NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
417318 |
2dmn   |
10291 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2dmn
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 1705
_Distance_constraint_stats_list.Viol_count 900
_Distance_constraint_stats_list.Viol_total 272.654
_Distance_constraint_stats_list.Viol_max 0.234
_Distance_constraint_stats_list.Viol_rms 0.0054
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0004
_Distance_constraint_stats_list.Viol_average_violations_only 0.0151
_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 13 ASN 0.008 0.004 20 0 "[ . 1 . 2]"
1 14 LEU 0.061 0.009 14 0 "[ . 1 . 2]"
1 15 PRO 0.001 0.001 4 0 "[ . 1 . 2]"
1 16 ALA 0.257 0.164 6 0 "[ . 1 . 2]"
1 17 GLU 0.280 0.164 6 0 "[ . 1 . 2]"
1 18 SER 0.076 0.010 6 0 "[ . 1 . 2]"
1 19 VAL 0.025 0.006 6 0 "[ . 1 . 2]"
1 20 LYS 0.540 0.039 12 0 "[ . 1 . 2]"
1 21 ILE 0.517 0.039 12 0 "[ . 1 . 2]"
1 22 LEU 0.105 0.013 5 0 "[ . 1 . 2]"
1 23 ARG 0.112 0.017 18 0 "[ . 1 . 2]"
1 24 ASP 0.144 0.014 14 0 "[ . 1 . 2]"
1 25 TRP 0.502 0.029 5 0 "[ . 1 . 2]"
1 26 MET 0.372 0.050 19 0 "[ . 1 . 2]"
1 27 TYR 0.093 0.015 19 0 "[ . 1 . 2]"
1 28 LYS 0.233 0.031 19 0 "[ . 1 . 2]"
1 29 HIS 0.232 0.031 19 0 "[ . 1 . 2]"
1 30 ARG 0.361 0.040 19 0 "[ . 1 . 2]"
1 31 PHE 0.065 0.009 18 0 "[ . 1 . 2]"
1 32 LYS 0.200 0.022 19 0 "[ . 1 . 2]"
1 33 ALA 0.244 0.053 1 0 "[ . 1 . 2]"
1 34 TYR 0.544 0.056 5 0 "[ . 1 . 2]"
1 35 PRO 0.577 0.056 5 0 "[ . 1 . 2]"
1 36 SER 0.081 0.029 5 0 "[ . 1 . 2]"
1 37 GLU 0.272 0.053 14 0 "[ . 1 . 2]"
1 38 GLU 0.210 0.126 13 0 "[ . 1 . 2]"
1 39 GLU 0.212 0.029 5 0 "[ . 1 . 2]"
1 40 LYS 3.467 0.105 13 0 "[ . 1 . 2]"
1 41 GLN 1.949 0.105 13 0 "[ . 1 . 2]"
1 42 MET 0.237 0.021 11 0 "[ . 1 . 2]"
1 43 LEU 0.237 0.020 5 0 "[ . 1 . 2]"
1 44 SER 0.115 0.011 5 0 "[ . 1 . 2]"
1 45 GLU 0.095 0.028 9 0 "[ . 1 . 2]"
1 46 LYS 0.223 0.028 9 0 "[ . 1 . 2]"
1 47 THR 0.113 0.027 9 0 "[ . 1 . 2]"
1 48 ASN 0.025 0.010 14 0 "[ . 1 . 2]"
1 49 LEU 0.145 0.013 14 0 "[ . 1 . 2]"
1 50 SER 0.008 0.003 7 0 "[ . 1 . 2]"
1 51 LEU 0.327 0.098 17 0 "[ . 1 . 2]"
1 52 LEU 0.029 0.008 5 0 "[ . 1 . 2]"
1 53 GLN 0.158 0.013 14 0 "[ . 1 . 2]"
1 54 ILE 0.407 0.020 19 0 "[ . 1 . 2]"
1 55 SER 0.281 0.062 7 0 "[ . 1 . 2]"
1 56 ASN 0.167 0.021 7 0 "[ . 1 . 2]"
1 57 TRP 0.198 0.023 8 0 "[ . 1 . 2]"
1 58 PHE 0.019 0.018 18 0 "[ . 1 . 2]"
1 59 ILE 0.133 0.019 12 0 "[ . 1 . 2]"
1 60 ASN 0.233 0.023 8 0 "[ . 1 . 2]"
1 61 ALA 0.172 0.031 11 0 "[ . 1 . 2]"
1 62 ARG 0.289 0.066 10 0 "[ . 1 . 2]"
1 63 ARG 0.030 0.018 17 0 "[ . 1 . 2]"
1 64 ARG 0.075 0.031 9 0 "[ . 1 . 2]"
1 65 ILE 0.202 0.057 19 0 "[ . 1 . 2]"
1 66 LEU 4.071 0.234 15 0 "[ . 1 . 2]"
1 67 PRO 3.312 0.234 15 0 "[ . 1 . 2]"
1 68 ASP 0.020 0.010 20 0 "[ . 1 . 2]"
1 69 MET 0.340 0.057 19 0 "[ . 1 . 2]"
1 70 LEU 0.749 0.116 12 0 "[ . 1 . 2]"
1 71 GLN 0.178 0.039 16 0 "[ . 1 . 2]"
1 72 GLN 0.158 0.039 16 0 "[ . 1 . 2]"
1 74 ARG 0.222 0.069 13 0 "[ . 1 . 2]"
1 77 PRO 0.000 0.000 20 0 "[ . 1 . 2]"
1 78 SER 0.000 0.000 20 0 "[ . 1 . 2]"
1 79 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 13 ASN HA 1 14 LEU MD1 . . 4.920 4.686 4.443 4.888 . 0 0 "[ . 1 . 2]" 1
2 1 13 ASN QB 1 14 LEU H . . 4.410 2.758 2.151 3.537 . 0 0 "[ . 1 . 2]" 1
3 1 13 ASN HB2 1 14 LEU H . . 5.120 3.824 3.334 4.230 . 0 0 "[ . 1 . 2]" 1
4 1 13 ASN HB3 1 14 LEU H . . 5.120 2.856 2.171 3.849 . 0 0 "[ . 1 . 2]" 1
5 1 13 ASN QD 1 60 ASN QB . . 4.640 4.411 4.020 4.644 0.004 20 0 "[ . 1 . 2]" 1
6 1 14 LEU H 1 14 LEU HB2 . . 3.970 2.694 2.587 2.774 . 0 0 "[ . 1 . 2]" 1
7 1 14 LEU H 1 14 LEU MD1 . . 4.610 3.404 3.191 3.739 . 0 0 "[ . 1 . 2]" 1
8 1 14 LEU H 1 14 LEU MD2 . . 5.010 3.520 3.348 3.890 . 0 0 "[ . 1 . 2]" 1
9 1 14 LEU H 1 14 LEU HG . . 3.920 2.170 1.900 2.650 . 0 0 "[ . 1 . 2]" 1
10 1 14 LEU H 1 19 VAL MG2 . . 5.330 3.696 3.346 4.023 . 0 0 "[ . 1 . 2]" 1
11 1 14 LEU HA 1 14 LEU MD1 . . 4.230 3.991 3.949 4.027 . 0 0 "[ . 1 . 2]" 1
12 1 14 LEU HA 1 14 LEU MD2 . . 2.990 2.457 2.349 2.557 . 0 0 "[ . 1 . 2]" 1
13 1 14 LEU HA 1 14 LEU HG . . 4.030 3.129 3.057 3.201 . 0 0 "[ . 1 . 2]" 1
14 1 14 LEU HA 1 15 PRO HD2 . . 3.220 2.352 2.308 2.381 . 0 0 "[ . 1 . 2]" 1
15 1 14 LEU HA 1 15 PRO HD3 . . 3.000 2.284 2.271 2.293 . 0 0 "[ . 1 . 2]" 1
16 1 14 LEU HA 1 15 PRO HG2 . . 4.570 4.474 4.438 4.498 . 0 0 "[ . 1 . 2]" 1
17 1 14 LEU HA 1 15 PRO HG3 . . 4.570 4.444 4.419 4.461 . 0 0 "[ . 1 . 2]" 1
18 1 14 LEU HB2 1 15 PRO HD2 . . 4.290 3.446 3.297 3.612 . 0 0 "[ . 1 . 2]" 1
19 1 14 LEU HB2 1 15 PRO HD3 . . 4.860 4.557 4.450 4.672 . 0 0 "[ . 1 . 2]" 1
20 1 14 LEU HB2 1 19 VAL MG2 . . 2.970 2.174 1.954 2.463 . 0 0 "[ . 1 . 2]" 1
21 1 14 LEU HB3 1 14 LEU MD1 . . 3.340 2.549 2.432 2.626 . 0 0 "[ . 1 . 2]" 1
22 1 14 LEU HB3 1 14 LEU MD2 . . 2.980 2.130 2.085 2.201 . 0 0 "[ . 1 . 2]" 1
23 1 14 LEU HB3 1 15 PRO HD2 . . 3.660 2.049 1.998 2.137 . 0 0 "[ . 1 . 2]" 1
24 1 14 LEU HB3 1 15 PRO HD3 . . 3.910 3.461 3.401 3.549 . 0 0 "[ . 1 . 2]" 1
25 1 14 LEU HB3 1 18 SER H . . 5.500 5.205 5.014 5.404 . 0 0 "[ . 1 . 2]" 1
26 1 14 LEU HB3 1 18 SER QB . . 4.440 3.091 2.706 3.791 . 0 0 "[ . 1 . 2]" 1
27 1 14 LEU HB3 1 19 VAL H . . 4.870 4.303 3.868 4.741 . 0 0 "[ . 1 . 2]" 1
28 1 14 LEU HB3 1 19 VAL HA . . 5.500 4.624 4.319 5.063 . 0 0 "[ . 1 . 2]" 1
29 1 14 LEU HB3 1 49 LEU MD1 . . 3.930 2.699 2.548 2.879 . 0 0 "[ . 1 . 2]" 1
30 1 14 LEU MD1 1 15 PRO HD2 . . 4.740 4.257 4.151 4.359 . 0 0 "[ . 1 . 2]" 1
31 1 14 LEU MD1 1 18 SER QB . . 4.770 4.009 3.377 4.426 . 0 0 "[ . 1 . 2]" 1
32 1 14 LEU MD1 1 19 VAL H . . 4.860 4.644 4.330 4.861 0.001 15 0 "[ . 1 . 2]" 1
33 1 14 LEU MD1 1 19 VAL HA . . 4.670 3.437 3.197 3.741 . 0 0 "[ . 1 . 2]" 1
34 1 14 LEU MD1 1 22 LEU MD1 . . 3.290 1.941 1.806 2.147 . 0 0 "[ . 1 . 2]" 1
35 1 14 LEU MD1 1 57 TRP H . . 4.350 4.143 3.857 4.354 0.004 6 0 "[ . 1 . 2]" 1
36 1 14 LEU MD1 1 57 TRP HB2 . . 4.020 2.110 1.910 2.485 . 0 0 "[ . 1 . 2]" 1
37 1 14 LEU MD1 1 57 TRP HB3 . . 4.390 2.665 2.413 2.888 . 0 0 "[ . 1 . 2]" 1
38 1 14 LEU MD1 1 57 TRP HD1 . . 3.540 2.583 2.312 2.939 . 0 0 "[ . 1 . 2]" 1
39 1 14 LEU MD1 1 57 TRP HE1 . . 4.530 3.617 3.238 3.849 . 0 0 "[ . 1 . 2]" 1
40 1 14 LEU MD2 1 15 PRO HD2 . . 3.750 2.934 2.691 3.159 . 0 0 "[ . 1 . 2]" 1
41 1 14 LEU MD2 1 15 PRO HD3 . . 4.050 3.682 3.477 3.883 . 0 0 "[ . 1 . 2]" 1
42 1 14 LEU MD2 1 18 SER QB . . 5.190 4.030 3.682 4.544 . 0 0 "[ . 1 . 2]" 1
43 1 14 LEU MD2 1 22 LEU MD1 . . 4.150 3.635 3.505 3.809 . 0 0 "[ . 1 . 2]" 1
44 1 14 LEU MD2 1 53 GLN HA . . 4.680 4.441 4.042 4.667 . 0 0 "[ . 1 . 2]" 1
45 1 14 LEU MD2 1 53 GLN HB2 . . 4.060 3.600 3.411 3.806 . 0 0 "[ . 1 . 2]" 1
46 1 14 LEU MD2 1 53 GLN HB3 . . 3.350 2.512 2.256 2.672 . 0 0 "[ . 1 . 2]" 1
47 1 14 LEU MD2 1 53 GLN QE . . 4.220 2.872 1.883 3.771 . 0 0 "[ . 1 . 2]" 1
48 1 14 LEU MD2 1 53 GLN QG . . 4.020 3.694 3.416 4.014 . 0 0 "[ . 1 . 2]" 1
49 1 14 LEU MD2 1 54 ILE MD . . 3.590 3.589 3.559 3.599 0.009 14 0 "[ . 1 . 2]" 1
50 1 14 LEU MD2 1 57 TRP HB2 . . 4.650 3.701 3.419 3.974 . 0 0 "[ . 1 . 2]" 1
51 1 14 LEU MD2 1 57 TRP HB3 . . 5.500 4.496 4.114 4.756 . 0 0 "[ . 1 . 2]" 1
52 1 14 LEU HG 1 15 PRO HD2 . . 5.000 4.648 4.562 4.743 . 0 0 "[ . 1 . 2]" 1
53 1 14 LEU HG 1 15 PRO HD3 . . 5.500 5.327 5.239 5.411 . 0 0 "[ . 1 . 2]" 1
54 1 14 LEU HG 1 22 LEU MD1 . . 5.120 4.378 4.124 4.643 . 0 0 "[ . 1 . 2]" 1
55 1 14 LEU HG 1 49 LEU MD1 . . 4.410 3.876 3.680 4.115 . 0 0 "[ . 1 . 2]" 1
56 1 14 LEU HG 1 57 TRP HA . . 5.500 5.053 4.806 5.366 . 0 0 "[ . 1 . 2]" 1
57 1 15 PRO HA 1 16 ALA MB . . 4.470 3.994 3.960 4.038 . 0 0 "[ . 1 . 2]" 1
58 1 15 PRO HA 1 18 SER H . . 5.060 4.737 4.583 4.880 . 0 0 "[ . 1 . 2]" 1
59 1 15 PRO HA 1 19 VAL MG2 . . 4.530 3.859 3.522 4.017 . 0 0 "[ . 1 . 2]" 1
60 1 15 PRO HB2 1 18 SER H . . 3.190 3.077 2.986 3.188 . 0 0 "[ . 1 . 2]" 1
61 1 15 PRO HB2 1 18 SER QB . . 4.220 3.789 3.662 3.950 . 0 0 "[ . 1 . 2]" 1
62 1 15 PRO HB3 1 17 GLU H . . 5.320 4.937 4.801 5.052 . 0 0 "[ . 1 . 2]" 1
63 1 15 PRO HB3 1 18 SER H . . 4.750 4.656 4.587 4.730 . 0 0 "[ . 1 . 2]" 1
64 1 15 PRO HD2 1 18 SER H . . 4.830 4.412 4.268 4.536 . 0 0 "[ . 1 . 2]" 1
65 1 15 PRO HD2 1 18 SER HB2 . . 4.720 3.102 2.435 3.998 . 0 0 "[ . 1 . 2]" 1
66 1 15 PRO HD2 1 18 SER QB . . 3.980 2.646 2.393 3.246 . 0 0 "[ . 1 . 2]" 1
67 1 15 PRO HD2 1 18 SER HB3 . . 4.720 3.291 2.445 3.777 . 0 0 "[ . 1 . 2]" 1
68 1 15 PRO HD2 1 49 LEU MD1 . . 4.890 3.737 3.354 3.951 . 0 0 "[ . 1 . 2]" 1
69 1 15 PRO HD2 1 49 LEU MD2 . . 3.680 2.973 2.726 3.180 . 0 0 "[ . 1 . 2]" 1
70 1 15 PRO HD3 1 49 LEU MD2 . . 4.410 3.905 3.712 4.011 . 0 0 "[ . 1 . 2]" 1
71 1 15 PRO QG 1 18 SER H . . 4.130 2.641 2.504 2.754 . 0 0 "[ . 1 . 2]" 1
72 1 15 PRO QG 1 18 SER QB . . 3.390 1.988 1.934 2.094 . 0 0 "[ . 1 . 2]" 1
73 1 15 PRO QG 1 49 LEU MD2 . . 3.900 3.761 3.585 3.901 0.001 4 0 "[ . 1 . 2]" 1
74 1 15 PRO HG2 1 18 SER H . . 5.010 2.665 2.524 2.782 . 0 0 "[ . 1 . 2]" 1
75 1 15 PRO HG2 1 49 LEU MD2 . . 4.580 4.143 3.939 4.299 . 0 0 "[ . 1 . 2]" 1
76 1 15 PRO HG3 1 18 SER H . . 5.010 4.296 4.174 4.396 . 0 0 "[ . 1 . 2]" 1
77 1 15 PRO HG3 1 49 LEU MD2 . . 4.580 4.316 4.079 4.508 . 0 0 "[ . 1 . 2]" 1
78 1 16 ALA HA 1 18 SER H . . 4.920 4.442 4.162 4.693 . 0 0 "[ . 1 . 2]" 1
79 1 16 ALA HA 1 19 VAL H . . 3.620 3.269 3.076 3.462 . 0 0 "[ . 1 . 2]" 1
80 1 16 ALA HA 1 19 VAL HB . . 3.290 2.242 2.043 2.448 . 0 0 "[ . 1 . 2]" 1
81 1 16 ALA HA 1 19 VAL MG1 . . 4.190 3.606 3.478 3.779 . 0 0 "[ . 1 . 2]" 1
82 1 16 ALA HA 1 19 VAL MG2 . . 3.220 2.403 2.019 2.742 . 0 0 "[ . 1 . 2]" 1
83 1 16 ALA HA 1 20 LYS H . . 3.850 3.688 3.508 3.850 . 0 0 "[ . 1 . 2]" 1
84 1 16 ALA MB 1 17 GLU H . . 3.710 2.100 1.965 2.295 . 0 0 "[ . 1 . 2]" 1
85 1 16 ALA MB 1 17 GLU HA . . 4.070 3.580 3.534 3.639 . 0 0 "[ . 1 . 2]" 1
86 1 16 ALA MB 1 17 GLU QB . . 4.710 3.763 3.643 3.919 . 0 0 "[ . 1 . 2]" 1
87 1 16 ALA MB 1 17 GLU QG . . 5.000 4.510 3.835 5.164 0.164 6 0 "[ . 1 . 2]" 1
88 1 16 ALA MB 1 18 SER H . . 4.570 4.421 4.273 4.547 . 0 0 "[ . 1 . 2]" 1
89 1 16 ALA MB 1 19 VAL H . . 4.570 4.399 4.267 4.568 . 0 0 "[ . 1 . 2]" 1
90 1 16 ALA MB 1 19 VAL HB . . 4.000 3.699 3.579 3.877 . 0 0 "[ . 1 . 2]" 1
91 1 16 ALA MB 1 19 VAL MG2 . . 4.020 3.741 3.481 3.972 . 0 0 "[ . 1 . 2]" 1
92 1 16 ALA MB 1 20 LYS H . . 4.890 4.235 4.100 4.363 . 0 0 "[ . 1 . 2]" 1
93 1 17 GLU H 1 17 GLU QB . . 3.360 2.282 2.130 2.481 . 0 0 "[ . 1 . 2]" 1
94 1 17 GLU H 1 17 GLU QG . . 4.060 3.238 2.232 3.996 . 0 0 "[ . 1 . 2]" 1
95 1 17 GLU H 1 18 SER H . . 3.620 3.088 2.976 3.171 . 0 0 "[ . 1 . 2]" 1
96 1 17 GLU H 1 19 VAL H . . 4.870 4.297 4.067 4.456 . 0 0 "[ . 1 . 2]" 1
97 1 17 GLU HA 1 17 GLU QG . . 3.440 2.779 2.236 3.339 . 0 0 "[ . 1 . 2]" 1
98 1 17 GLU HA 1 20 LYS H . . 4.160 4.030 3.853 4.155 . 0 0 "[ . 1 . 2]" 1
99 1 17 GLU HA 1 20 LYS QB . . 3.570 3.316 3.078 3.457 . 0 0 "[ . 1 . 2]" 1
100 1 17 GLU HA 1 20 LYS QD . . 4.450 4.135 3.771 4.456 0.006 4 0 "[ . 1 . 2]" 1
101 1 17 GLU HA 1 20 LYS QG . . 5.340 5.202 4.653 5.344 0.004 10 0 "[ . 1 . 2]" 1
102 1 17 GLU HA 1 21 ILE H . . 5.500 5.297 5.059 5.504 0.004 11 0 "[ . 1 . 2]" 1
103 1 17 GLU HA 1 21 ILE MD . . 4.790 4.054 3.858 4.344 . 0 0 "[ . 1 . 2]" 1
104 1 17 GLU QB 1 18 SER H . . 3.890 2.707 2.169 3.366 . 0 0 "[ . 1 . 2]" 1
105 1 17 GLU QB 1 21 ILE MD . . 4.490 4.181 3.804 4.485 . 0 0 "[ . 1 . 2]" 1
106 1 17 GLU QG 1 18 SER H . . 4.140 3.018 1.805 4.095 . 0 0 "[ . 1 . 2]" 1
107 1 17 GLU QG 1 21 ILE MD . . 4.340 3.789 3.037 4.342 0.002 18 0 "[ . 1 . 2]" 1
108 1 18 SER H 1 18 SER HB2 . . 3.700 2.754 2.256 3.620 . 0 0 "[ . 1 . 2]" 1
109 1 18 SER H 1 18 SER QB . . 3.060 2.311 2.162 2.474 . 0 0 "[ . 1 . 2]" 1
110 1 18 SER H 1 18 SER HB3 . . 3.700 3.013 2.227 3.601 . 0 0 "[ . 1 . 2]" 1
111 1 18 SER H 1 19 VAL H . . 2.980 2.578 2.446 2.764 . 0 0 "[ . 1 . 2]" 1
112 1 18 SER H 1 19 VAL HA . . 5.420 5.185 5.074 5.342 . 0 0 "[ . 1 . 2]" 1
113 1 18 SER H 1 19 VAL HB . . 5.000 4.767 4.575 4.979 . 0 0 "[ . 1 . 2]" 1
114 1 18 SER H 1 19 VAL MG2 . . 4.180 3.967 3.755 4.163 . 0 0 "[ . 1 . 2]" 1
115 1 18 SER H 1 20 LYS H . . 4.470 4.367 4.180 4.471 0.001 8 0 "[ . 1 . 2]" 1
116 1 18 SER H 1 20 LYS QB . . 5.200 4.986 4.855 5.148 . 0 0 "[ . 1 . 2]" 1
117 1 18 SER H 1 21 ILE MD . . 4.850 4.001 3.851 4.164 . 0 0 "[ . 1 . 2]" 1
118 1 18 SER H 1 47 THR MG . . 5.500 4.855 4.663 5.012 . 0 0 "[ . 1 . 2]" 1
119 1 18 SER HA 1 20 LYS H . . 4.680 4.599 4.379 4.690 0.010 6 0 "[ . 1 . 2]" 1
120 1 18 SER HA 1 21 ILE H . . 3.900 3.727 3.639 3.806 . 0 0 "[ . 1 . 2]" 1
121 1 18 SER HA 1 21 ILE HB . . 3.870 3.624 3.472 3.848 . 0 0 "[ . 1 . 2]" 1
122 1 18 SER HA 1 21 ILE MD . . 3.460 1.980 1.901 2.108 . 0 0 "[ . 1 . 2]" 1
123 1 18 SER HA 1 21 ILE HG13 . . 4.890 4.822 4.683 4.899 0.009 12 0 "[ . 1 . 2]" 1
124 1 18 SER HA 1 22 LEU H . . 5.400 5.100 4.936 5.301 . 0 0 "[ . 1 . 2]" 1
125 1 18 SER HA 1 47 THR MG . . 3.630 2.556 2.344 2.770 . 0 0 "[ . 1 . 2]" 1
126 1 18 SER QB 1 19 VAL H . . 3.570 2.771 2.442 3.395 . 0 0 "[ . 1 . 2]" 1
127 1 18 SER QB 1 19 VAL HA . . 4.550 4.118 3.832 4.553 0.003 3 0 "[ . 1 . 2]" 1
128 1 18 SER QB 1 19 VAL MG2 . . 4.240 3.487 3.105 4.100 . 0 0 "[ . 1 . 2]" 1
129 1 18 SER QB 1 21 ILE MD . . 3.850 3.574 3.361 3.739 . 0 0 "[ . 1 . 2]" 1
130 1 18 SER QB 1 22 LEU MD1 . . 5.340 4.418 3.778 5.046 . 0 0 "[ . 1 . 2]" 1
131 1 18 SER QB 1 47 THR HA . . 4.210 3.065 2.737 3.568 . 0 0 "[ . 1 . 2]" 1
132 1 18 SER QB 1 47 THR HB . . 3.390 2.304 1.988 3.126 . 0 0 "[ . 1 . 2]" 1
133 1 18 SER QB 1 47 THR MG . . 3.480 2.766 2.472 3.275 . 0 0 "[ . 1 . 2]" 1
134 1 18 SER QB 1 49 LEU MD1 . . 3.420 2.924 2.509 3.429 0.009 13 0 "[ . 1 . 2]" 1
135 1 18 SER QB 1 49 LEU MD2 . . 3.800 3.164 2.884 3.441 . 0 0 "[ . 1 . 2]" 1
136 1 18 SER QB 1 49 LEU HG . . 4.170 3.689 3.341 4.111 . 0 0 "[ . 1 . 2]" 1
137 1 18 SER HB2 1 19 VAL H . . 4.080 3.247 2.497 4.081 0.001 13 0 "[ . 1 . 2]" 1
138 1 18 SER HB2 1 21 ILE MD . . 4.620 4.139 3.564 4.508 . 0 0 "[ . 1 . 2]" 1
139 1 18 SER HB2 1 47 THR HA . . 4.960 3.898 2.793 4.830 . 0 0 "[ . 1 . 2]" 1
140 1 18 SER HB2 1 47 THR HB . . 4.090 3.262 1.997 3.955 . 0 0 "[ . 1 . 2]" 1
141 1 18 SER HB2 1 49 LEU MD1 . . 4.000 3.580 2.740 3.959 . 0 0 "[ . 1 . 2]" 1
142 1 18 SER HB3 1 19 VAL H . . 4.080 3.384 2.611 3.808 . 0 0 "[ . 1 . 2]" 1
143 1 18 SER HB3 1 21 ILE MD . . 4.620 4.032 3.594 4.559 . 0 0 "[ . 1 . 2]" 1
144 1 18 SER HB3 1 47 THR HA . . 4.960 3.715 2.863 4.796 . 0 0 "[ . 1 . 2]" 1
145 1 18 SER HB3 1 47 THR HB . . 4.090 2.910 2.002 4.099 0.009 13 0 "[ . 1 . 2]" 1
146 1 18 SER HB3 1 49 LEU MD1 . . 4.000 3.324 2.547 3.996 . 0 0 "[ . 1 . 2]" 1
147 1 19 VAL H 1 19 VAL HB . . 2.890 2.570 2.439 2.688 . 0 0 "[ . 1 . 2]" 1
148 1 19 VAL H 1 19 VAL MG1 . . 3.770 3.764 3.746 3.770 0.000 7 0 "[ . 1 . 2]" 1
149 1 19 VAL H 1 19 VAL MG2 . . 2.910 2.060 1.893 2.265 . 0 0 "[ . 1 . 2]" 1
150 1 19 VAL H 1 20 LYS H . . 3.140 2.881 2.793 2.986 . 0 0 "[ . 1 . 2]" 1
151 1 19 VAL H 1 20 LYS QB . . 4.690 4.495 4.405 4.605 . 0 0 "[ . 1 . 2]" 1
152 1 19 VAL H 1 21 ILE H . . 4.780 4.317 4.215 4.461 . 0 0 "[ . 1 . 2]" 1
153 1 19 VAL H 1 22 LEU MD1 . . 5.070 4.987 4.678 5.076 0.006 6 0 "[ . 1 . 2]" 1
154 1 19 VAL H 1 47 THR MG . . 5.280 4.459 4.332 4.674 . 0 0 "[ . 1 . 2]" 1
155 1 19 VAL H 1 49 LEU MD1 . . 5.300 5.019 4.692 5.300 0.000 16 0 "[ . 1 . 2]" 1
156 1 19 VAL HA 1 19 VAL MG1 . . 3.190 2.391 2.287 2.490 . 0 0 "[ . 1 . 2]" 1
157 1 19 VAL HA 1 19 VAL MG2 . . 3.020 2.380 2.245 2.458 . 0 0 "[ . 1 . 2]" 1
158 1 19 VAL HA 1 20 LYS HA . . 5.500 4.936 4.921 4.958 . 0 0 "[ . 1 . 2]" 1
159 1 19 VAL HA 1 21 ILE H . . 4.600 4.077 3.846 4.225 . 0 0 "[ . 1 . 2]" 1
160 1 19 VAL HA 1 21 ILE HB . . 4.800 4.672 4.505 4.782 . 0 0 "[ . 1 . 2]" 1
161 1 19 VAL HA 1 21 ILE MD . . 4.810 4.630 4.424 4.784 . 0 0 "[ . 1 . 2]" 1
162 1 19 VAL HA 1 22 LEU H . . 3.710 3.204 3.090 3.292 . 0 0 "[ . 1 . 2]" 1
163 1 19 VAL HA 1 22 LEU HB2 . . 3.600 2.850 2.750 3.020 . 0 0 "[ . 1 . 2]" 1
164 1 19 VAL HA 1 22 LEU HB3 . . 4.700 4.542 4.449 4.692 . 0 0 "[ . 1 . 2]" 1
165 1 19 VAL HA 1 22 LEU MD1 . . 3.420 3.039 2.735 3.171 . 0 0 "[ . 1 . 2]" 1
166 1 19 VAL HA 1 22 LEU MD2 . . 5.000 4.854 4.721 4.971 . 0 0 "[ . 1 . 2]" 1
167 1 19 VAL HA 1 22 LEU HG . . 3.890 3.470 3.274 3.629 . 0 0 "[ . 1 . 2]" 1
168 1 19 VAL HA 1 23 ARG H . . 4.210 3.684 3.553 3.853 . 0 0 "[ . 1 . 2]" 1
169 1 19 VAL HA 1 47 THR MG . . 4.860 4.016 3.719 4.216 . 0 0 "[ . 1 . 2]" 1
170 1 19 VAL HA 1 57 TRP HE1 . . 5.020 4.764 4.075 5.012 . 0 0 "[ . 1 . 2]" 1
171 1 19 VAL HB 1 20 LYS H . . 3.190 2.376 2.310 2.499 . 0 0 "[ . 1 . 2]" 1
172 1 19 VAL MG1 1 20 LYS H . . 3.860 3.215 2.998 3.423 . 0 0 "[ . 1 . 2]" 1
173 1 19 VAL MG1 1 20 LYS HA . . 4.090 3.372 3.107 3.668 . 0 0 "[ . 1 . 2]" 1
174 1 19 VAL MG1 1 22 LEU H . . 4.540 4.078 3.799 4.277 . 0 0 "[ . 1 . 2]" 1
175 1 19 VAL MG1 1 22 LEU HB2 . . 5.030 3.211 2.878 3.436 . 0 0 "[ . 1 . 2]" 1
176 1 19 VAL MG1 1 22 LEU MD1 . . 4.230 3.867 3.589 4.075 . 0 0 "[ . 1 . 2]" 1
177 1 19 VAL MG1 1 23 ARG H . . 4.080 2.888 2.682 3.030 . 0 0 "[ . 1 . 2]" 1
178 1 19 VAL MG1 1 23 ARG HA . . 4.740 4.112 4.019 4.274 . 0 0 "[ . 1 . 2]" 1
179 1 19 VAL MG1 1 23 ARG QB . . 4.050 2.746 2.493 3.006 . 0 0 "[ . 1 . 2]" 1
180 1 19 VAL MG1 1 23 ARG HD2 . . 3.880 2.804 1.907 3.767 . 0 0 "[ . 1 . 2]" 1
181 1 19 VAL MG1 1 23 ARG QD . . 3.400 2.265 1.896 2.834 . 0 0 "[ . 1 . 2]" 1
182 1 19 VAL MG1 1 23 ARG HD3 . . 3.880 2.659 2.091 3.545 . 0 0 "[ . 1 . 2]" 1
183 1 19 VAL MG1 1 23 ARG HG2 . . 4.290 3.298 3.149 3.440 . 0 0 "[ . 1 . 2]" 1
184 1 19 VAL MG1 1 23 ARG HG3 . . 3.840 1.909 1.823 2.096 . 0 0 "[ . 1 . 2]" 1
185 1 19 VAL MG1 1 57 TRP HE1 . . 3.530 2.891 2.340 3.347 . 0 0 "[ . 1 . 2]" 1
186 1 19 VAL MG1 1 57 TRP HH2 . . 4.820 3.796 3.582 4.019 . 0 0 "[ . 1 . 2]" 1
187 1 19 VAL MG1 1 57 TRP HZ2 . . 3.630 2.341 2.155 2.584 . 0 0 "[ . 1 . 2]" 1
188 1 19 VAL MG2 1 20 LYS H . . 3.840 3.760 3.589 3.844 0.004 20 0 "[ . 1 . 2]" 1
189 1 19 VAL MG2 1 21 ILE H . . 5.410 5.286 5.136 5.382 . 0 0 "[ . 1 . 2]" 1
190 1 19 VAL MG2 1 22 LEU MD1 . . 4.460 3.759 3.478 3.998 . 0 0 "[ . 1 . 2]" 1
191 1 19 VAL MG2 1 23 ARG QB . . 5.410 5.188 5.003 5.364 . 0 0 "[ . 1 . 2]" 1
192 1 19 VAL MG2 1 23 ARG QD . . 5.250 4.455 4.057 4.968 . 0 0 "[ . 1 . 2]" 1
193 1 19 VAL MG2 1 57 TRP HD1 . . 4.690 4.042 3.707 4.385 . 0 0 "[ . 1 . 2]" 1
194 1 19 VAL MG2 1 57 TRP HE1 . . 3.490 2.947 2.575 3.319 . 0 0 "[ . 1 . 2]" 1
195 1 19 VAL MG2 1 57 TRP HZ2 . . 4.560 4.020 3.671 4.356 . 0 0 "[ . 1 . 2]" 1
196 1 20 LYS H 1 20 LYS QB . . 2.660 2.262 2.167 2.285 . 0 0 "[ . 1 . 2]" 1
197 1 20 LYS H 1 20 LYS QD . . 4.640 4.454 4.102 4.623 . 0 0 "[ . 1 . 2]" 1
198 1 20 LYS H 1 20 LYS HG2 . . 4.730 4.500 4.454 4.577 . 0 0 "[ . 1 . 2]" 1
199 1 20 LYS H 1 20 LYS QG . . 4.130 3.979 3.853 4.055 . 0 0 "[ . 1 . 2]" 1
200 1 20 LYS H 1 20 LYS HG3 . . 4.730 4.439 4.146 4.653 . 0 0 "[ . 1 . 2]" 1
201 1 20 LYS H 1 21 ILE H . . 3.280 2.974 2.953 3.002 . 0 0 "[ . 1 . 2]" 1
202 1 20 LYS H 1 21 ILE HA . . 5.500 5.518 5.502 5.539 0.039 12 0 "[ . 1 . 2]" 1
203 1 20 LYS H 1 21 ILE MD . . 4.740 3.740 3.639 3.871 . 0 0 "[ . 1 . 2]" 1
204 1 20 LYS H 1 22 LEU H . . 4.650 4.467 4.399 4.569 . 0 0 "[ . 1 . 2]" 1
205 1 20 LYS H 1 23 ARG H . . 5.060 4.724 4.618 4.772 . 0 0 "[ . 1 . 2]" 1
206 1 20 LYS H 1 47 THR MG . . 5.500 5.225 5.047 5.395 . 0 0 "[ . 1 . 2]" 1
207 1 20 LYS HA 1 20 LYS QD . . 4.290 4.034 3.621 4.248 . 0 0 "[ . 1 . 2]" 1
208 1 20 LYS HA 1 20 LYS QE . . 5.500 4.402 3.253 5.020 . 0 0 "[ . 1 . 2]" 1
209 1 20 LYS HA 1 20 LYS HG2 . . 3.830 3.121 2.613 3.550 . 0 0 "[ . 1 . 2]" 1
210 1 20 LYS HA 1 20 LYS HG3 . . 3.830 2.736 2.410 3.669 . 0 0 "[ . 1 . 2]" 1
211 1 20 LYS HA 1 21 ILE MD . . 4.790 4.724 4.610 4.798 0.008 9 0 "[ . 1 . 2]" 1
212 1 20 LYS HA 1 22 LEU H . . 4.740 4.556 4.400 4.690 . 0 0 "[ . 1 . 2]" 1
213 1 20 LYS HA 1 23 ARG H . . 3.880 3.789 3.533 3.890 0.010 5 0 "[ . 1 . 2]" 1
214 1 20 LYS HA 1 23 ARG QB . . 3.540 2.547 2.337 2.656 . 0 0 "[ . 1 . 2]" 1
215 1 20 LYS HA 1 23 ARG QD . . 4.380 3.818 3.069 4.383 0.003 15 0 "[ . 1 . 2]" 1
216 1 20 LYS HA 1 23 ARG HG3 . . 4.760 4.388 4.221 4.550 . 0 0 "[ . 1 . 2]" 1
217 1 20 LYS HA 1 24 ASP H . . 4.610 3.431 3.344 3.563 . 0 0 "[ . 1 . 2]" 1
218 1 20 LYS HA 1 24 ASP HA . . 5.500 5.505 5.496 5.514 0.014 14 0 "[ . 1 . 2]" 1
219 1 20 LYS QB 1 20 LYS QE . . 4.350 3.120 2.026 3.761 . 0 0 "[ . 1 . 2]" 1
220 1 20 LYS QB 1 21 ILE H . . 3.040 2.596 2.495 2.773 . 0 0 "[ . 1 . 2]" 1
221 1 20 LYS QB 1 21 ILE HA . . 4.850 4.183 3.898 4.350 . 0 0 "[ . 1 . 2]" 1
222 1 20 LYS QB 1 21 ILE HG12 . . 5.500 5.287 5.084 5.431 . 0 0 "[ . 1 . 2]" 1
223 1 20 LYS QB 1 22 LEU H . . 5.500 4.869 4.776 4.965 . 0 0 "[ . 1 . 2]" 1
224 1 20 LYS QB 1 47 THR MG . . 5.500 5.248 5.059 5.403 . 0 0 "[ . 1 . 2]" 1
225 1 20 LYS QD 1 21 ILE HA . . 5.460 4.750 2.243 5.462 0.002 11 0 "[ . 1 . 2]" 1
226 1 20 LYS QG 1 21 ILE H . . 4.310 3.617 3.383 4.019 . 0 0 "[ . 1 . 2]" 1
227 1 20 LYS QG 1 21 ILE HA . . 4.590 3.650 3.415 4.161 . 0 0 "[ . 1 . 2]" 1
228 1 20 LYS HG2 1 21 ILE H . . 4.910 3.771 3.529 4.267 . 0 0 "[ . 1 . 2]" 1
229 1 20 LYS HG3 1 21 ILE H . . 4.910 4.671 4.263 4.917 0.007 9 0 "[ . 1 . 2]" 1
230 1 21 ILE H 1 21 ILE HB . . 3.170 2.431 2.370 2.506 . 0 0 "[ . 1 . 2]" 1
231 1 21 ILE H 1 21 ILE MD . . 3.700 1.940 1.853 2.106 . 0 0 "[ . 1 . 2]" 1
232 1 21 ILE H 1 21 ILE HG12 . . 4.030 3.925 3.828 3.996 . 0 0 "[ . 1 . 2]" 1
233 1 21 ILE H 1 21 ILE HG13 . . 3.390 3.124 2.958 3.257 . 0 0 "[ . 1 . 2]" 1
234 1 21 ILE H 1 21 ILE MG . . 3.830 3.743 3.723 3.759 . 0 0 "[ . 1 . 2]" 1
235 1 21 ILE H 1 22 LEU H . . 3.230 2.715 2.621 2.784 . 0 0 "[ . 1 . 2]" 1
236 1 21 ILE H 1 22 LEU HG . . 4.750 4.626 4.371 4.749 . 0 0 "[ . 1 . 2]" 1
237 1 21 ILE H 1 23 ARG H . . 4.600 4.328 4.088 4.464 . 0 0 "[ . 1 . 2]" 1
238 1 21 ILE H 1 47 THR MG . . 3.730 3.546 3.383 3.720 . 0 0 "[ . 1 . 2]" 1
239 1 21 ILE HA 1 21 ILE MD . . 3.590 3.277 3.217 3.344 . 0 0 "[ . 1 . 2]" 1
240 1 21 ILE HA 1 21 ILE HG12 . . 3.610 3.469 3.453 3.494 . 0 0 "[ . 1 . 2]" 1
241 1 21 ILE HA 1 21 ILE HG13 . . 3.350 2.239 2.190 2.289 . 0 0 "[ . 1 . 2]" 1
242 1 21 ILE HA 1 21 ILE MG . . 3.080 2.458 2.421 2.531 . 0 0 "[ . 1 . 2]" 1
243 1 21 ILE HA 1 24 ASP H . . 4.310 4.254 4.152 4.316 0.006 9 0 "[ . 1 . 2]" 1
244 1 21 ILE HA 1 24 ASP HB2 . . 3.770 3.692 3.572 3.775 0.005 20 0 "[ . 1 . 2]" 1
245 1 21 ILE HA 1 24 ASP HB3 . . 3.760 3.661 3.550 3.763 0.003 6 0 "[ . 1 . 2]" 1
246 1 21 ILE HA 1 25 TRP H . . 5.050 4.753 4.639 4.909 . 0 0 "[ . 1 . 2]" 1
247 1 21 ILE HB 1 21 ILE MD . . 2.970 2.130 2.083 2.258 . 0 0 "[ . 1 . 2]" 1
248 1 21 ILE HB 1 22 LEU H . . 3.280 2.554 2.449 2.640 . 0 0 "[ . 1 . 2]" 1
249 1 21 ILE HB 1 22 LEU MD1 . . 5.500 4.792 4.656 4.898 . 0 0 "[ . 1 . 2]" 1
250 1 21 ILE HB 1 22 LEU MD2 . . 5.090 3.928 3.597 4.083 . 0 0 "[ . 1 . 2]" 1
251 1 21 ILE HB 1 22 LEU HG . . 4.510 3.385 3.273 3.509 . 0 0 "[ . 1 . 2]" 1
252 1 21 ILE HB 1 43 LEU MD2 . . 4.870 4.233 4.017 4.456 . 0 0 "[ . 1 . 2]" 1
253 1 21 ILE HB 1 47 THR HA . . 4.910 4.310 4.122 4.509 . 0 0 "[ . 1 . 2]" 1
254 1 21 ILE HB 1 47 THR HB . . 5.020 4.471 4.299 4.656 . 0 0 "[ . 1 . 2]" 1
255 1 21 ILE HB 1 47 THR MG . . 3.100 1.955 1.841 2.079 . 0 0 "[ . 1 . 2]" 1
256 1 21 ILE MD 1 22 LEU H . . 5.090 3.744 3.580 3.882 . 0 0 "[ . 1 . 2]" 1
257 1 21 ILE MD 1 46 LYS HA . . 5.030 4.964 4.874 5.036 0.006 19 0 "[ . 1 . 2]" 1
258 1 21 ILE MD 1 47 THR HA . . 3.410 3.173 2.860 3.326 . 0 0 "[ . 1 . 2]" 1
259 1 21 ILE MD 1 47 THR HB . . 5.200 4.253 3.962 4.488 . 0 0 "[ . 1 . 2]" 1
260 1 21 ILE HG12 1 21 ILE MG . . 2.950 2.068 1.995 2.208 . 0 0 "[ . 1 . 2]" 1
261 1 21 ILE HG12 1 46 LYS HA . . 5.280 4.538 4.392 4.718 . 0 0 "[ . 1 . 2]" 1
262 1 21 ILE HG12 1 46 LYS QB . . 3.650 2.128 1.973 2.279 . 0 0 "[ . 1 . 2]" 1
263 1 21 ILE HG12 1 46 LYS HG2 . . 5.080 3.958 3.518 4.402 . 0 0 "[ . 1 . 2]" 1
264 1 21 ILE HG12 1 46 LYS QG . . 4.470 3.762 3.402 4.152 . 0 0 "[ . 1 . 2]" 1
265 1 21 ILE HG12 1 46 LYS HG3 . . 5.080 4.719 4.329 5.087 0.007 3 0 "[ . 1 . 2]" 1
266 1 21 ILE HG13 1 22 LEU H . . 4.890 4.783 4.727 4.821 . 0 0 "[ . 1 . 2]" 1
267 1 21 ILE MG 1 22 LEU H . . 3.750 3.220 2.982 3.368 . 0 0 "[ . 1 . 2]" 1
268 1 21 ILE MG 1 22 LEU HA . . 4.270 3.307 3.031 3.461 . 0 0 "[ . 1 . 2]" 1
269 1 21 ILE MG 1 22 LEU MD1 . . 5.000 4.635 4.513 4.808 . 0 0 "[ . 1 . 2]" 1
270 1 21 ILE MG 1 22 LEU MD2 . . 3.800 2.867 2.667 3.179 . 0 0 "[ . 1 . 2]" 1
271 1 21 ILE MG 1 22 LEU HG . . 4.100 3.520 3.344 3.817 . 0 0 "[ . 1 . 2]" 1
272 1 21 ILE MG 1 24 ASP H . . 5.440 5.350 5.194 5.441 0.001 12 0 "[ . 1 . 2]" 1
273 1 21 ILE MG 1 24 ASP HB2 . . 5.400 5.228 5.060 5.368 . 0 0 "[ . 1 . 2]" 1
274 1 21 ILE MG 1 25 TRP H . . 4.760 4.733 4.666 4.769 0.009 5 0 "[ . 1 . 2]" 1
275 1 21 ILE MG 1 25 TRP QB . . 4.590 4.125 4.006 4.272 . 0 0 "[ . 1 . 2]" 1
276 1 21 ILE MG 1 42 MET ME . . 4.790 4.575 4.340 4.801 0.011 5 0 "[ . 1 . 2]" 1
277 1 21 ILE MG 1 43 LEU HA . . 4.190 2.982 2.780 3.145 . 0 0 "[ . 1 . 2]" 1
278 1 21 ILE MG 1 43 LEU MD1 . . 4.560 3.800 3.530 4.033 . 0 0 "[ . 1 . 2]" 1
279 1 21 ILE MG 1 43 LEU MD2 . . 3.110 2.096 1.898 2.295 . 0 0 "[ . 1 . 2]" 1
280 1 21 ILE MG 1 43 LEU HG . . 4.770 4.283 3.981 4.492 . 0 0 "[ . 1 . 2]" 1
281 1 21 ILE MG 1 46 LYS H . . 4.710 3.965 3.839 4.091 . 0 0 "[ . 1 . 2]" 1
282 1 21 ILE MG 1 46 LYS HA . . 4.830 4.607 4.363 4.826 . 0 0 "[ . 1 . 2]" 1
283 1 21 ILE MG 1 46 LYS QB . . 3.390 2.044 1.930 2.137 . 0 0 "[ . 1 . 2]" 1
284 1 21 ILE MG 1 46 LYS QD . . 3.560 2.896 2.046 3.562 0.002 13 0 "[ . 1 . 2]" 1
285 1 21 ILE MG 1 46 LYS QE . . 4.650 3.905 2.243 4.638 . 0 0 "[ . 1 . 2]" 1
286 1 21 ILE MG 1 46 LYS HG2 . . 4.460 3.554 2.757 4.170 . 0 0 "[ . 1 . 2]" 1
287 1 21 ILE MG 1 46 LYS QG . . 3.850 3.334 2.707 3.723 . 0 0 "[ . 1 . 2]" 1
288 1 21 ILE MG 1 46 LYS HG3 . . 4.460 4.219 3.932 4.463 0.003 12 0 "[ . 1 . 2]" 1
289 1 21 ILE MG 1 47 THR H . . 4.600 3.504 3.203 3.700 . 0 0 "[ . 1 . 2]" 1
290 1 21 ILE MG 1 47 THR HB . . 4.970 4.695 4.581 4.862 . 0 0 "[ . 1 . 2]" 1
291 1 21 ILE MG 1 47 THR HG1 . . 4.930 4.108 3.685 4.766 . 0 0 "[ . 1 . 2]" 1
292 1 21 ILE MG 1 47 THR MG . . 2.880 2.039 1.912 2.217 . 0 0 "[ . 1 . 2]" 1
293 1 22 LEU H 1 22 LEU HB2 . . 3.260 2.423 2.385 2.491 . 0 0 "[ . 1 . 2]" 1
294 1 22 LEU H 1 22 LEU HB3 . . 3.690 3.587 3.577 3.604 . 0 0 "[ . 1 . 2]" 1
295 1 22 LEU H 1 22 LEU MD1 . . 3.750 3.713 3.620 3.755 0.005 5 0 "[ . 1 . 2]" 1
296 1 22 LEU H 1 22 LEU MD2 . . 3.540 3.375 3.224 3.493 . 0 0 "[ . 1 . 2]" 1
297 1 22 LEU H 1 22 LEU HG . . 2.970 2.417 2.297 2.496 . 0 0 "[ . 1 . 2]" 1
298 1 22 LEU H 1 23 ARG H . . 3.220 2.670 2.521 2.755 . 0 0 "[ . 1 . 2]" 1
299 1 22 LEU H 1 23 ARG HA . . 5.420 5.251 5.139 5.315 . 0 0 "[ . 1 . 2]" 1
300 1 22 LEU H 1 23 ARG QB . . 4.490 4.341 4.267 4.404 . 0 0 "[ . 1 . 2]" 1
301 1 22 LEU H 1 24 ASP H . . 4.530 4.380 4.154 4.503 . 0 0 "[ . 1 . 2]" 1
302 1 22 LEU H 1 43 LEU HB3 . . 5.500 4.999 4.753 5.168 . 0 0 "[ . 1 . 2]" 1
303 1 22 LEU H 1 47 THR MG . . 3.800 3.200 3.078 3.356 . 0 0 "[ . 1 . 2]" 1
304 1 22 LEU HA 1 22 LEU MD1 . . 4.120 3.844 3.822 3.892 . 0 0 "[ . 1 . 2]" 1
305 1 22 LEU HA 1 22 LEU MD2 . . 2.970 2.055 1.952 2.219 . 0 0 "[ . 1 . 2]" 1
306 1 22 LEU HA 1 22 LEU HG . . 3.800 3.131 3.080 3.207 . 0 0 "[ . 1 . 2]" 1
307 1 22 LEU HA 1 25 TRP H . . 4.260 3.696 3.570 3.797 . 0 0 "[ . 1 . 2]" 1
308 1 22 LEU HA 1 25 TRP QB . . 4.210 3.048 2.836 3.156 . 0 0 "[ . 1 . 2]" 1
309 1 22 LEU HA 1 43 LEU MD1 . . 4.190 2.993 2.635 3.314 . 0 0 "[ . 1 . 2]" 1
310 1 22 LEU HA 1 43 LEU MD2 . . 3.580 2.746 2.549 2.965 . 0 0 "[ . 1 . 2]" 1
311 1 22 LEU HA 1 47 THR MG . . 4.850 4.253 4.098 4.480 . 0 0 "[ . 1 . 2]" 1
312 1 22 LEU HA 1 58 PHE HZ . . 4.710 3.603 3.168 3.899 . 0 0 "[ . 1 . 2]" 1
313 1 22 LEU HB2 1 22 LEU MD1 . . 3.570 2.398 2.244 2.436 . 0 0 "[ . 1 . 2]" 1
314 1 22 LEU HB2 1 23 ARG H . . 3.390 2.335 2.218 2.477 . 0 0 "[ . 1 . 2]" 1
315 1 22 LEU HB2 1 23 ARG QB . . 5.500 4.330 4.231 4.431 . 0 0 "[ . 1 . 2]" 1
316 1 22 LEU HB2 1 23 ARG HG3 . . 5.500 3.937 3.739 4.128 . 0 0 "[ . 1 . 2]" 1
317 1 22 LEU HB2 1 24 ASP H . . 5.500 5.169 4.957 5.321 . 0 0 "[ . 1 . 2]" 1
318 1 22 LEU HB2 1 57 TRP HZ2 . . 5.000 3.936 3.483 4.227 . 0 0 "[ . 1 . 2]" 1
319 1 22 LEU HB3 1 22 LEU MD1 . . 3.210 2.270 2.214 2.371 . 0 0 "[ . 1 . 2]" 1
320 1 22 LEU HB3 1 23 ARG H . . 3.730 3.350 3.227 3.592 . 0 0 "[ . 1 . 2]" 1
321 1 22 LEU HB3 1 57 TRP HE3 . . 4.850 3.597 3.393 3.875 . 0 0 "[ . 1 . 2]" 1
322 1 22 LEU HB3 1 57 TRP HZ2 . . 5.030 4.514 4.120 4.709 . 0 0 "[ . 1 . 2]" 1
323 1 22 LEU HB3 1 57 TRP HZ3 . . 4.940 2.542 2.339 3.066 . 0 0 "[ . 1 . 2]" 1
324 1 22 LEU HB3 1 58 PHE QE . . 4.820 3.428 2.938 3.635 . 0 0 "[ . 1 . 2]" 1
325 1 22 LEU MD1 1 23 ARG H . . 4.660 4.330 4.195 4.431 . 0 0 "[ . 1 . 2]" 1
326 1 22 LEU MD1 1 43 LEU HB2 . . 5.500 4.744 4.621 4.871 . 0 0 "[ . 1 . 2]" 1
327 1 22 LEU MD1 1 43 LEU MD2 . . 5.240 4.903 4.755 5.034 . 0 0 "[ . 1 . 2]" 1
328 1 22 LEU MD1 1 47 THR HB . . 4.610 4.251 3.885 4.532 . 0 0 "[ . 1 . 2]" 1
329 1 22 LEU MD1 1 47 THR MG . . 3.820 3.119 2.842 3.351 . 0 0 "[ . 1 . 2]" 1
330 1 22 LEU MD1 1 49 LEU MD1 . . 3.240 2.529 2.241 2.750 . 0 0 "[ . 1 . 2]" 1
331 1 22 LEU MD1 1 49 LEU HG . . 5.160 4.836 4.455 5.104 . 0 0 "[ . 1 . 2]" 1
332 1 22 LEU MD1 1 54 ILE HA . . 3.930 2.770 2.543 2.994 . 0 0 "[ . 1 . 2]" 1
333 1 22 LEU MD1 1 54 ILE MD . . 3.410 2.288 2.055 2.390 . 0 0 "[ . 1 . 2]" 1
334 1 22 LEU MD1 1 54 ILE HG12 . . 4.670 4.646 4.553 4.678 0.008 6 0 "[ . 1 . 2]" 1
335 1 22 LEU MD1 1 54 ILE HG13 . . 5.060 4.729 4.548 4.827 . 0 0 "[ . 1 . 2]" 1
336 1 22 LEU MD1 1 54 ILE MG . . 3.680 2.937 2.643 3.145 . 0 0 "[ . 1 . 2]" 1
337 1 22 LEU MD1 1 57 TRP H . . 5.300 4.828 4.524 5.079 . 0 0 "[ . 1 . 2]" 1
338 1 22 LEU MD1 1 57 TRP HA . . 5.500 5.310 5.127 5.445 . 0 0 "[ . 1 . 2]" 1
339 1 22 LEU MD1 1 57 TRP HB2 . . 4.180 3.817 3.670 4.032 . 0 0 "[ . 1 . 2]" 1
340 1 22 LEU MD1 1 57 TRP HB3 . . 4.020 3.042 2.841 3.212 . 0 0 "[ . 1 . 2]" 1
341 1 22 LEU MD1 1 57 TRP HD1 . . 4.590 4.429 3.986 4.574 . 0 0 "[ . 1 . 2]" 1
342 1 22 LEU MD1 1 57 TRP HE1 . . 4.630 4.452 4.073 4.636 0.006 5 0 "[ . 1 . 2]" 1
343 1 22 LEU MD1 1 57 TRP HE3 . . 4.130 2.611 2.397 2.902 . 0 0 "[ . 1 . 2]" 1
344 1 22 LEU MD1 1 58 PHE H . . 5.500 4.449 3.927 4.881 . 0 0 "[ . 1 . 2]" 1
345 1 22 LEU MD1 1 58 PHE HA . . 5.500 4.963 4.605 5.394 . 0 0 "[ . 1 . 2]" 1
346 1 22 LEU MD1 1 58 PHE QD . . 4.920 3.853 3.376 4.281 . 0 0 "[ . 1 . 2]" 1
347 1 22 LEU MD1 1 58 PHE QE . . 4.440 3.361 2.871 3.732 . 0 0 "[ . 1 . 2]" 1
348 1 22 LEU MD2 1 23 ARG H . . 4.730 4.571 4.521 4.648 . 0 0 "[ . 1 . 2]" 1
349 1 22 LEU MD2 1 25 TRP H . . 5.500 5.163 4.989 5.287 . 0 0 "[ . 1 . 2]" 1
350 1 22 LEU MD2 1 25 TRP QB . . 5.230 3.967 3.743 4.106 . 0 0 "[ . 1 . 2]" 1
351 1 22 LEU MD2 1 43 LEU H . . 4.820 4.691 4.565 4.824 0.004 20 0 "[ . 1 . 2]" 1
352 1 22 LEU MD2 1 43 LEU HA . . 4.260 4.192 4.049 4.273 0.013 5 0 "[ . 1 . 2]" 1
353 1 22 LEU MD2 1 43 LEU HB2 . . 3.860 2.631 2.476 2.813 . 0 0 "[ . 1 . 2]" 1
354 1 22 LEU MD2 1 43 LEU HB3 . . 3.250 2.109 1.971 2.262 . 0 0 "[ . 1 . 2]" 1
355 1 22 LEU MD2 1 43 LEU MD1 . . 3.120 1.943 1.801 2.237 . 0 0 "[ . 1 . 2]" 1
356 1 22 LEU MD2 1 43 LEU MD2 . . 3.120 2.564 2.363 2.757 . 0 0 "[ . 1 . 2]" 1
357 1 22 LEU MD2 1 44 SER H . . 5.060 4.420 4.247 4.694 . 0 0 "[ . 1 . 2]" 1
358 1 22 LEU MD2 1 44 SER HA . . 4.950 4.500 4.245 4.839 . 0 0 "[ . 1 . 2]" 1
359 1 22 LEU MD2 1 47 THR HB . . 5.410 4.621 4.306 4.812 . 0 0 "[ . 1 . 2]" 1
360 1 22 LEU MD2 1 47 THR HG1 . . 4.810 4.097 3.555 4.772 . 0 0 "[ . 1 . 2]" 1
361 1 22 LEU MD2 1 47 THR MG . . 3.300 2.681 2.434 2.908 . 0 0 "[ . 1 . 2]" 1
362 1 22 LEU MD2 1 49 LEU MD1 . . 4.280 3.352 3.072 3.703 . 0 0 "[ . 1 . 2]" 1
363 1 22 LEU MD2 1 54 ILE HA . . 4.460 3.638 3.381 3.826 . 0 0 "[ . 1 . 2]" 1
364 1 22 LEU MD2 1 54 ILE MD . . 2.830 1.979 1.921 2.132 . 0 0 "[ . 1 . 2]" 1
365 1 22 LEU MD2 1 54 ILE HG12 . . 4.910 4.656 4.458 4.819 . 0 0 "[ . 1 . 2]" 1
366 1 22 LEU MD2 1 54 ILE HG13 . . 4.430 4.032 3.709 4.221 . 0 0 "[ . 1 . 2]" 1
367 1 22 LEU MD2 1 54 ILE MG . . 3.470 2.358 2.102 2.633 . 0 0 "[ . 1 . 2]" 1
368 1 22 LEU MD2 1 57 TRP HB3 . . 5.500 4.862 4.717 5.031 . 0 0 "[ . 1 . 2]" 1
369 1 22 LEU MD2 1 57 TRP HE3 . . 4.570 4.010 3.786 4.377 . 0 0 "[ . 1 . 2]" 1
370 1 22 LEU MD2 1 58 PHE QD . . 4.810 3.989 3.736 4.296 . 0 0 "[ . 1 . 2]" 1
371 1 22 LEU MD2 1 58 PHE QE . . 3.410 2.252 1.977 2.589 . 0 0 "[ . 1 . 2]" 1
372 1 22 LEU MD2 1 58 PHE HZ . . 4.020 3.018 2.430 3.496 . 0 0 "[ . 1 . 2]" 1
373 1 22 LEU HG 1 23 ARG H . . 4.880 4.279 4.204 4.341 . 0 0 "[ . 1 . 2]" 1
374 1 22 LEU HG 1 43 LEU MD1 . . 4.820 4.304 4.105 4.589 . 0 0 "[ . 1 . 2]" 1
375 1 22 LEU HG 1 43 LEU MD2 . . 4.460 4.346 4.125 4.466 0.006 13 0 "[ . 1 . 2]" 1
376 1 22 LEU HG 1 47 THR HB . . 4.540 4.313 4.079 4.542 0.002 6 0 "[ . 1 . 2]" 1
377 1 22 LEU HG 1 47 THR MG . . 3.200 2.165 1.984 2.417 . 0 0 "[ . 1 . 2]" 1
378 1 23 ARG H 1 23 ARG QB . . 2.830 2.238 2.196 2.266 . 0 0 "[ . 1 . 2]" 1
379 1 23 ARG H 1 23 ARG HD2 . . 5.100 4.820 3.859 5.101 0.001 5 0 "[ . 1 . 2]" 1
380 1 23 ARG H 1 23 ARG HD3 . . 5.100 4.672 4.233 5.100 0.000 1 0 "[ . 1 . 2]" 1
381 1 23 ARG H 1 23 ARG HG2 . . 4.060 3.738 3.596 3.931 . 0 0 "[ . 1 . 2]" 1
382 1 23 ARG H 1 23 ARG HG3 . . 3.730 2.720 2.633 2.808 . 0 0 "[ . 1 . 2]" 1
383 1 23 ARG H 1 24 ASP H . . 3.340 3.010 2.891 3.081 . 0 0 "[ . 1 . 2]" 1
384 1 23 ARG H 1 25 TRP H . . 4.510 4.307 4.144 4.448 . 0 0 "[ . 1 . 2]" 1
385 1 23 ARG H 1 57 TRP HH2 . . 4.590 3.435 3.185 3.755 . 0 0 "[ . 1 . 2]" 1
386 1 23 ARG H 1 57 TRP HZ2 . . 4.790 4.017 3.702 4.316 . 0 0 "[ . 1 . 2]" 1
387 1 23 ARG HA 1 23 ARG HD2 . . 4.890 4.507 4.215 4.692 . 0 0 "[ . 1 . 2]" 1
388 1 23 ARG HA 1 23 ARG QD . . 4.270 4.007 3.872 4.111 . 0 0 "[ . 1 . 2]" 1
389 1 23 ARG HA 1 23 ARG HD3 . . 4.890 4.519 4.183 4.714 . 0 0 "[ . 1 . 2]" 1
390 1 23 ARG HA 1 23 ARG HG2 . . 3.710 2.339 2.209 2.565 . 0 0 "[ . 1 . 2]" 1
391 1 23 ARG HA 1 23 ARG HG3 . . 3.540 2.887 2.657 3.043 . 0 0 "[ . 1 . 2]" 1
392 1 23 ARG HA 1 25 TRP H . . 4.460 4.245 4.060 4.425 . 0 0 "[ . 1 . 2]" 1
393 1 23 ARG HA 1 26 MET H . . 4.080 3.201 3.091 3.346 . 0 0 "[ . 1 . 2]" 1
394 1 23 ARG HA 1 26 MET QB . . 3.390 2.181 1.976 2.354 . 0 0 "[ . 1 . 2]" 1
395 1 23 ARG HA 1 26 MET QG . . 4.380 4.037 3.400 4.388 0.008 15 0 "[ . 1 . 2]" 1
396 1 23 ARG HA 1 57 TRP HH2 . . 3.420 2.411 2.129 2.643 . 0 0 "[ . 1 . 2]" 1
397 1 23 ARG HA 1 57 TRP HZ2 . . 4.300 3.930 3.668 4.124 . 0 0 "[ . 1 . 2]" 1
398 1 23 ARG HA 1 65 ILE MD . . 4.890 4.199 3.789 4.735 . 0 0 "[ . 1 . 2]" 1
399 1 23 ARG HA 1 69 MET ME . . 3.810 3.217 2.401 3.681 . 0 0 "[ . 1 . 2]" 1
400 1 23 ARG QB 1 23 ARG HD2 . . 3.750 2.818 2.307 3.295 . 0 0 "[ . 1 . 2]" 1
401 1 23 ARG QB 1 23 ARG QD . . 3.060 2.279 2.114 2.492 . 0 0 "[ . 1 . 2]" 1
402 1 23 ARG QB 1 23 ARG HD3 . . 3.750 2.660 2.248 3.294 . 0 0 "[ . 1 . 2]" 1
403 1 23 ARG QB 1 24 ASP H . . 3.240 2.355 2.265 2.495 . 0 0 "[ . 1 . 2]" 1
404 1 23 ARG QB 1 24 ASP HA . . 5.040 3.713 3.683 3.757 . 0 0 "[ . 1 . 2]" 1
405 1 23 ARG QB 1 24 ASP HB2 . . 4.900 4.068 4.011 4.159 . 0 0 "[ . 1 . 2]" 1
406 1 23 ARG QB 1 25 TRP H . . 4.660 4.514 4.364 4.637 . 0 0 "[ . 1 . 2]" 1
407 1 23 ARG QB 1 26 MET QB . . 4.980 3.987 3.874 4.144 . 0 0 "[ . 1 . 2]" 1
408 1 23 ARG QB 1 57 TRP HH2 . . 4.610 4.091 3.820 4.354 . 0 0 "[ . 1 . 2]" 1
409 1 23 ARG QB 1 57 TRP HZ2 . . 4.580 4.262 4.027 4.448 . 0 0 "[ . 1 . 2]" 1
410 1 23 ARG QD 1 65 ILE MD . . 4.500 2.804 2.151 4.048 . 0 0 "[ . 1 . 2]" 1
411 1 23 ARG QD 1 69 MET ME . . 4.610 3.868 2.991 4.571 . 0 0 "[ . 1 . 2]" 1
412 1 23 ARG HD2 1 57 TRP HZ2 . . 4.970 4.118 3.351 4.897 . 0 0 "[ . 1 . 2]" 1
413 1 23 ARG HD2 1 69 MET ME . . 5.240 4.358 3.062 5.247 0.007 20 0 "[ . 1 . 2]" 1
414 1 23 ARG HD3 1 57 TRP HZ2 . . 4.970 4.266 3.188 4.980 0.010 20 0 "[ . 1 . 2]" 1
415 1 23 ARG HD3 1 69 MET ME . . 5.240 4.543 3.212 5.241 0.001 16 0 "[ . 1 . 2]" 1
416 1 23 ARG HG2 1 24 ASP H . . 4.940 4.836 4.781 4.933 . 0 0 "[ . 1 . 2]" 1
417 1 23 ARG HG2 1 26 MET QB . . 4.720 3.756 3.535 4.085 . 0 0 "[ . 1 . 2]" 1
418 1 23 ARG HG2 1 57 TRP HH2 . . 4.560 3.044 2.632 3.503 . 0 0 "[ . 1 . 2]" 1
419 1 23 ARG HG2 1 57 TRP HZ2 . . 4.050 2.966 2.514 3.288 . 0 0 "[ . 1 . 2]" 1
420 1 23 ARG HG2 1 69 MET ME . . 3.660 3.088 2.129 3.614 . 0 0 "[ . 1 . 2]" 1
421 1 23 ARG HG3 1 24 ASP H . . 4.690 4.603 4.528 4.684 . 0 0 "[ . 1 . 2]" 1
422 1 23 ARG HG3 1 57 TRP HE1 . . 4.760 4.648 4.304 4.766 0.006 14 0 "[ . 1 . 2]" 1
423 1 23 ARG HG3 1 57 TRP HH2 . . 4.410 3.094 2.790 3.406 . 0 0 "[ . 1 . 2]" 1
424 1 23 ARG HG3 1 57 TRP HZ2 . . 3.650 2.293 2.011 2.525 . 0 0 "[ . 1 . 2]" 1
425 1 23 ARG HG3 1 61 ALA MB . . 4.950 4.787 4.514 4.967 0.017 18 0 "[ . 1 . 2]" 1
426 1 23 ARG HG3 1 65 ILE MD . . 4.740 3.016 2.664 3.498 . 0 0 "[ . 1 . 2]" 1
427 1 24 ASP H 1 24 ASP HB2 . . 3.110 2.228 2.183 2.279 . 0 0 "[ . 1 . 2]" 1
428 1 24 ASP H 1 24 ASP HB3 . . 3.370 2.954 2.865 3.033 . 0 0 "[ . 1 . 2]" 1
429 1 24 ASP H 1 25 TRP H . . 3.250 2.976 2.853 3.037 . 0 0 "[ . 1 . 2]" 1
430 1 24 ASP H 1 26 MET H . . 4.910 4.313 4.155 4.629 . 0 0 "[ . 1 . 2]" 1
431 1 24 ASP HA 1 27 TYR H . . 4.140 3.850 3.738 3.998 . 0 0 "[ . 1 . 2]" 1
432 1 24 ASP HA 1 27 TYR HB2 . . 3.990 3.523 3.363 3.728 . 0 0 "[ . 1 . 2]" 1
433 1 24 ASP HA 1 27 TYR HB3 . . 3.990 3.547 3.342 3.891 . 0 0 "[ . 1 . 2]" 1
434 1 24 ASP HA 1 27 TYR QD . . 4.770 4.711 4.488 4.778 0.008 14 0 "[ . 1 . 2]" 1
435 1 24 ASP HA 1 28 LYS H . . 5.360 4.845 4.649 5.201 . 0 0 "[ . 1 . 2]" 1
436 1 24 ASP HB2 1 25 TRP H . . 3.770 3.634 3.537 3.701 . 0 0 "[ . 1 . 2]" 1
437 1 24 ASP HB3 1 25 TRP H . . 3.570 2.559 2.406 2.715 . 0 0 "[ . 1 . 2]" 1
438 1 24 ASP HB3 1 25 TRP HA . . 4.940 4.061 4.000 4.121 . 0 0 "[ . 1 . 2]" 1
439 1 24 ASP HB3 1 25 TRP QB . . 5.330 3.798 3.730 3.867 . 0 0 "[ . 1 . 2]" 1
440 1 25 TRP H 1 25 TRP HB2 . . 3.040 2.699 2.622 2.758 . 0 0 "[ . 1 . 2]" 1
441 1 25 TRP H 1 25 TRP HB3 . . 3.040 2.423 2.369 2.508 . 0 0 "[ . 1 . 2]" 1
442 1 25 TRP H 1 25 TRP HD1 . . 5.280 5.166 5.077 5.224 . 0 0 "[ . 1 . 2]" 1
443 1 25 TRP H 1 26 MET H . . 3.330 2.524 2.463 2.645 . 0 0 "[ . 1 . 2]" 1
444 1 25 TRP H 1 26 MET QB . . 4.680 4.241 4.193 4.290 . 0 0 "[ . 1 . 2]" 1
445 1 25 TRP H 1 43 LEU MD2 . . 4.330 4.156 4.017 4.312 . 0 0 "[ . 1 . 2]" 1
446 1 25 TRP HA 1 25 TRP HD1 . . 3.950 3.463 3.349 3.554 . 0 0 "[ . 1 . 2]" 1
447 1 25 TRP HA 1 25 TRP HE1 . . 5.380 5.237 5.135 5.298 . 0 0 "[ . 1 . 2]" 1
448 1 25 TRP HA 1 25 TRP HE3 . . 5.090 4.300 4.201 4.382 . 0 0 "[ . 1 . 2]" 1
449 1 25 TRP HA 1 28 LYS H . . 3.890 3.497 3.340 3.688 . 0 0 "[ . 1 . 2]" 1
450 1 25 TRP HA 1 28 LYS HB2 . . 3.810 3.258 3.067 3.435 . 0 0 "[ . 1 . 2]" 1
451 1 25 TRP HA 1 28 LYS HB3 . . 5.000 4.939 4.744 5.010 0.010 15 0 "[ . 1 . 2]" 1
452 1 25 TRP HA 1 28 LYS QE . . 5.090 4.164 2.201 5.102 0.012 5 0 "[ . 1 . 2]" 1
453 1 25 TRP HA 1 28 LYS QG . . 4.910 3.875 3.260 4.500 . 0 0 "[ . 1 . 2]" 1
454 1 25 TRP HA 1 29 HIS H . . 5.390 4.180 3.993 4.564 . 0 0 "[ . 1 . 2]" 1
455 1 25 TRP HA 1 29 HIS HD2 . . 4.740 3.110 2.644 3.553 . 0 0 "[ . 1 . 2]" 1
456 1 25 TRP HA 1 43 LEU MD2 . . 4.840 4.774 4.609 4.843 0.003 17 0 "[ . 1 . 2]" 1
457 1 25 TRP QB 1 25 TRP HD1 . . 3.270 2.554 2.534 2.578 . 0 0 "[ . 1 . 2]" 1
458 1 25 TRP QB 1 25 TRP HE1 . . 4.620 4.416 4.408 4.425 . 0 0 "[ . 1 . 2]" 1
459 1 25 TRP QB 1 26 MET H . . 3.320 2.564 2.284 2.694 . 0 0 "[ . 1 . 2]" 1
460 1 25 TRP QB 1 43 LEU MD2 . . 3.390 2.509 2.343 2.612 . 0 0 "[ . 1 . 2]" 1
461 1 25 TRP QB 1 58 PHE HZ . . 4.700 3.423 3.143 3.805 . 0 0 "[ . 1 . 2]" 1
462 1 25 TRP HB2 1 26 MET H . . 4.000 3.920 3.733 4.013 0.013 11 0 "[ . 1 . 2]" 1
463 1 25 TRP HB2 1 43 LEU MD1 . . 4.580 3.867 3.583 4.110 . 0 0 "[ . 1 . 2]" 1
464 1 25 TRP HB2 1 43 LEU MD2 . . 4.050 2.696 2.522 2.823 . 0 0 "[ . 1 . 2]" 1
465 1 25 TRP HB3 1 26 MET H . . 4.000 2.600 2.305 2.738 . 0 0 "[ . 1 . 2]" 1
466 1 25 TRP HB3 1 43 LEU MD1 . . 4.580 3.328 2.886 3.583 . 0 0 "[ . 1 . 2]" 1
467 1 25 TRP HB3 1 43 LEU MD2 . . 4.050 2.998 2.782 3.227 . 0 0 "[ . 1 . 2]" 1
468 1 25 TRP HD1 1 29 HIS HE1 . . 5.310 5.183 4.663 5.324 0.014 3 0 "[ . 1 . 2]" 1
469 1 25 TRP HD1 1 39 GLU HB3 . . 5.500 4.588 4.345 5.186 . 0 0 "[ . 1 . 2]" 1
470 1 25 TRP HD1 1 42 MET ME . . 3.470 3.065 2.907 3.267 . 0 0 "[ . 1 . 2]" 1
471 1 25 TRP HD1 1 43 LEU MD1 . . 4.360 4.320 4.174 4.369 0.009 13 0 "[ . 1 . 2]" 1
472 1 25 TRP HD1 1 43 LEU MD2 . . 3.530 3.444 3.279 3.534 0.004 18 0 "[ . 1 . 2]" 1
473 1 25 TRP HD1 1 43 LEU HG . . 5.500 5.231 5.098 5.350 . 0 0 "[ . 1 . 2]" 1
474 1 25 TRP HE1 1 29 HIS HE1 . . 4.130 3.563 2.682 3.918 . 0 0 "[ . 1 . 2]" 1
475 1 25 TRP HE1 1 35 PRO HB3 . . 5.320 4.607 4.313 4.791 . 0 0 "[ . 1 . 2]" 1
476 1 25 TRP HE1 1 39 GLU HB3 . . 4.090 3.401 3.151 3.918 . 0 0 "[ . 1 . 2]" 1
477 1 25 TRP HE1 1 39 GLU QG . . 4.220 3.022 2.491 3.860 . 0 0 "[ . 1 . 2]" 1
478 1 25 TRP HE1 1 42 MET ME . . 3.690 3.619 3.378 3.710 0.020 5 0 "[ . 1 . 2]" 1
479 1 25 TRP HE1 1 43 LEU MD1 . . 4.990 4.658 4.407 4.833 . 0 0 "[ . 1 . 2]" 1
480 1 25 TRP HE1 1 43 LEU MD2 . . 5.050 4.853 4.620 5.049 . 0 0 "[ . 1 . 2]" 1
481 1 25 TRP HE3 1 26 MET H . . 4.150 2.550 2.384 2.703 . 0 0 "[ . 1 . 2]" 1
482 1 25 TRP HE3 1 26 MET HA . . 3.320 2.096 1.994 2.241 . 0 0 "[ . 1 . 2]" 1
483 1 25 TRP HE3 1 26 MET QB . . 4.640 2.753 2.592 2.903 . 0 0 "[ . 1 . 2]" 1
484 1 25 TRP HE3 1 26 MET QG . . 4.490 4.099 3.831 4.480 . 0 0 "[ . 1 . 2]" 1
485 1 25 TRP HE3 1 35 PRO HG3 . . 5.500 4.808 4.452 5.076 . 0 0 "[ . 1 . 2]" 1
486 1 25 TRP HE3 1 43 LEU MD1 . . 4.520 4.142 3.921 4.368 . 0 0 "[ . 1 . 2]" 1
487 1 25 TRP HE3 1 58 PHE QE . . 4.080 2.380 1.998 2.600 . 0 0 "[ . 1 . 2]" 1
488 1 25 TRP HE3 1 58 PHE HZ . . 3.960 2.566 2.178 2.857 . 0 0 "[ . 1 . 2]" 1
489 1 25 TRP HH2 1 29 HIS HB3 . . 5.010 3.440 3.125 3.720 . 0 0 "[ . 1 . 2]" 1
490 1 25 TRP HH2 1 29 HIS HD2 . . 5.400 4.974 4.678 5.340 . 0 0 "[ . 1 . 2]" 1
491 1 25 TRP HH2 1 32 LYS QD . . 4.220 3.875 3.479 4.176 . 0 0 "[ . 1 . 2]" 1
492 1 25 TRP HH2 1 32 LYS QE . . 5.210 5.135 4.687 5.224 0.014 20 0 "[ . 1 . 2]" 1
493 1 25 TRP HH2 1 32 LYS QG . . 4.560 3.594 3.117 3.910 . 0 0 "[ . 1 . 2]" 1
494 1 25 TRP HH2 1 33 ALA HA . . 4.640 4.175 3.575 4.537 . 0 0 "[ . 1 . 2]" 1
495 1 25 TRP HH2 1 34 TYR H . . 4.350 2.789 2.400 3.453 . 0 0 "[ . 1 . 2]" 1
496 1 25 TRP HH2 1 35 PRO HA . . 3.740 2.295 2.043 2.682 . 0 0 "[ . 1 . 2]" 1
497 1 25 TRP HH2 1 35 PRO HB2 . . 4.940 4.362 3.982 4.720 . 0 0 "[ . 1 . 2]" 1
498 1 25 TRP HH2 1 35 PRO HB3 . . 4.350 3.090 2.573 3.426 . 0 0 "[ . 1 . 2]" 1
499 1 25 TRP HH2 1 35 PRO QD . . 4.570 2.809 2.445 3.015 . 0 0 "[ . 1 . 2]" 1
500 1 25 TRP HH2 1 36 SER H . . 4.840 4.645 4.398 4.869 0.029 5 0 "[ . 1 . 2]" 1
501 1 25 TRP HZ2 1 32 LYS QD . . 4.420 4.374 4.252 4.442 0.022 19 0 "[ . 1 . 2]" 1
502 1 25 TRP HZ2 1 32 LYS QE . . 5.440 5.248 4.939 5.443 0.003 5 0 "[ . 1 . 2]" 1
503 1 25 TRP HZ2 1 35 PRO HA . . 3.790 2.317 2.074 3.040 . 0 0 "[ . 1 . 2]" 1
504 1 25 TRP HZ2 1 35 PRO HB2 . . 4.810 4.344 3.982 4.657 . 0 0 "[ . 1 . 2]" 1
505 1 25 TRP HZ2 1 35 PRO HB3 . . 4.280 3.283 2.827 3.467 . 0 0 "[ . 1 . 2]" 1
506 1 25 TRP HZ2 1 35 PRO HG3 . . 5.500 5.427 5.015 5.509 0.009 20 0 "[ . 1 . 2]" 1
507 1 25 TRP HZ2 1 36 SER H . . 4.770 3.742 3.442 4.446 . 0 0 "[ . 1 . 2]" 1
508 1 25 TRP HZ2 1 39 GLU HB2 . . 4.570 4.127 3.967 4.456 . 0 0 "[ . 1 . 2]" 1
509 1 25 TRP HZ2 1 39 GLU HB3 . . 4.040 3.864 3.701 4.043 0.003 5 0 "[ . 1 . 2]" 1
510 1 25 TRP HZ2 1 39 GLU QG . . 4.160 2.711 2.306 3.949 . 0 0 "[ . 1 . 2]" 1
511 1 25 TRP HZ2 1 42 MET ME . . 5.500 5.464 5.303 5.511 0.011 19 0 "[ . 1 . 2]" 1
512 1 25 TRP HZ2 1 43 LEU MD1 . . 5.500 5.171 4.880 5.396 . 0 0 "[ . 1 . 2]" 1
513 1 25 TRP HZ3 1 26 MET HA . . 4.280 2.762 2.674 2.965 . 0 0 "[ . 1 . 2]" 1
514 1 25 TRP HZ3 1 26 MET QG . . 5.200 3.982 3.438 4.710 . 0 0 "[ . 1 . 2]" 1
515 1 25 TRP HZ3 1 29 HIS HB3 . . 5.500 4.369 3.827 4.695 . 0 0 "[ . 1 . 2]" 1
516 1 25 TRP HZ3 1 33 ALA HA . . 4.270 3.097 2.404 3.471 . 0 0 "[ . 1 . 2]" 1
517 1 25 TRP HZ3 1 33 ALA MB . . 4.820 4.347 3.653 4.708 . 0 0 "[ . 1 . 2]" 1
518 1 25 TRP HZ3 1 35 PRO HB2 . . 5.500 5.258 4.834 5.506 0.006 20 0 "[ . 1 . 2]" 1
519 1 25 TRP HZ3 1 35 PRO QD . . 4.390 2.400 2.133 2.608 . 0 0 "[ . 1 . 2]" 1
520 1 25 TRP HZ3 1 58 PHE QE . . 4.470 2.178 1.997 2.533 . 0 0 "[ . 1 . 2]" 1
521 1 25 TRP HZ3 1 58 PHE HZ . . 4.850 3.471 3.002 3.871 . 0 0 "[ . 1 . 2]" 1
522 1 26 MET H 1 26 MET QB . . 3.210 2.239 2.221 2.255 . 0 0 "[ . 1 . 2]" 1
523 1 26 MET H 1 26 MET ME . . 5.500 5.441 5.169 5.550 0.050 19 0 "[ . 1 . 2]" 1
524 1 26 MET H 1 26 MET QG . . 4.150 3.964 3.942 3.995 . 0 0 "[ . 1 . 2]" 1
525 1 26 MET H 1 27 TYR H . . 3.730 2.681 2.599 2.794 . 0 0 "[ . 1 . 2]" 1
526 1 26 MET H 1 28 LYS H . . 5.100 4.677 4.474 4.906 . 0 0 "[ . 1 . 2]" 1
527 1 26 MET H 1 58 PHE HZ . . 5.180 4.009 3.275 4.460 . 0 0 "[ . 1 . 2]" 1
528 1 26 MET H 1 69 MET ME . . 4.790 4.455 3.765 4.733 . 0 0 "[ . 1 . 2]" 1
529 1 26 MET HA 1 26 MET QG . . 3.360 2.651 2.496 2.942 . 0 0 "[ . 1 . 2]" 1
530 1 26 MET HA 1 29 HIS H . . 4.050 3.661 3.490 3.817 . 0 0 "[ . 1 . 2]" 1
531 1 26 MET HA 1 29 HIS HB2 . . 4.300 3.184 2.984 3.391 . 0 0 "[ . 1 . 2]" 1
532 1 26 MET HA 1 30 ARG H . . 4.680 4.086 3.957 4.327 . 0 0 "[ . 1 . 2]" 1
533 1 26 MET HA 1 33 ALA MB . . 5.100 4.497 3.776 4.857 . 0 0 "[ . 1 . 2]" 1
534 1 26 MET HA 1 58 PHE HZ . . 4.990 4.250 3.685 4.599 . 0 0 "[ . 1 . 2]" 1
535 1 26 MET QB 1 26 MET ME . . 3.330 3.104 2.794 3.254 . 0 0 "[ . 1 . 2]" 1
536 1 26 MET QB 1 27 TYR H . . 3.590 2.948 2.842 3.067 . 0 0 "[ . 1 . 2]" 1
537 1 26 MET QB 1 27 TYR HA . . 5.240 4.286 4.201 4.358 . 0 0 "[ . 1 . 2]" 1
538 1 26 MET QB 1 27 TYR QB . . 5.230 4.164 4.054 4.229 . 0 0 "[ . 1 . 2]" 1
539 1 26 MET QB 1 33 ALA MB . . 5.100 4.480 3.935 4.807 . 0 0 "[ . 1 . 2]" 1
540 1 26 MET QB 1 57 TRP HH2 . . 4.500 2.799 2.648 2.962 . 0 0 "[ . 1 . 2]" 1
541 1 26 MET QB 1 57 TRP HZ3 . . 4.640 2.971 2.624 3.182 . 0 0 "[ . 1 . 2]" 1
542 1 26 MET QB 1 58 PHE QE . . 4.490 2.045 1.983 2.278 . 0 0 "[ . 1 . 2]" 1
543 1 26 MET QB 1 65 ILE MG . . 4.680 3.731 3.369 4.453 . 0 0 "[ . 1 . 2]" 1
544 1 26 MET QB 1 66 LEU MD1 . . 5.500 5.228 4.848 5.503 0.003 2 0 "[ . 1 . 2]" 1
545 1 26 MET QB 1 69 MET ME . . 3.280 2.663 1.998 2.927 . 0 0 "[ . 1 . 2]" 1
546 1 26 MET ME 1 26 MET QG . . 3.310 2.139 1.966 2.212 . 0 0 "[ . 1 . 2]" 1
547 1 26 MET ME 1 33 ALA HA . . 4.620 3.911 3.477 4.605 . 0 0 "[ . 1 . 2]" 1
548 1 26 MET ME 1 33 ALA MB . . 3.430 2.411 1.953 3.207 . 0 0 "[ . 1 . 2]" 1
549 1 26 MET ME 1 57 TRP HE3 . . 4.730 4.504 4.272 4.730 0.000 8 0 "[ . 1 . 2]" 1
550 1 26 MET ME 1 57 TRP HH2 . . 3.880 3.660 3.164 3.872 . 0 0 "[ . 1 . 2]" 1
551 1 26 MET ME 1 57 TRP HZ2 . . 5.500 4.714 4.112 5.129 . 0 0 "[ . 1 . 2]" 1
552 1 26 MET ME 1 57 TRP HZ3 . . 3.670 3.449 3.102 3.674 0.004 8 0 "[ . 1 . 2]" 1
553 1 26 MET ME 1 58 PHE H . . 5.460 5.148 4.794 5.461 0.001 4 0 "[ . 1 . 2]" 1
554 1 26 MET ME 1 58 PHE HA . . 3.920 2.800 2.462 3.110 . 0 0 "[ . 1 . 2]" 1
555 1 26 MET ME 1 58 PHE HB3 . . 4.590 3.620 3.271 4.337 . 0 0 "[ . 1 . 2]" 1
556 1 26 MET ME 1 58 PHE QD . . 3.560 2.229 1.985 2.817 . 0 0 "[ . 1 . 2]" 1
557 1 26 MET ME 1 58 PHE QE . . 3.680 3.411 3.145 3.677 . 0 0 "[ . 1 . 2]" 1
558 1 26 MET ME 1 61 ALA H . . 5.500 4.335 3.959 4.907 . 0 0 "[ . 1 . 2]" 1
559 1 26 MET ME 1 61 ALA HA . . 4.610 4.103 3.715 4.621 0.011 11 0 "[ . 1 . 2]" 1
560 1 26 MET ME 1 61 ALA MB . . 3.020 2.366 1.976 2.792 . 0 0 "[ . 1 . 2]" 1
561 1 26 MET ME 1 62 ARG H . . 4.280 2.875 2.311 3.277 . 0 0 "[ . 1 . 2]" 1
562 1 26 MET ME 1 62 ARG HA . . 3.180 1.999 1.803 2.325 . 0 0 "[ . 1 . 2]" 1
563 1 26 MET ME 1 62 ARG QD . . 4.480 3.576 3.082 4.480 . 0 0 "[ . 1 . 2]" 1
564 1 26 MET ME 1 62 ARG QG . . 3.720 2.550 1.683 3.663 . 0 0 "[ . 1 . 2]" 1
565 1 26 MET ME 1 65 ILE HB . . 4.670 2.793 2.030 3.103 . 0 0 "[ . 1 . 2]" 1
566 1 26 MET ME 1 65 ILE MD . . 4.010 3.544 3.115 3.873 . 0 0 "[ . 1 . 2]" 1
567 1 26 MET ME 1 65 ILE HG12 . . 5.500 5.239 4.718 5.517 0.017 8 0 "[ . 1 . 2]" 1
568 1 26 MET ME 1 65 ILE QG . . 4.700 4.119 3.698 4.484 . 0 0 "[ . 1 . 2]" 1
569 1 26 MET ME 1 65 ILE HG13 . . 5.500 4.317 3.800 4.765 . 0 0 "[ . 1 . 2]" 1
570 1 26 MET ME 1 66 LEU H . . 4.840 2.833 2.310 3.677 . 0 0 "[ . 1 . 2]" 1
571 1 26 MET ME 1 66 LEU HA . . 4.700 3.566 3.188 4.090 . 0 0 "[ . 1 . 2]" 1
572 1 26 MET ME 1 66 LEU HB2 . . 3.690 2.292 2.049 3.336 . 0 0 "[ . 1 . 2]" 1
573 1 26 MET ME 1 66 LEU MD1 . . 3.670 3.652 3.443 3.691 0.021 19 0 "[ . 1 . 2]" 1
574 1 26 MET ME 1 66 LEU MD2 . . 3.830 3.414 3.000 3.715 . 0 0 "[ . 1 . 2]" 1
575 1 26 MET QG 1 27 TYR H . . 4.460 3.782 3.587 4.009 . 0 0 "[ . 1 . 2]" 1
576 1 26 MET QG 1 27 TYR HA . . 4.650 3.617 3.444 3.913 . 0 0 "[ . 1 . 2]" 1
577 1 26 MET QG 1 33 ALA HA . . 4.620 3.275 2.775 4.069 . 0 0 "[ . 1 . 2]" 1
578 1 26 MET QG 1 33 ALA MB . . 3.640 2.910 2.134 3.652 0.012 14 0 "[ . 1 . 2]" 1
579 1 26 MET QG 1 57 TRP HH2 . . 5.500 4.034 3.008 4.449 . 0 0 "[ . 1 . 2]" 1
580 1 26 MET QG 1 58 PHE QE . . 4.550 3.038 2.189 3.798 . 0 0 "[ . 1 . 2]" 1
581 1 26 MET QG 1 66 LEU HA . . 4.920 3.572 3.154 4.290 . 0 0 "[ . 1 . 2]" 1
582 1 26 MET QG 1 66 LEU MD1 . . 4.020 3.409 3.072 3.644 . 0 0 "[ . 1 . 2]" 1
583 1 26 MET QG 1 66 LEU MD2 . . 5.020 4.439 4.072 4.842 . 0 0 "[ . 1 . 2]" 1
584 1 26 MET QG 1 69 MET ME . . 4.320 2.631 1.939 3.770 . 0 0 "[ . 1 . 2]" 1
585 1 27 TYR H 1 27 TYR HB2 . . 3.390 2.484 2.320 2.581 . 0 0 "[ . 1 . 2]" 1
586 1 27 TYR H 1 27 TYR HB3 . . 3.390 2.611 2.510 2.785 . 0 0 "[ . 1 . 2]" 1
587 1 27 TYR H 1 27 TYR QD . . 4.350 4.186 4.142 4.209 . 0 0 "[ . 1 . 2]" 1
588 1 27 TYR H 1 28 LYS H . . 3.560 2.695 2.583 2.826 . 0 0 "[ . 1 . 2]" 1
589 1 27 TYR H 1 28 LYS HB2 . . 5.260 4.699 4.588 4.923 . 0 0 "[ . 1 . 2]" 1
590 1 27 TYR H 1 29 HIS H . . 4.780 3.922 3.680 4.215 . 0 0 "[ . 1 . 2]" 1
591 1 27 TYR H 1 30 ARG HB3 . . 5.500 4.431 4.254 4.635 . 0 0 "[ . 1 . 2]" 1
592 1 27 TYR H 1 69 MET ME . . 4.020 3.463 2.724 3.875 . 0 0 "[ . 1 . 2]" 1
593 1 27 TYR HA 1 27 TYR QD . . 3.440 2.526 2.077 3.078 . 0 0 "[ . 1 . 2]" 1
594 1 27 TYR HA 1 27 TYR QE . . 4.590 4.474 4.294 4.603 0.013 19 0 "[ . 1 . 2]" 1
595 1 27 TYR HA 1 29 HIS H . . 4.670 4.473 4.212 4.675 0.005 7 0 "[ . 1 . 2]" 1
596 1 27 TYR HA 1 30 ARG H . . 5.090 3.369 3.228 3.489 . 0 0 "[ . 1 . 2]" 1
597 1 27 TYR HA 1 30 ARG HB2 . . 4.250 3.623 3.331 3.867 . 0 0 "[ . 1 . 2]" 1
598 1 27 TYR HA 1 30 ARG HB3 . . 3.630 2.136 1.995 2.307 . 0 0 "[ . 1 . 2]" 1
599 1 27 TYR HA 1 30 ARG QD . . 4.170 2.910 2.522 3.522 . 0 0 "[ . 1 . 2]" 1
600 1 27 TYR HA 1 69 MET QB . . 5.340 4.034 3.732 4.639 . 0 0 "[ . 1 . 2]" 1
601 1 27 TYR HA 1 69 MET ME . . 4.100 3.157 2.559 4.077 . 0 0 "[ . 1 . 2]" 1
602 1 27 TYR QB 1 28 LYS H . . 3.180 2.250 2.056 2.366 . 0 0 "[ . 1 . 2]" 1
603 1 27 TYR QB 1 69 MET QB . . 5.180 3.990 3.571 4.437 . 0 0 "[ . 1 . 2]" 1
604 1 27 TYR QB 1 69 MET ME . . 3.370 2.933 2.378 3.385 0.015 19 0 "[ . 1 . 2]" 1
605 1 27 TYR HB2 1 28 LYS H . . 3.740 3.629 3.400 3.720 . 0 0 "[ . 1 . 2]" 1
606 1 27 TYR HB3 1 28 LYS H . . 3.740 2.272 2.069 2.397 . 0 0 "[ . 1 . 2]" 1
607 1 27 TYR QD 1 28 LYS H . . 4.270 3.535 3.099 3.927 . 0 0 "[ . 1 . 2]" 1
608 1 27 TYR QD 1 28 LYS HA . . 4.390 3.718 3.002 4.354 . 0 0 "[ . 1 . 2]" 1
609 1 27 TYR QD 1 28 LYS HG2 . . 4.950 3.981 3.493 4.607 . 0 0 "[ . 1 . 2]" 1
610 1 27 TYR QD 1 28 LYS QG . . 4.250 3.267 2.712 3.924 . 0 0 "[ . 1 . 2]" 1
611 1 27 TYR QD 1 28 LYS HG3 . . 4.950 3.504 2.768 4.586 . 0 0 "[ . 1 . 2]" 1
612 1 27 TYR QD 1 30 ARG HB3 . . 4.440 3.800 3.195 4.114 . 0 0 "[ . 1 . 2]" 1
613 1 27 TYR QD 1 30 ARG QD . . 4.230 3.031 2.661 3.894 . 0 0 "[ . 1 . 2]" 1
614 1 27 TYR QD 1 69 MET HA . . 4.980 4.586 4.203 4.986 0.006 10 0 "[ . 1 . 2]" 1
615 1 27 TYR QD 1 69 MET QB . . 3.620 2.210 1.967 2.806 . 0 0 "[ . 1 . 2]" 1
616 1 27 TYR QD 1 69 MET ME . . 3.750 2.989 2.362 3.569 . 0 0 "[ . 1 . 2]" 1
617 1 27 TYR QD 1 69 MET HG2 . . 4.880 4.323 3.743 4.584 . 0 0 "[ . 1 . 2]" 1
618 1 27 TYR QD 1 69 MET HG3 . . 3.980 3.604 1.996 3.985 0.005 17 0 "[ . 1 . 2]" 1
619 1 27 TYR QE 1 30 ARG QD . . 3.980 3.423 2.860 3.931 . 0 0 "[ . 1 . 2]" 1
620 1 27 TYR QE 1 69 MET HA . . 4.450 4.022 3.293 4.440 . 0 0 "[ . 1 . 2]" 1
621 1 27 TYR QE 1 69 MET QB . . 4.570 2.523 2.048 3.224 . 0 0 "[ . 1 . 2]" 1
622 1 27 TYR QE 1 69 MET ME . . 4.860 4.623 4.104 4.872 0.012 19 0 "[ . 1 . 2]" 1
623 1 27 TYR QE 1 69 MET HG3 . . 4.550 4.167 2.983 4.533 . 0 0 "[ . 1 . 2]" 1
624 1 27 TYR QE 1 70 LEU H . . 5.500 5.087 4.658 5.431 . 0 0 "[ . 1 . 2]" 1
625 1 28 LYS H 1 28 LYS HB2 . . 3.020 2.420 2.303 2.645 . 0 0 "[ . 1 . 2]" 1
626 1 28 LYS H 1 28 LYS HB3 . . 3.650 3.574 3.553 3.590 . 0 0 "[ . 1 . 2]" 1
627 1 28 LYS H 1 28 LYS QD . . 4.640 3.915 3.422 4.352 . 0 0 "[ . 1 . 2]" 1
628 1 28 LYS H 1 28 LYS HG2 . . 4.200 3.527 3.234 3.844 . 0 0 "[ . 1 . 2]" 1
629 1 28 LYS H 1 28 LYS QG . . 3.550 2.315 1.887 2.545 . 0 0 "[ . 1 . 2]" 1
630 1 28 LYS H 1 28 LYS HG3 . . 4.200 2.350 1.898 2.606 . 0 0 "[ . 1 . 2]" 1
631 1 28 LYS H 1 29 HIS H . . 3.180 2.711 2.596 2.844 . 0 0 "[ . 1 . 2]" 1
632 1 28 LYS HA 1 28 LYS QD . . 4.240 3.994 3.845 4.238 . 0 0 "[ . 1 . 2]" 1
633 1 28 LYS HA 1 28 LYS QE . . 5.080 4.674 4.147 4.983 . 0 0 "[ . 1 . 2]" 1
634 1 28 LYS HA 1 28 LYS HG2 . . 3.750 2.515 2.324 2.760 . 0 0 "[ . 1 . 2]" 1
635 1 28 LYS HA 1 28 LYS HG3 . . 3.750 2.990 2.718 3.202 . 0 0 "[ . 1 . 2]" 1
636 1 28 LYS HB2 1 29 HIS H . . 4.440 2.674 2.407 2.917 . 0 0 "[ . 1 . 2]" 1
637 1 28 LYS HB2 1 29 HIS HE1 . . 5.500 5.382 5.078 5.508 0.008 8 0 "[ . 1 . 2]" 1
638 1 28 LYS HB3 1 28 LYS QE . . 5.010 3.759 2.433 4.143 . 0 0 "[ . 1 . 2]" 1
639 1 28 LYS HB3 1 29 HIS H . . 3.670 3.579 3.419 3.701 0.031 19 0 "[ . 1 . 2]" 1
640 1 28 LYS HB3 1 29 HIS HA . . 5.150 4.420 4.294 4.620 . 0 0 "[ . 1 . 2]" 1
641 1 28 LYS HB3 1 29 HIS HD2 . . 4.980 4.146 3.355 4.597 . 0 0 "[ . 1 . 2]" 1
642 1 28 LYS QD 1 29 HIS HE1 . . 5.500 5.490 5.186 5.514 0.014 4 0 "[ . 1 . 2]" 1
643 1 28 LYS QE 1 28 LYS HG2 . . 3.660 2.765 2.101 3.461 . 0 0 "[ . 1 . 2]" 1
644 1 28 LYS QE 1 28 LYS HG3 . . 3.660 2.504 2.152 3.262 . 0 0 "[ . 1 . 2]" 1
645 1 28 LYS QG 1 29 HIS H . . 4.410 4.154 3.837 4.316 . 0 0 "[ . 1 . 2]" 1
646 1 28 LYS HG2 1 29 HIS H . . 5.280 5.027 4.878 5.159 . 0 0 "[ . 1 . 2]" 1
647 1 28 LYS HG3 1 29 HIS H . . 5.280 4.433 4.009 4.679 . 0 0 "[ . 1 . 2]" 1
648 1 29 HIS H 1 29 HIS HB2 . . 3.260 2.577 2.533 2.661 . 0 0 "[ . 1 . 2]" 1
649 1 29 HIS H 1 29 HIS HB3 . . 3.700 3.679 3.655 3.705 0.005 13 0 "[ . 1 . 2]" 1
650 1 29 HIS H 1 29 HIS HD2 . . 4.500 2.692 2.031 3.088 . 0 0 "[ . 1 . 2]" 1
651 1 29 HIS H 1 30 ARG H . . 3.590 2.364 2.296 2.459 . 0 0 "[ . 1 . 2]" 1
652 1 29 HIS H 1 30 ARG HA . . 4.770 4.538 4.471 4.644 . 0 0 "[ . 1 . 2]" 1
653 1 29 HIS HA 1 29 HIS HD2 . . 4.930 4.311 3.909 4.497 . 0 0 "[ . 1 . 2]" 1
654 1 29 HIS HA 1 31 PHE H . . 4.780 3.368 3.198 3.537 . 0 0 "[ . 1 . 2]" 1
655 1 29 HIS HA 1 32 LYS H . . 5.480 3.927 3.535 4.105 . 0 0 "[ . 1 . 2]" 1
656 1 29 HIS HA 1 32 LYS QG . . 5.500 4.244 3.187 5.056 . 0 0 "[ . 1 . 2]" 1
657 1 29 HIS HB3 1 32 LYS H . . 4.940 3.871 3.591 4.048 . 0 0 "[ . 1 . 2]" 1
658 1 29 HIS HB3 1 32 LYS QD . . 4.730 2.694 1.971 3.768 . 0 0 "[ . 1 . 2]" 1
659 1 29 HIS HB3 1 32 LYS QG . . 4.640 2.938 2.074 3.604 . 0 0 "[ . 1 . 2]" 1
660 1 29 HIS HB3 1 34 TYR H . . 5.500 3.904 3.323 4.400 . 0 0 "[ . 1 . 2]" 1
661 1 30 ARG H 1 30 ARG HB3 . . 4.050 2.334 2.235 2.454 . 0 0 "[ . 1 . 2]" 1
662 1 30 ARG H 1 30 ARG HG2 . . 4.630 2.642 2.408 2.934 . 0 0 "[ . 1 . 2]" 1
663 1 30 ARG H 1 30 ARG QG . . 3.810 2.600 2.383 2.876 . 0 0 "[ . 1 . 2]" 1
664 1 30 ARG H 1 30 ARG HG3 . . 4.630 3.887 3.742 4.136 . 0 0 "[ . 1 . 2]" 1
665 1 30 ARG H 1 31 PHE H . . 4.550 2.947 2.881 3.001 . 0 0 "[ . 1 . 2]" 1
666 1 30 ARG HA 1 30 ARG QD . . 4.540 4.266 4.243 4.390 . 0 0 "[ . 1 . 2]" 1
667 1 30 ARG HA 1 32 LYS H . . 4.970 4.168 3.814 4.778 . 0 0 "[ . 1 . 2]" 1
668 1 30 ARG HA 1 33 ALA H . . 3.990 3.263 2.903 3.807 . 0 0 "[ . 1 . 2]" 1
669 1 30 ARG HA 1 33 ALA MB . . 3.730 2.867 2.523 3.339 . 0 0 "[ . 1 . 2]" 1
670 1 30 ARG HA 1 66 LEU MD1 . . 3.650 2.816 2.410 3.240 . 0 0 "[ . 1 . 2]" 1
671 1 30 ARG HA 1 66 LEU MD2 . . 4.150 4.166 4.149 4.190 0.040 19 0 "[ . 1 . 2]" 1
672 1 30 ARG HB2 1 31 PHE H . . 4.900 3.926 3.769 4.107 . 0 0 "[ . 1 . 2]" 1
673 1 30 ARG HB2 1 66 LEU MD1 . . 3.550 2.190 1.823 2.637 . 0 0 "[ . 1 . 2]" 1
674 1 30 ARG HB2 1 70 LEU QD . . 3.900 2.980 1.890 3.905 0.005 6 0 "[ . 1 . 2]" 1
675 1 30 ARG HB3 1 30 ARG QD . . 3.760 2.277 2.041 2.460 . 0 0 "[ . 1 . 2]" 1
676 1 30 ARG HB3 1 66 LEU MD1 . . 4.940 3.465 3.148 3.948 . 0 0 "[ . 1 . 2]" 1
677 1 30 ARG HB3 1 69 MET HG3 . . 5.410 4.216 3.759 4.642 . 0 0 "[ . 1 . 2]" 1
678 1 30 ARG QD 1 69 MET HG3 . . 4.560 3.332 2.565 4.506 . 0 0 "[ . 1 . 2]" 1
679 1 30 ARG QD 1 70 LEU HA . . 4.830 3.375 2.470 4.864 0.034 20 0 "[ . 1 . 2]" 1
680 1 30 ARG QD 1 70 LEU QD . . 3.940 2.405 1.714 3.561 . 0 0 "[ . 1 . 2]" 1
681 1 30 ARG QG 1 31 PHE H . . 3.960 2.137 1.982 2.323 . 0 0 "[ . 1 . 2]" 1
682 1 30 ARG QG 1 31 PHE QD . . 4.930 2.956 1.969 3.705 . 0 0 "[ . 1 . 2]" 1
683 1 30 ARG QG 1 70 LEU QD . . 4.360 2.765 2.320 3.444 . 0 0 "[ . 1 . 2]" 1
684 1 30 ARG HG2 1 31 PHE H . . 4.540 2.256 2.013 2.469 . 0 0 "[ . 1 . 2]" 1
685 1 30 ARG HG3 1 31 PHE H . . 4.540 2.726 2.238 3.070 . 0 0 "[ . 1 . 2]" 1
686 1 31 PHE H 1 31 PHE QB . . 3.580 2.389 2.129 2.603 . 0 0 "[ . 1 . 2]" 1
687 1 31 PHE H 1 31 PHE QD . . 4.450 2.865 2.039 3.851 . 0 0 "[ . 1 . 2]" 1
688 1 31 PHE H 1 33 ALA H . . 4.730 4.015 3.806 4.282 . 0 0 "[ . 1 . 2]" 1
689 1 31 PHE HA 1 31 PHE QD . . 3.740 2.193 1.990 2.811 . 0 0 "[ . 1 . 2]" 1
690 1 31 PHE HA 1 31 PHE QE . . 4.540 4.280 4.147 4.442 . 0 0 "[ . 1 . 2]" 1
691 1 31 PHE HA 1 70 LEU QD . . 4.560 4.106 3.683 4.497 . 0 0 "[ . 1 . 2]" 1
692 1 31 PHE QB 1 32 LYS H . . 4.190 2.482 2.248 2.611 . 0 0 "[ . 1 . 2]" 1
693 1 31 PHE QB 1 32 LYS QE . . 3.960 3.416 2.567 3.968 0.008 20 0 "[ . 1 . 2]" 1
694 1 31 PHE HB2 1 32 LYS H . . 4.810 2.673 2.394 3.483 . 0 0 "[ . 1 . 2]" 1
695 1 31 PHE HB2 1 32 LYS QE . . 4.630 3.753 2.721 4.404 . 0 0 "[ . 1 . 2]" 1
696 1 31 PHE HB3 1 32 LYS H . . 4.810 3.241 2.452 3.657 . 0 0 "[ . 1 . 2]" 1
697 1 31 PHE HB3 1 32 LYS QE . . 4.630 4.140 2.603 4.635 0.005 17 0 "[ . 1 . 2]" 1
698 1 31 PHE QD 1 70 LEU QD . . 4.260 4.156 3.712 4.269 0.009 18 0 "[ . 1 . 2]" 1
699 1 31 PHE QE 1 70 LEU QD . . 4.570 4.521 4.384 4.576 0.006 8 0 "[ . 1 . 2]" 1
700 1 32 LYS H 1 32 LYS HB2 . . 4.040 3.729 3.634 3.798 . 0 0 "[ . 1 . 2]" 1
701 1 32 LYS H 1 32 LYS HB3 . . 4.040 2.879 2.632 3.050 . 0 0 "[ . 1 . 2]" 1
702 1 32 LYS H 1 32 LYS QD . . 4.520 3.067 1.867 4.247 . 0 0 "[ . 1 . 2]" 1
703 1 32 LYS H 1 32 LYS QE . . 5.160 3.401 2.672 3.877 . 0 0 "[ . 1 . 2]" 1
704 1 32 LYS H 1 32 LYS QG . . 4.260 2.356 1.880 2.835 . 0 0 "[ . 1 . 2]" 1
705 1 32 LYS H 1 33 ALA H . . 4.450 2.035 1.860 2.386 . 0 0 "[ . 1 . 2]" 1
706 1 32 LYS H 1 33 ALA MB . . 4.840 4.137 3.982 4.319 . 0 0 "[ . 1 . 2]" 1
707 1 32 LYS HA 1 32 LYS QE . . 4.720 4.474 4.095 4.739 0.019 15 0 "[ . 1 . 2]" 1
708 1 32 LYS HA 1 32 LYS QG . . 3.650 3.364 3.301 3.421 . 0 0 "[ . 1 . 2]" 1
709 1 32 LYS HA 1 33 ALA MB . . 4.340 4.011 3.888 4.124 . 0 0 "[ . 1 . 2]" 1
710 1 32 LYS HA 1 34 TYR QD . . 4.340 3.866 3.379 4.197 . 0 0 "[ . 1 . 2]" 1
711 1 32 LYS HA 1 34 TYR QE . . 5.390 4.932 4.372 5.397 0.007 14 0 "[ . 1 . 2]" 1
712 1 32 LYS QB 1 32 LYS QE . . 3.340 2.297 1.967 3.022 . 0 0 "[ . 1 . 2]" 1
713 1 32 LYS HB2 1 32 LYS QE . . 4.120 3.479 3.183 4.080 . 0 0 "[ . 1 . 2]" 1
714 1 32 LYS HB2 1 34 TYR QD . . 4.940 3.047 2.716 3.350 . 0 0 "[ . 1 . 2]" 1
715 1 32 LYS HB3 1 32 LYS QE . . 4.120 2.333 1.979 3.115 . 0 0 "[ . 1 . 2]" 1
716 1 32 LYS HB3 1 34 TYR QD . . 4.940 4.684 4.325 4.944 0.004 2 0 "[ . 1 . 2]" 1
717 1 32 LYS QE 1 32 LYS QG . . 3.270 2.266 2.049 2.701 . 0 0 "[ . 1 . 2]" 1
718 1 32 LYS QG 1 34 TYR H . . 4.050 1.882 1.708 2.018 . 0 0 "[ . 1 . 2]" 1
719 1 32 LYS QG 1 34 TYR HB3 . . 4.680 4.168 3.344 4.573 . 0 0 "[ . 1 . 2]" 1
720 1 32 LYS QG 1 34 TYR QD . . 4.050 3.715 3.133 4.060 0.010 5 0 "[ . 1 . 2]" 1
721 1 33 ALA H 1 33 ALA MB . . 3.660 2.837 2.673 2.939 . 0 0 "[ . 1 . 2]" 1
722 1 33 ALA H 1 34 TYR H . . 4.060 2.779 2.636 2.924 . 0 0 "[ . 1 . 2]" 1
723 1 33 ALA H 1 34 TYR QD . . 5.250 4.877 4.261 5.257 0.007 19 0 "[ . 1 . 2]" 1
724 1 33 ALA HA 1 34 TYR H . . 3.350 2.771 2.656 2.988 . 0 0 "[ . 1 . 2]" 1
725 1 33 ALA MB 1 34 TYR H . . 3.710 3.681 3.585 3.716 0.006 20 0 "[ . 1 . 2]" 1
726 1 33 ALA MB 1 34 TYR HB2 . . 5.000 4.767 4.640 5.014 0.014 13 0 "[ . 1 . 2]" 1
727 1 33 ALA MB 1 34 TYR QD . . 3.990 3.841 3.463 4.043 0.053 1 0 "[ . 1 . 2]" 1
728 1 33 ALA MB 1 34 TYR QE . . 4.290 3.962 3.370 4.317 0.027 2 0 "[ . 1 . 2]" 1
729 1 33 ALA MB 1 58 PHE QD . . 4.910 3.437 2.436 4.140 . 0 0 "[ . 1 . 2]" 1
730 1 33 ALA MB 1 58 PHE QE . . 5.290 4.343 3.274 4.998 . 0 0 "[ . 1 . 2]" 1
731 1 33 ALA MB 1 62 ARG HA . . 4.380 3.671 3.109 4.212 . 0 0 "[ . 1 . 2]" 1
732 1 33 ALA MB 1 62 ARG QD . . 3.910 2.201 1.736 3.737 . 0 0 "[ . 1 . 2]" 1
733 1 33 ALA MB 1 62 ARG HG2 . . 4.450 2.988 1.925 4.139 . 0 0 "[ . 1 . 2]" 1
734 1 33 ALA MB 1 62 ARG QG . . 3.570 2.089 1.835 3.168 . 0 0 "[ . 1 . 2]" 1
735 1 33 ALA MB 1 62 ARG HG3 . . 4.450 2.374 1.847 3.392 . 0 0 "[ . 1 . 2]" 1
736 1 33 ALA MB 1 66 LEU HA . . 4.830 4.471 4.091 4.857 0.027 19 0 "[ . 1 . 2]" 1
737 1 33 ALA MB 1 66 LEU HB2 . . 3.990 2.982 2.428 3.675 . 0 0 "[ . 1 . 2]" 1
738 1 33 ALA MB 1 66 LEU MD1 . . 3.610 2.693 2.173 3.161 . 0 0 "[ . 1 . 2]" 1
739 1 33 ALA MB 1 66 LEU MD2 . . 3.490 2.081 1.793 2.645 . 0 0 "[ . 1 . 2]" 1
740 1 34 TYR H 1 34 TYR HB2 . . 3.870 2.814 2.605 2.987 . 0 0 "[ . 1 . 2]" 1
741 1 34 TYR H 1 34 TYR HB3 . . 3.990 3.854 3.699 3.962 . 0 0 "[ . 1 . 2]" 1
742 1 34 TYR H 1 34 TYR QD . . 3.960 3.841 3.562 3.978 0.018 9 0 "[ . 1 . 2]" 1
743 1 34 TYR H 1 35 PRO HA . . 4.680 4.511 4.432 4.625 . 0 0 "[ . 1 . 2]" 1
744 1 34 TYR H 1 35 PRO HD2 . . 5.120 4.346 4.272 4.386 . 0 0 "[ . 1 . 2]" 1
745 1 34 TYR H 1 35 PRO QD . . 4.340 3.529 3.434 3.581 . 0 0 "[ . 1 . 2]" 1
746 1 34 TYR H 1 35 PRO HD3 . . 5.120 3.733 3.619 3.798 . 0 0 "[ . 1 . 2]" 1
747 1 34 TYR HA 1 34 TYR QD . . 3.790 2.390 1.997 2.709 . 0 0 "[ . 1 . 2]" 1
748 1 34 TYR HA 1 35 PRO QD . . 3.230 1.862 1.848 1.900 . 0 0 "[ . 1 . 2]" 1
749 1 34 TYR HA 1 35 PRO HG2 . . 4.860 4.119 4.113 4.127 . 0 0 "[ . 1 . 2]" 1
750 1 34 TYR HB2 1 35 PRO QD . . 4.750 4.340 4.296 4.388 . 0 0 "[ . 1 . 2]" 1
751 1 34 TYR HB3 1 35 PRO HD2 . . 4.850 3.762 3.582 4.031 . 0 0 "[ . 1 . 2]" 1
752 1 34 TYR HB3 1 35 PRO QD . . 4.230 3.626 3.472 3.855 . 0 0 "[ . 1 . 2]" 1
753 1 34 TYR HB3 1 35 PRO HD3 . . 4.850 4.756 4.659 4.906 0.056 5 0 "[ . 1 . 2]" 1
754 1 34 TYR QD 1 35 PRO HD2 . . 5.000 3.215 3.020 3.585 . 0 0 "[ . 1 . 2]" 1
755 1 34 TYR QD 1 35 PRO HD3 . . 5.000 4.465 4.196 4.781 . 0 0 "[ . 1 . 2]" 1
756 1 34 TYR QD 1 58 PHE HB2 . . 5.500 4.782 4.059 5.385 . 0 0 "[ . 1 . 2]" 1
757 1 34 TYR QD 1 58 PHE HB3 . . 4.550 4.047 3.482 4.568 0.018 18 0 "[ . 1 . 2]" 1
758 1 34 TYR QD 1 62 ARG QD . . 4.430 3.753 3.264 4.443 0.013 10 0 "[ . 1 . 2]" 1
759 1 34 TYR QE 1 58 PHE HB3 . . 4.980 4.316 3.625 4.947 . 0 0 "[ . 1 . 2]" 1
760 1 34 TYR QE 1 59 ILE HA . . 4.230 3.907 3.254 4.241 0.011 1 0 "[ . 1 . 2]" 1
761 1 34 TYR QE 1 59 ILE MD . . 5.500 5.036 3.765 5.502 0.002 20 0 "[ . 1 . 2]" 1
762 1 34 TYR QE 1 59 ILE HG12 . . 4.880 3.862 2.904 4.372 . 0 0 "[ . 1 . 2]" 1
763 1 34 TYR QE 1 59 ILE MG . . 5.500 4.742 4.283 5.182 . 0 0 "[ . 1 . 2]" 1
764 1 34 TYR QE 1 62 ARG QD . . 3.990 2.939 2.432 3.348 . 0 0 "[ . 1 . 2]" 1
765 1 34 TYR QE 1 62 ARG QG . . 4.820 4.466 3.279 4.834 0.014 14 0 "[ . 1 . 2]" 1
766 1 35 PRO HA 1 36 SER H . . 2.980 2.380 2.216 2.458 . 0 0 "[ . 1 . 2]" 1
767 1 35 PRO HA 1 39 GLU HB2 . . 4.510 3.260 2.952 3.476 . 0 0 "[ . 1 . 2]" 1
768 1 35 PRO HA 1 39 GLU HB3 . . 4.580 3.925 3.585 4.286 . 0 0 "[ . 1 . 2]" 1
769 1 35 PRO HB2 1 36 SER H . . 4.060 2.674 2.472 3.173 . 0 0 "[ . 1 . 2]" 1
770 1 35 PRO HB2 1 39 GLU H . . 4.670 4.327 4.229 4.425 . 0 0 "[ . 1 . 2]" 1
771 1 35 PRO HB2 1 39 GLU HB2 . . 4.000 2.057 1.995 2.353 . 0 0 "[ . 1 . 2]" 1
772 1 35 PRO HB2 1 39 GLU HB3 . . 4.160 3.085 2.881 3.277 . 0 0 "[ . 1 . 2]" 1
773 1 35 PRO HB2 1 39 GLU QG . . 4.800 3.606 3.378 4.345 . 0 0 "[ . 1 . 2]" 1
774 1 35 PRO HB2 1 40 LYS H . . 3.750 2.830 2.717 2.939 . 0 0 "[ . 1 . 2]" 1
775 1 35 PRO HB2 1 40 LYS HA . . 4.500 3.858 3.628 4.024 . 0 0 "[ . 1 . 2]" 1
776 1 35 PRO HB2 1 40 LYS HB3 . . 5.180 4.516 4.369 4.725 . 0 0 "[ . 1 . 2]" 1
777 1 35 PRO HB2 1 40 LYS QD . . 4.880 3.915 3.693 4.085 . 0 0 "[ . 1 . 2]" 1
778 1 35 PRO HB2 1 43 LEU MD1 . . 5.000 3.560 3.240 3.839 . 0 0 "[ . 1 . 2]" 1
779 1 35 PRO HB3 1 36 SER H . . 4.010 3.487 3.384 3.769 . 0 0 "[ . 1 . 2]" 1
780 1 35 PRO HB3 1 39 GLU H . . 5.500 5.464 5.390 5.518 0.018 13 0 "[ . 1 . 2]" 1
781 1 35 PRO HB3 1 39 GLU HA . . 5.500 5.377 5.165 5.529 0.029 5 0 "[ . 1 . 2]" 1
782 1 35 PRO HB3 1 39 GLU HB2 . . 4.400 2.918 2.814 3.185 . 0 0 "[ . 1 . 2]" 1
783 1 35 PRO HB3 1 39 GLU HB3 . . 4.210 3.040 2.822 3.208 . 0 0 "[ . 1 . 2]" 1
784 1 35 PRO HB3 1 40 LYS H . . 4.990 4.311 4.173 4.417 . 0 0 "[ . 1 . 2]" 1
785 1 35 PRO HB3 1 43 LEU MD1 . . 3.610 3.258 2.826 3.617 0.007 7 0 "[ . 1 . 2]" 1
786 1 35 PRO QD 1 58 PHE QD . . 4.330 3.112 2.804 3.358 . 0 0 "[ . 1 . 2]" 1
787 1 35 PRO QD 1 58 PHE QE . . 4.660 3.105 2.835 3.434 . 0 0 "[ . 1 . 2]" 1
788 1 35 PRO HD2 1 58 PHE QD . . 5.050 3.786 3.501 4.043 . 0 0 "[ . 1 . 2]" 1
789 1 35 PRO HD3 1 58 PHE QD . . 5.050 3.314 2.951 3.651 . 0 0 "[ . 1 . 2]" 1
790 1 35 PRO HG2 1 40 LYS HA . . 4.950 4.657 4.453 4.789 . 0 0 "[ . 1 . 2]" 1
791 1 35 PRO HG2 1 40 LYS HB2 . . 5.320 5.282 5.068 5.338 0.018 3 0 "[ . 1 . 2]" 1
792 1 35 PRO HG2 1 40 LYS HB3 . . 4.930 4.358 4.092 4.458 . 0 0 "[ . 1 . 2]" 1
793 1 35 PRO HG2 1 40 LYS QD . . 5.370 2.809 2.370 3.021 . 0 0 "[ . 1 . 2]" 1
794 1 35 PRO HG2 1 40 LYS HE2 . . 4.310 2.195 2.010 2.429 . 0 0 "[ . 1 . 2]" 1
795 1 35 PRO HG2 1 40 LYS HE3 . . 4.140 3.733 3.588 3.781 . 0 0 "[ . 1 . 2]" 1
796 1 35 PRO HG2 1 58 PHE QD . . 5.210 4.081 3.846 4.585 . 0 0 "[ . 1 . 2]" 1
797 1 35 PRO HG3 1 36 SER H . . 5.500 5.129 4.985 5.462 . 0 0 "[ . 1 . 2]" 1
798 1 35 PRO HG3 1 39 GLU HB2 . . 5.500 4.567 4.468 4.876 . 0 0 "[ . 1 . 2]" 1
799 1 35 PRO HG3 1 40 LYS HB3 . . 5.500 4.806 4.577 5.010 . 0 0 "[ . 1 . 2]" 1
800 1 35 PRO HG3 1 40 LYS QD . . 5.500 3.897 3.609 4.240 . 0 0 "[ . 1 . 2]" 1
801 1 35 PRO HG3 1 40 LYS HE2 . . 4.960 3.951 3.744 4.198 . 0 0 "[ . 1 . 2]" 1
802 1 35 PRO HG3 1 40 LYS HE3 . . 5.410 5.400 5.252 5.442 0.032 5 0 "[ . 1 . 2]" 1
803 1 35 PRO HG3 1 40 LYS HG2 . . 4.380 3.350 3.262 3.517 . 0 0 "[ . 1 . 2]" 1
804 1 35 PRO HG3 1 40 LYS HG3 . . 5.320 5.067 4.989 5.232 . 0 0 "[ . 1 . 2]" 1
805 1 35 PRO HG3 1 54 ILE MG . . 3.910 3.317 2.924 3.820 . 0 0 "[ . 1 . 2]" 1
806 1 35 PRO HG3 1 58 PHE QD . . 5.090 3.350 2.958 3.961 . 0 0 "[ . 1 . 2]" 1
807 1 35 PRO HG3 1 58 PHE QE . . 4.070 2.715 2.472 3.318 . 0 0 "[ . 1 . 2]" 1
808 1 35 PRO HG3 1 58 PHE HZ . . 4.050 3.227 2.944 3.596 . 0 0 "[ . 1 . 2]" 1
809 1 36 SER H 1 36 SER QB . . 3.370 2.427 2.273 2.767 . 0 0 "[ . 1 . 2]" 1
810 1 36 SER H 1 39 GLU H . . 4.010 3.063 2.929 3.340 . 0 0 "[ . 1 . 2]" 1
811 1 36 SER H 1 39 GLU HA . . 4.960 4.598 4.458 4.871 . 0 0 "[ . 1 . 2]" 1
812 1 36 SER H 1 39 GLU HB2 . . 3.380 2.016 1.894 2.441 . 0 0 "[ . 1 . 2]" 1
813 1 36 SER H 1 39 GLU HB3 . . 3.770 3.420 3.284 3.765 . 0 0 "[ . 1 . 2]" 1
814 1 36 SER H 1 39 GLU QG . . 3.950 2.112 1.822 3.372 . 0 0 "[ . 1 . 2]" 1
815 1 36 SER H 1 40 LYS H . . 4.570 3.676 3.449 4.125 . 0 0 "[ . 1 . 2]" 1
816 1 36 SER H 1 43 LEU MD1 . . 5.500 5.241 4.976 5.520 0.020 5 0 "[ . 1 . 2]" 1
817 1 36 SER HA 1 37 GLU H . . 3.270 2.297 2.272 2.322 . 0 0 "[ . 1 . 2]" 1
818 1 36 SER HA 1 37 GLU HA . . 4.840 4.294 4.292 4.296 . 0 0 "[ . 1 . 2]" 1
819 1 36 SER HA 1 39 GLU H . . 5.500 4.466 4.363 4.605 . 0 0 "[ . 1 . 2]" 1
820 1 36 SER QB 1 37 GLU H . . 3.740 3.144 2.595 3.476 . 0 0 "[ . 1 . 2]" 1
821 1 36 SER QB 1 38 GLU H . . 3.660 2.725 2.383 3.207 . 0 0 "[ . 1 . 2]" 1
822 1 36 SER QB 1 38 GLU QB . . 4.130 2.972 2.787 3.627 . 0 0 "[ . 1 . 2]" 1
823 1 36 SER QB 1 39 GLU H . . 4.120 2.691 2.523 3.757 . 0 0 "[ . 1 . 2]" 1
824 1 36 SER QB 1 39 GLU QG . . 4.920 2.424 1.960 3.489 . 0 0 "[ . 1 . 2]" 1
825 1 36 SER HB2 1 37 GLU H . . 4.410 3.894 2.698 4.129 . 0 0 "[ . 1 . 2]" 1
826 1 36 SER HB3 1 37 GLU H . . 4.410 3.421 2.644 3.975 . 0 0 "[ . 1 . 2]" 1
827 1 37 GLU H 1 37 GLU HB2 . . 3.930 2.445 2.178 2.824 . 0 0 "[ . 1 . 2]" 1
828 1 37 GLU H 1 37 GLU QB . . 3.340 2.364 2.132 2.584 . 0 0 "[ . 1 . 2]" 1
829 1 37 GLU H 1 37 GLU HB3 . . 3.930 3.325 2.308 3.629 . 0 0 "[ . 1 . 2]" 1
830 1 37 GLU H 1 37 GLU QG . . 3.840 2.920 2.012 3.893 0.053 14 0 "[ . 1 . 2]" 1
831 1 37 GLU H 1 38 GLU H . . 3.820 2.945 2.882 3.048 . 0 0 "[ . 1 . 2]" 1
832 1 37 GLU H 1 39 GLU H . . 5.060 4.583 4.475 4.721 . 0 0 "[ . 1 . 2]" 1
833 1 37 GLU HA 1 37 GLU QG . . 3.640 2.384 2.256 2.740 . 0 0 "[ . 1 . 2]" 1
834 1 37 GLU HA 1 39 GLU H . . 4.830 4.802 4.690 4.836 0.006 10 0 "[ . 1 . 2]" 1
835 1 37 GLU HA 1 40 LYS H . . 4.460 4.040 3.878 4.133 . 0 0 "[ . 1 . 2]" 1
836 1 37 GLU HA 1 40 LYS QD . . 3.350 3.342 3.174 3.368 0.018 3 0 "[ . 1 . 2]" 1
837 1 37 GLU HA 1 40 LYS HE2 . . 4.580 4.488 4.367 4.595 0.015 13 0 "[ . 1 . 2]" 1
838 1 37 GLU HA 1 40 LYS HE3 . . 4.020 2.827 2.663 2.945 . 0 0 "[ . 1 . 2]" 1
839 1 37 GLU HA 1 40 LYS HG2 . . 5.250 4.309 4.200 4.399 . 0 0 "[ . 1 . 2]" 1
840 1 37 GLU HA 1 40 LYS HG3 . . 4.250 2.584 2.448 2.724 . 0 0 "[ . 1 . 2]" 1
841 1 37 GLU HA 1 41 GLN H . . 5.500 4.040 3.839 4.313 . 0 0 "[ . 1 . 2]" 1
842 1 37 GLU HA 1 51 LEU QD . . 4.550 3.578 2.563 4.063 . 0 0 "[ . 1 . 2]" 1
843 1 37 GLU HB2 1 38 GLU H . . 4.340 3.280 2.645 4.280 . 0 0 "[ . 1 . 2]" 1
844 1 37 GLU HB3 1 38 GLU H . . 4.340 3.388 2.806 3.834 . 0 0 "[ . 1 . 2]" 1
845 1 37 GLU QG 1 38 GLU H . . 4.790 4.212 3.393 4.542 . 0 0 "[ . 1 . 2]" 1
846 1 37 GLU QG 1 40 LYS QD . . 5.050 4.406 4.163 5.065 0.015 14 0 "[ . 1 . 2]" 1
847 1 38 GLU H 1 38 GLU HB2 . . 3.640 2.266 2.180 2.473 . 0 0 "[ . 1 . 2]" 1
848 1 38 GLU H 1 38 GLU QB . . 2.920 2.239 2.126 2.433 . 0 0 "[ . 1 . 2]" 1
849 1 38 GLU H 1 38 GLU HB3 . . 3.640 3.509 2.947 3.614 . 0 0 "[ . 1 . 2]" 1
850 1 38 GLU H 1 38 GLU HG2 . . 4.430 3.722 2.618 4.395 . 0 0 "[ . 1 . 2]" 1
851 1 38 GLU H 1 38 GLU QG . . 3.650 3.032 2.321 3.776 0.126 13 0 "[ . 1 . 2]" 1
852 1 38 GLU H 1 38 GLU HG3 . . 4.430 3.451 2.350 4.138 . 0 0 "[ . 1 . 2]" 1
853 1 38 GLU H 1 39 GLU H . . 3.340 2.548 2.420 2.740 . 0 0 "[ . 1 . 2]" 1
854 1 38 GLU H 1 39 GLU QG . . 5.500 4.059 3.816 4.805 . 0 0 "[ . 1 . 2]" 1
855 1 38 GLU HA 1 38 GLU HG2 . . 3.660 2.887 2.198 3.661 0.001 1 0 "[ . 1 . 2]" 1
856 1 38 GLU HA 1 38 GLU QG . . 3.120 2.403 2.155 2.997 . 0 0 "[ . 1 . 2]" 1
857 1 38 GLU HA 1 38 GLU HG3 . . 3.660 2.895 2.184 3.649 . 0 0 "[ . 1 . 2]" 1
858 1 38 GLU HA 1 41 GLN H . . 4.010 3.935 3.830 4.017 0.007 10 0 "[ . 1 . 2]" 1
859 1 38 GLU HA 1 41 GLN HB2 . . 3.670 3.651 3.446 3.681 0.011 14 0 "[ . 1 . 2]" 1
860 1 38 GLU HA 1 41 GLN QB . . 3.160 3.040 2.917 3.143 . 0 0 "[ . 1 . 2]" 1
861 1 38 GLU HA 1 41 GLN HB3 . . 3.670 3.261 3.059 3.462 . 0 0 "[ . 1 . 2]" 1
862 1 38 GLU QB 1 39 GLU H . . 3.270 2.469 2.369 2.604 . 0 0 "[ . 1 . 2]" 1
863 1 38 GLU HB2 1 39 GLU H . . 3.750 2.612 2.422 3.395 . 0 0 "[ . 1 . 2]" 1
864 1 38 GLU HB3 1 39 GLU H . . 3.750 3.206 2.417 3.506 . 0 0 "[ . 1 . 2]" 1
865 1 38 GLU QG 1 39 GLU H . . 5.140 4.259 3.976 4.442 . 0 0 "[ . 1 . 2]" 1
866 1 39 GLU H 1 39 GLU HB2 . . 3.180 2.569 2.342 2.671 . 0 0 "[ . 1 . 2]" 1
867 1 39 GLU H 1 39 GLU HB3 . . 3.780 3.588 3.564 3.593 . 0 0 "[ . 1 . 2]" 1
868 1 39 GLU H 1 39 GLU QG . . 3.090 2.084 1.923 2.549 . 0 0 "[ . 1 . 2]" 1
869 1 39 GLU H 1 40 LYS H . . 3.240 2.886 2.823 2.965 . 0 0 "[ . 1 . 2]" 1
870 1 39 GLU HA 1 39 GLU QG . . 3.140 2.881 2.356 3.095 . 0 0 "[ . 1 . 2]" 1
871 1 39 GLU HA 1 42 MET H . . 3.740 3.671 3.476 3.761 0.021 11 0 "[ . 1 . 2]" 1
872 1 39 GLU HA 1 42 MET HB3 . . 3.650 2.612 2.416 2.787 . 0 0 "[ . 1 . 2]" 1
873 1 39 GLU HA 1 42 MET ME . . 3.610 2.267 1.978 2.553 . 0 0 "[ . 1 . 2]" 1
874 1 39 GLU HA 1 42 MET QG . . 5.190 4.272 4.086 4.562 . 0 0 "[ . 1 . 2]" 1
875 1 39 GLU HA 1 43 LEU H . . 4.590 4.189 3.927 4.583 . 0 0 "[ . 1 . 2]" 1
876 1 39 GLU HA 1 43 LEU MD1 . . 5.030 4.082 3.753 4.496 . 0 0 "[ . 1 . 2]" 1
877 1 39 GLU HB2 1 40 LYS H . . 3.450 2.327 2.154 2.479 . 0 0 "[ . 1 . 2]" 1
878 1 39 GLU HB2 1 43 LEU MD1 . . 5.500 3.709 3.508 4.294 . 0 0 "[ . 1 . 2]" 1
879 1 39 GLU HB3 1 40 LYS H . . 4.360 3.424 3.181 3.593 . 0 0 "[ . 1 . 2]" 1
880 1 39 GLU HB3 1 43 LEU MD1 . . 4.590 2.886 2.601 3.181 . 0 0 "[ . 1 . 2]" 1
881 1 39 GLU QG 1 40 LYS H . . 4.200 3.890 3.772 4.227 0.027 5 0 "[ . 1 . 2]" 1
882 1 40 LYS H 1 40 LYS HB2 . . 3.780 2.989 2.965 3.053 . 0 0 "[ . 1 . 2]" 1
883 1 40 LYS H 1 40 LYS HB3 . . 3.710 3.491 3.476 3.499 . 0 0 "[ . 1 . 2]" 1
884 1 40 LYS H 1 40 LYS QD . . 4.280 3.831 3.814 3.842 . 0 0 "[ . 1 . 2]" 1
885 1 40 LYS H 1 40 LYS HE2 . . 5.000 4.444 4.362 4.624 . 0 0 "[ . 1 . 2]" 1
886 1 40 LYS H 1 40 LYS HE3 . . 5.080 4.105 3.954 4.176 . 0 0 "[ . 1 . 2]" 1
887 1 40 LYS H 1 40 LYS HG2 . . 3.430 2.141 2.039 2.235 . 0 0 "[ . 1 . 2]" 1
888 1 40 LYS H 1 40 LYS HG3 . . 3.210 1.985 1.915 2.049 . 0 0 "[ . 1 . 2]" 1
889 1 40 LYS H 1 41 GLN H . . 3.060 3.010 2.917 3.068 0.008 4 0 "[ . 1 . 2]" 1
890 1 40 LYS H 1 41 GLN QB . . 5.340 4.620 4.574 4.722 . 0 0 "[ . 1 . 2]" 1
891 1 40 LYS H 1 42 MET H . . 4.730 4.060 3.905 4.422 . 0 0 "[ . 1 . 2]" 1
892 1 40 LYS H 1 43 LEU MD1 . . 4.700 3.751 3.367 4.039 . 0 0 "[ . 1 . 2]" 1
893 1 40 LYS H 1 51 LEU QD . . 5.150 4.469 4.089 5.043 . 0 0 "[ . 1 . 2]" 1
894 1 40 LYS H 1 54 ILE MG . . 4.750 4.352 4.201 4.472 . 0 0 "[ . 1 . 2]" 1
895 1 40 LYS HA 1 40 LYS QD . . 4.470 3.871 3.823 3.920 . 0 0 "[ . 1 . 2]" 1
896 1 40 LYS HA 1 40 LYS HG2 . . 4.040 2.816 2.800 2.833 . 0 0 "[ . 1 . 2]" 1
897 1 40 LYS HA 1 40 LYS HG3 . . 3.730 3.656 3.623 3.683 . 0 0 "[ . 1 . 2]" 1
898 1 40 LYS HA 1 41 GLN HA . . 5.020 4.840 4.809 4.871 . 0 0 "[ . 1 . 2]" 1
899 1 40 LYS HA 1 42 MET H . . 4.900 4.146 3.723 4.596 . 0 0 "[ . 1 . 2]" 1
900 1 40 LYS HA 1 43 LEU H . . 3.850 3.440 3.182 3.635 . 0 0 "[ . 1 . 2]" 1
901 1 40 LYS HA 1 43 LEU HB2 . . 3.510 3.030 2.776 3.212 . 0 0 "[ . 1 . 2]" 1
902 1 40 LYS HA 1 43 LEU HB3 . . 4.900 4.668 4.446 4.855 . 0 0 "[ . 1 . 2]" 1
903 1 40 LYS HA 1 43 LEU MD1 . . 3.410 2.179 1.973 2.569 . 0 0 "[ . 1 . 2]" 1
904 1 40 LYS HA 1 43 LEU HG . . 4.910 3.679 3.469 3.935 . 0 0 "[ . 1 . 2]" 1
905 1 40 LYS HA 1 44 SER H . . 4.440 3.861 3.653 4.133 . 0 0 "[ . 1 . 2]" 1
906 1 40 LYS HA 1 54 ILE MD . . 4.160 4.116 3.978 4.180 0.020 19 0 "[ . 1 . 2]" 1
907 1 40 LYS HA 1 54 ILE MG . . 3.340 2.455 2.194 2.658 . 0 0 "[ . 1 . 2]" 1
908 1 40 LYS HB2 1 40 LYS HE2 . . 4.730 4.779 4.742 4.826 0.096 13 0 "[ . 1 . 2]" 1
909 1 40 LYS HB2 1 40 LYS HE3 . . 4.240 4.183 4.090 4.249 0.009 14 0 "[ . 1 . 2]" 1
910 1 40 LYS HB2 1 41 GLN H . . 3.610 2.134 2.011 2.320 . 0 0 "[ . 1 . 2]" 1
911 1 40 LYS HB2 1 42 MET H . . 5.460 4.613 4.394 4.921 . 0 0 "[ . 1 . 2]" 1
912 1 40 LYS HB2 1 43 LEU MD1 . . 5.150 4.796 4.632 5.071 . 0 0 "[ . 1 . 2]" 1
913 1 40 LYS HB2 1 51 LEU QD . . 3.790 2.243 1.861 3.056 . 0 0 "[ . 1 . 2]" 1
914 1 40 LYS HB2 1 54 ILE MD . . 5.490 5.342 5.121 5.472 . 0 0 "[ . 1 . 2]" 1
915 1 40 LYS HB2 1 54 ILE MG . . 4.180 3.578 3.223 3.779 . 0 0 "[ . 1 . 2]" 1
916 1 40 LYS HB3 1 40 LYS HE2 . . 4.940 4.414 4.357 4.485 . 0 0 "[ . 1 . 2]" 1
917 1 40 LYS HB3 1 40 LYS HE3 . . 4.940 4.486 4.423 4.534 . 0 0 "[ . 1 . 2]" 1
918 1 40 LYS HB3 1 41 GLN H . . 4.210 3.604 3.504 3.743 . 0 0 "[ . 1 . 2]" 1
919 1 40 LYS HB3 1 43 LEU MD1 . . 4.340 3.985 3.689 4.242 . 0 0 "[ . 1 . 2]" 1
920 1 40 LYS HB3 1 51 LEU HA . . 5.340 3.449 3.101 3.898 . 0 0 "[ . 1 . 2]" 1
921 1 40 LYS HB3 1 54 ILE MG . . 3.390 2.064 1.845 2.303 . 0 0 "[ . 1 . 2]" 1
922 1 40 LYS HB3 1 55 SER HA . . 5.500 5.210 4.424 5.508 0.008 19 0 "[ . 1 . 2]" 1
923 1 40 LYS QD 1 43 LEU MD1 . . 5.500 4.796 4.559 5.011 . 0 0 "[ . 1 . 2]" 1
924 1 40 LYS QD 1 51 LEU QD . . 4.040 3.109 2.755 3.479 . 0 0 "[ . 1 . 2]" 1
925 1 40 LYS QD 1 54 ILE MG . . 4.320 2.554 2.323 2.690 . 0 0 "[ . 1 . 2]" 1
926 1 40 LYS QD 1 55 SER H . . 4.220 3.267 3.035 3.436 . 0 0 "[ . 1 . 2]" 1
927 1 40 LYS QD 1 55 SER HA . . 4.960 3.426 2.440 3.792 . 0 0 "[ . 1 . 2]" 1
928 1 40 LYS QD 1 55 SER QB . . 4.460 2.829 2.238 3.548 . 0 0 "[ . 1 . 2]" 1
929 1 40 LYS HE2 1 40 LYS HG3 . . 4.090 3.093 3.018 3.236 . 0 0 "[ . 1 . 2]" 1
930 1 40 LYS HE2 1 54 ILE MG . . 4.680 4.376 4.269 4.554 . 0 0 "[ . 1 . 2]" 1
931 1 40 LYS HE2 1 55 SER HA . . 4.670 4.526 3.843 4.679 0.009 15 0 "[ . 1 . 2]" 1
932 1 40 LYS HE3 1 40 LYS HG3 . . 4.040 2.339 2.240 2.408 . 0 0 "[ . 1 . 2]" 1
933 1 40 LYS HE3 1 41 GLN H . . 5.500 5.505 5.453 5.521 0.021 10 0 "[ . 1 . 2]" 1
934 1 40 LYS HE3 1 54 ILE MG . . 5.120 5.093 4.951 5.132 0.012 14 0 "[ . 1 . 2]" 1
935 1 40 LYS HG2 1 41 GLN H . . 4.190 4.266 4.249 4.295 0.105 13 0 "[ . 1 . 2]" 1
936 1 40 LYS HG2 1 43 LEU MD1 . . 4.820 3.801 3.564 4.100 . 0 0 "[ . 1 . 2]" 1
937 1 40 LYS HG2 1 54 ILE HB . . 4.960 4.917 4.762 4.968 0.008 7 0 "[ . 1 . 2]" 1
938 1 40 LYS HG2 1 54 ILE MG . . 4.580 3.159 3.030 3.321 . 0 0 "[ . 1 . 2]" 1
939 1 40 LYS HG2 1 55 SER H . . 5.500 5.497 5.428 5.518 0.018 11 0 "[ . 1 . 2]" 1
940 1 40 LYS HG3 1 41 GLN H . . 4.130 3.338 3.305 3.416 . 0 0 "[ . 1 . 2]" 1
941 1 40 LYS HG3 1 43 LEU MD1 . . 5.500 4.920 4.733 5.236 . 0 0 "[ . 1 . 2]" 1
942 1 40 LYS HG3 1 54 ILE MG . . 4.400 4.222 4.117 4.316 . 0 0 "[ . 1 . 2]" 1
943 1 41 GLN H 1 41 GLN HB2 . . 3.120 2.235 2.149 2.374 . 0 0 "[ . 1 . 2]" 1
944 1 41 GLN H 1 41 GLN HB3 . . 3.120 2.884 2.697 3.010 . 0 0 "[ . 1 . 2]" 1
945 1 41 GLN H 1 41 GLN QG . . 4.510 4.015 3.770 4.069 . 0 0 "[ . 1 . 2]" 1
946 1 41 GLN H 1 42 MET H . . 3.230 2.842 2.748 2.976 . 0 0 "[ . 1 . 2]" 1
947 1 41 GLN H 1 43 LEU H . . 4.560 4.535 4.334 4.568 0.008 11 0 "[ . 1 . 2]" 1
948 1 41 GLN H 1 51 LEU MD1 . . 4.370 4.029 2.319 4.369 . 0 0 "[ . 1 . 2]" 1
949 1 41 GLN H 1 51 LEU QD . . 3.640 2.636 2.122 3.304 . 0 0 "[ . 1 . 2]" 1
950 1 41 GLN H 1 51 LEU MD2 . . 4.370 2.768 2.127 3.809 . 0 0 "[ . 1 . 2]" 1
951 1 41 GLN HA 1 41 GLN HE21 . . 4.850 2.526 2.113 3.508 . 0 0 "[ . 1 . 2]" 1
952 1 41 GLN HA 1 41 GLN HE22 . . 4.960 3.121 2.807 3.669 . 0 0 "[ . 1 . 2]" 1
953 1 41 GLN HA 1 41 GLN HG2 . . 4.170 3.480 2.426 3.744 . 0 0 "[ . 1 . 2]" 1
954 1 41 GLN HA 1 41 GLN QG . . 3.550 2.821 2.392 2.935 . 0 0 "[ . 1 . 2]" 1
955 1 41 GLN HA 1 41 GLN HG3 . . 4.170 3.098 2.853 3.708 . 0 0 "[ . 1 . 2]" 1
956 1 41 GLN HA 1 44 SER H . . 4.500 3.682 3.307 3.916 . 0 0 "[ . 1 . 2]" 1
957 1 41 GLN HA 1 45 GLU QG . . 5.220 4.550 4.381 4.706 . 0 0 "[ . 1 . 2]" 1
958 1 41 GLN HA 1 51 LEU QD . . 2.860 2.124 1.770 2.610 . 0 0 "[ . 1 . 2]" 1
959 1 41 GLN QB 1 41 GLN HE22 . . 4.360 4.208 3.865 4.348 . 0 0 "[ . 1 . 2]" 1
960 1 41 GLN QB 1 42 MET H . . 3.590 2.699 2.385 2.965 . 0 0 "[ . 1 . 2]" 1
961 1 41 GLN QB 1 44 SER H . . 5.340 5.144 4.834 5.331 . 0 0 "[ . 1 . 2]" 1
962 1 41 GLN QB 1 51 LEU QD . . 3.500 2.375 1.989 2.858 . 0 0 "[ . 1 . 2]" 1
963 1 41 GLN HE21 1 41 GLN QG . . 3.040 2.209 2.095 2.440 . 0 0 "[ . 1 . 2]" 1
964 1 41 GLN HE21 1 44 SER HB3 . . 4.890 3.249 2.394 4.302 . 0 0 "[ . 1 . 2]" 1
965 1 41 GLN HE21 1 45 GLU HG2 . . 4.560 3.914 3.224 4.441 . 0 0 "[ . 1 . 2]" 1
966 1 41 GLN HE21 1 45 GLU QG . . 3.770 3.373 3.052 3.770 0.000 2 0 "[ . 1 . 2]" 1
967 1 41 GLN HE21 1 45 GLU HG3 . . 4.560 3.941 3.219 4.568 0.008 7 0 "[ . 1 . 2]" 1
968 1 41 GLN HE21 1 51 LEU MD1 . . 5.270 4.144 2.807 4.857 . 0 0 "[ . 1 . 2]" 1
969 1 41 GLN HE21 1 51 LEU QD . . 4.590 3.346 2.772 4.303 . 0 0 "[ . 1 . 2]" 1
970 1 41 GLN HE21 1 51 LEU MD2 . . 5.270 3.891 2.821 4.997 . 0 0 "[ . 1 . 2]" 1
971 1 41 GLN HE22 1 44 SER HB3 . . 4.910 3.572 2.963 4.711 . 0 0 "[ . 1 . 2]" 1
972 1 41 GLN HE22 1 45 GLU QG . . 4.960 4.283 1.879 4.961 0.001 16 0 "[ . 1 . 2]" 1
973 1 41 GLN HE22 1 51 LEU MD1 . . 5.040 3.582 1.971 5.039 . 0 0 "[ . 1 . 2]" 1
974 1 41 GLN HE22 1 51 LEU QD . . 4.410 2.942 1.933 4.414 0.004 10 0 "[ . 1 . 2]" 1
975 1 41 GLN HE22 1 51 LEU MD2 . . 5.040 3.587 1.940 5.065 0.025 10 0 "[ . 1 . 2]" 1
976 1 41 GLN QG 1 42 MET H . . 4.350 4.182 3.793 4.363 0.013 7 0 "[ . 1 . 2]" 1
977 1 41 GLN QG 1 51 LEU QD . . 3.640 3.041 1.919 3.455 . 0 0 "[ . 1 . 2]" 1
978 1 41 GLN HG2 1 51 LEU MD1 . . 5.780 3.643 1.988 4.198 . 0 0 "[ . 1 . 2]" 1
979 1 41 GLN HG2 1 51 LEU MD2 . . 5.780 3.707 2.642 4.346 . 0 0 "[ . 1 . 2]" 1
980 1 41 GLN HG3 1 51 LEU MD1 . . 5.780 4.359 2.984 4.822 . 0 0 "[ . 1 . 2]" 1
981 1 41 GLN HG3 1 51 LEU MD2 . . 5.780 4.194 3.502 5.100 . 0 0 "[ . 1 . 2]" 1
982 1 42 MET H 1 42 MET HB3 . . 2.740 2.229 2.187 2.320 . 0 0 "[ . 1 . 2]" 1
983 1 42 MET H 1 42 MET ME . . 4.240 4.006 3.780 4.159 . 0 0 "[ . 1 . 2]" 1
984 1 42 MET H 1 42 MET HG2 . . 4.810 4.192 3.990 4.449 . 0 0 "[ . 1 . 2]" 1
985 1 42 MET H 1 42 MET HG3 . . 4.810 4.585 4.563 4.656 . 0 0 "[ . 1 . 2]" 1
986 1 42 MET H 1 43 LEU H . . 3.270 2.672 2.415 2.880 . 0 0 "[ . 1 . 2]" 1
987 1 42 MET H 1 43 LEU HB2 . . 5.370 4.920 4.614 5.152 . 0 0 "[ . 1 . 2]" 1
988 1 42 MET H 1 43 LEU HG . . 4.460 4.267 4.038 4.438 . 0 0 "[ . 1 . 2]" 1
989 1 42 MET H 1 44 SER H . . 4.230 4.003 3.732 4.164 . 0 0 "[ . 1 . 2]" 1
990 1 42 MET HA 1 42 MET HB2 . . 2.980 2.314 2.292 2.362 . 0 0 "[ . 1 . 2]" 1
991 1 42 MET HA 1 42 MET ME . . 4.660 4.582 4.384 4.664 0.004 13 0 "[ . 1 . 2]" 1
992 1 42 MET HA 1 42 MET HG2 . . 3.910 3.208 2.637 3.399 . 0 0 "[ . 1 . 2]" 1
993 1 42 MET HA 1 42 MET QG . . 3.240 2.709 2.580 2.763 . 0 0 "[ . 1 . 2]" 1
994 1 42 MET HA 1 42 MET HG3 . . 3.910 3.053 2.846 3.735 . 0 0 "[ . 1 . 2]" 1
995 1 42 MET HA 1 44 SER H . . 4.650 4.539 4.406 4.652 0.002 2 0 "[ . 1 . 2]" 1
996 1 42 MET HA 1 45 GLU H . . 4.100 3.859 3.724 3.957 . 0 0 "[ . 1 . 2]" 1
997 1 42 MET HA 1 45 GLU QG . . 4.160 3.001 2.576 3.358 . 0 0 "[ . 1 . 2]" 1
998 1 42 MET HB3 1 43 LEU H . . 3.280 2.597 2.444 2.754 . 0 0 "[ . 1 . 2]" 1
999 1 42 MET HB3 1 43 LEU MD1 . . 4.730 4.431 4.313 4.597 . 0 0 "[ . 1 . 2]" 1
1000 1 42 MET HB3 1 43 LEU MD2 . . 4.910 4.438 4.214 4.636 . 0 0 "[ . 1 . 2]" 1
1001 1 42 MET HB3 1 43 LEU HG . . 4.580 3.354 3.191 3.472 . 0 0 "[ . 1 . 2]" 1
1002 1 42 MET HB3 1 44 SER H . . 5.440 4.996 4.839 5.061 . 0 0 "[ . 1 . 2]" 1
1003 1 42 MET ME 1 42 MET HG2 . . 3.590 2.514 2.196 3.380 . 0 0 "[ . 1 . 2]" 1
1004 1 42 MET ME 1 42 MET QG . . 3.020 2.272 2.167 2.323 . 0 0 "[ . 1 . 2]" 1
1005 1 42 MET ME 1 42 MET HG3 . . 3.590 3.150 2.340 3.381 . 0 0 "[ . 1 . 2]" 1
1006 1 42 MET ME 1 43 LEU H . . 3.840 3.084 2.769 3.233 . 0 0 "[ . 1 . 2]" 1
1007 1 42 MET ME 1 43 LEU HA . . 4.090 3.875 3.508 4.107 0.017 5 0 "[ . 1 . 2]" 1
1008 1 42 MET ME 1 43 LEU HB3 . . 4.750 4.566 4.329 4.695 . 0 0 "[ . 1 . 2]" 1
1009 1 42 MET ME 1 43 LEU MD1 . . 3.770 3.107 2.877 3.298 . 0 0 "[ . 1 . 2]" 1
1010 1 42 MET ME 1 43 LEU MD2 . . 3.210 2.328 2.078 2.584 . 0 0 "[ . 1 . 2]" 1
1011 1 42 MET ME 1 43 LEU HG . . 3.170 2.172 1.971 2.360 . 0 0 "[ . 1 . 2]" 1
1012 1 42 MET ME 1 44 SER H . . 5.500 5.383 5.097 5.486 . 0 0 "[ . 1 . 2]" 1
1013 1 42 MET ME 1 46 LYS QD . . 5.070 4.418 3.720 4.951 . 0 0 "[ . 1 . 2]" 1
1014 1 42 MET QG 1 43 LEU H . . 4.800 2.970 2.676 3.742 . 0 0 "[ . 1 . 2]" 1
1015 1 42 MET QG 1 46 LYS QD . . 4.110 3.190 2.793 3.519 . 0 0 "[ . 1 . 2]" 1
1016 1 42 MET QG 1 46 LYS QE . . 4.450 2.996 2.182 4.454 0.004 3 0 "[ . 1 . 2]" 1
1017 1 43 LEU H 1 43 LEU HB2 . . 3.070 2.612 2.561 2.675 . 0 0 "[ . 1 . 2]" 1
1018 1 43 LEU H 1 43 LEU HB3 . . 3.880 3.585 3.576 3.604 . 0 0 "[ . 1 . 2]" 1
1019 1 43 LEU H 1 43 LEU MD1 . . 3.640 3.162 3.079 3.292 . 0 0 "[ . 1 . 2]" 1
1020 1 43 LEU H 1 43 LEU MD2 . . 3.730 3.499 3.378 3.638 . 0 0 "[ . 1 . 2]" 1
1021 1 43 LEU H 1 43 LEU HG . . 2.970 2.034 1.916 2.194 . 0 0 "[ . 1 . 2]" 1
1022 1 43 LEU H 1 44 SER H . . 3.220 2.674 2.490 2.760 . 0 0 "[ . 1 . 2]" 1
1023 1 43 LEU H 1 45 GLU H . . 4.560 4.087 4.027 4.129 . 0 0 "[ . 1 . 2]" 1
1024 1 43 LEU HA 1 43 LEU MD1 . . 3.990 3.963 3.951 3.977 . 0 0 "[ . 1 . 2]" 1
1025 1 43 LEU HA 1 43 LEU MD2 . . 2.860 2.482 2.327 2.651 . 0 0 "[ . 1 . 2]" 1
1026 1 43 LEU HA 1 43 LEU HG . . 3.450 2.962 2.905 3.027 . 0 0 "[ . 1 . 2]" 1
1027 1 43 LEU HA 1 45 GLU H . . 3.850 3.681 3.564 3.850 . 0 0 "[ . 1 . 2]" 1
1028 1 43 LEU HA 1 46 LYS H . . 3.780 3.164 3.052 3.243 . 0 0 "[ . 1 . 2]" 1
1029 1 43 LEU HA 1 46 LYS QB . . 3.410 3.037 2.684 3.258 . 0 0 "[ . 1 . 2]" 1
1030 1 43 LEU HA 1 46 LYS QD . . 3.650 2.413 2.164 2.661 . 0 0 "[ . 1 . 2]" 1
1031 1 43 LEU HA 1 46 LYS HG2 . . 5.400 4.746 4.402 5.030 . 0 0 "[ . 1 . 2]" 1
1032 1 43 LEU HA 1 46 LYS QG . . 4.570 4.062 3.562 4.466 . 0 0 "[ . 1 . 2]" 1
1033 1 43 LEU HA 1 46 LYS HG3 . . 5.400 4.648 3.666 5.403 0.003 10 0 "[ . 1 . 2]" 1
1034 1 43 LEU HA 1 47 THR H . . 4.330 4.058 3.946 4.208 . 0 0 "[ . 1 . 2]" 1
1035 1 43 LEU HA 1 47 THR MG . . 4.260 3.954 3.792 4.206 . 0 0 "[ . 1 . 2]" 1
1036 1 43 LEU HB2 1 43 LEU MD1 . . 3.200 2.110 1.978 2.219 . 0 0 "[ . 1 . 2]" 1
1037 1 43 LEU HB2 1 43 LEU MD2 . . 3.520 3.137 3.118 3.161 . 0 0 "[ . 1 . 2]" 1
1038 1 43 LEU HB2 1 44 SER H . . 3.480 2.556 2.445 2.696 . 0 0 "[ . 1 . 2]" 1
1039 1 43 LEU HB2 1 44 SER HB2 . . 5.500 4.856 4.578 5.493 . 0 0 "[ . 1 . 2]" 1
1040 1 43 LEU HB2 1 44 SER HB3 . . 5.500 4.638 4.216 4.841 . 0 0 "[ . 1 . 2]" 1
1041 1 43 LEU HB2 1 54 ILE MD . . 3.390 3.147 3.015 3.340 . 0 0 "[ . 1 . 2]" 1
1042 1 43 LEU HB2 1 54 ILE MG . . 3.880 3.155 2.994 3.446 . 0 0 "[ . 1 . 2]" 1
1043 1 43 LEU HB3 1 43 LEU MD1 . . 3.150 2.619 2.570 2.687 . 0 0 "[ . 1 . 2]" 1
1044 1 43 LEU HB3 1 43 LEU MD2 . . 3.110 2.149 2.028 2.251 . 0 0 "[ . 1 . 2]" 1
1045 1 43 LEU HB3 1 44 SER H . . 3.820 3.737 3.642 3.831 0.011 5 0 "[ . 1 . 2]" 1
1046 1 43 LEU HB3 1 44 SER HA . . 5.150 4.567 4.508 4.626 . 0 0 "[ . 1 . 2]" 1
1047 1 43 LEU HB3 1 46 LYS QB . . 4.760 4.113 3.899 4.287 . 0 0 "[ . 1 . 2]" 1
1048 1 43 LEU HB3 1 47 THR MG . . 4.610 3.052 2.900 3.146 . 0 0 "[ . 1 . 2]" 1
1049 1 43 LEU MD1 1 44 SER H . . 4.440 4.081 3.923 4.223 . 0 0 "[ . 1 . 2]" 1
1050 1 43 LEU MD1 1 47 THR MG . . 4.690 4.447 4.299 4.603 . 0 0 "[ . 1 . 2]" 1
1051 1 43 LEU MD1 1 54 ILE MD . . 3.870 3.554 3.390 3.661 . 0 0 "[ . 1 . 2]" 1
1052 1 43 LEU MD1 1 54 ILE MG . . 3.520 2.691 2.575 2.817 . 0 0 "[ . 1 . 2]" 1
1053 1 43 LEU MD1 1 58 PHE QD . . 4.970 4.690 4.391 4.892 . 0 0 "[ . 1 . 2]" 1
1054 1 43 LEU MD1 1 58 PHE QE . . 3.520 2.843 2.537 3.154 . 0 0 "[ . 1 . 2]" 1
1055 1 43 LEU MD1 1 58 PHE HZ . . 3.610 2.920 2.573 3.354 . 0 0 "[ . 1 . 2]" 1
1056 1 43 LEU MD2 1 44 SER H . . 4.980 4.803 4.735 4.845 . 0 0 "[ . 1 . 2]" 1
1057 1 43 LEU MD2 1 46 LYS H . . 5.350 5.048 4.951 5.173 . 0 0 "[ . 1 . 2]" 1
1058 1 43 LEU MD2 1 46 LYS QB . . 4.060 3.955 3.710 4.062 0.002 18 0 "[ . 1 . 2]" 1
1059 1 43 LEU MD2 1 46 LYS QD . . 4.140 3.399 2.723 4.054 . 0 0 "[ . 1 . 2]" 1
1060 1 43 LEU MD2 1 46 LYS QE . . 4.840 4.118 2.579 4.842 0.002 6 0 "[ . 1 . 2]" 1
1061 1 43 LEU MD2 1 47 THR MG . . 3.950 3.816 3.619 3.949 . 0 0 "[ . 1 . 2]" 1
1062 1 43 LEU MD2 1 58 PHE HZ . . 4.840 4.337 3.908 4.680 . 0 0 "[ . 1 . 2]" 1
1063 1 43 LEU HG 1 44 SER H . . 4.230 4.185 4.112 4.237 0.007 5 0 "[ . 1 . 2]" 1
1064 1 44 SER H 1 44 SER HB2 . . 3.530 2.979 2.732 3.502 . 0 0 "[ . 1 . 2]" 1
1065 1 44 SER H 1 44 SER HB3 . . 3.270 2.257 2.181 2.376 . 0 0 "[ . 1 . 2]" 1
1066 1 44 SER H 1 44 SER HG . . 4.520 4.203 3.900 4.387 . 0 0 "[ . 1 . 2]" 1
1067 1 44 SER H 1 45 GLU H . . 3.250 2.779 2.701 2.841 . 0 0 "[ . 1 . 2]" 1
1068 1 44 SER H 1 45 GLU HB2 . . 5.500 4.981 4.798 5.122 . 0 0 "[ . 1 . 2]" 1
1069 1 44 SER H 1 45 GLU QG . . 4.830 4.372 4.169 4.594 . 0 0 "[ . 1 . 2]" 1
1070 1 44 SER H 1 46 LYS H . . 5.280 4.411 4.275 4.548 . 0 0 "[ . 1 . 2]" 1
1071 1 44 SER H 1 47 THR HG1 . . 4.680 4.046 3.748 4.527 . 0 0 "[ . 1 . 2]" 1
1072 1 44 SER H 1 51 LEU QD . . 4.620 4.247 3.874 4.630 0.010 5 0 "[ . 1 . 2]" 1
1073 1 44 SER H 1 54 ILE MD . . 3.600 3.439 3.278 3.574 . 0 0 "[ . 1 . 2]" 1
1074 1 44 SER H 1 54 ILE MG . . 5.030 4.168 3.867 4.502 . 0 0 "[ . 1 . 2]" 1
1075 1 44 SER HA 1 44 SER HB2 . . 2.990 2.307 2.291 2.343 . 0 0 "[ . 1 . 2]" 1
1076 1 44 SER HA 1 44 SER HG . . 3.630 3.100 2.574 3.564 . 0 0 "[ . 1 . 2]" 1
1077 1 44 SER HA 1 46 LYS QB . . 5.500 5.402 5.297 5.497 . 0 0 "[ . 1 . 2]" 1
1078 1 44 SER HA 1 47 THR H . . 3.920 3.459 3.266 3.601 . 0 0 "[ . 1 . 2]" 1
1079 1 44 SER HA 1 47 THR HG1 . . 3.500 2.082 1.997 2.301 . 0 0 "[ . 1 . 2]" 1
1080 1 44 SER HA 1 47 THR MG . . 4.540 4.012 3.901 4.178 . 0 0 "[ . 1 . 2]" 1
1081 1 44 SER HA 1 48 ASN H . . 3.900 3.410 3.169 3.727 . 0 0 "[ . 1 . 2]" 1
1082 1 44 SER HA 1 48 ASN HA . . 5.150 4.493 4.300 4.821 . 0 0 "[ . 1 . 2]" 1
1083 1 44 SER HA 1 49 LEU H . . 3.220 2.472 2.349 2.705 . 0 0 "[ . 1 . 2]" 1
1084 1 44 SER HA 1 49 LEU HB2 . . 4.320 3.127 2.996 3.304 . 0 0 "[ . 1 . 2]" 1
1085 1 44 SER HA 1 49 LEU HB3 . . 5.340 4.821 4.700 4.988 . 0 0 "[ . 1 . 2]" 1
1086 1 44 SER HA 1 49 LEU MD2 . . 5.500 5.199 5.042 5.428 . 0 0 "[ . 1 . 2]" 1
1087 1 44 SER HA 1 49 LEU HG . . 4.800 3.992 3.732 4.361 . 0 0 "[ . 1 . 2]" 1
1088 1 44 SER HA 1 51 LEU QD . . 5.440 5.025 4.337 5.374 . 0 0 "[ . 1 . 2]" 1
1089 1 44 SER HA 1 54 ILE MD . . 2.920 2.358 2.113 2.559 . 0 0 "[ . 1 . 2]" 1
1090 1 44 SER HA 1 54 ILE HG12 . . 4.710 4.241 4.045 4.454 . 0 0 "[ . 1 . 2]" 1
1091 1 44 SER HA 1 54 ILE HG13 . . 5.000 3.702 3.311 3.857 . 0 0 "[ . 1 . 2]" 1
1092 1 44 SER HA 1 54 ILE MG . . 5.190 4.785 4.439 5.134 . 0 0 "[ . 1 . 2]" 1
1093 1 44 SER HB2 1 45 GLU H . . 4.320 4.266 4.135 4.326 0.006 10 0 "[ . 1 . 2]" 1
1094 1 44 SER HB2 1 45 GLU QG . . 5.340 5.187 4.978 5.341 0.001 20 0 "[ . 1 . 2]" 1
1095 1 44 SER HB2 1 49 LEU H . . 4.410 3.752 3.148 4.156 . 0 0 "[ . 1 . 2]" 1
1096 1 44 SER HB2 1 50 SER H . . 5.240 4.821 4.285 5.167 . 0 0 "[ . 1 . 2]" 1
1097 1 44 SER HB2 1 50 SER HA . . 4.900 3.842 3.087 4.243 . 0 0 "[ . 1 . 2]" 1
1098 1 44 SER HB2 1 51 LEU QD . . 3.660 3.227 2.471 3.664 0.004 7 0 "[ . 1 . 2]" 1
1099 1 44 SER HB2 1 51 LEU HG . . 5.500 4.511 3.669 5.498 . 0 0 "[ . 1 . 2]" 1
1100 1 44 SER HB2 1 54 ILE MD . . 3.130 2.966 2.617 3.135 0.005 14 0 "[ . 1 . 2]" 1
1101 1 44 SER HB2 1 54 ILE HG12 . . 5.040 3.363 3.049 3.712 . 0 0 "[ . 1 . 2]" 1
1102 1 44 SER HB2 1 54 ILE HG13 . . 4.310 2.797 2.132 3.383 . 0 0 "[ . 1 . 2]" 1
1103 1 44 SER HB2 1 54 ILE MG . . 5.500 4.576 4.014 5.126 . 0 0 "[ . 1 . 2]" 1
1104 1 44 SER HB3 1 45 GLU H . . 3.840 3.271 3.042 3.826 . 0 0 "[ . 1 . 2]" 1
1105 1 44 SER HB3 1 47 THR HG1 . . 5.260 4.866 4.516 5.048 . 0 0 "[ . 1 . 2]" 1
1106 1 44 SER HB3 1 51 LEU QD . . 3.490 3.088 2.621 3.492 0.002 10 0 "[ . 1 . 2]" 1
1107 1 44 SER HB3 1 51 LEU HG . . 5.500 4.480 3.682 5.457 . 0 0 "[ . 1 . 2]" 1
1108 1 44 SER HB3 1 54 ILE MD . . 4.230 3.924 3.080 4.236 0.006 15 0 "[ . 1 . 2]" 1
1109 1 44 SER HB3 1 54 ILE HG12 . . 5.270 4.672 3.549 5.137 . 0 0 "[ . 1 . 2]" 1
1110 1 44 SER HB3 1 54 ILE HG13 . . 4.720 3.626 2.506 4.090 . 0 0 "[ . 1 . 2]" 1
1111 1 44 SER HB3 1 54 ILE MG . . 5.500 4.986 4.051 5.414 . 0 0 "[ . 1 . 2]" 1
1112 1 44 SER HG 1 45 GLU H . . 4.340 3.863 3.306 4.351 0.011 13 0 "[ . 1 . 2]" 1
1113 1 44 SER HG 1 49 LEU H . . 4.450 3.479 2.552 4.428 . 0 0 "[ . 1 . 2]" 1
1114 1 44 SER HG 1 50 SER HA . . 4.750 4.085 3.526 4.623 . 0 0 "[ . 1 . 2]" 1
1115 1 44 SER HG 1 51 LEU H . . 5.180 4.799 4.433 5.152 . 0 0 "[ . 1 . 2]" 1
1116 1 44 SER HG 1 51 LEU QD . . 4.540 4.283 3.620 4.544 0.004 1 0 "[ . 1 . 2]" 1
1117 1 44 SER HG 1 54 ILE MD . . 4.860 4.600 4.180 4.866 0.006 1 0 "[ . 1 . 2]" 1
1118 1 45 GLU H 1 45 GLU HA . . 2.900 2.859 2.835 2.875 . 0 0 "[ . 1 . 2]" 1
1119 1 45 GLU H 1 45 GLU HB2 . . 3.040 2.413 2.300 2.495 . 0 0 "[ . 1 . 2]" 1
1120 1 45 GLU H 1 45 GLU HB3 . . 3.660 3.591 3.559 3.607 . 0 0 "[ . 1 . 2]" 1
1121 1 45 GLU H 1 45 GLU HG2 . . 3.950 3.160 2.336 3.732 . 0 0 "[ . 1 . 2]" 1
1122 1 45 GLU H 1 45 GLU QG . . 3.120 2.429 2.314 2.646 . 0 0 "[ . 1 . 2]" 1
1123 1 45 GLU H 1 45 GLU HG3 . . 3.950 2.814 2.382 3.825 . 0 0 "[ . 1 . 2]" 1
1124 1 45 GLU H 1 46 LYS QB . . 4.620 4.520 4.356 4.648 0.028 9 0 "[ . 1 . 2]" 1
1125 1 45 GLU H 1 47 THR HG1 . . 4.930 4.234 4.071 4.507 . 0 0 "[ . 1 . 2]" 1
1126 1 45 GLU H 1 54 ILE MD . . 5.300 5.145 4.944 5.290 . 0 0 "[ . 1 . 2]" 1
1127 1 45 GLU HA 1 45 GLU HG2 . . 3.740 2.564 2.361 3.131 . 0 0 "[ . 1 . 2]" 1
1128 1 45 GLU HA 1 45 GLU QG . . 3.250 2.475 2.301 2.977 . 0 0 "[ . 1 . 2]" 1
1129 1 45 GLU HA 1 45 GLU HG3 . . 3.740 3.332 2.872 3.739 . 0 0 "[ . 1 . 2]" 1
1130 1 45 GLU HA 1 48 ASN H . . 4.110 3.599 3.439 3.747 . 0 0 "[ . 1 . 2]" 1
1131 1 45 GLU HA 1 48 ASN HA . . 4.680 3.613 3.477 3.846 . 0 0 "[ . 1 . 2]" 1
1132 1 45 GLU HB2 1 46 LYS H . . 3.440 2.669 2.558 2.791 . 0 0 "[ . 1 . 2]" 1
1133 1 45 GLU HB2 1 46 LYS QG . . 4.730 3.785 3.001 4.522 . 0 0 "[ . 1 . 2]" 1
1134 1 45 GLU HB3 1 46 LYS H . . 3.720 3.630 3.459 3.721 0.001 16 0 "[ . 1 . 2]" 1
1135 1 45 GLU QG 1 46 LYS H . . 4.500 4.102 3.987 4.225 . 0 0 "[ . 1 . 2]" 1
1136 1 46 LYS H 1 46 LYS QB . . 2.830 2.362 2.224 2.487 . 0 0 "[ . 1 . 2]" 1
1137 1 46 LYS H 1 46 LYS QD . . 3.350 2.580 1.889 3.301 . 0 0 "[ . 1 . 2]" 1
1138 1 46 LYS H 1 46 LYS HG2 . . 4.170 3.965 3.712 4.169 . 0 0 "[ . 1 . 2]" 1
1139 1 46 LYS H 1 46 LYS QG . . 3.510 2.929 2.218 3.449 . 0 0 "[ . 1 . 2]" 1
1140 1 46 LYS H 1 46 LYS HG3 . . 4.170 3.064 2.235 3.702 . 0 0 "[ . 1 . 2]" 1
1141 1 46 LYS H 1 47 THR MG . . 4.290 4.052 3.900 4.257 . 0 0 "[ . 1 . 2]" 1
1142 1 46 LYS H 1 48 ASN H . . 4.170 3.615 3.527 3.750 . 0 0 "[ . 1 . 2]" 1
1143 1 46 LYS HA 1 46 LYS QD . . 4.140 3.527 2.969 4.164 0.024 3 0 "[ . 1 . 2]" 1
1144 1 46 LYS HA 1 46 LYS HG2 . . 3.680 3.300 2.908 3.585 . 0 0 "[ . 1 . 2]" 1
1145 1 46 LYS HA 1 46 LYS QG . . 3.110 2.378 2.220 2.545 . 0 0 "[ . 1 . 2]" 1
1146 1 46 LYS HA 1 46 LYS HG3 . . 3.680 2.495 2.244 2.807 . 0 0 "[ . 1 . 2]" 1
1147 1 46 LYS HA 1 47 THR MG . . 5.500 4.755 4.655 4.939 . 0 0 "[ . 1 . 2]" 1
1148 1 46 LYS HA 1 48 ASN H . . 4.850 4.207 3.971 4.486 . 0 0 "[ . 1 . 2]" 1
1149 1 46 LYS QB 1 46 LYS QD . . 3.280 2.122 2.025 2.264 . 0 0 "[ . 1 . 2]" 1
1150 1 46 LYS QB 1 46 LYS QE . . 4.320 3.418 2.346 3.721 . 0 0 "[ . 1 . 2]" 1
1151 1 46 LYS QB 1 47 THR H . . 3.420 2.672 2.550 2.892 . 0 0 "[ . 1 . 2]" 1
1152 1 46 LYS QB 1 47 THR HB . . 5.500 5.269 5.209 5.347 . 0 0 "[ . 1 . 2]" 1
1153 1 46 LYS QB 1 47 THR HG1 . . 4.700 4.194 3.969 4.694 . 0 0 "[ . 1 . 2]" 1
1154 1 46 LYS QB 1 48 ASN H . . 4.660 4.484 4.376 4.664 0.004 8 0 "[ . 1 . 2]" 1
1155 1 46 LYS QD 1 47 THR H . . 4.200 4.094 3.798 4.227 0.027 9 0 "[ . 1 . 2]" 1
1156 1 46 LYS QD 1 47 THR MG . . 4.950 4.363 3.956 4.747 . 0 0 "[ . 1 . 2]" 1
1157 1 46 LYS QE 1 46 LYS QG . . 3.210 2.220 2.092 2.438 . 0 0 "[ . 1 . 2]" 1
1158 1 47 THR H 1 47 THR HG1 . . 2.860 1.979 1.898 2.371 . 0 0 "[ . 1 . 2]" 1
1159 1 47 THR H 1 47 THR MG . . 3.200 2.391 2.229 2.576 . 0 0 "[ . 1 . 2]" 1
1160 1 47 THR H 1 48 ASN H . . 2.880 2.282 2.110 2.378 . 0 0 "[ . 1 . 2]" 1
1161 1 47 THR H 1 48 ASN HA . . 4.630 4.536 4.367 4.640 0.010 14 0 "[ . 1 . 2]" 1
1162 1 47 THR H 1 49 LEU H . . 4.100 3.935 3.763 4.099 . 0 0 "[ . 1 . 2]" 1
1163 1 47 THR H 1 49 LEU MD1 . . 4.960 4.566 4.475 4.758 . 0 0 "[ . 1 . 2]" 1
1164 1 47 THR H 1 49 LEU HG . . 4.710 4.554 4.360 4.712 0.002 13 0 "[ . 1 . 2]" 1
1165 1 47 THR H 1 54 ILE MD . . 5.010 4.616 4.404 4.756 . 0 0 "[ . 1 . 2]" 1
1166 1 47 THR HA 1 47 THR MG . . 3.020 2.386 2.232 2.459 . 0 0 "[ . 1 . 2]" 1
1167 1 47 THR HA 1 49 LEU H . . 4.960 4.703 4.515 4.899 . 0 0 "[ . 1 . 2]" 1
1168 1 47 THR HA 1 49 LEU MD1 . . 4.530 4.211 4.089 4.322 . 0 0 "[ . 1 . 2]" 1
1169 1 47 THR HA 1 49 LEU MD2 . . 4.940 4.655 4.446 4.867 . 0 0 "[ . 1 . 2]" 1
1170 1 47 THR HB 1 48 ASN H . . 4.770 4.069 3.890 4.193 . 0 0 "[ . 1 . 2]" 1
1171 1 47 THR HB 1 49 LEU H . . 4.340 3.847 3.569 4.050 . 0 0 "[ . 1 . 2]" 1
1172 1 47 THR HB 1 49 LEU HB2 . . 4.530 4.103 3.837 4.322 . 0 0 "[ . 1 . 2]" 1
1173 1 47 THR HB 1 49 LEU HB3 . . 5.500 4.898 4.745 5.083 . 0 0 "[ . 1 . 2]" 1
1174 1 47 THR HB 1 49 LEU MD1 . . 3.360 2.121 1.952 2.278 . 0 0 "[ . 1 . 2]" 1
1175 1 47 THR HB 1 49 LEU MD2 . . 4.110 3.204 2.991 3.446 . 0 0 "[ . 1 . 2]" 1
1176 1 47 THR HB 1 49 LEU HG . . 3.380 2.176 2.021 2.336 . 0 0 "[ . 1 . 2]" 1
1177 1 47 THR HG1 1 47 THR MG . . 3.100 2.484 2.151 2.924 . 0 0 "[ . 1 . 2]" 1
1178 1 47 THR HG1 1 48 ASN H . . 3.580 2.664 2.182 3.189 . 0 0 "[ . 1 . 2]" 1
1179 1 47 THR HG1 1 49 LEU H . . 3.420 2.698 1.901 3.220 . 0 0 "[ . 1 . 2]" 1
1180 1 47 THR HG1 1 49 LEU MD1 . . 4.440 3.099 2.993 3.372 . 0 0 "[ . 1 . 2]" 1
1181 1 47 THR HG1 1 54 ILE MD . . 3.480 3.017 2.812 3.221 . 0 0 "[ . 1 . 2]" 1
1182 1 47 THR MG 1 48 ASN H . . 4.100 4.019 3.915 4.102 0.002 2 0 "[ . 1 . 2]" 1
1183 1 47 THR MG 1 49 LEU H . . 4.620 4.491 4.388 4.626 0.006 9 0 "[ . 1 . 2]" 1
1184 1 47 THR MG 1 49 LEU HB2 . . 5.460 4.588 4.422 4.719 . 0 0 "[ . 1 . 2]" 1
1185 1 47 THR MG 1 49 LEU MD1 . . 3.330 2.590 2.497 2.670 . 0 0 "[ . 1 . 2]" 1
1186 1 47 THR MG 1 49 LEU HG . . 3.920 3.717 3.573 3.864 . 0 0 "[ . 1 . 2]" 1
1187 1 48 ASN H 1 48 ASN HA . . 2.620 2.277 2.274 2.285 . 0 0 "[ . 1 . 2]" 1
1188 1 48 ASN H 1 48 ASN HB2 . . 4.130 3.389 3.073 3.781 . 0 0 "[ . 1 . 2]" 1
1189 1 48 ASN H 1 48 ASN QB . . 3.510 3.185 2.947 3.447 . 0 0 "[ . 1 . 2]" 1
1190 1 48 ASN H 1 48 ASN HB3 . . 4.130 3.900 3.606 4.100 . 0 0 "[ . 1 . 2]" 1
1191 1 48 ASN H 1 49 LEU H . . 3.110 2.597 2.480 2.707 . 0 0 "[ . 1 . 2]" 1
1192 1 48 ASN H 1 49 LEU HB2 . . 5.360 5.001 4.901 5.094 . 0 0 "[ . 1 . 2]" 1
1193 1 48 ASN H 1 49 LEU MD1 . . 5.480 4.817 4.638 4.963 . 0 0 "[ . 1 . 2]" 1
1194 1 48 ASN H 1 49 LEU HG . . 4.770 3.930 3.721 4.193 . 0 0 "[ . 1 . 2]" 1
1195 1 48 ASN H 1 54 ILE MD . . 5.500 4.968 4.807 5.169 . 0 0 "[ . 1 . 2]" 1
1196 1 48 ASN HA 1 49 LEU H . . 3.210 2.881 2.820 2.946 . 0 0 "[ . 1 . 2]" 1
1197 1 48 ASN HB2 1 49 LEU H . . 4.620 4.345 4.067 4.579 . 0 0 "[ . 1 . 2]" 1
1198 1 48 ASN HB3 1 49 LEU H . . 4.620 4.301 4.071 4.566 . 0 0 "[ . 1 . 2]" 1
1199 1 49 LEU H 1 49 LEU HB2 . . 3.150 2.649 2.548 2.708 . 0 0 "[ . 1 . 2]" 1
1200 1 49 LEU H 1 49 LEU HB3 . . 3.750 3.712 3.679 3.745 . 0 0 "[ . 1 . 2]" 1
1201 1 49 LEU H 1 49 LEU MD1 . . 3.910 3.607 3.516 3.713 . 0 0 "[ . 1 . 2]" 1
1202 1 49 LEU H 1 49 LEU MD2 . . 3.760 3.644 3.514 3.762 0.002 2 0 "[ . 1 . 2]" 1
1203 1 49 LEU H 1 49 LEU HG . . 3.230 2.463 2.355 2.644 . 0 0 "[ . 1 . 2]" 1
1204 1 49 LEU H 1 50 SER H . . 4.590 4.436 4.416 4.458 . 0 0 "[ . 1 . 2]" 1
1205 1 49 LEU H 1 54 ILE MD . . 4.110 3.537 3.418 3.717 . 0 0 "[ . 1 . 2]" 1
1206 1 49 LEU HB2 1 49 LEU MD1 . . 3.220 2.271 2.215 2.311 . 0 0 "[ . 1 . 2]" 1
1207 1 49 LEU HB2 1 50 SER H . . 3.740 2.965 2.852 3.107 . 0 0 "[ . 1 . 2]" 1
1208 1 49 LEU HB2 1 53 GLN HB2 . . 4.400 3.816 3.680 3.947 . 0 0 "[ . 1 . 2]" 1
1209 1 49 LEU HB2 1 53 GLN HB3 . . 4.680 4.541 4.325 4.684 0.004 7 0 "[ . 1 . 2]" 1
1210 1 49 LEU HB2 1 54 ILE HA . . 5.090 4.415 4.309 4.551 . 0 0 "[ . 1 . 2]" 1
1211 1 49 LEU HB2 1 54 ILE MD . . 3.370 2.006 1.882 2.133 . 0 0 "[ . 1 . 2]" 1
1212 1 49 LEU HB2 1 54 ILE HG12 . . 4.370 3.017 2.900 3.209 . 0 0 "[ . 1 . 2]" 1
1213 1 49 LEU HB3 1 49 LEU MD1 . . 3.200 2.444 2.404 2.487 . 0 0 "[ . 1 . 2]" 1
1214 1 49 LEU HB3 1 49 LEU MD2 . . 3.290 2.271 2.179 2.327 . 0 0 "[ . 1 . 2]" 1
1215 1 49 LEU HB3 1 50 SER H . . 3.360 2.066 2.027 2.106 . 0 0 "[ . 1 . 2]" 1
1216 1 49 LEU HB3 1 53 GLN H . . 5.010 4.709 4.611 4.803 . 0 0 "[ . 1 . 2]" 1
1217 1 49 LEU HB3 1 53 GLN HA . . 5.500 5.454 5.322 5.501 0.001 16 0 "[ . 1 . 2]" 1
1218 1 49 LEU HB3 1 53 GLN HB2 . . 4.030 2.649 2.490 2.725 . 0 0 "[ . 1 . 2]" 1
1219 1 49 LEU HB3 1 53 GLN HB3 . . 4.050 3.267 3.143 3.369 . 0 0 "[ . 1 . 2]" 1
1220 1 49 LEU HB3 1 53 GLN QG . . 4.930 4.289 4.146 4.472 . 0 0 "[ . 1 . 2]" 1
1221 1 49 LEU HB3 1 54 ILE H . . 4.430 4.237 4.010 4.421 . 0 0 "[ . 1 . 2]" 1
1222 1 49 LEU HB3 1 54 ILE MD . . 3.770 3.037 2.864 3.252 . 0 0 "[ . 1 . 2]" 1
1223 1 49 LEU HB3 1 54 ILE HG12 . . 4.380 3.803 3.497 4.000 . 0 0 "[ . 1 . 2]" 1
1224 1 49 LEU MD1 1 50 SER H . . 4.820 4.132 4.096 4.184 . 0 0 "[ . 1 . 2]" 1
1225 1 49 LEU MD1 1 53 GLN HA . . 5.500 5.489 5.369 5.513 0.013 14 0 "[ . 1 . 2]" 1
1226 1 49 LEU MD1 1 53 GLN HB2 . . 4.410 3.853 3.691 3.958 . 0 0 "[ . 1 . 2]" 1
1227 1 49 LEU MD1 1 53 GLN HB3 . . 4.510 3.537 3.384 3.644 . 0 0 "[ . 1 . 2]" 1
1228 1 49 LEU MD2 1 50 SER H . . 3.850 3.646 3.510 3.769 . 0 0 "[ . 1 . 2]" 1
1229 1 49 LEU MD2 1 53 GLN HB2 . . 4.220 3.941 3.789 4.115 . 0 0 "[ . 1 . 2]" 1
1230 1 49 LEU MD2 1 53 GLN HE21 . . 3.790 3.056 2.415 3.684 . 0 0 "[ . 1 . 2]" 1
1231 1 49 LEU MD2 1 53 GLN HE22 . . 3.790 2.875 2.417 3.192 . 0 0 "[ . 1 . 2]" 1
1232 1 49 LEU MD2 1 54 ILE HA . . 5.500 5.491 5.381 5.508 0.008 3 0 "[ . 1 . 2]" 1
1233 1 49 LEU HG 1 50 SER H . . 4.970 4.708 4.688 4.735 . 0 0 "[ . 1 . 2]" 1
1234 1 50 SER H 1 50 SER QB . . 3.090 2.478 2.306 2.927 . 0 0 "[ . 1 . 2]" 1
1235 1 50 SER H 1 51 LEU H . . 4.720 4.468 4.437 4.507 . 0 0 "[ . 1 . 2]" 1
1236 1 50 SER H 1 53 GLN H . . 4.130 3.542 3.461 3.660 . 0 0 "[ . 1 . 2]" 1
1237 1 50 SER H 1 53 GLN HB2 . . 3.260 2.294 2.192 2.391 . 0 0 "[ . 1 . 2]" 1
1238 1 50 SER H 1 53 GLN HB3 . . 3.940 3.791 3.665 3.930 . 0 0 "[ . 1 . 2]" 1
1239 1 50 SER H 1 53 GLN HE21 . . 5.050 3.058 1.857 4.333 . 0 0 "[ . 1 . 2]" 1
1240 1 50 SER H 1 53 GLN QE . . 4.330 2.808 1.845 3.761 . 0 0 "[ . 1 . 2]" 1
1241 1 50 SER H 1 53 GLN HE22 . . 5.050 3.788 3.159 4.391 . 0 0 "[ . 1 . 2]" 1
1242 1 50 SER H 1 53 GLN QG . . 4.520 3.606 3.290 4.108 . 0 0 "[ . 1 . 2]" 1
1243 1 50 SER H 1 54 ILE H . . 4.800 3.989 3.888 4.133 . 0 0 "[ . 1 . 2]" 1
1244 1 50 SER H 1 54 ILE MD . . 5.110 3.998 3.786 4.180 . 0 0 "[ . 1 . 2]" 1
1245 1 50 SER HA 1 51 LEU H . . 2.900 2.185 2.172 2.224 . 0 0 "[ . 1 . 2]" 1
1246 1 50 SER HA 1 51 LEU HA . . 5.500 4.320 4.306 4.326 . 0 0 "[ . 1 . 2]" 1
1247 1 50 SER HA 1 51 LEU HB2 . . 4.900 4.600 4.403 4.777 . 0 0 "[ . 1 . 2]" 1
1248 1 50 SER HA 1 54 ILE MD . . 5.280 4.970 4.729 5.137 . 0 0 "[ . 1 . 2]" 1
1249 1 50 SER QB 1 51 LEU H . . 3.090 3.035 2.865 3.093 0.003 7 0 "[ . 1 . 2]" 1
1250 1 50 SER QB 1 51 LEU HB2 . . 4.520 4.221 4.133 4.326 . 0 0 "[ . 1 . 2]" 1
1251 1 50 SER QB 1 52 LEU H . . 3.840 2.691 2.483 2.911 . 0 0 "[ . 1 . 2]" 1
1252 1 50 SER QB 1 52 LEU QB . . 4.180 2.856 2.698 3.170 . 0 0 "[ . 1 . 2]" 1
1253 1 50 SER QB 1 53 GLN H . . 4.240 2.764 2.544 3.478 . 0 0 "[ . 1 . 2]" 1
1254 1 50 SER QB 1 53 GLN HB2 . . 5.220 3.200 2.932 4.198 . 0 0 "[ . 1 . 2]" 1
1255 1 50 SER QB 1 53 GLN QG . . 5.340 2.968 2.431 3.892 . 0 0 "[ . 1 . 2]" 1
1256 1 50 SER HB2 1 52 LEU H . . 4.500 3.530 2.755 3.956 . 0 0 "[ . 1 . 2]" 1
1257 1 50 SER HB2 1 52 LEU QB . . 4.800 3.313 2.992 3.578 . 0 0 "[ . 1 . 2]" 1
1258 1 50 SER HB3 1 52 LEU H . . 4.500 2.941 2.522 4.419 . 0 0 "[ . 1 . 2]" 1
1259 1 50 SER HB3 1 52 LEU QB . . 4.800 3.237 2.812 4.469 . 0 0 "[ . 1 . 2]" 1
1260 1 51 LEU H 1 51 LEU HB2 . . 2.920 2.545 2.352 2.745 . 0 0 "[ . 1 . 2]" 1
1261 1 51 LEU H 1 51 LEU HB3 . . 3.640 3.608 3.580 3.621 . 0 0 "[ . 1 . 2]" 1
1262 1 51 LEU H 1 51 LEU MD1 . . 4.000 3.201 1.764 3.874 . 0 0 "[ . 1 . 2]" 1
1263 1 51 LEU H 1 51 LEU MD2 . . 4.000 3.325 1.778 3.981 . 0 0 "[ . 1 . 2]" 1
1264 1 51 LEU H 1 51 LEU HG . . 3.290 2.576 1.986 3.388 0.098 17 0 "[ . 1 . 2]" 1
1265 1 51 LEU H 1 52 LEU H . . 3.830 2.989 2.833 3.069 . 0 0 "[ . 1 . 2]" 1
1266 1 51 LEU H 1 53 GLN H . . 4.920 4.548 4.462 4.702 . 0 0 "[ . 1 . 2]" 1
1267 1 51 LEU H 1 54 ILE MD . . 5.420 5.146 4.896 5.356 . 0 0 "[ . 1 . 2]" 1
1268 1 51 LEU HA 1 51 LEU QD . . 3.120 2.313 1.932 2.891 . 0 0 "[ . 1 . 2]" 1
1269 1 51 LEU HA 1 51 LEU HG . . 3.780 2.918 2.371 3.757 . 0 0 "[ . 1 . 2]" 1
1270 1 51 LEU HA 1 54 ILE H . . 4.030 3.450 3.278 3.585 . 0 0 "[ . 1 . 2]" 1
1271 1 51 LEU HA 1 54 ILE HB . . 3.330 2.609 2.279 2.771 . 0 0 "[ . 1 . 2]" 1
1272 1 51 LEU HA 1 54 ILE MD . . 4.330 4.175 4.010 4.316 . 0 0 "[ . 1 . 2]" 1
1273 1 51 LEU HA 1 54 ILE HG12 . . 4.110 2.824 2.625 3.117 . 0 0 "[ . 1 . 2]" 1
1274 1 51 LEU HA 1 54 ILE MG . . 3.910 3.831 3.557 3.926 0.016 19 0 "[ . 1 . 2]" 1
1275 1 51 LEU HA 1 55 SER H . . 4.110 3.972 3.638 4.115 0.005 10 0 "[ . 1 . 2]" 1
1276 1 51 LEU HB2 1 51 LEU QD . . 3.070 2.189 2.014 2.534 . 0 0 "[ . 1 . 2]" 1
1277 1 51 LEU HB2 1 52 LEU H . . 3.780 2.694 2.543 2.977 . 0 0 "[ . 1 . 2]" 1
1278 1 51 LEU QD 1 54 ILE H . . 5.100 4.894 4.426 5.110 0.010 11 0 "[ . 1 . 2]" 1
1279 1 51 LEU QD 1 54 ILE HB . . 4.490 3.862 3.427 4.499 0.009 14 0 "[ . 1 . 2]" 1
1280 1 51 LEU QD 1 55 SER H . . 5.440 4.851 4.373 5.342 . 0 0 "[ . 1 . 2]" 1
1281 1 52 LEU H 1 52 LEU QB . . 3.050 2.191 2.174 2.221 . 0 0 "[ . 1 . 2]" 1
1282 1 52 LEU H 1 52 LEU MD1 . . 4.770 4.218 4.154 4.273 . 0 0 "[ . 1 . 2]" 1
1283 1 52 LEU H 1 52 LEU MD2 . . 5.120 4.170 4.110 4.207 . 0 0 "[ . 1 . 2]" 1
1284 1 52 LEU H 1 52 LEU HG . . 4.600 4.340 4.262 4.418 . 0 0 "[ . 1 . 2]" 1
1285 1 52 LEU H 1 53 GLN H . . 3.620 2.744 2.533 2.860 . 0 0 "[ . 1 . 2]" 1
1286 1 52 LEU H 1 53 GLN QG . . 5.240 4.773 4.439 5.110 . 0 0 "[ . 1 . 2]" 1
1287 1 52 LEU HA 1 52 LEU MD1 . . 3.050 2.362 2.144 2.488 . 0 0 "[ . 1 . 2]" 1
1288 1 52 LEU HA 1 52 LEU MD2 . . 4.040 3.951 3.903 3.982 . 0 0 "[ . 1 . 2]" 1
1289 1 52 LEU HA 1 55 SER H . . 4.370 4.210 3.832 4.356 . 0 0 "[ . 1 . 2]" 1
1290 1 52 LEU HA 1 55 SER QB . . 4.120 3.761 3.573 4.121 0.001 7 0 "[ . 1 . 2]" 1
1291 1 52 LEU HA 1 56 ASN H . . 4.520 4.093 3.918 4.268 . 0 0 "[ . 1 . 2]" 1
1292 1 52 LEU QB 1 52 LEU MD1 . . 3.140 2.221 2.130 2.305 . 0 0 "[ . 1 . 2]" 1
1293 1 52 LEU QB 1 52 LEU MD2 . . 3.010 2.069 2.016 2.098 . 0 0 "[ . 1 . 2]" 1
1294 1 52 LEU QB 1 53 GLN H . . 3.220 2.501 2.301 2.630 . 0 0 "[ . 1 . 2]" 1
1295 1 52 LEU QB 1 53 GLN QG . . 4.440 3.523 3.415 3.709 . 0 0 "[ . 1 . 2]" 1
1296 1 52 LEU MD1 1 53 GLN H . . 5.040 4.252 4.127 4.366 . 0 0 "[ . 1 . 2]" 1
1297 1 52 LEU MD1 1 55 SER QB . . 4.420 4.252 4.077 4.427 0.007 14 0 "[ . 1 . 2]" 1
1298 1 52 LEU MD1 1 56 ASN H . . 4.050 3.996 3.707 4.058 0.008 5 0 "[ . 1 . 2]" 1
1299 1 52 LEU MD1 1 56 ASN HB2 . . 5.010 3.958 3.680 4.288 . 0 0 "[ . 1 . 2]" 1
1300 1 52 LEU MD1 1 56 ASN HD21 . . 4.040 2.877 2.014 3.405 . 0 0 "[ . 1 . 2]" 1
1301 1 52 LEU MD1 1 56 ASN HD22 . . 3.750 1.884 1.709 2.232 . 0 0 "[ . 1 . 2]" 1
1302 1 52 LEU MD2 1 53 GLN H . . 4.320 3.956 3.815 4.133 . 0 0 "[ . 1 . 2]" 1
1303 1 52 LEU MD2 1 53 GLN HA . . 5.110 4.567 4.411 4.705 . 0 0 "[ . 1 . 2]" 1
1304 1 52 LEU MD2 1 53 GLN QG . . 4.700 3.555 3.314 3.790 . 0 0 "[ . 1 . 2]" 1
1305 1 52 LEU MD2 1 56 ASN HD21 . . 5.070 3.757 3.353 4.226 . 0 0 "[ . 1 . 2]" 1
1306 1 52 LEU MD2 1 56 ASN HD22 . . 4.470 3.377 3.041 3.930 . 0 0 "[ . 1 . 2]" 1
1307 1 52 LEU HG 1 53 GLN H . . 3.790 3.257 3.131 3.440 . 0 0 "[ . 1 . 2]" 1
1308 1 52 LEU HG 1 53 GLN HB2 . . 5.400 4.993 4.816 5.213 . 0 0 "[ . 1 . 2]" 1
1309 1 52 LEU HG 1 53 GLN QG . . 5.170 3.359 3.076 3.684 . 0 0 "[ . 1 . 2]" 1
1310 1 52 LEU HG 1 54 ILE H . . 5.320 5.259 5.175 5.322 0.002 8 0 "[ . 1 . 2]" 1
1311 1 52 LEU HG 1 56 ASN HB2 . . 5.000 4.035 3.740 4.503 . 0 0 "[ . 1 . 2]" 1
1312 1 52 LEU HG 1 56 ASN HD21 . . 4.020 2.718 2.397 3.215 . 0 0 "[ . 1 . 2]" 1
1313 1 52 LEU HG 1 56 ASN HD22 . . 4.010 2.759 2.255 3.236 . 0 0 "[ . 1 . 2]" 1
1314 1 53 GLN H 1 53 GLN HB2 . . 3.790 2.324 2.256 2.371 . 0 0 "[ . 1 . 2]" 1
1315 1 53 GLN H 1 53 GLN HB3 . . 3.680 3.561 3.535 3.577 . 0 0 "[ . 1 . 2]" 1
1316 1 53 GLN H 1 53 GLN QE . . 4.880 4.313 3.593 4.870 . 0 0 "[ . 1 . 2]" 1
1317 1 53 GLN H 1 53 GLN QG . . 2.920 2.553 2.406 2.697 . 0 0 "[ . 1 . 2]" 1
1318 1 53 GLN H 1 54 ILE H . . 3.230 2.588 2.481 2.696 . 0 0 "[ . 1 . 2]" 1
1319 1 53 GLN H 1 54 ILE HA . . 5.500 5.185 5.087 5.285 . 0 0 "[ . 1 . 2]" 1
1320 1 53 GLN H 1 54 ILE HB . . 5.030 4.828 4.724 5.010 . 0 0 "[ . 1 . 2]" 1
1321 1 53 GLN H 1 54 ILE MD . . 5.500 4.965 4.767 5.204 . 0 0 "[ . 1 . 2]" 1
1322 1 53 GLN H 1 55 SER H . . 4.860 4.857 4.811 4.870 0.010 1 0 "[ . 1 . 2]" 1
1323 1 53 GLN HA 1 53 GLN QG . . 3.080 2.314 2.204 2.389 . 0 0 "[ . 1 . 2]" 1
1324 1 53 GLN HA 1 54 ILE HA . . 5.160 4.852 4.795 4.888 . 0 0 "[ . 1 . 2]" 1
1325 1 53 GLN HA 1 54 ILE MD . . 5.500 5.404 5.246 5.501 0.001 8 0 "[ . 1 . 2]" 1
1326 1 53 GLN HA 1 56 ASN H . . 4.100 3.783 3.628 3.962 . 0 0 "[ . 1 . 2]" 1
1327 1 53 GLN HA 1 56 ASN HB2 . . 3.710 2.334 2.123 2.686 . 0 0 "[ . 1 . 2]" 1
1328 1 53 GLN HA 1 56 ASN HB3 . . 4.100 3.705 3.429 4.105 0.005 7 0 "[ . 1 . 2]" 1
1329 1 53 GLN HA 1 56 ASN HD21 . . 4.520 3.031 2.733 3.622 . 0 0 "[ . 1 . 2]" 1
1330 1 53 GLN HA 1 56 ASN HD22 . . 4.920 4.373 3.952 4.919 . 0 0 "[ . 1 . 2]" 1
1331 1 53 GLN HA 1 57 TRP H . . 4.680 3.901 3.705 4.234 . 0 0 "[ . 1 . 2]" 1
1332 1 53 GLN HB2 1 54 ILE H . . 3.480 2.799 2.664 2.963 . 0 0 "[ . 1 . 2]" 1
1333 1 53 GLN HB2 1 54 ILE MD . . 4.950 3.886 3.641 4.068 . 0 0 "[ . 1 . 2]" 1
1334 1 53 GLN HB2 1 54 ILE HG13 . . 5.500 5.468 5.262 5.509 0.009 14 0 "[ . 1 . 2]" 1
1335 1 53 GLN HB3 1 53 GLN HE21 . . 4.810 2.843 2.124 3.533 . 0 0 "[ . 1 . 2]" 1
1336 1 53 GLN HB3 1 53 GLN QE . . 4.110 2.751 2.109 3.333 . 0 0 "[ . 1 . 2]" 1
1337 1 53 GLN HB3 1 53 GLN HE22 . . 4.810 3.868 3.601 4.085 . 0 0 "[ . 1 . 2]" 1
1338 1 53 GLN HB3 1 54 ILE H . . 4.290 3.589 3.414 3.761 . 0 0 "[ . 1 . 2]" 1
1339 1 53 GLN HB3 1 54 ILE HA . . 4.740 4.279 4.160 4.365 . 0 0 "[ . 1 . 2]" 1
1340 1 53 GLN HB3 1 54 ILE MD . . 5.140 4.154 3.952 4.321 . 0 0 "[ . 1 . 2]" 1
1341 1 53 GLN HB3 1 57 TRP H . . 5.490 4.833 4.624 5.151 . 0 0 "[ . 1 . 2]" 1
1342 1 53 GLN QE 1 53 GLN QG . . 3.090 2.390 2.247 2.533 . 0 0 "[ . 1 . 2]" 1
1343 1 53 GLN HE22 1 53 GLN QG . . 3.620 3.372 3.319 3.425 . 0 0 "[ . 1 . 2]" 1
1344 1 53 GLN QG 1 54 ILE H . . 4.860 4.264 4.163 4.370 . 0 0 "[ . 1 . 2]" 1
1345 1 54 ILE H 1 54 ILE HB . . 2.970 2.563 2.518 2.643 . 0 0 "[ . 1 . 2]" 1
1346 1 54 ILE H 1 54 ILE MD . . 3.790 3.135 2.906 3.353 . 0 0 "[ . 1 . 2]" 1
1347 1 54 ILE H 1 54 ILE HG12 . . 3.510 2.069 1.950 2.140 . 0 0 "[ . 1 . 2]" 1
1348 1 54 ILE H 1 54 ILE HG13 . . 3.700 3.562 3.467 3.657 . 0 0 "[ . 1 . 2]" 1
1349 1 54 ILE H 1 54 ILE MG . . 3.970 3.764 3.760 3.768 . 0 0 "[ . 1 . 2]" 1
1350 1 54 ILE H 1 55 SER H . . 3.190 3.068 2.876 3.154 . 0 0 "[ . 1 . 2]" 1
1351 1 54 ILE H 1 55 SER QB . . 5.240 4.743 4.627 5.025 . 0 0 "[ . 1 . 2]" 1
1352 1 54 ILE HA 1 54 ILE MD . . 3.500 2.131 2.041 2.253 . 0 0 "[ . 1 . 2]" 1
1353 1 54 ILE HA 1 54 ILE HG12 . . 3.550 3.036 2.948 3.125 . 0 0 "[ . 1 . 2]" 1
1354 1 54 ILE HA 1 54 ILE HG13 . . 3.890 3.710 3.654 3.764 . 0 0 "[ . 1 . 2]" 1
1355 1 54 ILE HA 1 54 ILE MG . . 3.230 2.357 2.273 2.464 . 0 0 "[ . 1 . 2]" 1
1356 1 54 ILE HA 1 57 TRP HB2 . . 4.470 4.234 3.990 4.413 . 0 0 "[ . 1 . 2]" 1
1357 1 54 ILE HA 1 57 TRP HB3 . . 3.730 3.199 2.994 3.334 . 0 0 "[ . 1 . 2]" 1
1358 1 54 ILE HA 1 58 PHE H . . 4.860 4.552 4.365 4.828 . 0 0 "[ . 1 . 2]" 1
1359 1 54 ILE HA 1 58 PHE QD . . 4.820 3.939 3.655 4.134 . 0 0 "[ . 1 . 2]" 1
1360 1 54 ILE HB 1 54 ILE MD . . 3.460 3.225 3.217 3.229 . 0 0 "[ . 1 . 2]" 1
1361 1 54 ILE HB 1 55 SER H . . 3.190 2.036 1.983 2.119 . 0 0 "[ . 1 . 2]" 1
1362 1 54 ILE HB 1 55 SER HA . . 5.060 4.228 4.148 4.282 . 0 0 "[ . 1 . 2]" 1
1363 1 54 ILE MD 1 54 ILE MG . . 2.770 1.966 1.885 2.129 . 0 0 "[ . 1 . 2]" 1
1364 1 54 ILE MD 1 55 SER H . . 4.640 4.492 4.439 4.589 . 0 0 "[ . 1 . 2]" 1
1365 1 54 ILE MD 1 58 PHE QE . . 4.690 3.887 3.621 4.116 . 0 0 "[ . 1 . 2]" 1
1366 1 54 ILE HG12 1 54 ILE MG . . 3.280 3.188 3.183 3.200 . 0 0 "[ . 1 . 2]" 1
1367 1 54 ILE HG12 1 55 SER H . . 4.740 4.095 4.007 4.150 . 0 0 "[ . 1 . 2]" 1
1368 1 54 ILE HG13 1 54 ILE MG . . 3.610 2.319 2.214 2.418 . 0 0 "[ . 1 . 2]" 1
1369 1 54 ILE MG 1 55 SER H . . 3.580 2.863 2.724 3.010 . 0 0 "[ . 1 . 2]" 1
1370 1 54 ILE MG 1 55 SER HA . . 4.190 3.266 3.029 3.403 . 0 0 "[ . 1 . 2]" 1
1371 1 54 ILE MG 1 55 SER QB . . 4.120 3.880 3.647 4.096 . 0 0 "[ . 1 . 2]" 1
1372 1 54 ILE MG 1 57 TRP HB3 . . 4.640 4.166 3.951 4.287 . 0 0 "[ . 1 . 2]" 1
1373 1 54 ILE MG 1 57 TRP HE3 . . 5.090 3.849 3.568 4.102 . 0 0 "[ . 1 . 2]" 1
1374 1 54 ILE MG 1 58 PHE H . . 4.620 4.306 4.091 4.581 . 0 0 "[ . 1 . 2]" 1
1375 1 54 ILE MG 1 58 PHE HB2 . . 4.730 4.388 4.141 4.637 . 0 0 "[ . 1 . 2]" 1
1376 1 54 ILE MG 1 58 PHE QD . . 3.280 2.500 2.340 2.773 . 0 0 "[ . 1 . 2]" 1
1377 1 54 ILE MG 1 58 PHE QE . . 3.260 2.189 2.040 2.510 . 0 0 "[ . 1 . 2]" 1
1378 1 54 ILE MG 1 58 PHE HZ . . 4.560 4.208 4.069 4.441 . 0 0 "[ . 1 . 2]" 1
1379 1 55 SER H 1 55 SER HB2 . . 3.530 2.362 2.210 3.592 0.062 7 0 "[ . 1 . 2]" 1
1380 1 55 SER H 1 55 SER QB . . 2.910 2.220 2.161 2.460 . 0 0 "[ . 1 . 2]" 1
1381 1 55 SER H 1 55 SER HB3 . . 3.530 2.977 2.506 3.524 . 0 0 "[ . 1 . 2]" 1
1382 1 55 SER H 1 56 ASN H . . 3.320 2.830 2.713 2.928 . 0 0 "[ . 1 . 2]" 1
1383 1 55 SER H 1 56 ASN HA . . 5.500 5.390 5.294 5.465 . 0 0 "[ . 1 . 2]" 1
1384 1 55 SER H 1 56 ASN HB2 . . 4.950 4.743 4.613 4.907 . 0 0 "[ . 1 . 2]" 1
1385 1 55 SER H 1 57 TRP H . . 4.640 4.355 4.164 4.608 . 0 0 "[ . 1 . 2]" 1
1386 1 55 SER HA 1 56 ASN HA . . 5.170 4.868 4.842 4.905 . 0 0 "[ . 1 . 2]" 1
1387 1 55 SER HA 1 57 TRP H . . 4.830 4.359 4.078 4.827 . 0 0 "[ . 1 . 2]" 1
1388 1 55 SER HA 1 58 PHE H . . 4.450 3.365 3.156 3.757 . 0 0 "[ . 1 . 2]" 1
1389 1 55 SER HA 1 58 PHE HB2 . . 4.420 2.509 2.259 2.893 . 0 0 "[ . 1 . 2]" 1
1390 1 55 SER HA 1 58 PHE HB3 . . 4.730 4.083 3.840 4.427 . 0 0 "[ . 1 . 2]" 1
1391 1 55 SER HA 1 58 PHE QD . . 4.540 2.616 2.197 3.020 . 0 0 "[ . 1 . 2]" 1
1392 1 55 SER QB 1 56 ASN H . . 3.160 2.512 2.263 3.169 0.009 7 0 "[ . 1 . 2]" 1
1393 1 55 SER QB 1 59 ILE MD . . 4.410 3.846 3.342 4.307 . 0 0 "[ . 1 . 2]" 1
1394 1 55 SER HB2 1 56 ASN H . . 3.740 3.381 2.648 3.740 0.000 19 0 "[ . 1 . 2]" 1
1395 1 55 SER HB3 1 56 ASN H . . 3.740 2.744 2.286 3.742 0.002 7 0 "[ . 1 . 2]" 1
1396 1 56 ASN H 1 56 ASN HB2 . . 2.950 2.331 2.237 2.472 . 0 0 "[ . 1 . 2]" 1
1397 1 56 ASN H 1 56 ASN HB3 . . 3.670 3.560 3.526 3.590 . 0 0 "[ . 1 . 2]" 1
1398 1 56 ASN H 1 56 ASN HD21 . . 4.340 4.097 2.110 4.342 0.002 1 0 "[ . 1 . 2]" 1
1399 1 56 ASN H 1 56 ASN HD22 . . 4.890 4.539 3.620 4.780 . 0 0 "[ . 1 . 2]" 1
1400 1 56 ASN H 1 57 TRP H . . 3.290 2.872 2.774 2.996 . 0 0 "[ . 1 . 2]" 1
1401 1 56 ASN H 1 57 TRP HB2 . . 5.500 5.498 5.443 5.521 0.021 7 0 "[ . 1 . 2]" 1
1402 1 56 ASN H 1 57 TRP HB3 . . 5.240 4.905 4.780 5.037 . 0 0 "[ . 1 . 2]" 1
1403 1 56 ASN H 1 58 PHE HB2 . . 5.500 5.025 4.895 5.227 . 0 0 "[ . 1 . 2]" 1
1404 1 56 ASN H 1 59 ILE H . . 5.260 4.962 4.787 5.088 . 0 0 "[ . 1 . 2]" 1
1405 1 56 ASN H 1 59 ILE MD . . 5.010 4.015 3.758 4.329 . 0 0 "[ . 1 . 2]" 1
1406 1 56 ASN HA 1 57 TRP HA . . 5.500 4.783 4.722 4.883 . 0 0 "[ . 1 . 2]" 1
1407 1 56 ASN HA 1 58 PHE H . . 5.060 4.535 4.233 4.971 . 0 0 "[ . 1 . 2]" 1
1408 1 56 ASN HA 1 59 ILE H . . 4.070 3.629 3.457 3.807 . 0 0 "[ . 1 . 2]" 1
1409 1 56 ASN HA 1 59 ILE HB . . 3.570 3.403 3.085 3.549 . 0 0 "[ . 1 . 2]" 1
1410 1 56 ASN HA 1 59 ILE MD . . 3.350 1.981 1.788 2.118 . 0 0 "[ . 1 . 2]" 1
1411 1 56 ASN HA 1 59 ILE HG12 . . 4.800 4.243 3.753 4.644 . 0 0 "[ . 1 . 2]" 1
1412 1 56 ASN HA 1 59 ILE HG13 . . 4.500 2.936 2.388 3.548 . 0 0 "[ . 1 . 2]" 1
1413 1 56 ASN HA 1 59 ILE MG . . 4.570 4.401 4.228 4.577 0.007 9 0 "[ . 1 . 2]" 1
1414 1 56 ASN HA 1 60 ASN H . . 5.010 4.838 4.517 5.029 0.019 17 0 "[ . 1 . 2]" 1
1415 1 56 ASN HB2 1 56 ASN HD22 . . 3.900 3.572 3.434 3.624 . 0 0 "[ . 1 . 2]" 1
1416 1 56 ASN HB2 1 57 TRP H . . 3.620 2.672 2.431 2.894 . 0 0 "[ . 1 . 2]" 1
1417 1 56 ASN HB2 1 57 TRP HB2 . . 4.920 4.654 4.381 4.859 . 0 0 "[ . 1 . 2]" 1
1418 1 56 ASN HB2 1 59 ILE MD . . 4.840 4.501 4.211 4.759 . 0 0 "[ . 1 . 2]" 1
1419 1 56 ASN HB3 1 57 TRP H . . 3.860 3.328 3.018 3.527 . 0 0 "[ . 1 . 2]" 1
1420 1 56 ASN HB3 1 59 ILE MD . . 4.890 3.858 3.389 4.316 . 0 0 "[ . 1 . 2]" 1
1421 1 56 ASN HD21 1 57 TRP H . . 5.360 5.059 4.333 5.293 . 0 0 "[ . 1 . 2]" 1
1422 1 57 TRP H 1 57 TRP HB2 . . 3.080 2.732 2.633 2.832 . 0 0 "[ . 1 . 2]" 1
1423 1 57 TRP H 1 57 TRP HB3 . . 3.150 2.357 2.284 2.465 . 0 0 "[ . 1 . 2]" 1
1424 1 57 TRP H 1 57 TRP HD1 . . 5.470 5.161 5.059 5.259 . 0 0 "[ . 1 . 2]" 1
1425 1 57 TRP H 1 57 TRP HE3 . . 4.840 4.317 4.121 4.551 . 0 0 "[ . 1 . 2]" 1
1426 1 57 TRP H 1 58 PHE QD . . 5.500 4.433 4.182 4.817 . 0 0 "[ . 1 . 2]" 1
1427 1 57 TRP H 1 59 ILE H . . 4.540 4.106 3.945 4.285 . 0 0 "[ . 1 . 2]" 1
1428 1 57 TRP H 1 59 ILE HG13 . . 5.500 4.998 4.471 5.417 . 0 0 "[ . 1 . 2]" 1
1429 1 57 TRP HA 1 57 TRP HD1 . . 4.030 3.267 3.170 3.554 . 0 0 "[ . 1 . 2]" 1
1430 1 57 TRP HA 1 57 TRP HE3 . . 4.770 4.621 4.332 4.714 . 0 0 "[ . 1 . 2]" 1
1431 1 57 TRP HA 1 60 ASN H . . 4.270 3.911 3.683 4.057 . 0 0 "[ . 1 . 2]" 1
1432 1 57 TRP HA 1 60 ASN QB . . 3.990 3.895 3.432 4.013 0.023 8 0 "[ . 1 . 2]" 1
1433 1 57 TRP HA 1 61 ALA MB . . 5.130 3.847 3.594 4.135 . 0 0 "[ . 1 . 2]" 1
1434 1 57 TRP HB2 1 57 TRP HE1 . . 5.030 4.792 4.764 4.803 . 0 0 "[ . 1 . 2]" 1
1435 1 57 TRP HB3 1 57 TRP HE3 . . 3.870 2.570 2.526 2.730 . 0 0 "[ . 1 . 2]" 1
1436 1 57 TRP HE1 1 61 ALA MB . . 4.890 3.158 2.931 3.610 . 0 0 "[ . 1 . 2]" 1
1437 1 57 TRP HE1 1 65 ILE MD . . 4.830 2.695 2.144 3.282 . 0 0 "[ . 1 . 2]" 1
1438 1 57 TRP HE3 1 58 PHE H . . 4.050 2.532 2.104 2.860 . 0 0 "[ . 1 . 2]" 1
1439 1 57 TRP HE3 1 58 PHE HA . . 3.570 2.749 2.299 3.021 . 0 0 "[ . 1 . 2]" 1
1440 1 57 TRP HE3 1 58 PHE HB2 . . 4.960 3.644 3.408 3.859 . 0 0 "[ . 1 . 2]" 1
1441 1 57 TRP HE3 1 58 PHE QD . . 4.320 2.576 2.148 2.874 . 0 0 "[ . 1 . 2]" 1
1442 1 57 TRP HE3 1 58 PHE QE . . 4.880 3.450 3.095 3.750 . 0 0 "[ . 1 . 2]" 1
1443 1 57 TRP HE3 1 61 ALA MB . . 4.590 3.607 3.435 3.825 . 0 0 "[ . 1 . 2]" 1
1444 1 57 TRP HH2 1 61 ALA MB . . 4.700 3.520 3.296 3.823 . 0 0 "[ . 1 . 2]" 1
1445 1 57 TRP HH2 1 65 ILE MD . . 4.240 3.133 2.713 4.001 . 0 0 "[ . 1 . 2]" 1
1446 1 57 TRP HH2 1 69 MET ME . . 5.030 4.292 3.560 4.862 . 0 0 "[ . 1 . 2]" 1
1447 1 57 TRP HZ2 1 61 ALA MB . . 4.540 3.048 2.779 3.253 . 0 0 "[ . 1 . 2]" 1
1448 1 57 TRP HZ2 1 65 ILE MD . . 3.680 1.984 1.835 2.808 . 0 0 "[ . 1 . 2]" 1
1449 1 57 TRP HZ2 1 69 MET ME . . 5.500 5.118 4.497 5.509 0.009 7 0 "[ . 1 . 2]" 1
1450 1 57 TRP HZ3 1 58 PHE QE . . 4.940 2.865 2.744 3.040 . 0 0 "[ . 1 . 2]" 1
1451 1 57 TRP HZ3 1 61 ALA MB . . 5.030 3.783 3.467 4.109 . 0 0 "[ . 1 . 2]" 1
1452 1 58 PHE H 1 58 PHE HB2 . . 3.120 2.222 2.178 2.298 . 0 0 "[ . 1 . 2]" 1
1453 1 58 PHE H 1 58 PHE HB3 . . 3.670 3.516 3.487 3.553 . 0 0 "[ . 1 . 2]" 1
1454 1 58 PHE H 1 58 PHE QD . . 3.570 2.638 2.444 2.808 . 0 0 "[ . 1 . 2]" 1
1455 1 58 PHE H 1 59 ILE H . . 3.480 2.727 2.540 2.902 . 0 0 "[ . 1 . 2]" 1
1456 1 58 PHE H 1 59 ILE HB . . 5.500 4.974 4.798 5.104 . 0 0 "[ . 1 . 2]" 1
1457 1 58 PHE H 1 59 ILE HG13 . . 4.700 4.218 3.972 4.552 . 0 0 "[ . 1 . 2]" 1
1458 1 58 PHE HA 1 58 PHE QD . . 3.630 2.859 2.721 3.024 . 0 0 "[ . 1 . 2]" 1
1459 1 58 PHE HA 1 61 ALA H . . 4.570 3.699 3.404 3.943 . 0 0 "[ . 1 . 2]" 1
1460 1 58 PHE HA 1 61 ALA MB . . 3.360 2.206 1.978 2.584 . 0 0 "[ . 1 . 2]" 1
1461 1 58 PHE HB2 1 59 ILE H . . 3.840 2.951 2.802 3.255 . 0 0 "[ . 1 . 2]" 1
1462 1 58 PHE HB2 1 59 ILE HG13 . . 5.090 3.822 3.716 3.907 . 0 0 "[ . 1 . 2]" 1
1463 1 58 PHE HB3 1 59 ILE H . . 4.220 3.447 3.263 3.738 . 0 0 "[ . 1 . 2]" 1
1464 1 58 PHE QD 1 59 ILE H . . 4.890 4.566 4.476 4.725 . 0 0 "[ . 1 . 2]" 1
1465 1 58 PHE QD 1 61 ALA MB . . 4.960 4.081 3.745 4.327 . 0 0 "[ . 1 . 2]" 1
1466 1 59 ILE H 1 59 ILE HB . . 3.270 2.554 2.456 2.663 . 0 0 "[ . 1 . 2]" 1
1467 1 59 ILE H 1 59 ILE MD . . 3.840 3.460 3.307 3.577 . 0 0 "[ . 1 . 2]" 1
1468 1 59 ILE H 1 59 ILE HG12 . . 3.720 3.413 3.165 3.695 . 0 0 "[ . 1 . 2]" 1
1469 1 59 ILE H 1 59 ILE HG13 . . 3.390 2.062 1.891 2.278 . 0 0 "[ . 1 . 2]" 1
1470 1 59 ILE H 1 59 ILE MG . . 3.790 3.763 3.752 3.768 . 0 0 "[ . 1 . 2]" 1
1471 1 59 ILE H 1 60 ASN H . . 3.470 3.070 2.811 3.218 . 0 0 "[ . 1 . 2]" 1
1472 1 59 ILE H 1 60 ASN QB . . 5.340 5.067 4.666 5.298 . 0 0 "[ . 1 . 2]" 1
1473 1 59 ILE HA 1 59 ILE MD . . 3.960 3.850 3.810 3.876 . 0 0 "[ . 1 . 2]" 1
1474 1 59 ILE HA 1 59 ILE HG12 . . 3.400 2.591 2.491 2.694 . 0 0 "[ . 1 . 2]" 1
1475 1 59 ILE HA 1 59 ILE HG13 . . 3.730 2.909 2.735 3.045 . 0 0 "[ . 1 . 2]" 1
1476 1 59 ILE HA 1 59 ILE MG . . 3.120 2.375 2.291 2.469 . 0 0 "[ . 1 . 2]" 1
1477 1 59 ILE HA 1 62 ARG H . . 4.850 3.852 3.549 4.213 . 0 0 "[ . 1 . 2]" 1
1478 1 59 ILE HA 1 62 ARG QB . . 4.290 3.211 2.821 4.000 . 0 0 "[ . 1 . 2]" 1
1479 1 59 ILE HA 1 62 ARG QD . . 4.780 3.746 2.204 4.781 0.001 9 0 "[ . 1 . 2]" 1
1480 1 59 ILE HB 1 59 ILE MD . . 3.140 2.318 2.188 2.432 . 0 0 "[ . 1 . 2]" 1
1481 1 59 ILE HB 1 60 ASN H . . 3.440 2.021 1.927 2.138 . 0 0 "[ . 1 . 2]" 1
1482 1 59 ILE HB 1 60 ASN HB2 . . 5.270 4.527 3.810 5.239 . 0 0 "[ . 1 . 2]" 1
1483 1 59 ILE HB 1 60 ASN QB . . 4.490 4.155 3.609 4.507 0.017 9 0 "[ . 1 . 2]" 1
1484 1 59 ILE HB 1 60 ASN HB3 . . 5.270 4.991 3.749 5.289 0.019 12 0 "[ . 1 . 2]" 1
1485 1 59 ILE HB 1 61 ALA H . . 5.500 4.370 4.120 4.603 . 0 0 "[ . 1 . 2]" 1
1486 1 59 ILE MD 1 60 ASN H . . 4.970 4.019 3.882 4.184 . 0 0 "[ . 1 . 2]" 1
1487 1 59 ILE HG12 1 59 ILE MG . . 3.120 2.339 2.229 2.424 . 0 0 "[ . 1 . 2]" 1
1488 1 59 ILE MG 1 60 ASN H . . 3.850 2.777 2.610 3.005 . 0 0 "[ . 1 . 2]" 1
1489 1 59 ILE MG 1 60 ASN HA . . 3.910 3.178 2.999 3.382 . 0 0 "[ . 1 . 2]" 1
1490 1 59 ILE MG 1 60 ASN HB2 . . 4.890 4.461 3.461 4.893 0.003 9 0 "[ . 1 . 2]" 1
1491 1 59 ILE MG 1 60 ASN HB3 . . 4.890 4.550 3.829 4.898 0.008 17 0 "[ . 1 . 2]" 1
1492 1 59 ILE MG 1 60 ASN QD . . 5.000 3.751 2.494 4.881 . 0 0 "[ . 1 . 2]" 1
1493 1 59 ILE MG 1 63 ARG QD . . 4.110 3.350 2.563 4.112 0.002 17 0 "[ . 1 . 2]" 1
1494 1 60 ASN H 1 60 ASN HB2 . . 3.730 2.752 2.177 3.528 . 0 0 "[ . 1 . 2]" 1
1495 1 60 ASN H 1 60 ASN QB . . 3.080 2.536 2.156 2.791 . 0 0 "[ . 1 . 2]" 1
1496 1 60 ASN H 1 60 ASN HB3 . . 3.730 3.259 2.238 3.586 . 0 0 "[ . 1 . 2]" 1
1497 1 60 ASN H 1 61 ALA H . . 3.540 2.632 2.503 2.778 . 0 0 "[ . 1 . 2]" 1
1498 1 60 ASN H 1 61 ALA MB . . 4.740 4.288 4.190 4.421 . 0 0 "[ . 1 . 2]" 1
1499 1 60 ASN H 1 62 ARG H . . 4.640 4.206 3.905 4.618 . 0 0 "[ . 1 . 2]" 1
1500 1 60 ASN HA 1 60 ASN QD . . 4.330 3.233 2.236 4.227 . 0 0 "[ . 1 . 2]" 1
1501 1 60 ASN HA 1 63 ARG QB . . 3.920 3.084 2.475 3.928 0.008 7 0 "[ . 1 . 2]" 1
1502 1 60 ASN HA 1 63 ARG QG . . 4.330 3.008 1.948 3.734 . 0 0 "[ . 1 . 2]" 1
1503 1 60 ASN QB 1 61 ALA MB . . 5.270 3.939 3.755 4.548 . 0 0 "[ . 1 . 2]" 1
1504 1 60 ASN QB 1 63 ARG QB . . 5.340 4.393 3.774 5.358 0.018 17 0 "[ . 1 . 2]" 1
1505 1 60 ASN QB 1 63 ARG QD . . 4.550 3.748 3.097 4.477 . 0 0 "[ . 1 . 2]" 1
1506 1 60 ASN QB 1 63 ARG QG . . 5.180 4.524 3.270 5.181 0.001 1 0 "[ . 1 . 2]" 1
1507 1 60 ASN HB2 1 61 ALA H . . 4.140 3.117 2.453 4.161 0.021 8 0 "[ . 1 . 2]" 1
1508 1 60 ASN HB2 1 63 ARG QD . . 5.320 4.669 3.377 5.318 . 0 0 "[ . 1 . 2]" 1
1509 1 60 ASN HB3 1 61 ALA H . . 4.140 3.704 2.590 4.146 0.006 13 0 "[ . 1 . 2]" 1
1510 1 60 ASN HB3 1 63 ARG QD . . 5.320 4.130 3.161 5.196 . 0 0 "[ . 1 . 2]" 1
1511 1 61 ALA H 1 61 ALA MB . . 3.520 2.217 2.033 2.272 . 0 0 "[ . 1 . 2]" 1
1512 1 61 ALA H 1 62 ARG H . . 3.940 2.629 2.387 2.856 . 0 0 "[ . 1 . 2]" 1
1513 1 61 ALA HA 1 64 ARG H . . 4.540 3.311 3.079 3.611 . 0 0 "[ . 1 . 2]" 1
1514 1 61 ALA HA 1 64 ARG HB2 . . 4.860 4.230 3.135 4.891 0.031 9 0 "[ . 1 . 2]" 1
1515 1 61 ALA HA 1 64 ARG QB . . 4.080 3.403 2.832 4.089 0.009 16 0 "[ . 1 . 2]" 1
1516 1 61 ALA HA 1 64 ARG HB3 . . 4.860 3.758 2.886 4.859 . 0 0 "[ . 1 . 2]" 1
1517 1 61 ALA HA 1 65 ILE H . . 3.980 2.928 2.525 4.011 0.031 11 0 "[ . 1 . 2]" 1
1518 1 61 ALA HA 1 65 ILE HB . . 4.020 3.473 2.737 3.971 . 0 0 "[ . 1 . 2]" 1
1519 1 61 ALA HA 1 65 ILE MD . . 3.960 2.821 2.217 3.175 . 0 0 "[ . 1 . 2]" 1
1520 1 61 ALA HA 1 65 ILE HG12 . . 4.410 3.806 3.380 4.289 . 0 0 "[ . 1 . 2]" 1
1521 1 61 ALA HA 1 65 ILE QG . . 3.860 2.150 1.980 2.717 . 0 0 "[ . 1 . 2]" 1
1522 1 61 ALA HA 1 65 ILE HG13 . . 4.410 2.162 1.989 2.749 . 0 0 "[ . 1 . 2]" 1
1523 1 61 ALA HA 1 65 ILE MG . . 5.020 4.572 4.109 4.886 . 0 0 "[ . 1 . 2]" 1
1524 1 61 ALA MB 1 62 ARG H . . 3.960 2.660 2.251 2.969 . 0 0 "[ . 1 . 2]" 1
1525 1 61 ALA MB 1 62 ARG HA . . 5.500 3.849 3.763 3.932 . 0 0 "[ . 1 . 2]" 1
1526 1 61 ALA MB 1 65 ILE H . . 5.090 3.755 3.526 4.448 . 0 0 "[ . 1 . 2]" 1
1527 1 61 ALA MB 1 65 ILE HB . . 4.100 2.645 1.982 3.230 . 0 0 "[ . 1 . 2]" 1
1528 1 61 ALA MB 1 65 ILE MD . . 3.640 1.820 1.706 2.019 . 0 0 "[ . 1 . 2]" 1
1529 1 61 ALA MB 1 65 ILE HG12 . . 4.750 3.702 3.334 4.346 . 0 0 "[ . 1 . 2]" 1
1530 1 61 ALA MB 1 65 ILE QG . . 4.150 2.549 1.955 3.335 . 0 0 "[ . 1 . 2]" 1
1531 1 61 ALA MB 1 65 ILE HG13 . . 4.750 2.605 1.969 3.464 . 0 0 "[ . 1 . 2]" 1
1532 1 61 ALA MB 1 65 ILE MG . . 4.580 3.300 2.710 3.756 . 0 0 "[ . 1 . 2]" 1
1533 1 61 ALA MB 1 66 LEU H . . 5.170 4.048 3.602 4.805 . 0 0 "[ . 1 . 2]" 1
1534 1 61 ALA MB 1 69 MET ME . . 5.500 4.861 4.394 5.322 . 0 0 "[ . 1 . 2]" 1
1535 1 62 ARG H 1 62 ARG HB2 . . 3.620 2.604 2.226 3.515 . 0 0 "[ . 1 . 2]" 1
1536 1 62 ARG H 1 62 ARG QB . . 3.140 2.252 2.196 2.400 . 0 0 "[ . 1 . 2]" 1
1537 1 62 ARG H 1 62 ARG HB3 . . 3.620 2.721 2.219 3.589 . 0 0 "[ . 1 . 2]" 1
1538 1 62 ARG H 1 62 ARG QD . . 4.930 4.168 3.324 4.555 . 0 0 "[ . 1 . 2]" 1
1539 1 62 ARG H 1 62 ARG HG2 . . 4.790 4.206 2.934 4.491 . 0 0 "[ . 1 . 2]" 1
1540 1 62 ARG H 1 62 ARG HG3 . . 4.790 4.026 2.353 4.682 . 0 0 "[ . 1 . 2]" 1
1541 1 62 ARG H 1 63 ARG H . . 3.910 2.582 2.399 2.719 . 0 0 "[ . 1 . 2]" 1
1542 1 62 ARG HA 1 62 ARG QD . . 4.250 4.056 3.653 4.270 0.020 16 0 "[ . 1 . 2]" 1
1543 1 62 ARG HA 1 62 ARG QG . . 3.580 2.507 2.314 3.258 . 0 0 "[ . 1 . 2]" 1
1544 1 62 ARG HA 1 64 ARG H . . 4.230 4.041 3.868 4.247 0.017 9 0 "[ . 1 . 2]" 1
1545 1 62 ARG HA 1 65 ILE H . . 4.760 4.070 3.224 4.396 . 0 0 "[ . 1 . 2]" 1
1546 1 62 ARG HA 1 66 LEU H . . 4.370 2.481 2.070 2.698 . 0 0 "[ . 1 . 2]" 1
1547 1 62 ARG HA 1 66 LEU HA . . 4.370 4.074 3.499 4.436 0.066 10 0 "[ . 1 . 2]" 1
1548 1 62 ARG HA 1 66 LEU HB2 . . 3.440 2.309 1.991 2.742 . 0 0 "[ . 1 . 2]" 1
1549 1 62 ARG HA 1 66 LEU HB3 . . 4.130 2.312 1.979 3.449 . 0 0 "[ . 1 . 2]" 1
1550 1 62 ARG HA 1 66 LEU MD1 . . 4.730 4.281 3.620 4.649 . 0 0 "[ . 1 . 2]" 1
1551 1 62 ARG HA 1 66 LEU MD2 . . 3.630 3.140 2.779 3.585 . 0 0 "[ . 1 . 2]" 1
1552 1 62 ARG HA 1 66 LEU HG . . 4.940 4.561 4.118 4.971 0.031 16 0 "[ . 1 . 2]" 1
1553 1 62 ARG HA 1 67 PRO HD3 . . 4.800 3.671 3.305 4.361 . 0 0 "[ . 1 . 2]" 1
1554 1 62 ARG QB 1 66 LEU MD2 . . 4.380 3.088 1.942 3.640 . 0 0 "[ . 1 . 2]" 1
1555 1 62 ARG QD 1 66 LEU MD2 . . 4.190 3.272 2.574 4.045 . 0 0 "[ . 1 . 2]" 1
1556 1 62 ARG QG 1 66 LEU HA . . 5.340 4.825 4.539 5.389 0.049 16 0 "[ . 1 . 2]" 1
1557 1 62 ARG QG 1 66 LEU MD2 . . 3.380 1.942 1.652 2.702 . 0 0 "[ . 1 . 2]" 1
1558 1 62 ARG HG2 1 66 LEU MD2 . . 4.090 2.223 1.768 3.456 . 0 0 "[ . 1 . 2]" 1
1559 1 62 ARG HG3 1 66 LEU MD2 . . 4.090 2.473 1.772 4.052 . 0 0 "[ . 1 . 2]" 1
1560 1 63 ARG H 1 63 ARG QB . . 3.530 2.474 2.208 2.962 . 0 0 "[ . 1 . 2]" 1
1561 1 63 ARG H 1 63 ARG QD . . 4.820 3.852 2.607 4.249 . 0 0 "[ . 1 . 2]" 1
1562 1 63 ARG H 1 63 ARG HG2 . . 4.730 3.493 1.911 4.421 . 0 0 "[ . 1 . 2]" 1
1563 1 63 ARG H 1 63 ARG QG . . 4.030 2.728 1.875 3.833 . 0 0 "[ . 1 . 2]" 1
1564 1 63 ARG H 1 63 ARG HG3 . . 4.730 3.171 2.275 4.208 . 0 0 "[ . 1 . 2]" 1
1565 1 63 ARG H 1 64 ARG H . . 3.920 2.123 2.054 2.321 . 0 0 "[ . 1 . 2]" 1
1566 1 63 ARG HA 1 63 ARG QD . . 4.620 4.049 2.640 4.554 . 0 0 "[ . 1 . 2]" 1
1567 1 63 ARG HA 1 63 ARG HG2 . . 3.880 3.003 2.393 3.742 . 0 0 "[ . 1 . 2]" 1
1568 1 63 ARG HA 1 63 ARG HG3 . . 3.880 3.126 2.311 3.818 . 0 0 "[ . 1 . 2]" 1
1569 1 63 ARG HA 1 66 LEU MD2 . . 5.500 4.485 4.149 4.951 . 0 0 "[ . 1 . 2]" 1
1570 1 63 ARG QB 1 63 ARG QD . . 3.180 2.228 2.045 2.405 . 0 0 "[ . 1 . 2]" 1
1571 1 63 ARG QB 1 64 ARG H . . 4.390 3.206 2.769 3.822 . 0 0 "[ . 1 . 2]" 1
1572 1 64 ARG H 1 64 ARG HB2 . . 3.770 2.789 2.494 3.012 . 0 0 "[ . 1 . 2]" 1
1573 1 64 ARG H 1 64 ARG HB3 . . 3.770 3.021 2.756 3.661 . 0 0 "[ . 1 . 2]" 1
1574 1 64 ARG H 1 64 ARG QG . . 4.520 4.045 3.330 4.254 . 0 0 "[ . 1 . 2]" 1
1575 1 64 ARG H 1 65 ILE H . . 3.290 1.977 1.843 2.112 . 0 0 "[ . 1 . 2]" 1
1576 1 64 ARG HA 1 64 ARG QD . . 4.190 3.502 2.088 4.113 . 0 0 "[ . 1 . 2]" 1
1577 1 64 ARG HA 1 64 ARG HG2 . . 3.700 2.862 2.162 3.660 . 0 0 "[ . 1 . 2]" 1
1578 1 64 ARG HA 1 64 ARG HG3 . . 3.700 2.700 2.204 3.630 . 0 0 "[ . 1 . 2]" 1
1579 1 64 ARG QB 1 65 ILE H . . 3.870 2.622 2.497 3.580 . 0 0 "[ . 1 . 2]" 1
1580 1 64 ARG HB2 1 65 ILE H . . 4.690 3.530 2.712 4.349 . 0 0 "[ . 1 . 2]" 1
1581 1 64 ARG HB3 1 65 ILE H . . 4.690 2.787 2.543 3.809 . 0 0 "[ . 1 . 2]" 1
1582 1 64 ARG QG 1 65 ILE H . . 5.340 4.152 3.771 4.735 . 0 0 "[ . 1 . 2]" 1
1583 1 65 ILE H 1 65 ILE HB . . 3.410 2.583 2.406 2.723 . 0 0 "[ . 1 . 2]" 1
1584 1 65 ILE H 1 65 ILE MD . . 4.600 3.794 3.618 4.440 . 0 0 "[ . 1 . 2]" 1
1585 1 65 ILE H 1 65 ILE HG12 . . 3.930 3.234 2.829 3.842 . 0 0 "[ . 1 . 2]" 1
1586 1 65 ILE H 1 65 ILE HG13 . . 3.930 2.278 2.067 3.195 . 0 0 "[ . 1 . 2]" 1
1587 1 65 ILE H 1 65 ILE MG . . 4.190 3.782 3.738 3.859 . 0 0 "[ . 1 . 2]" 1
1588 1 65 ILE H 1 66 LEU H . . 3.390 2.694 2.067 2.934 . 0 0 "[ . 1 . 2]" 1
1589 1 65 ILE H 1 67 PRO HD2 . . 4.790 2.850 2.035 3.160 . 0 0 "[ . 1 . 2]" 1
1590 1 65 ILE H 1 67 PRO HD3 . . 4.880 4.289 3.521 4.693 . 0 0 "[ . 1 . 2]" 1
1591 1 65 ILE HA 1 65 ILE HG12 . . 3.940 2.482 2.315 2.618 . 0 0 "[ . 1 . 2]" 1
1592 1 65 ILE HA 1 65 ILE QG . . 3.450 2.402 2.265 2.509 . 0 0 "[ . 1 . 2]" 1
1593 1 65 ILE HA 1 65 ILE HG13 . . 3.940 3.227 2.876 3.490 . 0 0 "[ . 1 . 2]" 1
1594 1 65 ILE HA 1 65 ILE MG . . 3.230 2.347 2.193 2.501 . 0 0 "[ . 1 . 2]" 1
1595 1 65 ILE HA 1 67 PRO HD2 . . 4.540 3.721 3.400 3.940 . 0 0 "[ . 1 . 2]" 1
1596 1 65 ILE HB 1 65 ILE MD . . 3.220 2.495 2.342 2.622 . 0 0 "[ . 1 . 2]" 1
1597 1 65 ILE HB 1 66 LEU H . . 3.700 2.171 1.964 2.626 . 0 0 "[ . 1 . 2]" 1
1598 1 65 ILE HB 1 67 PRO HD2 . . 4.380 3.942 3.822 4.185 . 0 0 "[ . 1 . 2]" 1
1599 1 65 ILE HB 1 69 MET ME . . 5.220 3.685 2.876 4.645 . 0 0 "[ . 1 . 2]" 1
1600 1 65 ILE MD 1 69 MET ME . . 4.020 3.930 3.651 4.077 0.057 19 0 "[ . 1 . 2]" 1
1601 1 65 ILE QG 1 66 LEU H . . 4.370 3.776 3.533 4.036 . 0 0 "[ . 1 . 2]" 1
1602 1 65 ILE QG 1 69 MET ME . . 5.000 4.563 4.277 4.920 . 0 0 "[ . 1 . 2]" 1
1603 1 65 ILE HG12 1 66 LEU H . . 4.970 4.680 4.442 4.914 . 0 0 "[ . 1 . 2]" 1
1604 1 65 ILE HG13 1 66 LEU H . . 4.970 3.988 3.709 4.306 . 0 0 "[ . 1 . 2]" 1
1605 1 65 ILE MG 1 66 LEU H . . 3.880 3.161 2.896 3.612 . 0 0 "[ . 1 . 2]" 1
1606 1 65 ILE MG 1 66 LEU HA . . 4.200 3.443 3.012 3.741 . 0 0 "[ . 1 . 2]" 1
1607 1 65 ILE MG 1 69 MET H . . 5.070 3.708 3.144 4.259 . 0 0 "[ . 1 . 2]" 1
1608 1 65 ILE MG 1 69 MET QB . . 3.880 3.331 2.776 3.885 0.005 19 0 "[ . 1 . 2]" 1
1609 1 65 ILE MG 1 69 MET ME . . 3.160 1.932 1.714 2.346 . 0 0 "[ . 1 . 2]" 1
1610 1 66 LEU H 1 66 LEU HB2 . . 3.310 2.661 2.292 2.738 . 0 0 "[ . 1 . 2]" 1
1611 1 66 LEU H 1 66 LEU HB3 . . 3.600 2.397 2.304 2.745 . 0 0 "[ . 1 . 2]" 1
1612 1 66 LEU H 1 66 LEU MD1 . . 4.430 4.142 3.823 4.216 . 0 0 "[ . 1 . 2]" 1
1613 1 66 LEU H 1 66 LEU MD2 . . 4.810 4.211 4.070 4.275 . 0 0 "[ . 1 . 2]" 1
1614 1 66 LEU H 1 66 LEU HG . . 4.670 4.406 4.326 4.618 . 0 0 "[ . 1 . 2]" 1
1615 1 66 LEU H 1 67 PRO HD2 . . 4.070 2.234 2.088 2.380 . 0 0 "[ . 1 . 2]" 1
1616 1 66 LEU H 1 67 PRO HD3 . . 3.860 3.182 2.967 3.340 . 0 0 "[ . 1 . 2]" 1
1617 1 66 LEU H 1 67 PRO QG . . 5.350 4.123 3.988 4.253 . 0 0 "[ . 1 . 2]" 1
1618 1 66 LEU HA 1 66 LEU MD1 . . 3.190 2.282 1.935 2.460 . 0 0 "[ . 1 . 2]" 1
1619 1 66 LEU HA 1 66 LEU MD2 . . 4.120 3.892 3.690 3.975 . 0 0 "[ . 1 . 2]" 1
1620 1 66 LEU HA 1 66 LEU HG . . 4.030 3.425 3.276 3.555 . 0 0 "[ . 1 . 2]" 1
1621 1 66 LEU HA 1 69 MET H . . 3.860 3.695 3.547 3.895 0.035 19 0 "[ . 1 . 2]" 1
1622 1 66 LEU HA 1 69 MET QB . . 4.820 4.225 3.872 4.708 . 0 0 "[ . 1 . 2]" 1
1623 1 66 LEU HA 1 69 MET ME . . 4.290 3.043 2.188 4.292 0.002 2 0 "[ . 1 . 2]" 1
1624 1 66 LEU HA 1 69 MET HG2 . . 4.320 2.348 2.030 2.838 . 0 0 "[ . 1 . 2]" 1
1625 1 66 LEU HA 1 69 MET HG3 . . 4.520 3.214 2.739 4.120 . 0 0 "[ . 1 . 2]" 1
1626 1 66 LEU HB2 1 66 LEU MD2 . . 3.160 2.358 2.073 2.501 . 0 0 "[ . 1 . 2]" 1
1627 1 66 LEU HB2 1 67 PRO HD2 . . 4.420 3.893 3.607 3.929 . 0 0 "[ . 1 . 2]" 1
1628 1 66 LEU HB2 1 67 PRO HD3 . . 3.890 3.556 3.300 3.597 . 0 0 "[ . 1 . 2]" 1
1629 1 66 LEU HB2 1 69 MET HG2 . . 5.500 4.667 4.371 5.106 . 0 0 "[ . 1 . 2]" 1
1630 1 66 LEU HB3 1 66 LEU MD1 . . 3.650 3.185 3.163 3.196 . 0 0 "[ . 1 . 2]" 1
1631 1 66 LEU HB3 1 67 PRO HA . . 4.450 4.599 4.156 4.684 0.234 15 0 "[ . 1 . 2]" 1
1632 1 66 LEU HB3 1 67 PRO HD2 . . 4.570 2.580 2.484 2.861 . 0 0 "[ . 1 . 2]" 1
1633 1 66 LEU HB3 1 67 PRO HD3 . . 3.080 1.853 1.820 1.875 . 0 0 "[ . 1 . 2]" 1
1634 1 66 LEU HB3 1 70 LEU QD . . 5.060 4.653 4.207 5.081 0.021 2 0 "[ . 1 . 2]" 1
1635 1 66 LEU MD1 1 67 PRO HA . . 4.640 3.952 3.598 4.660 0.020 16 0 "[ . 1 . 2]" 1
1636 1 66 LEU MD1 1 67 PRO HD2 . . 5.240 4.601 4.481 4.790 . 0 0 "[ . 1 . 2]" 1
1637 1 66 LEU MD1 1 67 PRO HD3 . . 4.770 4.103 3.948 4.506 . 0 0 "[ . 1 . 2]" 1
1638 1 66 LEU MD1 1 69 MET QB . . 5.340 4.704 4.202 5.018 . 0 0 "[ . 1 . 2]" 1
1639 1 66 LEU MD1 1 69 MET ME . . 4.870 4.081 3.014 4.892 0.022 2 0 "[ . 1 . 2]" 1
1640 1 66 LEU MD1 1 69 MET HG2 . . 4.280 3.500 3.090 3.986 . 0 0 "[ . 1 . 2]" 1
1641 1 66 LEU MD1 1 69 MET HG3 . . 4.450 3.214 2.778 4.138 . 0 0 "[ . 1 . 2]" 1
1642 1 66 LEU MD1 1 70 LEU QD . . 3.600 1.980 1.725 2.596 . 0 0 "[ . 1 . 2]" 1
1643 1 66 LEU MD2 1 67 PRO HA . . 5.500 4.732 4.505 5.391 . 0 0 "[ . 1 . 2]" 1
1644 1 66 LEU MD2 1 67 PRO HD2 . . 4.950 4.406 4.216 4.865 . 0 0 "[ . 1 . 2]" 1
1645 1 66 LEU MD2 1 67 PRO HD3 . . 4.630 3.228 2.952 4.006 . 0 0 "[ . 1 . 2]" 1
1646 1 66 LEU HG 1 67 PRO HD3 . . 4.290 2.825 2.535 3.845 . 0 0 "[ . 1 . 2]" 1
1647 1 67 PRO HA 1 70 LEU H . . 4.510 3.752 3.362 4.072 . 0 0 "[ . 1 . 2]" 1
1648 1 67 PRO HA 1 70 LEU QB . . 4.020 2.763 2.307 3.206 . 0 0 "[ . 1 . 2]" 1
1649 1 67 PRO HA 1 70 LEU QD . . 3.840 3.139 2.146 3.855 0.015 19 0 "[ . 1 . 2]" 1
1650 1 67 PRO QB 1 68 ASP H . . 3.910 3.475 3.212 3.734 . 0 0 "[ . 1 . 2]" 1
1651 1 67 PRO HB2 1 68 ASP H . . 4.610 3.662 3.344 3.982 . 0 0 "[ . 1 . 2]" 1
1652 1 67 PRO HB3 1 68 ASP H . . 4.610 4.330 4.146 4.513 . 0 0 "[ . 1 . 2]" 1
1653 1 67 PRO HD2 1 68 ASP QB . . 5.500 4.010 3.954 4.121 . 0 0 "[ . 1 . 2]" 1
1654 1 67 PRO QG 1 68 ASP H . . 5.030 2.798 2.362 3.304 . 0 0 "[ . 1 . 2]" 1
1655 1 68 ASP H 1 68 ASP QB . . 3.490 2.269 2.167 2.370 . 0 0 "[ . 1 . 2]" 1
1656 1 68 ASP H 1 69 MET H . . 3.510 2.356 2.182 2.512 . 0 0 "[ . 1 . 2]" 1
1657 1 68 ASP HA 1 71 GLN H . . 4.360 3.947 3.600 4.213 . 0 0 "[ . 1 . 2]" 1
1658 1 68 ASP HA 1 71 GLN QG . . 4.220 3.368 2.062 4.228 0.008 14 0 "[ . 1 . 2]" 1
1659 1 68 ASP QB 1 69 MET H . . 3.750 2.687 2.245 3.078 . 0 0 "[ . 1 . 2]" 1
1660 1 68 ASP QB 1 69 MET HA . . 4.860 4.160 3.820 4.472 . 0 0 "[ . 1 . 2]" 1
1661 1 68 ASP QB 1 71 GLN H . . 5.500 5.286 4.738 5.510 0.010 20 0 "[ . 1 . 2]" 1
1662 1 69 MET H 1 69 MET QB . . 3.430 2.687 2.348 2.870 . 0 0 "[ . 1 . 2]" 1
1663 1 69 MET H 1 69 MET HG2 . . 3.470 1.972 1.882 2.518 . 0 0 "[ . 1 . 2]" 1
1664 1 69 MET H 1 69 MET HG3 . . 3.890 2.938 2.590 3.906 0.016 2 0 "[ . 1 . 2]" 1
1665 1 69 MET H 1 70 LEU H . . 3.740 2.450 2.234 2.753 . 0 0 "[ . 1 . 2]" 1
1666 1 69 MET H 1 70 LEU QB . . 4.550 4.166 3.925 4.442 . 0 0 "[ . 1 . 2]" 1
1667 1 69 MET HA 1 69 MET ME . . 4.530 4.174 3.938 4.376 . 0 0 "[ . 1 . 2]" 1
1668 1 69 MET HA 1 69 MET HG2 . . 3.830 3.719 3.622 3.794 . 0 0 "[ . 1 . 2]" 1
1669 1 69 MET HA 1 69 MET HG3 . . 3.830 3.756 3.686 3.854 0.024 2 0 "[ . 1 . 2]" 1
1670 1 69 MET QB 1 69 MET ME . . 3.000 2.048 1.836 2.286 . 0 0 "[ . 1 . 2]" 1
1671 1 69 MET HB2 1 69 MET ME . . 3.490 2.954 2.004 3.471 . 0 0 "[ . 1 . 2]" 1
1672 1 69 MET HB3 1 69 MET ME . . 3.490 2.101 1.962 2.342 . 0 0 "[ . 1 . 2]" 1
1673 1 69 MET HG2 1 70 LEU H . . 3.450 2.757 1.896 3.352 . 0 0 "[ . 1 . 2]" 1
1674 1 69 MET HG2 1 70 LEU QB . . 5.340 4.312 3.040 4.918 . 0 0 "[ . 1 . 2]" 1
1675 1 69 MET HG3 1 70 LEU H . . 4.880 2.156 1.894 3.120 . 0 0 "[ . 1 . 2]" 1
1676 1 69 MET HG3 1 70 LEU QB . . 5.340 3.549 2.909 3.980 . 0 0 "[ . 1 . 2]" 1
1677 1 70 LEU H 1 70 LEU HB2 . . 3.570 2.335 2.130 2.835 . 0 0 "[ . 1 . 2]" 1
1678 1 70 LEU H 1 70 LEU QB . . 3.010 2.161 2.086 2.226 . 0 0 "[ . 1 . 2]" 1
1679 1 70 LEU H 1 70 LEU HB3 . . 3.570 3.128 2.261 3.536 . 0 0 "[ . 1 . 2]" 1
1680 1 70 LEU H 1 70 LEU MD1 . . 4.530 3.536 2.168 4.247 . 0 0 "[ . 1 . 2]" 1
1681 1 70 LEU H 1 70 LEU QD . . 3.880 2.911 1.872 3.762 . 0 0 "[ . 1 . 2]" 1
1682 1 70 LEU H 1 70 LEU MD2 . . 4.530 3.653 1.877 4.374 . 0 0 "[ . 1 . 2]" 1
1683 1 70 LEU H 1 70 LEU HG . . 4.280 3.864 2.794 4.396 0.116 12 0 "[ . 1 . 2]" 1
1684 1 70 LEU HA 1 70 LEU MD1 . . 4.270 2.712 2.027 3.819 . 0 0 "[ . 1 . 2]" 1
1685 1 70 LEU HA 1 70 LEU QD . . 2.970 2.345 1.876 2.913 . 0 0 "[ . 1 . 2]" 1
1686 1 70 LEU HA 1 70 LEU MD2 . . 4.270 3.133 2.025 3.988 . 0 0 "[ . 1 . 2]" 1
1687 1 70 LEU HA 1 70 LEU HG . . 3.580 2.955 2.231 3.680 0.100 7 0 "[ . 1 . 2]" 1
1688 1 70 LEU QB 1 71 GLN QG . . 5.180 4.203 3.419 5.126 . 0 0 "[ . 1 . 2]" 1
1689 1 71 GLN H 1 71 GLN QG . . 3.720 2.493 1.874 3.023 . 0 0 "[ . 1 . 2]" 1
1690 1 71 GLN H 1 72 GLN H . . 4.610 3.755 2.682 4.649 0.039 16 0 "[ . 1 . 2]" 1
1691 1 71 GLN HA 1 71 GLN QG . . 3.570 2.691 2.216 3.450 . 0 0 "[ . 1 . 2]" 1
1692 1 71 GLN QG 1 72 GLN H . . 4.940 4.113 2.099 4.708 . 0 0 "[ . 1 . 2]" 1
1693 1 72 GLN H 1 72 GLN QB . . 3.650 2.415 2.123 3.466 . 0 0 "[ . 1 . 2]" 1
1694 1 72 GLN HA 1 72 GLN QG . . 3.980 2.481 2.196 2.888 . 0 0 "[ . 1 . 2]" 1
1695 1 74 ARG HA 1 74 ARG QD . . 4.080 3.205 1.967 4.149 0.069 13 0 "[ . 1 . 2]" 1
1696 1 74 ARG HA 1 74 ARG QG . . 3.320 2.621 2.174 3.376 0.056 20 0 "[ . 1 . 2]" 1
1697 1 74 ARG QB 1 74 ARG QD . . 3.170 2.232 2.016 2.485 . 0 0 "[ . 1 . 2]" 1
1698 1 74 ARG QB 1 74 ARG QG . . 2.210 2.041 1.995 2.087 . 0 0 "[ . 1 . 2]" 1
1699 1 74 ARG HB2 1 74 ARG QD . . 3.620 2.590 2.049 3.447 . 0 0 "[ . 1 . 2]" 1
1700 1 74 ARG HB2 1 74 ARG QG . . 2.590 2.347 2.145 2.479 . 0 0 "[ . 1 . 2]" 1
1701 1 74 ARG HB3 1 74 ARG QD . . 3.620 2.792 2.146 3.418 . 0 0 "[ . 1 . 2]" 1
1702 1 74 ARG HB3 1 74 ARG QG . . 2.590 2.274 2.144 2.464 . 0 0 "[ . 1 . 2]" 1
1703 1 77 PRO HA 1 78 SER QB . . 4.380 4.233 4.082 4.380 . 20 0 "[ . 1 . 2]" 1
1704 1 79 GLY HA2 1 80 PRO QD . . 3.550 2.364 1.887 3.471 . 0 0 "[ . 1 . 2]" 1
1705 1 79 GLY HA3 1 80 PRO QD . . 3.550 2.627 1.975 3.453 . 0 0 "[ . 1 . 2]" 1
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