.765 2.691 2.799 . 0 0 "[ . 1 . 2]" 1
340 1 24 ILE H 1 25 ALA MB . . 4.480 4.354 4.297 4.419 . 0 0 "[ . 1 . 2]" 1
341 1 24 ILE H 1 26 LYS H . . 4.410 4.373 4.302 4.417 0.007 10 0 "[ . 1 . 2]" 1
342 1 24 ILE HA 1 24 ILE HG12 . . 3.370 2.761 2.681 2.810 . 0 0 "[ . 1 . 2]" 1
343 1 24 ILE HA 1 24 ILE HG13 . . 3.370 2.778 2.745 2.887 . 0 0 "[ . 1 . 2]" 1
344 1 24 ILE HA 1 24 ILE MG . . 2.800 2.324 2.278 2.394 . 0 0 "[ . 1 . 2]" 1
345 1 24 ILE HA 1 25 ALA HA . . 5.340 4.830 4.791 4.849 . 0 0 "[ . 1 . 2]" 1
346 1 24 ILE HA 1 26 LYS H . . 4.630 4.396 4.215 4.518 . 0 0 "[ . 1 . 2]" 1
347 1 24 ILE HA 1 27 ARG H . . 4.260 3.394 3.254 3.495 . 0 0 "[ . 1 . 2]" 1
348 1 24 ILE HA 1 27 ARG QB . . 3.580 2.496 2.180 2.732 . 0 0 "[ . 1 . 2]" 1
349 1 24 ILE HB 1 24 ILE MD . . 3.360 2.288 2.159 2.377 . 0 0 "[ . 1 . 2]" 1
350 1 24 ILE HB 1 25 ALA H . . 3.270 2.667 2.585 2.827 . 0 0 "[ . 1 . 2]" 1
351 1 24 ILE HB 1 25 ALA MB . . 4.340 4.078 3.960 4.213 . 0 0 "[ . 1 . 2]" 1
352 1 24 ILE HB 1 35 VAL MG1 . . 3.680 1.996 1.968 2.068 . 0 0 "[ . 1 . 2]" 1
353 1 24 ILE HB 1 35 VAL MG2 . . 3.400 3.113 2.985 3.346 . 0 0 "[ . 1 . 2]" 1
354 1 24 ILE HG13 1 25 ALA H . . 4.270 4.241 4.206 4.270 0.000 18 0 "[ . 1 . 2]" 1
355 1 24 ILE MG 1 25 ALA H . . 3.890 3.529 3.428 3.685 . 0 0 "[ . 1 . 2]" 1
356 1 24 ILE MG 1 25 ALA HA . . 4.250 3.557 3.430 3.699 . 0 0 "[ . 1 . 2]" 1
357 1 24 ILE MG 1 27 ARG H . . 4.660 4.542 4.276 4.690 0.030 17 0 "[ . 1 . 2]" 1
358 1 24 ILE MG 1 28 SER H . . 3.730 3.555 3.337 3.739 0.009 12 0 "[ . 1 . 2]" 1
359 1 24 ILE MG 1 29 ASN H . . 5.500 5.436 5.205 5.514 0.014 10 0 "[ . 1 . 2]" 1
360 1 24 ILE MG 1 30 ASN H . . 5.360 5.191 5.120 5.351 . 0 0 "[ . 1 . 2]" 1
361 1 24 ILE MG 1 30 ASN HB2 . . 5.410 4.651 4.471 5.106 . 0 0 "[ . 1 . 2]" 1
362 1 25 ALA H 1 25 ALA MB . . 2.970 2.123 2.031 2.220 . 0 0 "[ . 1 . 2]" 1
363 1 25 ALA H 1 26 LYS H . . 3.500 2.751 2.674 2.804 . 0 0 "[ . 1 . 2]" 1
364 1 25 ALA H 1 26 LYS QD . . 5.340 5.165 4.828 5.354 0.014 6 0 "[ . 1 . 2]" 1
365 1 25 ALA H 1 26 LYS HG2 . . 4.660 4.317 4.122 4.462 . 0 0 "[ . 1 . 2]" 1
366 1 25 ALA H 1 27 ARG QB . . 5.340 4.901 4.633 5.139 . 0 0 "[ . 1 . 2]" 1
367 1 25 ALA H 1 35 VAL MG1 . . 4.170 3.509 3.343 3.649 . 0 0 "[ . 1 . 2]" 1
368 1 25 ALA H 1 35 VAL MG2 . . 3.480 3.233 3.117 3.474 . 0 0 "[ . 1 . 2]" 1
369 1 25 ALA HA 1 26 LYS HA . . 5.010 4.743 4.735 4.751 . 0 0 "[ . 1 . 2]" 1
370 1 25 ALA HA 1 30 ASN H . . 3.550 2.945 2.766 3.151 . 0 0 "[ . 1 . 2]" 1
371 1 25 ALA HA 1 30 ASN HB2 . . 4.310 3.354 3.088 3.757 . 0 0 "[ . 1 . 2]" 1
372 1 25 ALA HA 1 30 ASN HB3 . . 4.350 4.030 3.954 4.158 . 0 0 "[ . 1 . 2]" 1
373 1 25 ALA HA 1 32 MET HA . . 5.070 4.972 4.745 5.086 0.016 9 0 "[ . 1 . 2]" 1
374 1 25 ALA HA 1 34 THR HB . . 5.500 5.519 5.509 5.541 0.041 12 0 "[ . 1 . 2]" 1
375 1 25 ALA HA 1 35 VAL H . . 4.800 4.757 4.627 4.820 0.020 7 0 "[ . 1 . 2]" 1
376 1 25 ALA HA 1 35 VAL HA . . 5.500 5.262 5.178 5.389 . 0 0 "[ . 1 . 2]" 1
377 1 25 ALA HA 1 35 VAL HB . . 4.550 3.772 3.490 3.928 . 0 0 "[ . 1 . 2]" 1
378 1 25 ALA HA 1 35 VAL MG1 . . 4.670 3.742 3.532 3.870 . 0 0 "[ . 1 . 2]" 1
379 1 25 ALA HA 1 35 VAL MG2 . . 3.180 1.949 1.899 2.017 . 0 0 "[ . 1 . 2]" 1
380 1 25 ALA MB 1 26 LYS H . . 3.010 2.596 2.460 2.683 . 0 0 "[ . 1 . 2]" 1
381 1 25 ALA MB 1 26 LYS HA . . 4.280 3.779 3.714 3.842 . 0 0 "[ . 1 . 2]" 1
382 1 25 ALA MB 1 27 ARG H . . 5.420 4.515 4.328 4.755 . 0 0 "[ . 1 . 2]" 1
383 1 25 ALA MB 1 28 SER H . . 5.100 4.841 4.632 4.959 . 0 0 "[ . 1 . 2]" 1
384 1 25 ALA MB 1 29 ASN H . . 4.910 4.876 4.765 4.923 0.013 15 0 "[ . 1 . 2]" 1
385 1 25 ALA MB 1 30 ASN H . . 3.830 3.770 3.638 3.839 0.009 15 0 "[ . 1 . 2]" 1
386 1 25 ALA MB 1 30 ASN HB2 . . 4.680 4.386 4.094 4.651 . 0 0 "[ . 1 . 2]" 1
387 1 25 ALA MB 1 30 ASN HB3 . . 4.510 4.369 4.147 4.511 0.001 1 0 "[ . 1 . 2]" 1
388 1 25 ALA MB 1 31 SER H . . 5.080 4.546 4.401 4.757 . 0 0 "[ . 1 . 2]" 1
389 1 25 ALA MB 1 31 SER HA . . 4.770 3.263 3.007 3.597 . 0 0 "[ . 1 . 2]" 1
390 1 25 ALA MB 1 32 MET HA . . 3.410 3.004 2.854 3.130 . 0 0 "[ . 1 . 2]" 1
391 1 25 ALA MB 1 32 MET HG2 . . 4.330 4.047 3.578 4.331 0.001 12 0 "[ . 1 . 2]" 1
392 1 25 ALA MB 1 32 MET HG3 . . 4.190 3.659 2.911 4.108 . 0 0 "[ . 1 . 2]" 1
393 1 25 ALA MB 1 35 VAL H . . 4.360 4.290 4.146 4.361 0.001 10 0 "[ . 1 . 2]" 1
394 1 25 ALA MB 1 35 VAL HB . . 3.670 3.323 3.204 3.460 . 0 0 "[ . 1 . 2]" 1
395 1 26 LYS H 1 26 LYS HB2 . . 2.720 2.567 2.458 2.681 . 0 0 "[ . 1 . 2]" 1
396 1 26 LYS H 1 26 LYS QD . . 3.610 3.092 2.848 3.304 . 0 0 "[ . 1 . 2]" 1
397 1 26 LYS H 1 26 LYS QE . . 4.780 4.319 3.775 4.657 . 0 0 "[ . 1 . 2]" 1
398 1 26 LYS H 1 26 LYS HG2 . . 3.650 2.134 1.967 2.303 . 0 0 "[ . 1 . 2]" 1
399 1 26 LYS H 1 27 ARG H . . 3.480 2.585 2.524 2.681 . 0 0 "[ . 1 . 2]" 1
400 1 26 LYS H 1 28 SER H . . 4.560 4.216 3.771 4.380 . 0 0 "[ . 1 . 2]" 1
401 1 26 LYS H 1 29 ASN H . . 4.640 4.566 4.393 4.649 0.009 16 0 "[ . 1 . 2]" 1
402 1 26 LYS H 1 30 ASN H . . 5.080 5.008 4.917 5.081 0.001 8 0 "[ . 1 . 2]" 1
403 1 26 LYS H 1 35 VAL MG2 . . 4.830 4.723 4.659 4.817 . 0 0 "[ . 1 . 2]" 1
404 1 26 LYS HA 1 26 LYS HB3 . . 3.010 2.431 2.378 2.487 . 0 0 "[ . 1 . 2]" 1
405 1 26 LYS HA 1 26 LYS QD . . 3.710 2.066 1.977 2.166 . 0 0 "[ . 1 . 2]" 1
406 1 26 LYS HA 1 26 LYS QE . . 4.560 3.077 2.422 4.254 . 0 0 "[ . 1 . 2]" 1
407 1 26 LYS HA 1 26 LYS HG2 . . 3.710 3.229 3.129 3.330 . 0 0 "[ . 1 . 2]" 1
408 1 26 LYS HA 1 29 ASN H . . 3.590 3.415 3.225 3.558 . 0 0 "[ . 1 . 2]" 1
409 1 26 LYS HA 1 29 ASN HA . . 3.760 3.242 3.111 3.393 . 0 0 "[ . 1 . 2]" 1
410 1 26 LYS HA 1 30 ASN H . . 4.650 4.404 4.303 4.481 . 0 0 "[ . 1 . 2]" 1
411 1 26 LYS HB2 1 26 LYS HG2 . . 2.850 2.414 2.408 2.419 . 0 0 "[ . 1 . 2]" 1
412 1 26 LYS HB2 1 27 ARG H . . 2.840 2.628 2.315 2.846 0.006 8 0 "[ . 1 . 2]" 1
413 1 26 LYS HB2 1 29 ASN H . . 5.310 5.215 5.040 5.331 0.021 17 0 "[ . 1 . 2]" 1
414 1 26 LYS HB3 1 26 LYS QD . . 3.510 2.806 2.379 2.989 . 0 0 "[ . 1 . 2]" 1
415 1 26 LYS QD 1 30 ASN H . . 5.340 5.344 5.327 5.351 0.011 7 0 "[ . 1 . 2]" 1
416 1 26 LYS QE 1 26 LYS HG3 . . 3.570 2.406 2.203 2.978 . 0 0 "[ . 1 . 2]" 1
417 1 26 LYS HG3 1 27 ARG H . . 5.500 4.918 4.649 5.093 . 0 0 "[ . 1 . 2]" 1
418 1 27 ARG H 1 27 ARG QB . . 3.020 2.213 2.048 2.471 . 0 0 "[ . 1 . 2]" 1
419 1 27 ARG H 1 28 SER H . . 3.490 2.691 2.614 2.829 . 0 0 "[ . 1 . 2]" 1
420 1 27 ARG H 1 29 ASN H . . 4.330 3.663 3.575 3.893 . 0 0 "[ . 1 . 2]" 1
421 1 27 ARG HA 1 27 ARG QB . . 2.610 2.469 2.355 2.538 . 0 0 "[ . 1 . 2]" 1
422 1 27 ARG HA 1 27 ARG QD . . 4.060 3.216 2.550 3.888 . 0 0 "[ . 1 . 2]" 1
423 1 27 ARG HA 1 27 ARG QG . . 2.790 2.272 2.051 2.644 . 0 0 "[ . 1 . 2]" 1
424 1 27 ARG QB 1 27 ARG QD . . 2.880 2.058 1.942 2.396 . 0 0 "[ . 1 . 2]" 1
425 1 27 ARG QB 1 28 SER H . . 3.240 2.529 2.362 2.973 . 0 0 "[ . 1 . 2]" 1
426 1 27 ARG QB 1 29 ASN H . . 4.710 4.249 4.187 4.528 . 0 0 "[ . 1 . 2]" 1
427 1 27 ARG HB2 1 28 SER H . . 3.710 2.802 2.403 3.455 . 0 0 "[ . 1 . 2]" 1
428 1 27 ARG HB2 1 29 ASN H . . 5.500 4.721 4.479 5.111 . 0 0 "[ . 1 . 2]" 1
429 1 27 ARG HB3 1 28 SER H . . 3.710 3.127 2.417 3.698 . 0 0 "[ . 1 . 2]" 1
430 1 27 ARG HB3 1 29 ASN H . . 5.500 4.869 4.478 5.206 . 0 0 "[ . 1 . 2]" 1
431 1 28 SER H 1 29 ASN H . . 3.170 2.438 2.232 2.513 . 0 0 "[ . 1 . 2]" 1
432 1 28 SER H 1 29 ASN QB . . 5.340 4.975 4.687 5.336 . 0 0 "[ . 1 . 2]" 1
433 1 28 SER H 1 30 ASN H . . 4.230 3.721 3.528 3.998 . 0 0 "[ . 1 . 2]" 1
434 1 29 ASN H 1 29 ASN HA . . 2.790 2.275 2.273 2.276 . 0 0 "[ . 1 . 2]" 1
435 1 29 ASN H 1 29 ASN QB . . 3.470 3.076 2.894 3.418 . 0 0 "[ . 1 . 2]" 1
436 1 29 ASN H 1 30 ASN H . . 3.280 2.681 2.616 2.769 . 0 0 "[ . 1 . 2]" 1
437 1 29 ASN H 1 30 ASN HA . . 5.500 5.297 5.253 5.345 . 0 0 "[ . 1 . 2]" 1
438 1 29 ASN HA 1 30 ASN H . . 3.080 2.918 2.830 2.996 . 0 0 "[ . 1 . 2]" 1
439 1 29 ASN HA 1 30 ASN HA . . 4.670 4.502 4.462 4.557 . 0 0 "[ . 1 . 2]" 1
440 1 29 ASN HA 1 30 ASN HB2 . . 5.440 5.159 5.095 5.229 . 0 0 "[ . 1 . 2]" 1
441 1 29 ASN QB 1 30 ASN H . . 4.320 3.790 3.723 3.853 . 0 0 "[ . 1 . 2]" 1
442 1 30 ASN H 1 30 ASN HB2 . . 3.470 2.352 2.284 2.416 . 0 0 "[ . 1 . 2]" 1
443 1 30 ASN H 1 30 ASN HB3 . . 3.660 3.494 3.453 3.537 . 0 0 "[ . 1 . 2]" 1
444 1 30 ASN H 1 31 SER H . . 4.660 4.457 4.427 4.509 . 0 0 "[ . 1 . 2]" 1
445 1 30 ASN H 1 34 THR MG . . 5.500 5.386 5.181 5.511 0.011 15 0 "[ . 1 . 2]" 1
446 1 30 ASN H 1 35 VAL MG2 . . 3.780 3.409 3.303 3.478 . 0 0 "[ . 1 . 2]" 1
447 1 30 ASN HA 1 31 SER H . . 3.160 2.578 2.526 2.608 . 0 0 "[ . 1 . 2]" 1
448 1 30 ASN HA 1 34 THR HB . . 4.980 4.020 3.973 4.068 . 0 0 "[ . 1 . 2]" 1
449 1 30 ASN HB2 1 31 SER H . . 4.090 3.654 3.616 3.730 . 0 0 "[ . 1 . 2]" 1
450 1 30 ASN HB2 1 34 THR HB . . 3.870 3.709 3.670 3.822 . 0 0 "[ . 1 . 2]" 1
451 1 30 ASN HB2 1 34 THR MG . . 3.990 3.553 3.268 3.846 . 0 0 "[ . 1 . 2]" 1
452 1 30 ASN HB2 1 35 VAL H . . 4.260 4.268 4.211 4.280 0.020 12 0 "[ . 1 . 2]" 1
453 1 30 ASN HB2 1 35 VAL MG1 . . 5.500 4.826 4.643 4.931 . 0 0 "[ . 1 . 2]" 1
454 1 30 ASN HB2 1 35 VAL MG2 . . 3.650 2.294 2.127 2.393 . 0 0 "[ . 1 . 2]" 1
455 1 30 ASN HB3 1 31 SER H . . 3.900 2.158 2.111 2.261 . 0 0 "[ . 1 . 2]" 1
456 1 30 ASN HB3 1 34 THR H . . 4.550 4.205 4.135 4.342 . 0 0 "[ . 1 . 2]" 1
457 1 30 ASN HB3 1 34 THR HB . . 4.100 2.002 1.987 2.115 . 0 0 "[ . 1 . 2]" 1
458 1 30 ASN HB3 1 34 THR MG . . 4.270 2.617 2.407 2.748 . 0 0 "[ . 1 . 2]" 1
459 1 30 ASN HB3 1 35 VAL H . . 4.410 3.088 3.032 3.196 . 0 0 "[ . 1 . 2]" 1
460 1 30 ASN HB3 1 35 VAL MG1 . . 5.010 5.017 5.000 5.025 0.015 15 0 "[ . 1 . 2]" 1
461 1 30 ASN HB3 1 35 VAL MG2 . . 3.600 2.390 2.282 2.499 . 0 0 "[ . 1 . 2]" 1
462 1 31 SER H 1 31 SER QB . . 3.460 2.270 2.174 2.385 . 0 0 "[ . 1 . 2]" 1
463 1 31 SER H 1 34 THR H . . 4.580 3.511 3.412 3.653 . 0 0 "[ . 1 . 2]" 1
464 1 31 SER H 1 34 THR HA . . 5.250 4.891 4.796 4.973 . 0 0 "[ . 1 . 2]" 1
465 1 31 SER H 1 34 THR HB . . 3.540 2.122 1.975 2.265 . 0 0 "[ . 1 . 2]" 1
466 1 31 SER H 1 34 THR MG . . 4.340 3.310 3.040 3.429 . 0 0 "[ . 1 . 2]" 1
467 1 31 SER H 1 35 VAL H . . 5.050 3.779 3.693 3.886 . 0 0 "[ . 1 . 2]" 1
468 1 31 SER H 1 35 VAL HB . . 5.500 5.405 5.312 5.503 0.003 17 0 "[ . 1 . 2]" 1
469 1 31 SER H 1 35 VAL MG2 . . 4.680 3.811 3.728 3.887 . 0 0 "[ . 1 . 2]" 1
470 1 31 SER HA 1 34 THR H . . 4.860 4.347 4.288 4.504 . 0 0 "[ . 1 . 2]" 1
471 1 31 SER QB 1 34 THR HB . . 3.860 3.302 3.101 3.467 . 0 0 "[ . 1 . 2]" 1
472 1 31 SER HB2 1 34 THR HB . . 4.440 3.818 3.432 4.350 . 0 0 "[ . 1 . 2]" 1
473 1 31 SER HB3 1 34 THR HB . . 4.440 3.713 3.285 4.261 . 0 0 "[ . 1 . 2]" 1
474 1 32 MET HA 1 32 MET HG2 . . 3.870 2.286 2.059 2.810 . 0 0 "[ . 1 . 2]" 1
475 1 32 MET HA 1 32 MET HG3 . . 4.140 2.806 2.332 3.091 . 0 0 "[ . 1 . 2]" 1
476 1 32 MET HA 1 34 THR H . . 4.390 4.052 3.985 4.092 . 0 0 "[ . 1 . 2]" 1
477 1 32 MET HA 1 35 VAL H . . 3.940 3.716 3.693 3.747 . 0 0 "[ . 1 . 2]" 1
478 1 32 MET HA 1 35 VAL HB . . 3.620 3.104 3.020 3.236 . 0 0 "[ . 1 . 2]" 1
479 1 32 MET HA 1 36 TYR H . . 4.030 3.569 3.414 3.874 . 0 0 "[ . 1 . 2]" 1
480 1 33 SER H 1 34 THR H . . 4.440 2.406 2.397 2.456 . 0 0 "[ . 1 . 2]" 1
481 1 33 SER H 1 35 VAL H . . 5.080 4.306 4.262 4.404 . 0 0 "[ . 1 . 2]" 1
482 1 33 SER HA 1 36 TYR HB3 . . 3.330 3.330 3.165 3.347 0.017 18 0 "[ . 1 . 2]" 1
483 1 34 THR H 1 34 THR HB . . 3.090 2.574 2.500 2.638 . 0 0 "[ . 1 . 2]" 1
484 1 34 THR H 1 34 THR MG . . 3.900 3.793 3.782 3.798 . 0 0 "[ . 1 . 2]" 1
485 1 34 THR H 1 35 VAL HA . . 5.410 5.116 5.114 5.118 . 0 0 "[ . 1 . 2]" 1
486 1 34 THR H 1 35 VAL HB . . 4.390 4.457 4.445 4.471 0.081 18 0 "[ . 1 . 2]" 1
487 1 34 THR H 1 35 VAL MG2 . . 4.850 4.390 4.361 4.435 . 0 0 "[ . 1 . 2]" 1
488 1 34 THR H 1 36 TYR H . . 4.190 4.127 4.031 4.145 . 0 0 "[ . 1 . 2]" 1
489 1 34 THR H 1 36 TYR HB2 . . 5.500 5.531 5.515 5.539 0.039 6 0 "[ . 1 . 2]" 1
490 1 34 THR HA 1 34 THR MG . . 3.200 2.286 2.240 2.376 . 0 0 "[ . 1 . 2]" 1
491 1 34 THR HA 1 35 VAL HA . . 5.010 4.776 4.761 4.786 . 0 0 "[ . 1 . 2]" 1
492 1 34 THR HA 1 37 LYS H . . 3.880 3.834 3.775 3.888 0.008 8 0 "[ . 1 . 2]" 1
493 1 34 THR HA 1 37 LYS QB . . 3.470 2.729 2.640 2.978 . 0 0 "[ . 1 . 2]" 1
494 1 34 THR HB 1 35 VAL H . . 3.410 2.383 2.369 2.403 . 0 0 "[ . 1 . 2]" 1
495 1 34 THR HB 1 35 VAL HB . . 4.570 4.532 4.493 4.559 . 0 0 "[ . 1 . 2]" 1
496 1 34 THR HB 1 35 VAL MG2 . . 4.020 3.357 3.242 3.435 . 0 0 "[ . 1 . 2]" 1
497 1 34 THR HB 1 36 TYR H . . 5.370 5.118 5.052 5.143 . 0 0 "[ . 1 . 2]" 1
498 1 34 THR MG 1 35 VAL H . . 3.770 3.429 3.274 3.542 . 0 0 "[ . 1 . 2]" 1
499 1 34 THR MG 1 35 VAL HA . . 3.930 3.625 3.378 3.793 . 0 0 "[ . 1 . 2]" 1
500 1 35 VAL H 1 35 VAL HB . . 3.100 2.349 2.336 2.355 . 0 0 "[ . 1 . 2]" 1
501 1 35 VAL H 1 35 VAL MG1 . . 3.990 3.715 3.708 3.718 . 0 0 "[ . 1 . 2]" 1
502 1 35 VAL H 1 35 VAL MG2 . . 2.970 2.484 2.424 2.538 . 0 0 "[ . 1 . 2]" 1
503 1 35 VAL H 1 36 TYR H . . 3.280 2.820 2.770 2.839 . 0 0 "[ . 1 . 2]" 1
504 1 35 VAL H 1 36 TYR HB2 . . 5.230 4.910 4.879 4.962 . 0 0 "[ . 1 . 2]" 1
505 1 35 VAL H 1 36 TYR HB3 . . 5.310 5.184 5.038 5.224 . 0 0 "[ . 1 . 2]" 1
506 1 35 VAL H 1 37 LYS H . . 4.140 4.059 4.010 4.146 0.006 12 0 "[ . 1 . 2]" 1
507 1 35 VAL H 1 38 ALA H . . 5.500 4.850 4.805 4.891 . 0 0 "[ . 1 . 2]" 1
508 1 35 VAL HA 1 35 VAL MG1 . . 2.720 2.517 2.511 2.526 . 0 0 "[ . 1 . 2]" 1
509 1 35 VAL HA 1 35 VAL MG2 . . 2.660 2.164 2.129 2.225 . 0 0 "[ . 1 . 2]" 1
510 1 35 VAL HA 1 37 LYS H . . 4.670 4.351 4.296 4.405 . 0 0 "[ . 1 . 2]" 1
511 1 35 VAL HA 1 38 ALA H . . 3.850 3.458 3.409 3.479 . 0 0 "[ . 1 . 2]" 1
512 1 35 VAL HA 1 38 ALA MB . . 3.240 2.775 2.621 2.963 . 0 0 "[ . 1 . 2]" 1
513 1 35 VAL HA 1 39 LEU H . . 4.980 4.419 4.307 4.560 . 0 0 "[ . 1 . 2]" 1
514 1 35 VAL HA 1 39 LEU MD2 . . 5.120 4.646 4.577 4.847 . 0 0 "[ . 1 . 2]" 1
515 1 35 VAL HB 1 36 TYR H . . 3.190 2.387 2.363 2.472 . 0 0 "[ . 1 . 2]" 1
516 1 35 VAL MG1 1 36 TYR HB3 . . 4.720 4.796 4.787 4.805 0.085 12 0 "[ . 1 . 2]" 1
517 1 35 VAL MG1 1 38 ALA MB . . 3.850 3.554 3.443 3.594 . 0 0 "[ . 1 . 2]" 1
518 1 35 VAL MG2 1 36 TYR H . . 4.130 3.878 3.864 3.923 . 0 0 "[ . 1 . 2]" 1
519 1 36 TYR H 1 36 TYR HB2 . . 3.150 2.263 2.245 2.352 . 0 0 "[ . 1 . 2]" 1
520 1 36 TYR H 1 36 TYR HB3 . . 3.260 2.838 2.728 2.864 . 0 0 "[ . 1 . 2]" 1
521 1 36 TYR H 1 36 TYR QD . . 4.390 4.041 3.976 4.154 . 0 0 "[ . 1 . 2]" 1
522 1 36 TYR H 1 37 LYS H . . 3.400 2.807 2.791 2.830 . 0 0 "[ . 1 . 2]" 1
523 1 36 TYR H 1 37 LYS QB . . 5.340 4.525 4.487 4.560 . 0 0 "[ . 1 . 2]" 1
524 1 36 TYR H 1 38 ALA H . . 4.320 4.141 4.108 4.190 . 0 0 "[ . 1 . 2]" 1
525 1 36 TYR H 1 38 ALA MB . . 5.030 4.887 4.808 4.978 . 0 0 "[ . 1 . 2]" 1
526 1 36 TYR H 1 39 LEU HG . . 4.740 4.363 4.299 4.520 . 0 0 "[ . 1 . 2]" 1
527 1 36 TYR HA 1 36 TYR QD . . 3.150 2.641 2.068 3.115 . 0 0 "[ . 1 . 2]" 1
528 1 36 TYR HA 1 38 ALA H . . 4.320 4.026 3.991 4.062 . 0 0 "[ . 1 . 2]" 1
529 1 36 TYR HA 1 38 ALA MB . . 4.790 4.776 4.751 4.800 0.010 18 0 "[ . 1 . 2]" 1
530 1 36 TYR HA 1 39 LEU H . . 3.860 3.300 3.233 3.349 . 0 0 "[ . 1 . 2]" 1
531 1 36 TYR HA 1 39 LEU HB2 . . 4.390 2.971 2.852 3.048 . 0 0 "[ . 1 . 2]" 1
532 1 36 TYR HA 1 39 LEU HB3 . . 4.560 4.404 4.304 4.452 . 0 0 "[ . 1 . 2]" 1
533 1 36 TYR HA 1 39 LEU MD1 . . 3.420 2.022 1.947 2.217 . 0 0 "[ . 1 . 2]" 1
534 1 36 TYR HA 1 39 LEU HG . . 4.270 2.648 2.492 2.906 . 0 0 "[ . 1 . 2]" 1
535 1 36 TYR HA 1 40 GLU H . . 4.360 4.118 3.970 4.183 . 0 0 "[ . 1 . 2]" 1
536 1 36 TYR HB2 1 37 LYS H . . 3.920 3.700 3.674 3.766 . 0 0 "[ . 1 . 2]" 1
537 1 36 TYR HB2 1 38 ALA H . . 5.500 5.518 5.494 5.556 0.056 15 0 "[ . 1 . 2]" 1
538 1 36 TYR HB3 1 37 LYS H . . 3.640 2.630 2.561 2.680 . 0 0 "[ . 1 . 2]" 1
539 1 36 TYR HB3 1 37 LYS HA . . 4.410 4.016 4.000 4.102 . 0 0 "[ . 1 . 2]" 1
540 1 36 TYR HB3 1 37 LYS QB . . 4.420 4.218 3.985 4.380 . 0 0 "[ . 1 . 2]" 1
541 1 36 TYR HB3 1 38 ALA H . . 5.010 4.874 4.835 4.928 . 0 0 "[ . 1 . 2]" 1
542 1 36 TYR HB3 1 39 LEU H . . 5.500 5.460 5.294 5.513 0.013 17 0 "[ . 1 . 2]" 1
543 1 36 TYR HB3 1 39 LEU MD1 . . 5.100 4.608 4.477 4.800 . 0 0 "[ . 1 . 2]" 1
544 1 37 LYS H 1 37 LYS QB . . 2.850 2.163 2.075 2.244 . 0 0 "[ . 1 . 2]" 1
545 1 37 LYS H 1 38 ALA H . . 3.300 2.651 2.647 2.659 . 0 0 "[ . 1 . 2]" 1
546 1 37 LYS H 1 39 LEU H . . 4.480 4.265 4.113 4.319 . 0 0 "[ . 1 . 2]" 1
547 1 37 LYS H 1 40 GLU H . . 5.160 5.081 4.959 5.130 . 0 0 "[ . 1 . 2]" 1
548 1 37 LYS H 1 40 GLU HG2 . . 4.540 4.384 4.246 4.565 0.025 8 0 "[ . 1 . 2]" 1
549 1 37 LYS HA 1 40 GLU H . . 4.020 3.896 3.790 3.979 . 0 0 "[ . 1 . 2]" 1
550 1 37 LYS HA 1 40 GLU QB . . 4.280 4.010 3.837 4.077 . 0 0 "[ . 1 . 2]" 1
551 1 37 LYS HA 1 40 GLU HG2 . . 3.300 2.169 1.997 2.276 . 0 0 "[ . 1 . 2]" 1
552 1 37 LYS HA 1 40 GLU HG3 . . 4.040 3.331 3.240 3.598 . 0 0 "[ . 1 . 2]" 1
553 1 38 ALA H 1 38 ALA MB . . 2.910 2.170 2.069 2.264 . 0 0 "[ . 1 . 2]" 1
554 1 38 ALA H 1 39 LEU HA . . 5.340 5.113 5.076 5.129 . 0 0 "[ . 1 . 2]" 1
555 1 38 ALA H 1 39 LEU HG . . 4.160 3.849 3.790 3.926 . 0 0 "[ . 1 . 2]" 1
556 1 38 ALA HA 1 41 LYS H . . 3.870 3.460 3.374 3.689 . 0 0 "[ . 1 . 2]" 1
557 1 38 ALA HA 1 41 LYS HB2 . . 3.330 2.636 2.408 2.953 . 0 0 "[ . 1 . 2]" 1
558 1 38 ALA HA 1 41 LYS HB3 . . 4.500 3.665 3.486 3.979 . 0 0 "[ . 1 . 2]" 1
559 1 38 ALA HA 1 41 LYS QD . . 4.370 3.886 3.601 4.441 0.071 8 0 "[ . 1 . 2]" 1
560 1 38 ALA MB 1 39 LEU H . . 3.240 2.600 2.481 2.730 . 0 0 "[ . 1 . 2]" 1
561 1 38 ALA MB 1 39 LEU MD2 . . 4.150 3.316 3.104 3.580 . 0 0 "[ . 1 . 2]" 1
562 1 38 ALA MB 1 40 GLU H . . 4.780 4.688 4.649 4.789 0.009 10 0 "[ . 1 . 2]" 1
563 1 38 ALA MB 1 40 GLU HG3 . . 5.500 5.474 5.421 5.505 0.005 10 0 "[ . 1 . 2]" 1
564 1 39 LEU H 1 39 LEU HB2 . . 3.350 2.653 2.590 2.680 . 0 0 "[ . 1 . 2]" 1
565 1 39 LEU H 1 39 LEU HB3 . . 3.680 3.579 3.575 3.593 . 0 0 "[ . 1 . 2]" 1
566 1 39 LEU H 1 39 LEU MD2 . . 3.650 2.998 2.889 3.363 . 0 0 "[ . 1 . 2]" 1
567 1 39 LEU H 1 39 LEU HG . . 3.160 1.982 1.941 2.076 . 0 0 "[ . 1 . 2]" 1
568 1 39 LEU H 1 40 GLU H . . 3.390 2.817 2.656 2.888 . 0 0 "[ . 1 . 2]" 1
569 1 39 LEU H 1 40 GLU HG2 . . 4.460 4.104 3.898 4.385 . 0 0 "[ . 1 . 2]" 1
570 1 39 LEU H 1 42 LEU H . . 5.260 4.691 4.586 4.898 . 0 0 "[ . 1 . 2]" 1
571 1 39 LEU H 1 42 LEU QD . . 4.030 3.566 3.277 4.055 0.025 8 0 "[ . 1 . 2]" 1
572 1 39 LEU H 1 48 ILE MG . . 5.500 5.517 5.505 5.530 0.030 15 0 "[ . 1 . 2]" 1
573 1 39 LEU HA 1 39 LEU MD1 . . 4.130 3.910 3.882 3.951 . 0 0 "[ . 1 . 2]" 1
574 1 39 LEU HA 1 39 LEU MD2 . . 3.230 2.308 2.241 2.425 . 0 0 "[ . 1 . 2]" 1
575 1 39 LEU HA 1 40 GLU HA . . 4.920 4.806 4.789 4.844 . 0 0 "[ . 1 . 2]" 1
576 1 39 LEU HA 1 41 LYS H . . 4.500 4.040 3.855 4.150 . 0 0 "[ . 1 . 2]" 1
577 1 39 LEU HA 1 42 LEU H . . 3.770 3.329 3.177 3.456 . 0 0 "[ . 1 . 2]" 1
578 1 39 LEU HA 1 42 LEU HB2 . . 4.040 2.746 2.591 3.079 . 0 0 "[ . 1 . 2]" 1
579 1 39 LEU HA 1 42 LEU QD . . 3.360 2.237 1.957 2.900 . 0 0 "[ . 1 . 2]" 1
580 1 39 LEU HA 1 43 GLU H . . 4.190 3.658 3.616 3.749 . 0 0 "[ . 1 . 2]" 1
581 1 39 LEU HA 1 48 ILE MG . . 3.790 3.284 3.156 3.377 . 0 0 "[ . 1 . 2]" 1
582 1 39 LEU HB2 1 39 LEU MD1 . . 3.630 2.327 2.155 2.367 . 0 0 "[ . 1 . 2]" 1
583 1 39 LEU HB2 1 40 GLU H . . 3.660 2.364 2.358 2.371 . 0 0 "[ . 1 . 2]" 1
584 1 39 LEU HB2 1 40 GLU HA . . 4.730 4.086 4.055 4.140 . 0 0 "[ . 1 . 2]" 1
585 1 39 LEU HB2 1 40 GLU HG3 . . 5.310 5.312 5.299 5.317 0.007 14 0 "[ . 1 . 2]" 1
586 1 39 LEU HB2 1 48 ILE MD . . 4.000 3.902 3.732 4.004 0.004 20 0 "[ . 1 . 2]" 1
587 1 39 LEU HB3 1 39 LEU MD1 . . 3.550 2.323 2.275 2.475 . 0 0 "[ . 1 . 2]" 1
588 1 39 LEU HB3 1 39 LEU MD2 . . 3.440 2.259 2.159 2.305 . 0 0 "[ . 1 . 2]" 1
589 1 39 LEU HB3 1 40 GLU H . . 3.610 3.593 3.547 3.620 0.010 11 0 "[ . 1 . 2]" 1
590 1 39 LEU MD1 1 40 GLU H . . 4.630 4.256 4.109 4.320 . 0 0 "[ . 1 . 2]" 1
591 1 39 LEU MD2 1 40 GLU H . . 4.730 4.592 4.561 4.681 . 0 0 "[ . 1 . 2]" 1
592 1 39 LEU MD2 1 42 LEU H . . 5.140 5.011 4.948 5.075 . 0 0 "[ . 1 . 2]" 1
593 1 39 LEU MD2 1 43 GLU H . . 5.180 5.077 4.980 5.136 . 0 0 "[ . 1 . 2]" 1
594 1 39 LEU MD2 1 48 ILE HB . . 4.470 4.269 4.045 4.398 . 0 0 "[ . 1 . 2]" 1
595 1 39 LEU MD2 1 48 ILE MD . . 2.620 2.536 2.400 2.621 0.001 20 0 "[ . 1 . 2]" 1
596 1 39 LEU MD2 1 48 ILE HG12 . . 4.920 4.921 4.889 4.938 0.018 18 0 "[ . 1 . 2]" 1
597 1 39 LEU MD2 1 48 ILE MG . . 3.200 2.880 2.628 3.063 . 0 0 "[ . 1 . 2]" 1
598 1 39 LEU HG 1 40 GLU H . . 4.320 4.032 3.976 4.118 . 0 0 "[ . 1 . 2]" 1
599 1 40 GLU H 1 40 GLU QB . . 3.200 2.532 2.471 2.569 . 0 0 "[ . 1 . 2]" 1
600 1 40 GLU H 1 40 GLU HG2 . . 3.330 2.190 2.082 2.386 . 0 0 "[ . 1 . 2]" 1
601 1 40 GLU H 1 40 GLU HG3 . . 3.460 2.954 2.944 2.965 . 0 0 "[ . 1 . 2]" 1
602 1 40 GLU H 1 41 LYS QE . . 5.340 5.045 4.783 5.291 . 0 0 "[ . 1 . 2]" 1
603 1 40 GLU H 1 42 LEU H . . 4.580 4.292 4.151 4.544 . 0 0 "[ . 1 . 2]" 1
604 1 40 GLU HA 1 40 GLU HG2 . . 4.060 3.827 3.780 3.915 . 0 0 "[ . 1 . 2]" 1
605 1 40 GLU HA 1 40 GLU HG3 . . 3.740 3.675 3.622 3.707 . 0 0 "[ . 1 . 2]" 1
606 1 40 GLU HA 1 43 GLU QB . . 4.120 3.022 2.803 3.154 . 0 0 "[ . 1 . 2]" 1
607 1 40 GLU HA 1 44 ALA H . . 4.690 4.140 3.791 4.393 . 0 0 "[ . 1 . 2]" 1
608 1 40 GLU HA 1 48 ILE MD . . 5.080 4.240 4.032 4.328 . 0 0 "[ . 1 . 2]" 1
609 1 40 GLU HG3 1 41 LYS H . . 4.460 2.248 2.181 2.399 . 0 0 "[ . 1 . 2]" 1
610 1 40 GLU HG3 1 41 LYS HA . . 4.240 3.565 3.459 3.629 . 0 0 "[ . 1 . 2]" 1
611 1 40 GLU HG3 1 41 LYS HB2 . . 4.140 3.198 3.103 3.345 . 0 0 "[ . 1 . 2]" 1
612 1 40 GLU HG3 1 41 LYS HD2 . . 4.700 2.968 2.167 4.547 . 0 0 "[ . 1 . 2]" 1
613 1 40 GLU HG3 1 41 LYS QD . . 4.090 2.689 2.155 3.074 . 0 0 "[ . 1 . 2]" 1
614 1 40 GLU HG3 1 41 LYS HD3 . . 4.700 4.066 2.559 4.600 . 0 0 "[ . 1 . 2]" 1
615 1 40 GLU HG3 1 41 LYS HG3 . . 5.040 4.721 4.559 4.982 . 0 0 "[ . 1 . 2]" 1
616 1 41 LYS H 1 41 LYS HB2 . . 2.770 2.114 2.105 2.136 . 0 0 "[ . 1 . 2]" 1
617 1 41 LYS H 1 41 LYS QD . . 3.770 3.244 2.825 3.531 . 0 0 "[ . 1 . 2]" 1
618 1 41 LYS H 1 41 LYS QE . . 4.860 3.439 3.246 3.603 . 0 0 "[ . 1 . 2]" 1
619 1 41 LYS H 1 42 LEU H . . 3.450 2.470 2.433 2.552 . 0 0 "[ . 1 . 2]" 1
620 1 41 LYS H 1 43 GLU H . . 4.230 4.105 3.926 4.200 . 0 0 "[ . 1 . 2]" 1
621 1 41 LYS H 1 44 ALA MB . . 4.680 4.659 4.581 4.692 0.012 10 0 "[ . 1 . 2]" 1
622 1 41 LYS HA 1 41 LYS HD2 . . 4.340 3.373 2.985 3.595 . 0 0 "[ . 1 . 2]" 1
623 1 41 LYS HA 1 41 LYS QD . . 3.540 3.063 2.122 3.413 . 0 0 "[ . 1 . 2]" 1
624 1 41 LYS HA 1 41 LYS HD3 . . 4.340 3.797 2.150 4.250 . 0 0 "[ . 1 . 2]" 1
625 1 41 LYS HA 1 41 LYS QE . . 3.740 2.436 1.962 3.850 0.110 8 0 "[ . 1 . 2]" 1
626 1 41 LYS HA 1 41 LYS HG2 . . 3.610 3.531 3.458 3.576 . 0 0 "[ . 1 . 2]" 1
627 1 41 LYS HA 1 41 LYS HG3 . . 2.940 2.256 2.116 2.453 . 0 0 "[ . 1 . 2]" 1
628 1 41 LYS HB2 1 41 LYS QE . . 4.780 3.068 1.979 3.539 . 0 0 "[ . 1 . 2]" 1
629 1 41 LYS QE 1 41 LYS HG3 . . 3.680 2.277 1.986 3.429 . 0 0 "[ . 1 . 2]" 1
630 1 42 LEU H 1 42 LEU HB2 . . 2.850 2.412 2.310 2.474 . 0 0 "[ . 1 . 2]" 1
631 1 42 LEU H 1 42 LEU HB3 . . 3.640 3.579 3.553 3.591 . 0 0 "[ . 1 . 2]" 1
632 1 42 LEU H 1 42 LEU HG . . 3.280 2.568 2.365 2.923 . 0 0 "[ . 1 . 2]" 1
633 1 42 LEU H 1 43 GLU H . . 3.490 2.659 2.618 2.710 . 0 0 "[ . 1 . 2]" 1
634 1 42 LEU H 1 44 ALA H . . 4.440 4.001 3.838 4.204 . 0 0 "[ . 1 . 2]" 1
635 1 42 LEU H 1 45 MET HB2 . . 5.500 5.502 5.476 5.508 0.008 10 0 "[ . 1 . 2]" 1
636 1 42 LEU H 1 48 ILE MD . . 3.960 3.854 3.716 3.963 0.003 13 0 "[ . 1 . 2]" 1
637 1 42 LEU H 1 48 ILE HG12 . . 4.840 4.843 4.784 4.857 0.017 12 0 "[ . 1 . 2]" 1
638 1 42 LEU H 1 48 ILE MG . . 4.580 4.438 4.242 4.552 . 0 0 "[ . 1 . 2]" 1
639 1 42 LEU HA 1 42 LEU MD1 . . 3.990 3.848 3.691 3.919 . 0 0 "[ . 1 . 2]" 1
640 1 42 LEU HA 1 42 LEU QD . . 2.990 2.600 2.429 2.845 . 0 0 "[ . 1 . 2]" 1
641 1 42 LEU HA 1 42 LEU MD2 . . 3.990 2.650 2.453 2.959 . 0 0 "[ . 1 . 2]" 1
642 1 42 LEU HA 1 45 MET H . . 3.810 3.435 3.291 3.539 . 0 0 "[ . 1 . 2]" 1
643 1 42 LEU HA 1 45 MET HB2 . . 4.310 2.935 2.872 3.003 . 0 0 "[ . 1 . 2]" 1
644 1 42 LEU HA 1 45 MET HB3 . . 4.940 4.621 4.535 4.685 . 0 0 "[ . 1 . 2]" 1
645 1 42 LEU HA 1 46 GLY H . . 4.780 4.303 4.168 4.387 . 0 0 "[ . 1 . 2]" 1
646 1 42 LEU HA 1 47 ARG HB2 . . 4.360 3.385 3.292 3.448 . 0 0 "[ . 1 . 2]" 1
647 1 42 LEU HA 1 47 ARG HB3 . . 4.760 4.732 4.636 4.786 0.026 8 0 "[ . 1 . 2]" 1
648 1 42 LEU HA 1 47 ARG HD3 . . 4.900 4.909 4.902 4.915 0.015 8 0 "[ . 1 . 2]" 1
649 1 42 LEU HA 1 48 ILE HG12 . . 4.650 4.587 4.533 4.655 0.005 11 0 "[ . 1 . 2]" 1
650 1 42 LEU HA 1 48 ILE MG . . 4.720 4.308 4.227 4.508 . 0 0 "[ . 1 . 2]" 1
651 1 42 LEU HB2 1 42 LEU QD . . 3.090 2.090 1.954 2.146 . 0 0 "[ . 1 . 2]" 1
652 1 42 LEU HB2 1 43 GLU H . . 3.200 2.426 2.364 2.538 . 0 0 "[ . 1 . 2]" 1
653 1 42 LEU HB2 1 48 ILE H . . 4.080 3.848 3.728 4.066 . 0 0 "[ . 1 . 2]" 1
654 1 42 LEU HB2 1 48 ILE MD . . 4.170 2.529 2.325 2.821 . 0 0 "[ . 1 . 2]" 1
655 1 42 LEU HB2 1 48 ILE HG12 . . 3.640 2.923 2.812 3.123 . 0 0 "[ . 1 . 2]" 1
656 1 42 LEU HB2 1 48 ILE MG . . 3.180 2.359 2.222 2.532 . 0 0 "[ . 1 . 2]" 1
657 1 42 LEU HB3 1 43 GLU H . . 3.830 3.415 3.323 3.483 . 0 0 "[ . 1 . 2]" 1
658 1 42 LEU HB3 1 43 GLU HA . . 4.540 4.276 4.148 4.353 . 0 0 "[ . 1 . 2]" 1
659 1 42 LEU HB3 1 44 ALA H . . 5.500 5.346 5.138 5.469 . 0 0 "[ . 1 . 2]" 1
660 1 42 LEU HB3 1 47 ARG H . . 4.410 3.450 3.320 3.523 . 0 0 "[ . 1 . 2]" 1
661 1 42 LEU HB3 1 47 ARG HB2 . . 4.390 1.995 1.984 2.000 . 0 0 "[ . 1 . 2]" 1
662 1 42 LEU HB3 1 47 ARG HB3 . . 4.350 3.686 3.670 3.708 . 0 0 "[ . 1 . 2]" 1
663 1 42 LEU HB3 1 48 ILE H . . 4.190 2.790 2.649 2.933 . 0 0 "[ . 1 . 2]" 1
664 1 42 LEU HB3 1 48 ILE HG12 . . 4.020 2.889 2.836 2.962 . 0 0 "[ . 1 . 2]" 1
665 1 42 LEU HB3 1 48 ILE MG . . 3.730 2.082 1.973 2.480 . 0 0 "[ . 1 . 2]" 1
666 1 42 LEU QD 1 45 MET H . . 5.290 5.128 5.028 5.194 . 0 0 "[ . 1 . 2]" 1
667 1 42 LEU QD 1 45 MET HB2 . . 4.270 4.252 4.050 4.289 0.019 8 0 "[ . 1 . 2]" 1
668 1 42 LEU QD 1 45 MET HG3 . . 4.920 4.883 4.737 4.925 0.005 15 0 "[ . 1 . 2]" 1
669 1 42 LEU QD 1 46 GLY H . . 5.440 5.289 5.127 5.348 . 0 0 "[ . 1 . 2]" 1
670 1 42 LEU QD 1 47 ARG H . . 4.160 4.079 3.910 4.164 0.004 5 0 "[ . 1 . 2]" 1
671 1 42 LEU QD 1 47 ARG HB2 . . 3.600 2.137 1.899 2.356 . 0 0 "[ . 1 . 2]" 1
672 1 42 LEU QD 1 47 ARG HB3 . . 3.580 2.744 2.479 2.952 . 0 0 "[ . 1 . 2]" 1
673 1 42 LEU QD 1 47 ARG HD3 . . 4.640 4.580 4.368 4.644 0.004 13 0 "[ . 1 . 2]" 1
674 1 43 GLU H 1 43 GLU HB2 . . 3.340 2.164 2.075 2.340 . 0 0 "[ . 1 . 2]" 1
675 1 43 GLU H 1 43 GLU HB3 . . 3.340 2.984 2.723 3.165 . 0 0 "[ . 1 . 2]" 1
676 1 43 GLU H 1 43 GLU QG . . 4.120 3.731 3.549 3.920 . 0 0 "[ . 1 . 2]" 1
677 1 43 GLU H 1 44 ALA H . . 3.380 2.757 2.702 2.813 . 0 0 "[ . 1 . 2]" 1
678 1 43 GLU H 1 44 ALA MB . . 4.650 4.322 4.284 4.365 . 0 0 "[ . 1 . 2]" 1
679 1 43 GLU H 1 45 MET H . . 4.750 4.072 4.015 4.147 . 0 0 "[ . 1 . 2]" 1
680 1 43 GLU H 1 48 ILE H . . 4.710 4.284 4.225 4.355 . 0 0 "[ . 1 . 2]" 1
681 1 43 GLU H 1 48 ILE MD . . 3.610 2.205 2.061 2.300 . 0 0 "[ . 1 . 2]" 1
682 1 43 GLU H 1 48 ILE HG12 . . 4.080 2.880 2.808 2.929 . 0 0 "[ . 1 . 2]" 1
683 1 43 GLU H 1 48 ILE HG13 . . 4.110 4.087 4.029 4.121 0.011 15 0 "[ . 1 . 2]" 1
684 1 43 GLU H 1 48 ILE MG . . 4.050 3.847 3.702 3.961 . 0 0 "[ . 1 . 2]" 1
685 1 43 GLU HA 1 43 GLU QG . . 3.230 2.221 2.047 2.414 . 0 0 "[ . 1 . 2]" 1
686 1 43 GLU HA 1 45 MET H . . 4.020 3.857 3.770 4.021 0.001 17 0 "[ . 1 . 2]" 1
687 1 43 GLU HA 1 48 ILE H . . 3.220 3.170 3.003 3.231 0.011 6 0 "[ . 1 . 2]" 1
688 1 43 GLU HA 1 48 ILE MD . . 3.900 3.093 2.943 3.207 . 0 0 "[ . 1 . 2]" 1
689 1 43 GLU HA 1 48 ILE HG12 . . 3.690 2.326 2.157 2.424 . 0 0 "[ . 1 . 2]" 1
690 1 43 GLU HA 1 48 ILE HG13 . . 3.590 2.825 2.646 2.933 . 0 0 "[ . 1 . 2]" 1
691 1 43 GLU HA 1 48 ILE MG . . 4.610 4.308 4.167 4.399 . 0 0 "[ . 1 . 2]" 1
692 1 43 GLU QB 1 44 ALA H . . 3.070 2.688 2.539 2.904 . 0 0 "[ . 1 . 2]" 1
693 1 43 GLU HB2 1 44 ALA H . . 3.850 3.580 3.355 3.824 . 0 0 "[ . 1 . 2]" 1
694 1 43 GLU HB3 1 44 ALA H . . 3.850 2.784 2.594 3.016 . 0 0 "[ . 1 . 2]" 1
695 1 43 GLU QG 1 44 ALA H . . 5.300 4.343 3.983 4.612 . 0 0 "[ . 1 . 2]" 1
696 1 44 ALA H 1 44 ALA MB . . 2.780 2.042 2.027 2.082 . 0 0 "[ . 1 . 2]" 1
697 1 44 ALA H 1 45 MET H . . 2.860 2.592 2.429 2.669 . 0 0 "[ . 1 . 2]" 1
698 1 44 ALA H 1 45 MET HB2 . . 5.500 4.771 4.615 4.937 . 0 0 "[ . 1 . 2]" 1
699 1 44 ALA H 1 45 MET HG2 . . 4.570 4.491 4.296 4.571 0.001 16 0 "[ . 1 . 2]" 1
700 1 44 ALA H 1 48 ILE MD . . 4.620 4.541 4.385 4.621 0.001 7 0 "[ . 1 . 2]" 1
701 1 44 ALA H 1 48 ILE HG12 . . 5.080 5.004 4.854 5.082 0.002 4 0 "[ . 1 . 2]" 1
702 1 44 ALA HA 1 45 MET H . . 3.470 3.447 3.433 3.462 . 0 0 "[ . 1 . 2]" 1
703 1 44 ALA HA 1 46 GLY H . . 4.530 4.340 4.253 4.394 . 0 0 "[ . 1 . 2]" 1
704 1 44 ALA MB 1 45 MET H . . 3.200 3.003 2.969 3.036 . 0 0 "[ . 1 . 2]" 1
705 1 44 ALA MB 1 45 MET HG2 . . 4.100 3.137 3.067 3.212 . 0 0 "[ . 1 . 2]" 1
706 1 44 ALA MB 1 45 MET HG3 . . 4.670 4.607 4.531 4.656 . 0 0 "[ . 1 . 2]" 1
707 1 44 ALA MB 1 46 GLY H . . 4.750 4.548 4.512 4.583 . 0 0 "[ . 1 . 2]" 1
708 1 45 MET H 1 45 MET HB2 . . 3.450 2.428 2.393 2.487 . 0 0 "[ . 1 . 2]" 1
709 1 45 MET H 1 45 MET HB3 . . 3.740 3.643 3.626 3.667 . 0 0 "[ . 1 . 2]" 1
710 1 45 MET H 1 45 MET HG2 . . 3.280 2.783 2.603 2.861 . 0 0 "[ . 1 . 2]" 1
711 1 45 MET H 1 45 MET HG3 . . 3.940 3.878 3.704 3.941 0.001 12 0 "[ . 1 . 2]" 1
712 1 45 MET H 1 46 GLY HA2 . . 5.000 4.450 4.419 4.511 . 0 0 "[ . 1 . 2]" 1
713 1 45 MET H 1 46 GLY QA . . 4.210 4.115 4.089 4.166 . 0 0 "[ . 1 . 2]" 1
714 1 45 MET H 1 46 GLY HA3 . . 5.000 4.846 4.820 4.897 . 0 0 "[ . 1 . 2]" 1
715 1 45 MET H 1 48 ILE H . . 5.230 5.211 5.145 5.234 0.004 11 0 "[ . 1 . 2]" 1
716 1 45 MET HA 1 45 MET HG2 . . 3.530 2.839 2.826 2.883 . 0 0 "[ . 1 . 2]" 1
717 1 45 MET HA 1 45 MET HG3 . . 3.900 3.747 3.728 3.792 . 0 0 "[ . 1 . 2]" 1
718 1 45 MET HA 1 47 ARG H . . 5.240 4.965 4.924 5.066 . 0 0 "[ . 1 . 2]" 1
719 1 45 MET HB2 1 46 GLY H . . 4.000 3.038 2.998 3.105 . 0 0 "[ . 1 . 2]" 1
720 1 45 MET HB2 1 47 ARG H . . 4.040 3.206 3.176 3.277 . 0 0 "[ . 1 . 2]" 1
721 1 45 MET HB2 1 47 ARG HA . . 5.300 5.151 5.108 5.191 . 0 0 "[ . 1 . 2]" 1
722 1 45 MET HB2 1 47 ARG HD2 . . 4.780 4.373 4.247 4.445 . 0 0 "[ . 1 . 2]" 1
723 1 45 MET HB2 1 47 ARG HD3 . . 4.400 2.982 2.887 3.038 . 0 0 "[ . 1 . 2]" 1
724 1 45 MET HB2 1 47 ARG HG2 . . 3.920 2.068 1.990 2.112 . 0 0 "[ . 1 . 2]" 1
725 1 45 MET HB2 1 47 ARG HG3 . . 4.120 3.223 3.055 3.330 . 0 0 "[ . 1 . 2]" 1
726 1 45 MET HB3 1 46 GLY H . . 4.040 3.903 3.846 4.006 . 0 0 "[ . 1 . 2]" 1
727 1 45 MET HB3 1 47 ARG H . . 4.520 4.191 4.089 4.441 . 0 0 "[ . 1 . 2]" 1
728 1 45 MET HB3 1 47 ARG HD2 . . 4.690 4.302 4.222 4.451 . 0 0 "[ . 1 . 2]" 1
729 1 45 MET HB3 1 47 ARG HD3 . . 4.330 2.574 2.491 2.712 . 0 0 "[ . 1 . 2]" 1
730 1 45 MET HB3 1 47 ARG HG2 . . 4.080 3.081 3.023 3.168 . 0 0 "[ . 1 . 2]" 1
731 1 45 MET HG2 1 46 GLY H . . 4.560 4.521 4.408 4.562 0.002 12 0 "[ . 1 . 2]" 1
732 1 45 MET HG2 1 47 ARG H . . 5.500 5.497 5.463 5.505 0.005 8 0 "[ . 1 . 2]" 1
733 1 45 MET HG2 1 47 ARG HD3 . . 5.500 5.243 5.187 5.330 . 0 0 "[ . 1 . 2]" 1
734 1 45 MET HG3 1 46 GLY H . . 5.370 5.191 5.093 5.243 . 0 0 "[ . 1 . 2]" 1
735 1 45 MET HG3 1 47 ARG H . . 5.500 5.495 5.478 5.504 0.004 10 0 "[ . 1 . 2]" 1
736 1 46 GLY H 1 47 ARG H . . 3.400 2.215 2.168 2.306 . 0 0 "[ . 1 . 2]" 1
737 1 46 GLY H 1 47 ARG HD2 . . 5.290 5.265 5.216 5.294 0.004 11 0 "[ . 1 . 2]" 1
738 1 46 GLY H 1 48 ILE H . . 4.200 3.966 3.863 4.067 . 0 0 "[ . 1 . 2]" 1
739 1 46 GLY HA2 1 47 ARG H . . 3.560 2.982 2.918 3.014 . 0 0 "[ . 1 . 2]" 1
740 1 46 GLY HA3 1 47 ARG H . . 3.560 3.481 3.467 3.508 . 0 0 "[ . 1 . 2]" 1
741 1 47 ARG H 1 47 ARG HB2 . . 3.190 2.702 2.683 2.734 . 0 0 "[ . 1 . 2]" 1
742 1 47 ARG H 1 47 ARG HB3 . . 3.700 3.630 3.616 3.658 . 0 0 "[ . 1 . 2]" 1
743 1 47 ARG H 1 47 ARG HD2 . . 4.150 3.590 3.547 3.653 . 0 0 "[ . 1 . 2]" 1
744 1 47 ARG H 1 47 ARG HD3 . . 4.400 3.353 3.161 3.565 . 0 0 "[ . 1 . 2]" 1
745 1 47 ARG H 1 47 ARG HG2 . . 3.250 2.039 1.985 2.130 . 0 0 "[ . 1 . 2]" 1
746 1 47 ARG H 1 48 ILE H . . 3.170 2.389 2.260 2.464 . 0 0 "[ . 1 . 2]" 1
747 1 47 ARG H 1 48 ILE HA . . 5.260 5.064 4.966 5.119 . 0 0 "[ . 1 . 2]" 1
748 1 47 ARG H 1 48 ILE HG12 . . 4.780 3.721 3.554 3.824 . 0 0 "[ . 1 . 2]" 1
749 1 47 ARG H 1 48 ILE MG . . 4.940 4.257 4.095 4.413 . 0 0 "[ . 1 . 2]" 1
750 1 47 ARG H 1 49 LYS H . . 5.340 3.810 3.379 4.215 . 0 0 "[ . 1 . 2]" 1
751 1 47 ARG HA 1 47 ARG HD2 . . 3.860 2.074 2.059 2.100 . 0 0 "[ . 1 . 2]" 1
752 1 47 ARG HA 1 47 ARG HD3 . . 3.960 3.283 3.148 3.445 . 0 0 "[ . 1 . 2]" 1
753 1 47 ARG HA 1 47 ARG HG2 . . 3.640 3.328 3.290 3.392 . 0 0 "[ . 1 . 2]" 1
754 1 47 ARG HA 1 47 ARG HG3 . . 3.960 3.850 3.827 3.880 . 0 0 "[ . 1 . 2]" 1
755 1 47 ARG HA 1 48 ILE HG12 . . 5.500 5.471 5.434 5.506 0.006 17 0 "[ . 1 . 2]" 1
756 1 47 ARG HB2 1 48 ILE H . . 3.610 2.588 2.506 2.742 . 0 0 "[ . 1 . 2]" 1
757 1 47 ARG HB3 1 47 ARG HD3 . . 4.180 3.683 3.667 3.698 . 0 0 "[ . 1 . 2]" 1
758 1 47 ARG HB3 1 48 ILE H . . 3.980 3.854 3.782 3.978 . 0 0 "[ . 1 . 2]" 1
759 1 47 ARG HD2 1 48 ILE H . . 5.170 5.002 4.989 5.014 . 0 0 "[ . 1 . 2]" 1
760 1 47 ARG HD3 1 48 ILE H . . 5.500 5.398 5.208 5.505 0.005 1 0 "[ . 1 . 2]" 1
761 1 47 ARG HG2 1 48 ILE H . . 3.990 3.826 3.793 3.854 . 0 0 "[ . 1 . 2]" 1
762 1 47 ARG HG3 1 48 ILE MG . . 5.060 4.800 4.702 4.952 . 0 0 "[ . 1 . 2]" 1
763 1 48 ILE H 1 48 ILE MD . . 3.920 3.633 3.619 3.655 . 0 0 "[ . 1 . 2]" 1
764 1 48 ILE H 1 48 ILE HG12 . . 3.590 1.956 1.940 1.975 . 0 0 "[ . 1 . 2]" 1
765 1 48 ILE H 1 48 ILE HG13 . . 3.550 2.980 2.850 3.084 . 0 0 "[ . 1 . 2]" 1
766 1 48 ILE H 1 48 ILE MG . . 3.820 2.562 2.451 2.721 . 0 0 "[ . 1 . 2]" 1
767 1 48 ILE H 1 49 LYS H . . 4.680 2.611 2.198 2.996 . 0 0 "[ . 1 . 2]" 1
768 1 48 ILE H 1 49 LYS HA . . 5.500 5.008 4.861 5.192 . 0 0 "[ . 1 . 2]" 1
769 1 48 ILE HA 1 48 ILE MD . . 4.270 4.162 4.160 4.163 . 0 0 "[ . 1 . 2]" 1
770 1 48 ILE HB 1 48 ILE MD . . 3.400 2.400 2.363 2.420 . 0 0 "[ . 1 . 2]" 1
771 1 48 ILE MD 1 48 ILE MG . . 2.900 1.944 1.910 2.038 . 0 0 "[ . 1 . 2]" 1
772 1 48 ILE MD 1 49 LYS H . . 5.270 4.728 3.924 5.274 0.004 15 0 "[ . 1 . 2]" 1
773 1 48 ILE MD 1 49 LYS QB . . 5.200 4.404 3.406 5.189 . 0 0 "[ . 1 . 2]" 1
774 1 48 ILE HG12 1 48 ILE MG . . 2.940 2.372 2.331 2.417 . 0 0 "[ . 1 . 2]" 1
775 1 48 ILE HG12 1 49 LYS H . . 5.070 3.649 2.667 4.388 . 0 0 "[ . 1 . 2]" 1
776 1 48 ILE HG13 1 48 ILE MG . . 3.340 3.199 3.185 3.203 . 0 0 "[ . 1 . 2]" 1
777 1 48 ILE HG13 1 49 LYS H . . 4.140 3.392 2.395 4.115 . 0 0 "[ . 1 . 2]" 1
778 1 48 ILE HG13 1 49 LYS HA . . 4.860 4.056 3.353 4.475 . 0 0 "[ . 1 . 2]" 1
779 1 48 ILE HG13 1 49 LYS QB . . 4.870 3.198 2.259 4.014 . 0 0 "[ . 1 . 2]" 1
780 1 49 LYS H 1 49 LYS QB . . 3.320 2.537 2.147 2.794 . 0 0 "[ . 1 . 2]" 1
781 1 49 LYS H 1 49 LYS HG2 . . 5.340 4.696 4.157 5.131 . 0 0 "[ . 1 . 2]" 1
782 1 49 LYS H 1 49 LYS QG . . 4.580 4.047 3.799 4.330 . 0 0 "[ . 1 . 2]" 1
783 1 49 LYS H 1 49 LYS HG3 . . 5.340 4.443 4.072 4.760 . 0 0 "[ . 1 . 2]" 1
784 1 49 LYS HA 1 50 ARG H . . 3.430 2.234 2.141 2.442 . 0 0 "[ . 1 . 2]" 1
785 1 49 LYS QE 1 49 LYS QG . . 3.280 2.088 1.968 2.306 . 0 0 "[ . 1 . 2]" 1
786 1 49 LYS QG 1 50 ARG H . . 4.540 2.817 2.032 3.692 . 0 0 "[ . 1 . 2]" 1
787 1 49 LYS HG2 1 50 ARG H . . 5.260 3.290 2.055 4.836 . 0 0 "[ . 1 . 2]" 1
788 1 49 LYS HG3 1 50 ARG H . . 5.260 3.551 2.208 5.098 . 0 0 "[ . 1 . 2]" 1
789 1 50 ARG H 1 50 ARG QB . . 3.430 2.767 2.060 3.330 . 0 0 "[ . 1 . 2]" 1
790 1 61 LEU H 1 61 LEU QB . . 3.610 2.901 2.198 3.433 . 0 0 "[ . 1 . 2]" 1
791 1 61 LEU H 1 61 LEU MD1 . . 4.720 3.303 2.169 4.460 . 0 0 "[ . 1 . 2]" 1
792 1 61 LEU H 1 61 LEU QD . . 4.090 2.912 2.156 4.083 . 0 0 "[ . 1 . 2]" 1
793 1 61 LEU H 1 61 LEU MD2 . . 4.720 4.193 2.586 4.735 0.015 20 0 "[ . 1 . 2]" 1
794 1 61 LEU H 1 61 LEU HG . . 4.280 3.792 2.640 4.327 0.047 14 0 "[ . 1 . 2]" 1
795 1 61 LEU H 1 62 THR H . . 5.150 2.644 2.180 3.015 . 0 0 "[ . 1 . 2]" 1
796 1 61 LEU H 1 65 GLU H . . 5.500 5.473 5.305 5.565 0.065 14 0 "[ . 1 . 2]" 1
797 1 61 LEU HA 1 61 LEU QD . . 3.630 2.688 1.969 3.369 . 0 0 "[ . 1 . 2]" 1
798 1 61 LEU QB 1 62 THR H . . 4.350 2.935 1.939 3.948 . 0 0 "[ . 1 . 2]" 1
799 1 61 LEU QB 1 96 ALA MB . . 4.430 4.252 3.369 4.440 0.010 18 0 "[ . 1 . 2]" 1
800 1 61 LEU QD 1 62 THR H . . 4.410 3.866 2.772 4.421 0.011 4 0 "[ . 1 . 2]" 1
801 1 61 LEU QD 1 88 ARG QD . . 4.810 4.110 2.535 4.795 . 0 0 "[ . 1 . 2]" 1
802 1 61 LEU QD 1 92 THR HA . . 4.550 3.666 2.592 4.554 0.004 14 0 "[ . 1 . 2]" 1
803 1 61 LEU QD 1 92 THR HB . . 5.360 4.092 3.456 4.757 . 0 0 "[ . 1 . 2]" 1
804 1 61 LEU QD 1 92 THR MG . . 3.470 2.000 1.667 2.536 . 0 0 "[ . 1 . 2]" 1
805 1 61 LEU QD 1 93 ILE HA . . 4.160 3.912 3.476 4.170 0.010 3 0 "[ . 1 . 2]" 1
806 1 61 LEU QD 1 93 ILE MD . . 4.730 4.035 3.435 4.618 . 0 0 "[ . 1 . 2]" 1
807 1 61 LEU QD 1 95 TYR H . . 5.440 4.513 3.552 5.430 . 0 0 "[ . 1 . 2]" 1
808 1 61 LEU QD 1 96 ALA H . . 3.910 3.218 2.394 3.909 . 0 0 "[ . 1 . 2]" 1
809 1 61 LEU QD 1 96 ALA HA . . 5.390 2.610 1.938 3.702 . 0 0 "[ . 1 . 2]" 1
810 1 61 LEU QD 1 96 ALA MB . . 3.310 2.173 1.800 2.896 . 0 0 "[ . 1 . 2]" 1
811 1 61 LEU MD1 1 62 THR H . . 5.500 4.365 2.869 5.526 0.026 20 0 "[ . 1 . 2]" 1
812 1 61 LEU MD1 1 93 ILE HA . . 5.500 4.416 3.662 5.519 0.019 12 0 "[ . 1 . 2]" 1
813 1 61 LEU MD1 1 96 ALA MB . . 4.110 2.687 1.889 4.113 0.003 12 0 "[ . 1 . 2]" 1
814 1 61 LEU MD2 1 62 THR H . . 5.500 4.529 3.671 5.530 0.030 2 0 "[ . 1 . 2]" 1
815 1 61 LEU MD2 1 93 ILE HA . . 5.500 5.011 3.535 5.506 0.006 8 0 "[ . 1 . 2]" 1
816 1 61 LEU MD2 1 96 ALA MB . . 4.110 3.135 1.812 4.128 0.018 3 0 "[ . 1 . 2]" 1
817 1 61 LEU HG 1 96 ALA HA . . 5.080 4.204 2.300 5.096 0.016 14 0 "[ . 1 . 2]" 1
818 1 62 THR H 1 62 THR MG . . 3.860 3.673 1.911 3.843 . 0 0 "[ . 1 . 2]" 1
819 1 62 THR H 1 63 GLU H . . 4.700 4.569 4.504 4.619 . 0 0 "[ . 1 . 2]" 1
820 1 62 THR H 1 65 GLU H . . 4.820 3.698 3.352 4.088 . 0 0 "[ . 1 . 2]" 1
821 1 62 THR H 1 65 GLU HA . . 5.500 5.142 4.907 5.520 0.020 20 0 "[ . 1 . 2]" 1
822 1 62 THR H 1 65 GLU QB . . 4.100 2.263 1.927 3.088 . 0 0 "[ . 1 . 2]" 1
823 1 62 THR H 1 65 GLU QG . . 4.670 3.181 2.249 3.908 . 0 0 "[ . 1 . 2]" 1
824 1 62 THR H 1 66 LEU QD . . 5.440 4.623 4.180 5.444 0.004 7 0 "[ . 1 . 2]" 1
825 1 62 THR HA 1 64 GLU H . . 4.680 4.325 4.094 4.688 0.008 16 0 "[ . 1 . 2]" 1
826 1 62 THR HB 1 63 GLU H . . 3.390 3.147 2.784 3.373 . 0 0 "[ . 1 . 2]" 1
827 1 62 THR HB 1 64 GLU H . . 3.670 2.787 2.398 3.729 0.059 20 0 "[ . 1 . 2]" 1
828 1 62 THR MG 1 63 GLU H . . 3.810 2.153 1.903 3.963 0.153 20 0 "[ . 1 . 2]" 1
829 1 62 THR MG 1 64 GLU H . . 4.280 2.738 2.358 3.569 . 0 0 "[ . 1 . 2]" 1
830 1 62 THR MG 1 64 GLU HA . . 5.250 5.167 4.795 5.462 0.212 20 0 "[ . 1 . 2]" 1
831 1 62 THR MG 1 65 GLU H . . 4.160 3.730 3.108 4.161 0.001 4 0 "[ . 1 . 2]" 1
832 1 62 THR MG 1 65 GLU QB . . 4.980 4.313 3.534 4.908 . 0 0 "[ . 1 . 2]" 1
833 1 63 GLU H 1 64 GLU H . . 4.250 2.735 2.562 2.805 . 0 0 "[ . 1 . 2]" 1
834 1 63 GLU H 1 65 GLU H . . 4.910 4.139 3.829 4.625 . 0 0 "[ . 1 . 2]" 1
835 1 63 GLU H 1 66 LEU H . . 5.100 4.857 4.592 5.079 . 0 0 "[ . 1 . 2]" 1
836 1 63 GLU H 1 66 LEU QD . . 4.830 3.805 3.277 4.214 . 0 0 "[ . 1 . 2]" 1
837 1 63 GLU H 1 66 LEU HG . . 5.500 5.340 4.434 5.552 0.052 3 0 "[ . 1 . 2]" 1
838 1 63 GLU HA 1 66 LEU QB . . 3.970 3.330 2.208 3.972 0.002 13 0 "[ . 1 . 2]" 1
839 1 64 GLU H 1 64 GLU QB . . 3.210 2.112 2.064 2.195 . 0 0 "[ . 1 . 2]" 1
840 1 64 GLU H 1 64 GLU HG2 . . 4.640 4.138 2.906 4.627 . 0 0 "[ . 1 . 2]" 1
841 1 64 GLU H 1 64 GLU QG . . 4.000 3.429 2.837 3.896 . 0 0 "[ . 1 . 2]" 1
842 1 64 GLU H 1 64 GLU HG3 . . 4.640 3.743 3.022 4.278 . 0 0 "[ . 1 . 2]" 1
843 1 64 GLU H 1 65 GLU H . . 4.000 2.513 2.446 2.706 . 0 0 "[ . 1 . 2]" 1
844 1 64 GLU H 1 66 LEU H . . 5.090 4.207 3.827 4.453 . 0 0 "[ . 1 . 2]" 1
845 1 64 GLU H 1 66 LEU QD . . 4.830 4.557 4.358 4.832 0.002 15 0 "[ . 1 . 2]" 1
846 1 64 GLU H 1 67 ALA H . . 5.180 4.906 4.736 5.103 . 0 0 "[ . 1 . 2]" 1
847 1 64 GLU H 1 67 ALA MB . . 5.500 4.917 4.518 5.298 . 0 0 "[ . 1 . 2]" 1
848 1 64 GLU HA 1 64 GLU HG2 . . 3.900 2.617 2.056 3.536 . 0 0 "[ . 1 . 2]" 1
849 1 64 GLU HA 1 64 GLU HG3 . . 3.900 2.715 2.095 3.650 . 0 0 "[ . 1 . 2]" 1
850 1 64 GLU HA 1 66 LEU H . . 4.950 4.598 4.196 4.894 . 0 0 "[ . 1 . 2]" 1
851 1 64 GLU HA 1 67 ALA MB . . 3.560 2.838 2.454 3.407 . 0 0 "[ . 1 . 2]" 1
852 1 64 GLU QB 1 65 GLU H . . 3.170 2.768 2.566 2.889 . 0 0 "[ . 1 . 2]" 1
853 1 64 GLU HB2 1 65 GLU H . . 3.630 3.175 2.756 3.589 . 0 0 "[ . 1 . 2]" 1
854 1 64 GLU HB3 1 65 GLU H . . 3.630 3.128 2.691 3.563 . 0 0 "[ . 1 . 2]" 1
855 1 65 GLU H 1 65 GLU HB2 . . 3.610 2.376 2.145 2.839 . 0 0 "[ . 1 . 2]" 1
856 1 65 GLU H 1 65 GLU QB . . 3.110 2.289 2.125 2.501 . 0 0 "[ . 1 . 2]" 1
857 1 65 GLU H 1 65 GLU HB3 . . 3.610 3.428 2.258 3.595 . 0 0 "[ . 1 . 2]" 1
858 1 65 GLU H 1 66 LEU H . . 3.690 2.658 2.511 2.889 . 0 0 "[ . 1 . 2]" 1
859 1 65 GLU H 1 66 LEU QD . . 4.640 4.511 4.427 4.642 0.002 20 0 "[ . 1 . 2]" 1
860 1 65 GLU H 1 68 THR HB . . 5.500 5.296 5.077 5.483 . 0 0 "[ . 1 . 2]" 1
861 1 65 GLU HA 1 68 THR H . . 3.380 3.213 3.052 3.392 0.012 16 0 "[ . 1 . 2]" 1
862 1 65 GLU HA 1 68 THR HB . . 3.930 2.682 2.470 2.761 . 0 0 "[ . 1 . 2]" 1
863 1 65 GLU HA 1 68 THR MG . . 4.130 4.101 3.896 4.150 0.020 3 0 "[ . 1 . 2]" 1
864 1 65 GLU HA 1 69 ILE H . . 4.560 3.853 3.618 3.999 . 0 0 "[ . 1 . 2]" 1
865 1 65 GLU HA 1 86 LEU QD . . 4.560 2.975 1.987 3.672 . 0 0 "[ . 1 . 2]" 1
866 1 65 GLU QB 1 66 LEU H . . 3.820 2.519 2.291 2.737 . 0 0 "[ . 1 . 2]" 1
867 1 65 GLU QB 1 66 LEU QD . . 4.500 4.190 3.579 4.488 . 0 0 "[ . 1 . 2]" 1
868 1 65 GLU QB 1 68 THR HB . . 5.090 4.307 3.807 4.733 . 0 0 "[ . 1 . 2]" 1
869 1 65 GLU QB 1 86 LEU QD . . 4.230 2.812 2.014 3.841 . 0 0 "[ . 1 . 2]" 1
870 1 65 GLU QB 1 86 LEU HG . . 4.020 3.966 3.276 4.065 0.045 7 0 "[ . 1 . 2]" 1
871 1 65 GLU QG 1 68 THR HB . . 5.000 4.418 3.905 5.007 0.007 14 0 "[ . 1 . 2]" 1
872 1 65 GLU QG 1 86 LEU QD . . 4.440 2.661 1.925 4.241 . 0 0 "[ . 1 . 2]" 1
873 1 66 LEU H 1 66 LEU HB2 . . 3.720 3.016 2.227 3.549 . 0 0 "[ . 1 . 2]" 1
874 1 66 LEU H 1 66 LEU QB . . 3.250 2.287 2.204 2.517 . 0 0 "[ . 1 . 2]" 1
875 1 66 LEU H 1 66 LEU HB3 . . 3.720 2.848 2.234 3.585 . 0 0 "[ . 1 . 2]" 1
876 1 66 LEU H 1 66 LEU QD . . 3.340 3.074 2.985 3.217 . 0 0 "[ . 1 . 2]" 1
877 1 66 LEU H 1 66 LEU HG . . 4.060 2.663 2.083 2.875 . 0 0 "[ . 1 . 2]" 1
878 1 66 LEU H 1 67 ALA H . . 3.650 2.690 2.557 2.759 . 0 0 "[ . 1 . 2]" 1
879 1 66 LEU H 1 68 THR H . . 4.700 4.045 3.942 4.105 . 0 0 "[ . 1 . 2]" 1
880 1 66 LEU H 1 69 ILE MG . . 4.250 3.946 3.881 4.042 . 0 0 "[ . 1 . 2]" 1
881 1 66 LEU HA 1 66 LEU QD . . 4.110 2.872 2.233 3.336 . 0 0 "[ . 1 . 2]" 1
882 1 66 LEU HA 1 69 ILE H . . 4.800 3.622 3.553 3.756 . 0 0 "[ . 1 . 2]" 1
883 1 66 LEU HA 1 69 ILE HB . . 4.460 3.947 3.829 4.170 . 0 0 "[ . 1 . 2]" 1
884 1 66 LEU HA 1 69 ILE MD . . 4.260 4.145 3.953 4.275 0.015 12 0 "[ . 1 . 2]" 1
885 1 66 LEU HA 1 69 ILE MG . . 4.180 1.935 1.898 2.046 . 0 0 "[ . 1 . 2]" 1
886 1 66 LEU QB 1 67 ALA H . . 4.120 3.180 2.687 3.530 . 0 0 "[ . 1 . 2]" 1
887 1 66 LEU QB 1 69 ILE MG . . 4.550 3.388 3.266 3.574 . 0 0 "[ . 1 . 2]" 1
888 1 66 LEU QD 1 67 ALA H . . 4.440 3.524 2.868 4.236 . 0 0 "[ . 1 . 2]" 1
889 1 67 ALA H 1 67 ALA MB . . 2.920 2.174 2.078 2.272 . 0 0 "[ . 1 . 2]" 1
890 1 67 ALA H 1 68 THR H . . 3.170 2.390 2.376 2.417 . 0 0 "[ . 1 . 2]" 1
891 1 67 ALA H 1 68 THR HB . . 4.860 4.676 4.641 4.752 . 0 0 "[ . 1 . 2]" 1
892 1 67 ALA HA 1 68 THR HA . . 4.850 4.689 4.685 4.692 . 0 0 "[ . 1 . 2]" 1
893 1 67 ALA HA 1 70 ARG H . . 3.940 3.823 3.756 3.924 . 0 0 "[ . 1 . 2]" 1
894 1 67 ALA HA 1 70 ARG QB . . 4.030 3.361 3.285 3.447 . 0 0 "[ . 1 . 2]" 1
895 1 67 ALA HA 1 70 ARG HD2 . . 5.260 4.962 4.558 5.241 . 0 0 "[ . 1 . 2]" 1
896 1 67 ALA HA 1 70 ARG HG2 . . 4.930 2.448 2.135 2.806 . 0 0 "[ . 1 . 2]" 1
897 1 67 ALA MB 1 68 THR H . . 3.260 2.891 2.831 2.951 . 0 0 "[ . 1 . 2]" 1
898 1 67 ALA MB 1 68 THR HA . . 4.870 3.893 3.818 3.946 . 0 0 "[ . 1 . 2]" 1
899 1 67 ALA MB 1 69 ILE H . . 5.260 4.757 4.687 4.894 . 0 0 "[ . 1 . 2]" 1
900 1 68 THR H 1 68 THR HB . . 3.470 2.509 2.481 2.579 . 0 0 "[ . 1 . 2]" 1
901 1 68 THR H 1 68 THR MG . . 3.810 3.782 3.776 3.794 . 0 0 "[ . 1 . 2]" 1
902 1 68 THR H 1 69 ILE H . . 3.710 2.419 2.385 2.489 . 0 0 "[ . 1 . 2]" 1
903 1 68 THR HA 1 68 THR MG . . 3.310 2.364 2.316 2.414 . 0 0 "[ . 1 . 2]" 1
904 1 68 THR HA 1 69 ILE MG . . 5.080 4.830 4.773 4.851 . 0 0 "[ . 1 . 2]" 1
905 1 68 THR HA 1 70 ARG HG3 . . 4.060 3.975 3.827 4.047 . 0 0 "[ . 1 . 2]" 1
906 1 68 THR HA 1 71 GLU H . . 3.780 3.676 3.609 3.741 . 0 0 "[ . 1 . 2]" 1
907 1 68 THR HA 1 86 LEU QD . . 5.320 4.480 3.974 5.093 . 0 0 "[ . 1 . 2]" 1
908 1 68 THR HB 1 69 ILE H . . 4.230 2.590 2.419 2.686 . 0 0 "[ . 1 . 2]" 1
909 1 68 THR HB 1 69 ILE HB . . 5.040 4.344 4.247 4.399 . 0 0 "[ . 1 . 2]" 1
910 1 68 THR HB 1 86 LEU MD1 . . 5.100 2.991 1.950 3.970 . 0 0 "[ . 1 . 2]" 1
911 1 68 THR HB 1 86 LEU QD . . 3.980 2.668 1.921 3.178 . 0 0 "[ . 1 . 2]" 1
912 1 68 THR HB 1 86 LEU MD2 . . 5.100 3.098 2.551 3.814 . 0 0 "[ . 1 . 2]" 1
913 1 68 THR MG 1 69 ILE H . . 4.170 3.490 3.255 3.628 . 0 0 "[ . 1 . 2]" 1
914 1 68 THR MG 1 69 ILE MG . . 4.820 4.690 4.532 4.790 . 0 0 "[ . 1 . 2]" 1
915 1 68 THR MG 1 71 GLU H . . 4.490 4.255 4.110 4.364 . 0 0 "[ . 1 . 2]" 1
916 1 68 THR MG 1 86 LEU MD1 . . 3.310 2.584 1.745 3.319 0.009 7 0 "[ . 1 . 2]" 1
917 1 68 THR MG 1 86 LEU MD2 . . 3.310 2.588 1.768 3.327 0.017 14 0 "[ . 1 . 2]" 1
918 1 69 ILE H 1 69 ILE HB . . 3.410 2.589 2.515 2.611 . 0 0 "[ . 1 . 2]" 1
919 1 69 ILE H 1 69 ILE MG . . 3.430 1.952 1.917 2.076 . 0 0 "[ . 1 . 2]" 1
920 1 69 ILE H 1 70 ARG H . . 3.880 2.678 2.629 2.753 . 0 0 "[ . 1 . 2]" 1
921 1 69 ILE H 1 86 LEU QD . . 3.680 3.211 2.675 3.680 . 0 0 "[ . 1 . 2]" 1
922 1 69 ILE H 1 86 LEU HG . . 5.500 5.012 4.225 5.514 0.014 7 0 "[ . 1 . 2]" 1
923 1 69 ILE HA 1 69 ILE MD . . 4.590 3.686 3.519 3.815 . 0 0 "[ . 1 . 2]" 1
924 1 69 ILE HA 1 69 ILE MG . . 3.350 3.198 3.188 3.201 . 0 0 "[ . 1 . 2]" 1
925 1 69 ILE HA 1 72 LEU H . . 4.570 3.828 3.796 3.852 . 0 0 "[ . 1 . 2]" 1
926 1 69 ILE HA 1 72 LEU MD1 . . 4.780 4.286 4.274 4.292 . 0 0 "[ . 1 . 2]" 1
927 1 69 ILE HA 1 86 LEU QD . . 5.060 2.750 2.220 3.570 . 0 0 "[ . 1 . 2]" 1
928 1 69 ILE HB 1 93 ILE MD . . 4.550 4.341 3.756 4.551 0.001 6 0 "[ . 1 . 2]" 1
929 1 69 ILE MD 1 69 ILE MG . . 3.150 2.130 1.950 2.426 . 0 0 "[ . 1 . 2]" 1
930 1 69 ILE MD 1 82 ILE HB . . 4.270 3.067 2.327 3.522 . 0 0 "[ . 1 . 2]" 1
931 1 69 ILE MD 1 82 ILE MD . . 3.540 2.055 1.881 2.418 . 0 0 "[ . 1 . 2]" 1
932 1 69 ILE MD 1 86 LEU HB2 . . 5.380 5.123 4.562 5.385 0.005 12 0 "[ . 1 . 2]" 1
933 1 69 ILE MD 1 93 ILE HA . . 4.550 3.876 3.056 4.479 . 0 0 "[ . 1 . 2]" 1
934 1 69 ILE MD 1 93 ILE MD . . 3.420 2.637 2.299 2.974 . 0 0 "[ . 1 . 2]" 1
935 1 69 ILE MD 1 93 ILE MG . . 3.730 2.828 1.891 3.561 . 0 0 "[ . 1 . 2]" 1
936 1 69 ILE MD 1 96 ALA MB . . 3.410 2.941 2.142 3.443 0.033 3 0 "[ . 1 . 2]" 1
937 1 69 ILE QG 1 82 ILE MG . . 3.370 1.984 1.892 2.235 . 0 0 "[ . 1 . 2]" 1
938 1 69 ILE QG 1 93 ILE MD . . 4.650 3.910 3.380 4.270 . 0 0 "[ . 1 . 2]" 1
939 1 69 ILE MG 1 70 ARG H . . 3.410 2.058 1.902 2.096 . 0 0 "[ . 1 . 2]" 1
940 1 69 ILE MG 1 70 ARG HA . . 4.300 3.219 3.184 3.345 . 0 0 "[ . 1 . 2]" 1
941 1 69 ILE MG 1 70 ARG HG2 . . 4.870 4.498 4.458 4.570 . 0 0 "[ . 1 . 2]" 1
942 1 69 ILE MG 1 70 ARG HG3 . . 5.170 4.327 4.283 4.371 . 0 0 "[ . 1 . 2]" 1
943 1 69 ILE MG 1 96 ALA MB . . 4.920 4.027 2.669 4.867 . 0 0 "[ . 1 . 2]" 1
944 1 70 ARG H 1 70 ARG HB2 . . 3.750 3.557 3.548 3.564 . 0 0 "[ . 1 . 2]" 1
945 1 70 ARG H 1 70 ARG QB . . 3.200 2.290 2.265 2.308 . 0 0 "[ . 1 . 2]" 1
946 1 70 ARG H 1 70 ARG HB3 . . 3.750 2.319 2.291 2.337 . 0 0 "[ . 1 . 2]" 1
947 1 70 ARG H 1 70 ARG HG2 . . 3.570 3.317 3.269 3.400 . 0 0 "[ . 1 . 2]" 1
948 1 70 ARG HA 1 70 ARG HG3 . . 3.710 3.595 3.587 3.606 . 0 0 "[ . 1 . 2]" 1
949 1 70 ARG HA 1 72 LEU H . . 3.990 3.733 3.727 3.747 . 0 0 "[ . 1 . 2]" 1
950 1 70 ARG HA 1 72 LEU MD1 . . 3.630 2.315 2.305 2.339 . 0 0 "[ . 1 . 2]" 1
951 1 70 ARG HA 1 72 LEU MD2 . . 5.220 4.774 4.760 4.805 . 0 0 "[ . 1 . 2]" 1
952 1 70 ARG HA 1 73 TYR H . . 4.550 3.757 3.744 3.769 . 0 0 "[ . 1 . 2]" 1
953 1 70 ARG HA 1 73 TYR QD . . 5.460 4.310 3.937 5.455 . 0 0 "[ . 1 . 2]" 1
954 1 70 ARG HA 1 74 LEU QD . . 4.880 4.725 4.636 4.808 . 0 0 "[ . 1 . 2]" 1
955 1 70 ARG HA 1 82 ILE MG . . 5.500 5.067 4.883 5.205 . 0 0 "[ . 1 . 2]" 1
956 1 70 ARG QB 1 71 GLU H . . 3.650 3.610 3.601 3.618 . 0 0 "[ . 1 . 2]" 1
957 1 70 ARG HB2 1 70 ARG HD3 . . 3.670 2.122 1.994 2.475 . 0 0 "[ . 1 . 2]" 1
958 1 70 ARG HB2 1 71 GLU H . . 4.190 4.153 4.138 4.169 . 0 0 "[ . 1 . 2]" 1
959 1 70 ARG HB3 1 70 ARG HD3 . . 3.670 3.450 3.358 3.662 . 0 0 "[ . 1 . 2]" 1
960 1 70 ARG HB3 1 71 GLU H . . 4.190 3.966 3.941 3.982 . 0 0 "[ . 1 . 2]" 1
961 1 70 ARG HD2 1 71 GLU H . . 4.230 3.774 3.582 4.059 . 0 0 "[ . 1 . 2]" 1
962 1 70 ARG HD2 1 74 LEU QD . . 3.970 2.354 2.186 2.525 . 0 0 "[ . 1 . 2]" 1
963 1 70 ARG HD3 1 72 LEU MD1 . . 4.750 4.512 4.336 4.609 . 0 0 "[ . 1 . 2]" 1
964 1 70 ARG HD3 1 73 TYR H . . 4.670 4.486 4.149 4.675 0.005 4 0 "[ . 1 . 2]" 1
965 1 70 ARG HD3 1 73 TYR QD . . 5.290 5.070 4.884 5.261 . 0 0 "[ . 1 . 2]" 1
966 1 70 ARG HD3 1 74 LEU QD . . 4.250 2.521 2.195 2.707 . 0 0 "[ . 1 . 2]" 1
967 1 70 ARG HG3 1 71 GLU H . . 3.700 2.220 2.204 2.236 . 0 0 "[ . 1 . 2]" 1
968 1 70 ARG HG3 1 74 LEU QD . . 3.840 3.815 3.736 3.859 0.019 2 0 "[ . 1 . 2]" 1
969 1 71 GLU H 1 72 LEU H . . 3.780 2.746 2.742 2.751 . 0 0 "[ . 1 . 2]" 1
970 1 71 GLU H 1 72 LEU MD1 . . 3.690 3.581 3.574 3.599 . 0 0 "[ . 1 . 2]" 1
971 1 71 GLU H 1 73 TYR H . . 4.830 4.253 4.245 4.257 . 0 0 "[ . 1 . 2]" 1
972 1 72 LEU H 1 72 LEU QB . . 3.400 2.155 2.151 2.157 . 0 0 "[ . 1 . 2]" 1
973 1 72 LEU H 1 72 LEU MD1 . . 3.130 1.932 1.926 1.950 . 0 0 "[ . 1 . 2]" 1
974 1 72 LEU H 1 72 LEU HG . . 3.960 3.904 3.902 3.908 . 0 0 "[ . 1 . 2]" 1
975 1 72 LEU H 1 73 TYR H . . 3.520 2.734 2.729 2.737 . 0 0 "[ . 1 . 2]" 1
976 1 72 LEU H 1 73 TYR HB2 . . 4.940 4.599 4.569 4.685 . 0 0 "[ . 1 . 2]" 1
977 1 72 LEU H 1 74 LEU QD . . 4.430 4.419 4.368 4.434 0.004 18 0 "[ . 1 . 2]" 1
978 1 72 LEU H 1 77 ALA H . . 5.500 5.397 5.192 5.511 0.011 9 0 "[ . 1 . 2]" 1
979 1 72 LEU HA 1 72 LEU MD1 . . 4.190 3.385 3.382 3.387 . 0 0 "[ . 1 . 2]" 1
980 1 72 LEU HA 1 72 LEU MD2 . . 3.300 3.231 3.225 3.234 . 0 0 "[ . 1 . 2]" 1
981 1 72 LEU HA 1 74 LEU QD . . 5.290 5.122 5.032 5.178 . 0 0 "[ . 1 . 2]" 1
982 1 72 LEU HA 1 75 LYS H . . 3.770 3.637 3.599 3.689 . 0 0 "[ . 1 . 2]" 1
983 1 72 LEU HA 1 75 LYS QB . . 3.520 3.077 2.895 3.295 . 0 0 "[ . 1 . 2]" 1
984 1 72 LEU HA 1 77 ALA H . . 4.340 2.696 2.463 2.852 . 0 0 "[ . 1 . 2]" 1
985 1 72 LEU HA 1 77 ALA MB . . 4.270 2.242 2.041 2.542 . 0 0 "[ . 1 . 2]" 1
986 1 72 LEU QB 1 72 LEU MD1 . . 3.050 2.350 2.348 2.353 . 0 0 "[ . 1 . 2]" 1
987 1 72 LEU QB 1 73 TYR H . . 3.660 3.582 3.579 3.583 . 0 0 "[ . 1 . 2]" 1
988 1 72 LEU QB 1 73 TYR HA . . 5.090 4.671 4.669 4.675 . 0 0 "[ . 1 . 2]" 1
989 1 72 LEU QB 1 77 ALA MB . . 3.920 2.364 2.097 2.490 . 0 0 "[ . 1 . 2]" 1
990 1 72 LEU QB 1 82 ILE MD . . 4.380 3.724 3.149 3.888 . 0 0 "[ . 1 . 2]" 1
991 1 72 LEU QB 1 82 ILE HG12 . . 5.180 4.321 4.020 4.524 . 0 0 "[ . 1 . 2]" 1
992 1 72 LEU HB2 1 73 TYR H . . 4.320 4.253 4.249 4.258 . 0 0 "[ . 1 . 2]" 1
993 1 72 LEU HB2 1 82 ILE MG . . 3.810 2.624 2.378 2.807 . 0 0 "[ . 1 . 2]" 1
994 1 72 LEU HB3 1 73 TYR H . . 4.320 3.855 3.850 3.858 . 0 0 "[ . 1 . 2]" 1
995 1 72 LEU HB3 1 82 ILE MG . . 3.810 2.111 2.001 2.220 . 0 0 "[ . 1 . 2]" 1
996 1 72 LEU MD1 1 73 TYR H . . 3.540 1.853 1.842 1.859 . 0 0 "[ . 1 . 2]" 1
997 1 72 LEU MD1 1 73 TYR HB2 . . 4.010 2.249 2.141 2.295 . 0 0 "[ . 1 . 2]" 1
998 1 72 LEU MD1 1 73 TYR HB3 . . 4.230 3.674 3.560 3.714 . 0 0 "[ . 1 . 2]" 1
999 1 72 LEU MD1 1 75 LYS H . . 5.500 5.033 4.976 5.078 . 0 0 "[ . 1 . 2]" 1
1000 1 72 LEU MD1 1 76 GLY H . . 4.990 4.893 4.855 4.916 . 0 0 "[ . 1 . 2]" 1
1001 1 72 LEU MD2 1 73 TYR HA . . 3.850 2.241 2.234 2.249 . 0 0 "[ . 1 . 2]" 1
1002 1 72 LEU MD2 1 73 TYR HB3 . . 4.510 4.345 4.312 4.372 . 0 0 "[ . 1 . 2]" 1
1003 1 72 LEU MD2 1 75 LYS H . . 5.500 5.042 4.977 5.123 . 0 0 "[ . 1 . 2]" 1
1004 1 72 LEU MD2 1 76 GLY HA2 . . 3.670 3.575 3.519 3.667 . 0 0 "[ . 1 . 2]" 1
1005 1 72 LEU MD2 1 77 ALA MB . . 3.590 3.450 3.122 3.601 0.011 3 0 "[ . 1 . 2]" 1
1006 1 72 LEU HG 1 73 TYR H . . 4.420 4.296 4.292 4.301 . 0 0 "[ . 1 . 2]" 1
1007 1 72 LEU HG 1 82 ILE MG . . 4.200 2.790 2.356 3.109 . 0 0 "[ . 1 . 2]" 1
1008 1 73 TYR H 1 73 TYR HB2 . . 4.200 2.173 2.137 2.269 . 0 0 "[ . 1 . 2]" 1
1009 1 73 TYR H 1 73 TYR HB3 . . 4.070 3.077 2.909 3.159 . 0 0 "[ . 1 . 2]" 1
1010 1 73 TYR H 1 74 LEU H . . 3.670 2.456 2.425 2.503 . 0 0 "[ . 1 . 2]" 1
1011 1 73 TYR H 1 74 LEU QB . . 4.620 4.422 4.335 4.488 . 0 0 "[ . 1 . 2]" 1
1012 1 73 TYR H 1 75 LYS H . . 5.080 4.018 3.936 4.092 . 0 0 "[ . 1 . 2]" 1
1013 1 73 TYR H 1 82 ILE MG . . 5.270 5.172 5.047 5.284 0.014 14 0 "[ . 1 . 2]" 1
1014 1 73 TYR HA 1 73 TYR QD . . 4.000 2.498 2.199 2.676 . 0 0 "[ . 1 . 2]" 1
1015 1 73 TYR HB3 1 74 LEU H . . 3.780 2.831 2.631 2.991 . 0 0 "[ . 1 . 2]" 1
1016 1 73 TYR HB3 1 74 LEU HA . . 4.130 3.912 3.871 3.975 . 0 0 "[ . 1 . 2]" 1
1017 1 73 TYR HB3 1 74 LEU QD . . 4.270 2.670 2.341 3.217 . 0 0 "[ . 1 . 2]" 1
1018 1 73 TYR HB3 1 75 LYS H . . 5.500 5.200 5.056 5.313 . 0 0 "[ . 1 . 2]" 1
1019 1 73 TYR HB3 1 76 GLY H . . 5.500 5.260 5.186 5.293 . 0 0 "[ . 1 . 2]" 1
1020 1 73 TYR QD 1 74 LEU HA . . 4.720 4.553 4.313 4.713 . 0 0 "[ . 1 . 2]" 1
1021 1 74 LEU H 1 74 LEU QB . . 3.650 2.342 2.281 2.389 . 0 0 "[ . 1 . 2]" 1
1022 1 74 LEU H 1 74 LEU QD . . 3.390 1.910 1.871 1.952 . 0 0 "[ . 1 . 2]" 1
1023 1 74 LEU H 1 75 LYS H . . 3.770 2.571 2.550 2.643 . 0 0 "[ . 1 . 2]" 1
1024 1 74 LEU H 1 76 GLY H . . 4.630 3.614 3.586 3.681 . 0 0 "[ . 1 . 2]" 1
1025 1 74 LEU H 1 77 ALA H . . 5.500 5.355 5.272 5.443 . 0 0 "[ . 1 . 2]" 1
1026 1 74 LEU HA 1 74 LEU MD1 . . 3.970 2.643 1.947 3.515 . 0 0 "[ . 1 . 2]" 1
1027 1 74 LEU HA 1 74 LEU QD . . 3.250 2.464 1.926 3.087 . 0 0 "[ . 1 . 2]" 1
1028 1 74 LEU HA 1 74 LEU MD2 . . 3.970 3.207 2.909 3.618 . 0 0 "[ . 1 . 2]" 1
1029 1 74 LEU HA 1 75 LYS QG . . 5.340 4.981 4.784 5.141 . 0 0 "[ . 1 . 2]" 1
1030 1 74 LEU QB 1 75 LYS QG . . 3.270 2.988 2.819 3.084 . 0 0 "[ . 1 . 2]" 1
1031 1 74 LEU QD 1 75 LYS H . . 4.100 3.550 3.427 3.636 . 0 0 "[ . 1 . 2]" 1
1032 1 74 LEU QD 1 76 GLY H . . 4.970 4.738 4.583 4.951 . 0 0 "[ . 1 . 2]" 1
1033 1 75 LYS H 1 75 LYS QB . . 3.140 2.444 2.312 2.590 . 0 0 "[ . 1 . 2]" 1
1034 1 75 LYS H 1 75 LYS QE . . 5.340 4.158 3.365 4.804 . 0 0 "[ . 1 . 2]" 1
1035 1 75 LYS H 1 75 LYS QG . . 3.380 2.402 2.082 2.633 . 0 0 "[ . 1 . 2]" 1
1036 1 75 LYS H 1 76 GLY H . . 3.060 2.357 2.324 2.384 . 0 0 "[ . 1 . 2]" 1
1037 1 75 LYS H 1 76 GLY HA2 . . 4.890 4.670 4.644 4.695 . 0 0 "[ . 1 . 2]" 1
1038 1 75 LYS H 1 77 ALA H . . 3.880 3.790 3.726 3.832 . 0 0 "[ . 1 . 2]" 1
1039 1 75 LYS H 1 77 ALA MB . . 4.710 4.493 4.425 4.530 . 0 0 "[ . 1 . 2]" 1
1040 1 75 LYS HA 1 76 GLY H . . 3.450 3.429 3.428 3.431 . 0 0 "[ . 1 . 2]" 1
1041 1 75 LYS QB 1 76 GLY H . . 3.760 3.020 3.014 3.033 . 0 0 "[ . 1 . 2]" 1
1042 1 75 LYS QB 1 77 ALA H . . 3.840 2.644 2.565 2.733 . 0 0 "[ . 1 . 2]" 1
1043 1 75 LYS QD 1 75 LYS QE . . 2.330 2.061 1.994 2.091 . 0 0 "[ . 1 . 2]" 1
1044 1 75 LYS QE 1 75 LYS QG . . 3.290 2.247 1.993 2.815 . 0 0 "[ . 1 . 2]" 1
1045 1 75 LYS QE 1 76 GLY H . . 5.340 5.164 4.560 5.343 0.003 4 0 "[ . 1 . 2]" 1
1046 1 75 LYS QE 1 77 ALA H . . 5.280 4.531 3.878 5.285 0.005 4 0 "[ . 1 . 2]" 1
1047 1 75 LYS QE 1 77 ALA MB . . 5.040 3.531 2.804 5.037 . 0 0 "[ . 1 . 2]" 1
1048 1 75 LYS QG 1 76 GLY H . . 4.600 4.176 3.943 4.357 . 0 0 "[ . 1 . 2]" 1
1049 1 75 LYS QG 1 77 ALA H . . 5.130 4.583 4.364 4.820 . 0 0 "[ . 1 . 2]" 1
1050 1 76 GLY H 1 77 ALA H . . 3.270 2.437 2.383 2.468 . 0 0 "[ . 1 . 2]" 1
1051 1 76 GLY H 1 77 ALA MB . . 4.220 4.011 3.940 4.048 . 0 0 "[ . 1 . 2]" 1
1052 1 76 GLY HA3 1 77 ALA H . . 3.460 3.403 3.402 3.404 . 0 0 "[ . 1 . 2]" 1
1053 1 76 GLY HA3 1 77 ALA MB . . 5.050 4.876 4.856 4.905 . 0 0 "[ . 1 . 2]" 1
1054 1 77 ALA H 1 77 ALA MB . . 3.090 2.033 2.024 2.062 . 0 0 "[ . 1 . 2]" 1
1055 1 77 ALA H 1 78 THR H . . 4.700 4.611 4.604 4.631 . 0 0 "[ . 1 . 2]" 1
1056 1 77 ALA H 1 78 THR MG . . 5.380 5.185 5.052 5.259 . 0 0 "[ . 1 . 2]" 1
1057 1 77 ALA HA 1 78 THR H . . 3.410 2.488 2.442 2.496 . 0 0 "[ . 1 . 2]" 1
1058 1 77 ALA HA 1 78 THR MG . . 5.050 3.362 3.232 3.526 . 0 0 "[ . 1 . 2]" 1
1059 1 77 ALA HA 1 81 GLU HB3 . . 5.300 4.352 4.101 4.670 . 0 0 "[ . 1 . 2]" 1
1060 1 77 ALA HA 1 81 GLU QG . . 4.540 2.616 2.396 2.958 . 0 0 "[ . 1 . 2]" 1
1061 1 77 ALA MB 1 78 THR H . . 3.650 2.399 2.331 2.428 . 0 0 "[ . 1 . 2]" 1
1062 1 77 ALA MB 1 81 GLU H . . 4.030 3.919 3.841 4.021 . 0 0 "[ . 1 . 2]" 1
1063 1 77 ALA MB 1 81 GLU HA . . 4.990 4.224 4.150 4.464 . 0 0 "[ . 1 . 2]" 1
1064 1 77 ALA MB 1 81 GLU HB2 . . 4.110 2.016 1.931 2.155 . 0 0 "[ . 1 . 2]" 1
1065 1 77 ALA MB 1 81 GLU HB3 . . 3.590 2.261 2.101 2.585 . 0 0 "[ . 1 . 2]" 1
1066 1 77 ALA MB 1 81 GLU QG . . 4.450 2.063 1.939 2.308 . 0 0 "[ . 1 . 2]" 1
1067 1 77 ALA MB 1 82 ILE H . . 4.040 3.456 3.325 3.662 . 0 0 "[ . 1 . 2]" 1
1068 1 77 ALA MB 1 82 ILE HA . . 4.680 4.498 4.224 4.685 0.005 7 0 "[ . 1 . 2]" 1
1069 1 77 ALA MB 1 82 ILE HG12 . . 5.500 4.631 4.408 4.872 . 0 0 "[ . 1 . 2]" 1
1070 1 78 THR H 1 78 THR MG . . 3.590 2.668 2.408 2.868 . 0 0 "[ . 1 . 2]" 1
1071 1 78 THR H 1 80 TYR H . . 4.510 4.394 4.286 4.515 0.005 13 0 "[ . 1 . 2]" 1
1072 1 78 THR H 1 81 GLU H . . 4.470 3.096 2.959 3.297 . 0 0 "[ . 1 . 2]" 1
1073 1 78 THR H 1 81 GLU HA . . 4.840 4.630 4.476 4.840 . 0 0 "[ . 1 . 2]" 1
1074 1 78 THR H 1 81 GLU HB2 . . 3.830 2.194 1.954 2.457 . 0 0 "[ . 1 . 2]" 1
1075 1 78 THR H 1 81 GLU HB3 . . 4.040 3.589 3.355 3.844 . 0 0 "[ . 1 . 2]" 1
1076 1 78 THR H 1 82 ILE H . . 4.820 4.215 4.002 4.427 . 0 0 "[ . 1 . 2]" 1
1077 1 78 THR HA 1 82 ILE H . . 5.480 5.217 5.041 5.417 . 0 0 "[ . 1 . 2]" 1
1078 1 78 THR HB 1 79 VAL H . . 3.810 2.132 2.063 2.273 . 0 0 "[ . 1 . 2]" 1
1079 1 78 THR HB 1 80 TYR H . . 3.800 3.071 2.851 3.191 . 0 0 "[ . 1 . 2]" 1
1080 1 78 THR HB 1 81 GLU H . . 4.510 4.300 4.123 4.467 . 0 0 "[ . 1 . 2]" 1
1081 1 78 THR MG 1 81 GLU H . . 4.540 4.458 4.309 4.540 0.000 15 0 "[ . 1 . 2]" 1
1082 1 79 VAL H 1 79 VAL HB . . 3.780 2.667 2.621 2.685 . 0 0 "[ . 1 . 2]" 1
1083 1 79 VAL H 1 79 VAL MG2 . . 3.550 2.037 1.926 2.120 . 0 0 "[ . 1 . 2]" 1
1084 1 79 VAL H 1 80 TYR H . . 4.260 2.729 2.686 2.761 . 0 0 "[ . 1 . 2]" 1
1085 1 79 VAL HA 1 79 VAL MG2 . . 3.540 2.373 2.329 2.416 . 0 0 "[ . 1 . 2]" 1
1086 1 79 VAL HA 1 82 ILE HB . . 4.940 4.840 4.748 4.941 0.001 5 0 "[ . 1 . 2]" 1
1087 1 79 VAL HA 1 82 ILE MD . . 3.990 2.060 1.960 2.229 . 0 0 "[ . 1 . 2]" 1
1088 1 79 VAL HA 1 82 ILE HG12 . . 4.370 2.127 2.005 2.281 . 0 0 "[ . 1 . 2]" 1
1089 1 79 VAL HA 1 93 ILE MG . . 4.300 3.474 3.158 4.145 . 0 0 "[ . 1 . 2]" 1
1090 1 79 VAL HB 1 80 TYR H . . 3.060 2.856 2.780 2.971 . 0 0 "[ . 1 . 2]" 1
1091 1 79 VAL MG1 1 80 TYR H . . 4.050 3.762 3.692 3.848 . 0 0 "[ . 1 . 2]" 1
1092 1 79 VAL MG1 1 80 TYR HA . . 4.670 3.761 3.654 3.908 . 0 0 "[ . 1 . 2]" 1
1093 1 79 VAL MG1 1 82 ILE H . . 5.140 4.865 4.616 5.061 . 0 0 "[ . 1 . 2]" 1
1094 1 79 VAL MG1 1 82 ILE HB . . 5.500 5.166 5.000 5.378 . 0 0 "[ . 1 . 2]" 1
1095 1 79 VAL MG1 1 82 ILE MD . . 3.940 2.180 1.996 2.500 . 0 0 "[ . 1 . 2]" 1
1096 1 79 VAL MG1 1 82 ILE HG12 . . 4.030 3.417 3.076 3.646 . 0 0 "[ . 1 . 2]" 1
1097 1 79 VAL MG1 1 83 ALA H . . 4.400 4.285 4.016 4.401 0.001 3 0 "[ . 1 . 2]" 1
1098 1 79 VAL MG1 1 83 ALA MB . . 4.280 3.620 3.246 3.902 . 0 0 "[ . 1 . 2]" 1
1099 1 79 VAL MG1 1 93 ILE HB . . 3.950 3.448 3.079 3.952 0.002 7 0 "[ . 1 . 2]" 1
1100 1 79 VAL MG1 1 93 ILE HG12 . . 5.500 4.867 4.609 5.258 . 0 0 "[ . 1 . 2]" 1
1101 1 79 VAL MG1 1 93 ILE MG . . 3.910 2.017 1.716 2.860 . 0 0 "[ . 1 . 2]" 1
1102 1 79 VAL MG2 1 80 TYR H . . 3.840 3.824 3.783 3.842 0.002 13 0 "[ . 1 . 2]" 1
1103 1 80 TYR H 1 80 TYR HB2 . . 3.680 2.492 2.363 2.634 . 0 0 "[ . 1 . 2]" 1
1104 1 80 TYR H 1 80 TYR HB3 . . 3.680 2.606 2.462 2.749 . 0 0 "[ . 1 . 2]" 1
1105 1 80 TYR H 1 80 TYR QD . . 4.450 4.191 4.141 4.209 . 0 0 "[ . 1 . 2]" 1
1106 1 80 TYR H 1 81 GLU H . . 3.890 2.495 2.477 2.552 . 0 0 "[ . 1 . 2]" 1
1107 1 80 TYR H 1 82 ILE H . . 5.220 4.432 4.264 4.524 . 0 0 "[ . 1 . 2]" 1
1108 1 80 TYR HA 1 80 TYR QD . . 3.860 2.796 2.265 3.088 . 0 0 "[ . 1 . 2]" 1
1109 1 80 TYR HA 1 80 TYR QE . . 4.660 4.572 4.359 4.661 0.001 4 0 "[ . 1 . 2]" 1
1110 1 80 TYR HA 1 82 ILE HG12 . . 4.880 4.764 4.637 4.880 . 0 0 "[ . 1 . 2]" 1
1111 1 80 TYR HA 1 83 ALA MB . . 3.780 2.702 2.429 2.911 . 0 0 "[ . 1 . 2]" 1
1112 1 80 TYR HB2 1 81 GLU H . . 4.110 3.961 3.720 4.090 . 0 0 "[ . 1 . 2]" 1
1113 1 80 TYR HB3 1 81 GLU H . . 4.110 2.908 2.563 3.003 . 0 0 "[ . 1 . 2]" 1
1114 1 80 TYR QD 1 81 GLU HA . . 4.440 3.684 3.291 4.246 . 0 0 "[ . 1 . 2]" 1
1115 1 80 TYR QD 1 81 GLU QG . . 4.210 3.746 3.360 4.074 . 0 0 "[ . 1 . 2]" 1
1116 1 80 TYR QE 1 84 ARG HD2 . . 3.900 3.172 2.110 3.892 . 0 0 "[ . 1 . 2]" 1
1117 1 80 TYR QE 1 84 ARG HD3 . . 3.900 3.544 2.822 3.892 . 0 0 "[ . 1 . 2]" 1
1118 1 81 GLU H 1 81 GLU HB2 . . 3.430 2.310 2.215 2.365 . 0 0 "[ . 1 . 2]" 1
1119 1 81 GLU H 1 81 GLU HB3 . . 4.030 3.561 3.512 3.586 . 0 0 "[ . 1 . 2]" 1
1120 1 81 GLU H 1 82 ILE H . . 4.040 2.660 2.549 2.913 . 0 0 "[ . 1 . 2]" 1
1121 1 81 GLU H 1 82 ILE HG12 . . 4.360 3.635 3.538 3.868 . 0 0 "[ . 1 . 2]" 1
1122 1 81 GLU H 1 83 ALA H . . 4.180 3.852 3.798 3.942 . 0 0 "[ . 1 . 2]" 1
1123 1 81 GLU HA 1 81 GLU QG . . 3.600 2.587 2.255 2.778 . 0 0 "[ . 1 . 2]" 1
1124 1 81 GLU HA 1 83 ALA H . . 4.600 4.122 4.040 4.249 . 0 0 "[ . 1 . 2]" 1
1125 1 81 GLU HB2 1 82 ILE H . . 4.000 2.441 2.374 2.556 . 0 0 "[ . 1 . 2]" 1
1126 1 81 GLU HB2 1 82 ILE HA . . 5.290 4.443 4.344 4.622 . 0 0 "[ . 1 . 2]" 1
1127 1 81 GLU HB2 1 82 ILE MD . . 5.230 5.207 5.089 5.245 0.015 12 0 "[ . 1 . 2]" 1
1128 1 82 ILE H 1 82 ILE HB . . 3.790 3.609 3.603 3.613 . 0 0 "[ . 1 . 2]" 1
1129 1 82 ILE H 1 82 ILE HG12 . . 3.250 1.957 1.940 2.007 . 0 0 "[ . 1 . 2]" 1
1130 1 82 ILE H 1 82 ILE HG13 . . 3.340 3.078 2.904 3.191 . 0 0 "[ . 1 . 2]" 1
1131 1 82 ILE H 1 83 ALA HA . . 5.500 5.313 5.230 5.335 . 0 0 "[ . 1 . 2]" 1
1132 1 82 ILE H 1 85 GLN H . . 4.970 4.765 4.621 4.871 . 0 0 "[ . 1 . 2]" 1
1133 1 82 ILE HA 1 82 ILE HG13 . . 3.860 3.732 3.704 3.747 . 0 0 "[ . 1 . 2]" 1
1134 1 82 ILE HA 1 82 ILE MG . . 3.390 2.268 2.158 2.308 . 0 0 "[ . 1 . 2]" 1
1135 1 82 ILE HA 1 84 ARG H . . 4.700 4.521 4.275 4.672 . 0 0 "[ . 1 . 2]" 1
1136 1 82 ILE HA 1 85 GLN H . . 4.190 3.408 3.102 3.571 . 0 0 "[ . 1 . 2]" 1
1137 1 82 ILE HA 1 85 GLN HB2 . . 4.260 3.165 2.843 3.355 . 0 0 "[ . 1 . 2]" 1
1138 1 82 ILE HA 1 85 GLN HB3 . . 3.710 2.379 2.267 2.502 . 0 0 "[ . 1 . 2]" 1
1139 1 82 ILE HA 1 85 GLN HG2 . . 5.500 4.249 3.869 4.915 . 0 0 "[ . 1 . 2]" 1
1140 1 82 ILE HA 1 85 GLN QG . . 4.740 3.985 3.663 4.400 . 0 0 "[ . 1 . 2]" 1
1141 1 82 ILE HA 1 85 GLN HG3 . . 5.500 4.875 4.371 5.260 . 0 0 "[ . 1 . 2]" 1
1142 1 82 ILE HA 1 86 LEU HB2 . . 5.060 4.521 4.165 5.074 0.014 7 0 "[ . 1 . 2]" 1
1143 1 82 ILE HA 1 93 ILE MD . . 5.110 4.530 3.953 4.913 . 0 0 "[ . 1 . 2]" 1
1144 1 82 ILE HB 1 83 ALA H . . 3.900 3.745 3.680 3.812 . 0 0 "[ . 1 . 2]" 1
1145 1 82 ILE HB 1 85 GLN HB3 . . 4.480 4.263 3.718 4.483 0.003 16 0 "[ . 1 . 2]" 1
1146 1 82 ILE HG12 1 83 ALA H . . 3.700 2.848 2.682 3.012 . 0 0 "[ . 1 . 2]" 1
1147 1 82 ILE HG13 1 83 ALA H . . 3.280 2.250 2.122 2.343 . 0 0 "[ . 1 . 2]" 1
1148 1 82 ILE HG13 1 84 ARG H . . 5.100 4.940 4.863 5.014 . 0 0 "[ . 1 . 2]" 1
1149 1 82 ILE MG 1 85 GLN HB2 . . 4.690 4.568 4.287 4.694 0.004 14 0 "[ . 1 . 2]" 1
1150 1 82 ILE MG 1 93 ILE MD . . 3.950 3.953 3.858 3.993 0.043 14 0 "[ . 1 . 2]" 1
1151 1 83 ALA H 1 83 ALA MB . . 3.410 2.137 2.025 2.235 . 0 0 "[ . 1 . 2]" 1
1152 1 83 ALA H 1 84 ARG H . . 3.910 2.778 2.682 2.851 . 0 0 "[ . 1 . 2]" 1
1153 1 83 ALA H 1 85 GLN H . . 4.450 4.002 3.768 4.126 . 0 0 "[ . 1 . 2]" 1
1154 1 83 ALA HA 1 86 LEU HB2 . . 5.090 3.773 3.473 4.093 . 0 0 "[ . 1 . 2]" 1
1155 1 83 ALA HA 1 87 GLY H . . 4.310 4.253 4.075 4.329 0.019 14 0 "[ . 1 . 2]" 1
1156 1 83 ALA HA 1 88 ARG H . . 3.900 3.273 3.071 3.701 . 0 0 "[ . 1 . 2]" 1
1157 1 83 ALA HA 1 88 ARG HB2 . . 4.830 3.152 2.339 3.627 . 0 0 "[ . 1 . 2]" 1
1158 1 83 ALA HA 1 88 ARG HB3 . . 5.500 4.721 3.969 5.272 . 0 0 "[ . 1 . 2]" 1
1159 1 83 ALA HA 1 88 ARG QG . . 4.830 4.433 3.669 4.837 0.007 12 0 "[ . 1 . 2]" 1
1160 1 83 ALA HA 1 93 ILE MD . . 4.250 2.719 2.188 3.264 . 0 0 "[ . 1 . 2]" 1
1161 1 83 ALA HA 1 93 ILE HG12 . . 4.650 3.405 3.031 3.770 . 0 0 "[ . 1 . 2]" 1
1162 1 83 ALA HA 1 93 ILE HG13 . . 4.440 2.605 2.120 2.881 . 0 0 "[ . 1 . 2]" 1
1163 1 83 ALA HA 1 93 ILE MG . . 4.490 4.303 3.840 4.519 0.029 15 0 "[ . 1 . 2]" 1
1164 1 83 ALA MB 1 84 ARG H . . 3.170 2.449 2.341 2.576 . 0 0 "[ . 1 . 2]" 1
1165 1 83 ALA MB 1 84 ARG HA . . 4.510 3.765 3.691 3.837 . 0 0 "[ . 1 . 2]" 1
1166 1 83 ALA MB 1 85 GLN H . . 4.500 4.397 4.250 4.502 0.002 11 0 "[ . 1 . 2]" 1
1167 1 83 ALA MB 1 93 ILE H . . 5.420 5.051 4.626 5.376 . 0 0 "[ . 1 . 2]" 1
1168 1 83 ALA MB 1 93 ILE HB . . 4.670 4.153 3.706 4.668 . 0 0 "[ . 1 . 2]" 1
1169 1 83 ALA MB 1 93 ILE MD . . 4.260 3.602 3.255 3.974 . 0 0 "[ . 1 . 2]" 1
1170 1 83 ALA MB 1 93 ILE HG12 . . 4.920 3.645 3.352 3.967 . 0 0 "[ . 1 . 2]" 1
1171 1 83 ALA MB 1 93 ILE HG13 . . 5.340 2.644 2.129 3.175 . 0 0 "[ . 1 . 2]" 1
1172 1 84 ARG H 1 84 ARG HB2 . . 3.650 2.115 2.083 2.249 . 0 0 "[ . 1 . 2]" 1
1173 1 84 ARG H 1 84 ARG QB . . 3.060 2.094 2.061 2.225 . 0 0 "[ . 1 . 2]" 1
1174 1 84 ARG H 1 84 ARG HB3 . . 3.650 3.357 3.098 3.533 . 0 0 "[ . 1 . 2]" 1
1175 1 84 ARG H 1 84 ARG HD2 . . 4.890 4.190 2.817 4.874 . 0 0 "[ . 1 . 2]" 1
1176 1 84 ARG H 1 84 ARG QD . . 4.210 3.563 2.779 4.077 . 0 0 "[ . 1 . 2]" 1
1177 1 84 ARG H 1 84 ARG HD3 . . 4.890 4.121 2.974 4.856 . 0 0 "[ . 1 . 2]" 1
1178 1 84 ARG H 1 85 GLN H . . 3.540 2.528 2.484 2.564 . 0 0 "[ . 1 . 2]" 1
1179 1 84 ARG H 1 85 GLN HB2 . . 4.860 4.784 4.739 4.832 . 0 0 "[ . 1 . 2]" 1
1180 1 84 ARG H 1 85 GLN HB3 . . 4.810 4.802 4.752 4.813 0.003 18 0 "[ . 1 . 2]" 1
1181 1 84 ARG HA 1 84 ARG HD2 . . 4.680 4.221 3.610 4.617 . 0 0 "[ . 1 . 2]" 1
1182 1 84 ARG HA 1 84 ARG QD . . 4.100 3.777 3.433 4.016 . 0 0 "[ . 1 . 2]" 1
1183 1 84 ARG HA 1 84 ARG HD3 . . 4.680 4.323 3.785 4.518 . 0 0 "[ . 1 . 2]" 1
1184 1 84 ARG HA 1 84 ARG HG2 . . 4.060 2.881 2.459 3.452 . 0 0 "[ . 1 . 2]" 1
1185 1 84 ARG HA 1 84 ARG QG . . 3.470 2.153 2.014 2.297 . 0 0 "[ . 1 . 2]" 1
1186 1 84 ARG HA 1 84 ARG HG3 . . 4.060 2.276 2.035 2.661 . 0 0 "[ . 1 . 2]" 1
1187 1 84 ARG QB 1 84 ARG QD . . 2.760 2.063 1.986 2.128 . 0 0 "[ . 1 . 2]" 1
1188 1 84 ARG HB2 1 85 GLN H . . 3.560 3.068 2.675 3.308 . 0 0 "[ . 1 . 2]" 1
1189 1 84 ARG HB3 1 85 GLN H . . 3.560 3.167 2.751 3.498 . 0 0 "[ . 1 . 2]" 1
1190 1 85 GLN H 1 85 GLN HB2 . . 3.240 2.459 2.409 2.530 . 0 0 "[ . 1 . 2]" 1
1191 1 85 GLN H 1 85 GLN HB3 . . 3.330 2.597 2.533 2.644 . 0 0 "[ . 1 . 2]" 1
1192 1 85 GLN H 1 85 GLN HG2 . . 4.770 4.554 4.440 4.610 . 0 0 "[ . 1 . 2]" 1
1193 1 85 GLN H 1 85 GLN QG . . 4.160 4.004 3.950 4.060 . 0 0 "[ . 1 . 2]" 1
1194 1 85 GLN H 1 85 GLN HG3 . . 4.770 4.442 4.366 4.539 . 0 0 "[ . 1 . 2]" 1
1195 1 85 GLN H 1 86 LEU HA . . 5.500 5.397 5.286 5.457 . 0 0 "[ . 1 . 2]" 1
1196 1 85 GLN H 1 86 LEU QD . . 4.410 4.229 3.941 4.414 0.004 7 0 "[ . 1 . 2]" 1
1197 1 85 GLN HA 1 85 GLN HG2 . . 3.740 3.456 2.712 3.742 0.002 8 0 "[ . 1 . 2]" 1
1198 1 85 GLN HA 1 85 GLN QG . . 3.200 2.621 2.331 3.026 . 0 0 "[ . 1 . 2]" 1
1199 1 85 GLN HA 1 85 GLN HG3 . . 3.740 2.751 2.369 3.226 . 0 0 "[ . 1 . 2]" 1
1200 1 85 GLN HA 1 86 LEU QD . . 4.390 4.305 4.211 4.389 . 0 0 "[ . 1 . 2]" 1
1201 1 85 GLN HB3 1 86 LEU H . . 3.720 2.256 2.245 2.321 . 0 0 "[ . 1 . 2]" 1
1202 1 85 GLN HB3 1 86 LEU HB2 . . 4.140 4.012 3.858 4.143 0.003 3 0 "[ . 1 . 2]" 1
1203 1 85 GLN HB3 1 86 LEU QD . . 3.650 2.496 2.320 2.710 . 0 0 "[ . 1 . 2]" 1
1204 1 85 GLN HB3 1 87 GLY H . . 4.470 4.418 4.357 4.462 . 0 0 "[ . 1 . 2]" 1
1205 1 85 GLN QG 1 86 LEU H . . 4.520 3.423 3.323 3.634 . 0 0 "[ . 1 . 2]" 1
1206 1 85 GLN QG 1 86 LEU QD . . 3.880 2.473 2.123 2.870 . 0 0 "[ . 1 . 2]" 1
1207 1 86 LEU H 1 86 LEU HB3 . . 3.610 3.475 3.432 3.523 . 0 0 "[ . 1 . 2]" 1
1208 1 86 LEU H 1 86 LEU QD . . 3.450 2.281 1.963 2.542 . 0 0 "[ . 1 . 2]" 1
1209 1 86 LEU H 1 87 GLY H . . 2.850 2.471 2.374 2.567 . 0 0 "[ . 1 . 2]" 1
1210 1 86 LEU HA 1 86 LEU QD . . 3.430 2.077 1.892 2.423 . 0 0 "[ . 1 . 2]" 1
1211 1 86 LEU HA 1 88 ARG H . . 5.140 4.736 4.314 5.065 . 0 0 "[ . 1 . 2]" 1
1212 1 86 LEU HA 1 88 ARG QG . . 4.410 4.395 4.096 4.437 0.027 15 0 "[ . 1 . 2]" 1
1213 1 86 LEU HB2 1 87 GLY H . . 4.750 3.319 3.218 3.523 . 0 0 "[ . 1 . 2]" 1
1214 1 86 LEU HB2 1 88 ARG H . . 4.070 3.376 2.985 3.708 . 0 0 "[ . 1 . 2]" 1
1215 1 86 LEU HB2 1 88 ARG HB2 . . 4.050 3.806 3.657 4.054 0.004 7 0 "[ . 1 . 2]" 1
1216 1 86 LEU HB2 1 93 ILE MD . . 4.020 3.083 2.078 3.995 . 0 0 "[ . 1 . 2]" 1
1217 1 86 LEU HB3 1 87 GLY H . . 3.980 3.784 3.698 3.915 . 0 0 "[ . 1 . 2]" 1
1218 1 86 LEU HB3 1 88 ARG QG . . 3.880 2.252 1.957 2.514 . 0 0 "[ . 1 . 2]" 1
1219 1 86 LEU QD 1 87 GLY H . . 4.240 3.973 3.883 4.086 . 0 0 "[ . 1 . 2]" 1
1220 1 86 LEU QD 1 88 ARG QG . . 4.010 3.404 2.708 3.792 . 0 0 "[ . 1 . 2]" 1
1221 1 86 LEU QD 1 93 ILE MD . . 4.930 3.294 1.978 4.335 . 0 0 "[ . 1 . 2]" 1
1222 1 87 GLY H 1 88 ARG H . . 2.780 2.527 2.352 2.692 . 0 0 "[ . 1 . 2]" 1
1223 1 87 GLY H 1 88 ARG QG . . 4.330 4.176 3.818 4.351 0.021 15 0 "[ . 1 . 2]" 1
1224 1 88 ARG HA 1 88 ARG HD2 . . 4.470 3.607 2.815 4.185 . 0 0 "[ . 1 . 2]" 1
1225 1 88 ARG HA 1 88 ARG QD . . 3.860 2.389 1.970 3.705 . 0 0 "[ . 1 . 2]" 1
1226 1 88 ARG HA 1 88 ARG HD3 . . 4.470 2.482 1.999 4.399 . 0 0 "[ . 1 . 2]" 1
1227 1 88 ARG HB2 1 88 ARG QG . . 2.570 2.167 2.160 2.225 . 0 0 "[ . 1 . 2]" 1
1228 1 88 ARG HB2 1 92 THR HB . . 4.590 3.401 2.652 4.638 0.048 13 0 "[ . 1 . 2]" 1
1229 1 88 ARG HB2 1 93 ILE HG13 . . 4.130 3.711 3.240 4.133 0.003 3 0 "[ . 1 . 2]" 1
1230 1 88 ARG HB3 1 92 THR HB . . 3.780 2.333 1.997 3.032 . 0 0 "[ . 1 . 2]" 1
1231 1 88 ARG HB3 1 93 ILE H . . 4.980 3.684 3.373 4.055 . 0 0 "[ . 1 . 2]" 1
1232 1 88 ARG HB3 1 93 ILE HA . . 5.500 5.323 5.010 5.518 0.018 18 0 "[ . 1 . 2]" 1
1233 1 88 ARG HB3 1 93 ILE MD . . 4.780 3.652 2.979 4.256 . 0 0 "[ . 1 . 2]" 1
1234 1 88 ARG QD 1 92 THR MG . . 3.880 2.434 1.908 3.250 . 0 0 "[ . 1 . 2]" 1
1235 1 88 ARG QD 1 93 ILE MD . . 5.340 4.330 1.964 5.002 . 0 0 "[ . 1 . 2]" 1
1236 1 88 ARG HD2 1 92 THR MG . . 4.460 2.579 1.932 3.773 . 0 0 "[ . 1 . 2]" 1
1237 1 88 ARG HD3 1 92 THR MG . . 4.460 3.393 2.697 4.462 0.002 14 0 "[ . 1 . 2]" 1
1238 1 88 ARG QG 1 92 THR HB . . 4.420 3.207 1.982 4.387 . 0 0 "[ . 1 . 2]" 1
1239 1 88 ARG QG 1 93 ILE MD . . 3.650 2.942 1.953 3.506 . 0 0 "[ . 1 . 2]" 1
1240 1 88 ARG QG 1 93 ILE HG12 . . 4.900 3.938 3.341 4.587 . 0 0 "[ . 1 . 2]" 1
1241 1 88 ARG HG2 1 93 ILE MD . . 4.250 3.850 3.204 4.253 0.003 11 0 "[ . 1 . 2]" 1
1242 1 88 ARG HG3 1 93 ILE MD . . 4.250 3.091 1.970 3.734 . 0 0 "[ . 1 . 2]" 1
1243 1 91 SER QB 1 92 THR H . . 3.930 2.594 2.258 3.085 . 0 0 "[ . 1 . 2]" 1
1244 1 91 SER QB 1 92 THR HA . . 5.340 3.853 3.663 4.332 . 0 0 "[ . 1 . 2]" 1
1245 1 92 THR H 1 92 THR HB . . 4.170 2.668 2.488 2.915 . 0 0 "[ . 1 . 2]" 1
1246 1 92 THR H 1 92 THR MG . . 4.090 3.747 3.683 3.770 . 0 0 "[ . 1 . 2]" 1
1247 1 92 THR H 1 93 ILE H . . 3.730 2.799 2.560 2.920 . 0 0 "[ . 1 . 2]" 1
1248 1 92 THR HA 1 92 THR MG . . 3.710 2.316 2.140 2.414 . 0 0 "[ . 1 . 2]" 1
1249 1 92 THR HA 1 93 ILE HG12 . . 5.500 5.377 5.308 5.420 . 0 0 "[ . 1 . 2]" 1
1250 1 92 THR HA 1 94 TYR H . . 4.800 4.511 4.181 4.767 . 0 0 "[ . 1 . 2]" 1
1251 1 92 THR HA 1 95 TYR H . . 3.790 3.529 3.310 3.721 . 0 0 "[ . 1 . 2]" 1
1252 1 92 THR HA 1 95 TYR QB . . 4.010 2.766 2.554 2.979 . 0 0 "[ . 1 . 2]" 1
1253 1 92 THR HB 1 93 ILE H . . 4.190 2.447 2.355 2.662 . 0 0 "[ . 1 . 2]" 1
1254 1 92 THR HB 1 93 ILE HA . . 4.430 4.117 3.891 4.250 . 0 0 "[ . 1 . 2]" 1
1255 1 92 THR HB 1 93 ILE MD . . 4.640 3.734 3.473 4.032 . 0 0 "[ . 1 . 2]" 1
1256 1 92 THR HB 1 93 ILE HG12 . . 5.260 3.270 3.058 3.556 . 0 0 "[ . 1 . 2]" 1
1257 1 92 THR MG 1 93 ILE H . . 5.150 3.490 3.233 3.776 . 0 0 "[ . 1 . 2]" 1
1258 1 92 THR MG 1 93 ILE HA . . 4.470 3.683 3.305 4.107 . 0 0 "[ . 1 . 2]" 1
1259 1 92 THR MG 1 93 ILE MD . . 4.140 3.570 3.086 3.930 . 0 0 "[ . 1 . 2]" 1
1260 1 92 THR MG 1 94 TYR H . . 5.160 5.103 4.837 5.172 0.012 7 0 "[ . 1 . 2]" 1
1261 1 92 THR MG 1 95 TYR H . . 4.750 4.507 4.084 4.752 0.002 12 0 "[ . 1 . 2]" 1
1262 1 92 THR MG 1 96 ALA H . . 4.420 4.132 3.464 4.434 0.014 18 0 "[ . 1 . 2]" 1
1263 1 92 THR MG 1 96 ALA MB . . 4.400 3.724 2.934 4.305 . 0 0 "[ . 1 . 2]" 1
1264 1 93 ILE H 1 93 ILE HB . . 4.170 2.568 2.531 2.613 . 0 0 "[ . 1 . 2]" 1
1265 1 93 ILE H 1 93 ILE MD . . 4.030 3.240 3.071 3.358 . 0 0 "[ . 1 . 2]" 1
1266 1 93 ILE H 1 93 ILE HG12 . . 3.840 2.043 1.976 2.108 . 0 0 "[ . 1 . 2]" 1
1267 1 93 ILE H 1 93 ILE HG13 . . 4.210 3.523 3.482 3.576 . 0 0 "[ . 1 . 2]" 1
1268 1 93 ILE H 1 93 ILE MG . . 3.930 3.765 3.762 3.767 . 0 0 "[ . 1 . 2]" 1
1269 1 93 ILE H 1 94 TYR H . . 3.920 2.792 2.657 2.905 . 0 0 "[ . 1 . 2]" 1
1270 1 93 ILE H 1 95 TYR H . . 4.340 4.175 4.047 4.315 . 0 0 "[ . 1 . 2]" 1
1271 1 93 ILE H 1 95 TYR QB . . 5.320 4.940 4.781 5.090 . 0 0 "[ . 1 . 2]" 1
1272 1 93 ILE H 1 96 ALA MB . . 5.500 4.736 4.316 5.176 . 0 0 "[ . 1 . 2]" 1
1273 1 93 ILE HA 1 93 ILE MD . . 3.600 1.977 1.968 2.038 . 0 0 "[ . 1 . 2]" 1
1274 1 93 ILE HA 1 93 ILE HG12 . . 4.170 2.998 2.934 3.050 . 0 0 "[ . 1 . 2]" 1
1275 1 93 ILE HA 1 93 ILE MG . . 3.720 2.360 2.305 2.404 . 0 0 "[ . 1 . 2]" 1
1276 1 93 ILE HA 1 95 TYR H . . 4.520 4.280 4.034 4.403 . 0 0 "[ . 1 . 2]" 1
1277 1 93 ILE HA 1 96 ALA MB . . 4.090 2.596 2.256 3.040 . 0 0 "[ . 1 . 2]" 1
1278 1 93 ILE HB 1 94 TYR H . . 3.980 2.518 2.404 2.688 . 0 0 "[ . 1 . 2]" 1
1279 1 93 ILE MD 1 93 ILE MG . . 3.210 2.013 1.915 2.097 . 0 0 "[ . 1 . 2]" 1
1280 1 93 ILE MD 1 96 ALA MB . . 4.510 3.456 3.220 3.785 . 0 0 "[ . 1 . 2]" 1
1281 1 93 ILE HG12 1 94 TYR H . . 4.410 4.193 4.141 4.264 . 0 0 "[ . 1 . 2]" 1
1282 1 93 ILE HG13 1 94 TYR H . . 5.120 4.838 4.751 4.969 . 0 0 "[ . 1 . 2]" 1
1283 1 93 ILE MG 1 94 TYR H . . 3.780 3.359 3.237 3.545 . 0 0 "[ . 1 . 2]" 1
1284 1 93 ILE MG 1 94 TYR HA . . 4.380 3.407 3.302 3.627 . 0 0 "[ . 1 . 2]" 1
1285 1 93 ILE MG 1 95 TYR H . . 4.900 4.879 4.696 4.914 0.014 7 0 "[ . 1 . 2]" 1
1286 1 93 ILE MG 1 96 ALA H . . 4.510 4.430 4.103 4.523 0.013 18 0 "[ . 1 . 2]" 1
1287 1 93 ILE MG 1 96 ALA MB . . 4.280 3.339 2.966 3.514 . 0 0 "[ . 1 . 2]" 1
1288 1 93 ILE MG 1 97 LEU H . . 4.130 3.961 3.639 4.133 0.003 12 0 "[ . 1 . 2]" 1
1289 1 94 TYR H 1 94 TYR QB . . 3.410 2.135 2.049 2.253 . 0 0 "[ . 1 . 2]" 1
1290 1 94 TYR H 1 95 TYR H . . 3.590 2.715 2.558 2.806 . 0 0 "[ . 1 . 2]" 1
1291 1 94 TYR H 1 95 TYR QB . . 5.020 4.444 4.250 4.598 . 0 0 "[ . 1 . 2]" 1
1292 1 94 TYR H 1 96 ALA H . . 4.770 4.157 4.040 4.394 . 0 0 "[ . 1 . 2]" 1
1293 1 94 TYR H 1 96 ALA MB . . 4.990 4.769 4.564 5.004 0.014 5 0 "[ . 1 . 2]" 1
1294 1 94 TYR HA 1 97 LEU H . . 4.380 3.806 3.615 3.942 . 0 0 "[ . 1 . 2]" 1
1295 1 94 TYR HA 1 97 LEU QB . . 4.700 3.477 2.980 4.210 . 0 0 "[ . 1 . 2]" 1
1296 1 94 TYR HA 1 97 LEU QD . . 4.150 2.968 1.886 3.872 . 0 0 "[ . 1 . 2]" 1
1297 1 94 TYR HA 1 98 LYS H . . 3.950 3.815 3.614 3.958 0.008 14 0 "[ . 1 . 2]" 1
1298 1 94 TYR QB 1 95 TYR H . . 4.080 2.733 2.597 2.882 . 0 0 "[ . 1 . 2]" 1
1299 1 95 TYR H 1 95 TYR QB . . 3.310 2.118 2.050 2.250 . 0 0 "[ . 1 . 2]" 1
1300 1 95 TYR H 1 96 ALA H . . 3.930 2.582 2.518 2.670 . 0 0 "[ . 1 . 2]" 1
1301 1 95 TYR H 1 97 LEU QD . . 5.370 5.086 4.179 5.369 . 0 0 "[ . 1 . 2]" 1
1302 1 95 TYR H 1 98 LYS H . . 4.990 4.766 4.637 4.840 . 0 0 "[ . 1 . 2]" 1
1303 1 95 TYR H 1 99 LYS H . . 5.500 5.519 5.481 5.626 0.126 16 0 "[ . 1 . 2]" 1
1304 1 95 TYR HA 1 99 LYS H . . 4.220 3.262 3.131 3.725 . 0 0 "[ . 1 . 2]" 1
1305 1 95 TYR QB 1 96 ALA H . . 3.590 2.765 2.558 2.883 . 0 0 "[ . 1 . 2]" 1
1306 1 95 TYR QB 1 97 LEU H . . 5.340 5.037 4.735 5.267 . 0 0 "[ . 1 . 2]" 1
1307 1 95 TYR QB 1 99 LYS H . . 5.340 4.476 4.196 4.944 . 0 0 "[ . 1 . 2]" 1
1308 1 96 ALA H 1 96 ALA MB . . 3.370 2.105 2.025 2.234 . 0 0 "[ . 1 . 2]" 1
1309 1 96 ALA H 1 97 LEU H . . 4.180 2.862 2.698 2.938 . 0 0 "[ . 1 . 2]" 1
1310 1 96 ALA H 1 98 LYS H . . 4.330 4.183 3.984 4.334 0.004 18 0 "[ . 1 . 2]" 1
1311 1 96 ALA HA 1 99 LYS H . . 4.270 4.158 3.718 4.271 0.001 10 0 "[ . 1 . 2]" 1
1312 1 96 ALA HA 1 99 LYS HB2 . . 4.870 4.286 3.437 4.597 . 0 0 "[ . 1 . 2]" 1
1313 1 96 ALA HA 1 99 LYS HB3 . . 4.410 3.379 2.738 3.645 . 0 0 "[ . 1 . 2]" 1
1314 1 96 ALA MB 1 97 LEU H . . 3.940 2.342 2.169 2.608 . 0 0 "[ . 1 . 2]" 1
1315 1 97 LEU H 1 97 LEU HB2 . . 4.160 2.486 2.162 3.567 . 0 0 "[ . 1 . 2]" 1
1316 1 97 LEU H 1 97 LEU QB . . 3.480 2.403 2.142 2.657 . 0 0 "[ . 1 . 2]" 1
1317 1 97 LEU H 1 97 LEU HB3 . . 4.160 3.528 2.742 3.593 . 0 0 "[ . 1 . 2]" 1
1318 1 97 LEU H 1 97 LEU QD . . 4.120 2.587 1.921 2.953 . 0 0 "[ . 1 . 2]" 1
1319 1 97 LEU H 1 98 LYS H . . 4.070 2.658 2.594 2.749 . 0 0 "[ . 1 . 2]" 1
1320 1 97 LEU H 1 104 LEU HG . . 4.800 4.610 4.086 4.798 . 0 0 "[ . 1 . 2]" 1
1321 1 97 LEU HA 1 100 LEU H . . 3.960 3.512 3.443 3.714 . 0 0 "[ . 1 . 2]" 1
1322 1 97 LEU HA 1 100 LEU HB2 . . 4.950 2.486 2.236 3.215 . 0 0 "[ . 1 . 2]" 1
1323 1 97 LEU HA 1 100 LEU HB3 . . 4.830 3.731 3.405 4.772 . 0 0 "[ . 1 . 2]" 1
1324 1 97 LEU HA 1 100 LEU QD . . 3.930 3.237 2.398 3.782 . 0 0 "[ . 1 . 2]" 1
1325 1 97 LEU HA 1 104 LEU QD . . 4.330 3.832 2.460 4.315 . 0 0 "[ . 1 . 2]" 1
1326 1 97 LEU QB 1 98 LYS H . . 3.090 2.452 2.264 3.113 0.023 16 0 "[ . 1 . 2]" 1
1327 1 97 LEU QB 1 104 LEU QB . . 3.580 3.169 1.936 3.643 0.063 7 0 "[ . 1 . 2]" 1
1328 1 97 LEU QB 1 104 LEU QD . . 2.680 2.003 1.820 2.485 . 0 0 "[ . 1 . 2]" 1
1329 1 97 LEU QB 1 104 LEU HG . . 2.680 2.221 1.894 2.668 . 0 0 "[ . 1 . 2]" 1
1330 1 97 LEU QD 1 98 LYS H . . 4.560 3.637 2.037 3.924 . 0 0 "[ . 1 . 2]" 1
1331 1 98 LYS H 1 99 LYS H . . 3.860 2.911 2.647 2.975 . 0 0 "[ . 1 . 2]" 1
1332 1 98 LYS H 1 100 LEU H . . 4.750 3.945 3.815 4.235 . 0 0 "[ . 1 . 2]" 1
1333 1 98 LYS H 1 102 LEU H . . 5.240 4.950 4.726 5.245 0.005 18 0 "[ . 1 . 2]" 1
1334 1 98 LYS H 1 104 LEU QB . . 4.800 4.186 3.023 4.873 0.073 5 0 "[ . 1 . 2]" 1
1335 1 98 LYS H 1 104 LEU QD . . 4.180 3.499 1.915 4.202 0.022 5 0 "[ . 1 . 2]" 1
1336 1 98 LYS H 1 104 LEU HG . . 5.170 3.878 2.917 5.202 0.032 16 0 "[ . 1 . 2]" 1
1337 1 99 LYS H 1 99 LYS HB2 . . 3.340 2.440 2.276 2.630 . 0 0 "[ . 1 . 2]" 1
1338 1 99 LYS H 1 99 LYS HB3 . . 3.150 2.609 2.416 2.797 . 0 0 "[ . 1 . 2]" 1
1339 1 99 LYS H 1 100 LEU HB2 . . 4.790 4.524 4.474 4.609 . 0 0 "[ . 1 . 2]" 1
1340 1 99 LYS H 1 100 LEU QD . . 4.600 4.382 4.049 4.603 0.003 15 0 "[ . 1 . 2]" 1
1341 1 99 LYS H 1 101 GLY H . . 4.480 4.156 4.070 4.202 . 0 0 "[ . 1 . 2]" 1
1342 1 99 LYS HB3 1 100 LEU H . . 3.320 2.955 2.809 2.984 . 0 0 "[ . 1 . 2]" 1
1343 1 100 LEU H 1 100 LEU HB2 . . 3.600 2.076 2.060 2.144 . 0 0 "[ . 1 . 2]" 1
1344 1 100 LEU H 1 100 LEU HB3 . . 3.760 3.311 3.249 3.423 . 0 0 "[ . 1 . 2]" 1
1345 1 100 LEU H 1 100 LEU MD1 . . 4.410 3.623 2.579 4.241 . 0 0 "[ . 1 . 2]" 1
1346 1 100 LEU H 1 100 LEU QD . . 3.420 2.707 2.431 3.001 . 0 0 "[ . 1 . 2]" 1
1347 1 100 LEU H 1 100 LEU MD2 . . 4.410 3.274 2.447 4.391 . 0 0 "[ . 1 . 2]" 1
1348 1 100 LEU H 1 101 GLY H . . 3.870 2.468 2.326 2.561 . 0 0 "[ . 1 . 2]" 1
1349 1 100 LEU HA 1 100 LEU QD . . 3.780 2.131 1.889 2.792 . 0 0 "[ . 1 . 2]" 1
1350 1 100 LEU HB2 1 101 GLY H . . 4.020 3.337 3.176 3.635 . 0 0 "[ . 1 . 2]" 1
1351 1 100 LEU HB2 1 102 LEU H . . 3.830 3.776 3.615 3.952 0.122 5 0 "[ . 1 . 2]" 1
1352 1 100 LEU HB3 1 101 GLY H . . 3.910 3.397 3.290 3.658 . 0 0 "[ . 1 . 2]" 1
1353 1 100 LEU HB3 1 102 LEU H . . 3.760 3.483 3.130 3.848 0.088 5 0 "[ . 1 . 2]" 1
1354 1 100 LEU QD 1 101 GLY H . . 4.310 4.082 3.967 4.293 . 0 0 "[ . 1 . 2]" 1
1355 1 100 LEU MD1 1 101 GLY H . . 5.040 4.556 4.340 4.755 . 0 0 "[ . 1 . 2]" 1
1356 1 100 LEU MD2 1 101 GLY H . . 5.040 4.651 4.248 4.994 . 0 0 "[ . 1 . 2]" 1
1357 1 101 GLY H 1 102 LEU H . . 2.940 2.147 1.970 2.384 . 0 0 "[ . 1 . 2]" 1
1358 1 101 GLY H 1 102 LEU HA . . 5.100 4.799 4.160 5.013 . 0 0 "[ . 1 . 2]" 1
1359 1 102 LEU H 1 103 LYS H . . 4.680 3.883 2.316 4.585 . 0 0 "[ . 1 . 2]" 1
1360 1 102 LEU H 1 104 LEU QD . . 4.160 3.746 3.226 4.161 0.001 12 0 "[ . 1 . 2]" 1
1361 1 102 LEU HA 1 103 LYS HG2 . . 4.890 4.420 3.660 4.894 0.004 16 0 "[ . 1 . 2]" 1
1362 1 102 LEU HA 1 103 LYS QG . . 4.020 3.781 3.213 4.047 0.027 5 0 "[ . 1 . 2]" 1
1363 1 102 LEU HA 1 103 LYS HG3 . . 4.890 4.219 3.466 4.855 . 0 0 "[ . 1 . 2]" 1
1364 1 102 LEU HA 1 104 LEU QD . . 4.460 4.180 3.513 4.477 0.017 7 0 "[ . 1 . 2]" 1
1365 1 103 LYS H 1 103 LYS QG . . 3.970 2.465 2.033 3.022 . 0 0 "[ . 1 . 2]" 1
1366 1 103 LYS H 1 104 LEU QD . . 4.030 3.632 2.260 4.047 0.017 9 0 "[ . 1 . 2]" 1
1367 1 103 LYS HA 1 103 LYS HG2 . . 3.960 2.923 2.288 3.939 . 0 0 "[ . 1 . 2]" 1
1368 1 103 LYS HA 1 103 LYS QG . . 3.440 2.707 2.262 3.331 . 0 0 "[ . 1 . 2]" 1
1369 1 103 LYS HA 1 103 LYS HG3 . . 3.960 3.530 3.130 3.759 . 0 0 "[ . 1 . 2]" 1
1370 1 103 LYS HA 1 104 LEU QD . . 4.820 3.888 2.420 4.725 . 0 0 "[ . 1 . 2]" 1
1371 1 104 LEU HA 1 104 LEU MD1 . . 4.550 2.459 1.976 3.448 . 0 0 "[ . 1 . 2]" 1
1372 1 104 LEU HA 1 104 LEU QD . . 3.440 2.247 1.892 3.142 . 0 0 "[ . 1 . 2]" 1
1373 1 104 LEU HA 1 104 LEU MD2 . . 4.550 2.628 2.117 3.626 . 0 0 "[ . 1 . 2]" 1
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save_