NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
607993 |
2ncl   |
26031 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2ncl
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 1865
_Distance_constraint_stats_list.Viol_count 4692
_Distance_constraint_stats_list.Viol_total 4238.700
_Distance_constraint_stats_list.Viol_max 1.966
_Distance_constraint_stats_list.Viol_rms 0.0294
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0057
_Distance_constraint_stats_list.Viol_average_violations_only 0.0452
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 THR 0.591 0.118 14 0 "[ . 1 . 2]"
1 3 GLN 7.939 0.904 17 1 "[ . 1 . + 2]"
1 4 THR 2.740 0.101 14 0 "[ . 1 . 2]"
1 5 GLU 1.012 0.065 7 0 "[ . 1 . 2]"
1 6 GLY 0.753 0.043 6 0 "[ . 1 . 2]"
1 7 GLU 3.301 0.098 11 0 "[ . 1 . 2]"
1 8 LEU 9.284 0.904 17 1 "[ . 1 . + 2]"
1 9 ARG 6.124 0.245 1 0 "[ . 1 . 2]"
1 10 VAL 11.356 0.528 4 1 "[ +. 1 . 2]"
1 11 THR 5.006 0.094 7 0 "[ . 1 . 2]"
1 12 GLN 4.655 0.171 15 0 "[ . 1 . 2]"
1 13 ILE 2.841 0.077 10 0 "[ . 1 . 2]"
1 14 LEU 4.132 0.078 4 0 "[ . 1 . 2]"
1 15 LYS 7.222 0.133 15 0 "[ . 1 . 2]"
1 16 GLU 6.140 0.159 7 0 "[ . 1 . 2]"
1 17 LYS 4.845 0.126 17 0 "[ . 1 . 2]"
1 18 PHE 10.897 0.300 10 0 "[ . 1 . 2]"
1 19 PRO 7.095 0.159 7 0 "[ . 1 . 2]"
1 20 ARG 3.802 0.193 7 0 "[ . 1 . 2]"
1 21 ALA 1.001 0.065 4 0 "[ . 1 . 2]"
1 22 THR 3.194 0.098 16 0 "[ . 1 . 2]"
1 23 ALA 2.033 0.104 4 0 "[ . 1 . 2]"
1 24 ILE 1.085 0.055 4 0 "[ . 1 . 2]"
1 25 LYS 1.954 0.061 2 0 "[ . 1 . 2]"
1 26 VAL 2.450 0.077 16 0 "[ . 1 . 2]"
1 27 THR 5.551 0.125 6 0 "[ . 1 . 2]"
1 28 ASP 7.593 0.121 11 0 "[ . 1 . 2]"
1 29 ILE 5.498 0.121 11 0 "[ . 1 . 2]"
1 30 SER 3.035 0.155 14 0 "[ . 1 . 2]"
1 31 GLY 0.844 0.083 5 0 "[ . 1 . 2]"
1 32 GLY 0.899 0.070 13 0 "[ . 1 . 2]"
1 33 CYS 1.032 0.073 6 0 "[ . 1 . 2]"
1 34 GLY 3.256 0.155 14 0 "[ . 1 . 2]"
1 35 ALA 1.550 0.091 16 0 "[ . 1 . 2]"
1 36 MET 4.301 0.108 11 0 "[ . 1 . 2]"
1 37 TYR 10.102 0.897 1 2 "[+ . - 1 . 2]"
1 38 GLU 4.340 0.125 6 0 "[ . 1 . 2]"
1 39 ILE 1.061 0.051 2 0 "[ . 1 . 2]"
1 40 LYS 2.921 0.241 2 0 "[ . 1 . 2]"
1 41 ILE 7.755 0.254 20 0 "[ . 1 . 2]"
1 42 GLU 9.085 0.236 6 0 "[ . 1 . 2]"
1 43 SER 2.973 0.100 12 0 "[ . 1 . 2]"
1 44 GLU 5.049 0.122 14 0 "[ . 1 . 2]"
1 45 GLU 2.822 0.102 8 0 "[ . 1 . 2]"
1 46 PHE 8.464 0.254 20 0 "[ . 1 . 2]"
1 47 LYS 13.747 1.966 7 10 "[ ***.*+ * -*.** 2]"
1 48 GLU 11.729 1.966 7 10 "[ ***.*+ * -*.** 2]"
1 49 LYS 3.495 0.078 18 0 "[ . 1 . 2]"
1 50 ARG 9.400 0.221 16 0 "[ . 1 . 2]"
1 51 THR 2.493 0.138 16 0 "[ . 1 . 2]"
1 52 VAL 1.028 0.037 6 0 "[ . 1 . 2]"
1 53 GLN 2.527 0.144 20 0 "[ . 1 . 2]"
1 54 GLN 1.008 0.045 2 0 "[ . 1 . 2]"
1 55 HIS 1.334 0.050 15 0 "[ . 1 . 2]"
1 56 GLN 2.059 0.127 8 0 "[ . 1 . 2]"
1 57 MET 5.119 0.258 19 0 "[ . 1 . 2]"
1 58 VAL 8.628 0.300 10 0 "[ . 1 . 2]"
1 59 ASN 2.872 0.081 16 0 "[ . 1 . 2]"
1 60 GLN 4.981 0.192 19 0 "[ . 1 . 2]"
1 61 ALA 2.664 0.089 3 0 "[ . 1 . 2]"
1 62 LEU 8.539 0.128 6 0 "[ . 1 . 2]"
1 63 LYS 6.239 0.126 14 0 "[ . 1 . 2]"
1 64 GLU 7.715 0.187 1 0 "[ . 1 . 2]"
1 65 GLU 6.882 0.528 4 1 "[ +. 1 . 2]"
1 66 ILE 3.457 0.897 1 2 "[+ . - 1 . 2]"
1 67 LYS 6.323 0.145 7 0 "[ . 1 . 2]"
1 68 GLU 4.752 0.188 16 0 "[ . 1 . 2]"
1 69 MET 0.477 0.053 6 0 "[ . 1 . 2]"
1 70 HIS 1.621 0.083 4 0 "[ . 1 . 2]"
1 71 GLY 3.539 0.099 14 0 "[ . 1 . 2]"
1 72 LEU 8.162 0.197 3 0 "[ . 1 . 2]"
1 73 ARG 2.811 0.083 1 0 "[ . 1 . 2]"
1 74 ILE 6.801 0.222 20 0 "[ . 1 . 2]"
1 75 PHE 7.530 0.241 2 0 "[ . 1 . 2]"
1 76 THR 8.476 0.236 6 0 "[ . 1 . 2]"
1 77 SER 2.874 0.136 5 0 "[ . 1 . 2]"
1 78 VAL 5.272 0.079 1 0 "[ . 1 . 2]"
1 79 PRO 4.951 0.099 8 0 "[ . 1 . 2]"
1 80 LYS 3.376 0.135 2 0 "[ . 1 . 2]"
1 81 ARG 1.001 0.079 12 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 THR HA 1 2 THR HB . . 2.950 2.707 2.212 3.005 0.055 2 0 "[ . 1 . 2]" 1
2 1 2 THR HA 1 2 THR MG . . 3.490 2.797 2.181 3.267 . 0 0 "[ . 1 . 2]" 1
3 1 2 THR HA 1 3 GLN H . . 3.230 2.537 2.153 3.348 0.118 14 0 "[ . 1 . 2]" 1
4 1 2 THR HA 1 3 GLN HB2 . . 5.020 4.370 3.759 5.035 0.015 7 0 "[ . 1 . 2]" 1
5 1 2 THR HB 1 3 GLN H . . 4.800 3.884 2.587 4.623 . 0 0 "[ . 1 . 2]" 1
6 1 2 THR MG 1 3 GLN H . . 4.850 2.942 1.835 4.095 . 0 0 "[ . 1 . 2]" 1
7 1 2 THR MG 1 4 THR H . . 5.500 5.232 4.841 5.549 0.049 14 0 "[ . 1 . 2]" 1
8 1 3 GLN H 1 3 GLN HB2 . . 3.830 2.657 2.106 3.072 . 0 0 "[ . 1 . 2]" 1
9 1 3 GLN H 1 3 GLN HG2 . . 5.400 4.508 3.349 5.042 . 0 0 "[ . 1 . 2]" 1
10 1 3 GLN H 1 3 GLN QG . . 4.910 3.740 2.781 4.204 . 0 0 "[ . 1 . 2]" 1
11 1 3 GLN H 1 4 THR H . . 5.340 4.442 4.183 4.656 . 0 0 "[ . 1 . 2]" 1
12 1 3 GLN H 1 28 ASP HB3 . . 4.780 4.617 3.810 4.842 0.062 7 0 "[ . 1 . 2]" 1
13 1 3 GLN HA 1 3 GLN HE22 . . 4.250 3.946 3.272 4.334 0.084 18 0 "[ . 1 . 2]" 1
14 1 3 GLN HA 1 3 GLN HG2 . . 3.280 3.005 2.419 3.417 0.137 9 0 "[ . 1 . 2]" 1
15 1 3 GLN HA 1 3 GLN QG . . 3.510 2.151 2.030 2.870 . 0 0 "[ . 1 . 2]" 1
16 1 3 GLN HA 1 3 GLN HG3 . . 3.690 2.307 2.073 3.703 0.013 3 0 "[ . 1 . 2]" 1
17 1 3 GLN HA 1 4 THR H . . 2.880 2.224 2.057 2.604 . 0 0 "[ . 1 . 2]" 1
18 1 3 GLN HB2 1 4 THR H . . 4.360 4.090 2.951 4.379 0.019 18 0 "[ . 1 . 2]" 1
19 1 3 GLN HB2 1 8 LEU QD . . 4.080 4.116 3.053 4.573 0.493 3 0 "[ . 1 . 2]" 1
20 1 3 GLN HB3 1 3 GLN HE22 . . 4.800 4.353 2.133 4.657 . 0 0 "[ . 1 . 2]" 1
21 1 3 GLN HB3 1 4 THR H . . 3.660 2.964 2.253 3.436 . 0 0 "[ . 1 . 2]" 1
22 1 3 GLN HB3 1 8 LEU HG . . 4.570 4.378 3.286 4.625 0.055 18 0 "[ . 1 . 2]" 1
23 1 3 GLN HE21 1 8 LEU QD . . 4.950 4.026 2.423 5.854 0.904 17 1 "[ . 1 . + 2]" 1
24 1 3 GLN HE22 1 3 GLN QG . . 3.550 2.206 2.130 2.633 . 0 0 "[ . 1 . 2]" 1
25 1 3 GLN HE22 1 3 GLN HG3 . . 3.720 2.437 2.186 3.622 . 0 0 "[ . 1 . 2]" 1
26 1 3 GLN HE22 1 4 THR H . . 5.370 5.145 4.714 5.404 0.034 7 0 "[ . 1 . 2]" 1
27 1 3 GLN HE22 1 8 LEU QD . . 4.760 3.636 2.458 4.717 . 0 0 "[ . 1 . 2]" 1
28 1 3 GLN HE22 1 8 LEU MD2 . . 5.280 3.700 2.616 4.788 . 0 0 "[ . 1 . 2]" 1
29 1 3 GLN QG 1 4 THR H . . 4.580 3.057 2.413 4.168 . 0 0 "[ . 1 . 2]" 1
30 1 3 GLN QG 1 8 LEU QD . . 4.240 2.549 2.091 3.420 . 0 0 "[ . 1 . 2]" 1
31 1 3 GLN HG2 1 4 THR H . . 4.540 3.649 2.485 4.608 0.068 3 0 "[ . 1 . 2]" 1
32 1 3 GLN HG2 1 8 LEU QD . . 5.000 2.708 2.125 4.578 . 0 0 "[ . 1 . 2]" 1
33 1 3 GLN HG3 1 8 LEU QD . . 5.070 3.439 2.861 3.845 . 0 0 "[ . 1 . 2]" 1
34 1 3 GLN HG3 1 8 LEU HG . . 5.350 5.148 4.592 5.428 0.078 20 0 "[ . 1 . 2]" 1
35 1 4 THR H 1 4 THR MG . . 3.270 2.990 2.647 3.239 . 0 0 "[ . 1 . 2]" 1
36 1 4 THR H 1 5 GLU H . . 4.860 4.482 4.394 4.598 . 0 0 "[ . 1 . 2]" 1
37 1 4 THR H 1 7 GLU H . . 4.410 3.208 2.973 3.463 . 0 0 "[ . 1 . 2]" 1
38 1 4 THR H 1 7 GLU HA . . 5.240 4.738 4.557 4.991 . 0 0 "[ . 1 . 2]" 1
39 1 4 THR H 1 7 GLU HB2 . . 3.970 2.074 1.896 2.338 . 0 0 "[ . 1 . 2]" 1
40 1 4 THR H 1 7 GLU HB3 . . 3.590 2.775 2.331 3.101 . 0 0 "[ . 1 . 2]" 1
41 1 4 THR H 1 7 GLU HG2 . . 5.080 4.311 3.950 4.657 . 0 0 "[ . 1 . 2]" 1
42 1 4 THR H 1 8 LEU H . . 4.920 4.412 3.695 4.747 . 0 0 "[ . 1 . 2]" 1
43 1 4 THR H 1 8 LEU HG . . 5.500 4.527 3.678 4.951 . 0 0 "[ . 1 . 2]" 1
44 1 4 THR H 1 28 ASP HB3 . . 4.640 3.474 3.008 4.004 . 0 0 "[ . 1 . 2]" 1
45 1 4 THR HA 1 4 THR HB . . 2.880 2.462 2.402 2.510 . 0 0 "[ . 1 . 2]" 1
46 1 4 THR HA 1 4 THR MG . . 3.270 2.390 2.229 2.481 . 0 0 "[ . 1 . 2]" 1
47 1 4 THR HA 1 5 GLU H . . 2.950 2.576 2.431 2.771 . 0 0 "[ . 1 . 2]" 1
48 1 4 THR HA 1 5 GLU HA . . 4.920 4.551 4.398 4.658 . 0 0 "[ . 1 . 2]" 1
49 1 4 THR HA 1 6 GLY H . . 4.440 4.141 3.792 4.420 . 0 0 "[ . 1 . 2]" 1
50 1 4 THR HA 1 7 GLU HB2 . . 5.000 4.585 4.390 4.796 . 0 0 "[ . 1 . 2]" 1
51 1 4 THR HA 1 28 ASP HB2 . . 5.110 5.176 5.128 5.211 0.101 14 0 "[ . 1 . 2]" 1
52 1 4 THR HB 1 5 GLU H . . 3.140 2.314 2.118 2.588 . 0 0 "[ . 1 . 2]" 1
53 1 4 THR HB 1 5 GLU HB2 . . 4.160 4.055 3.831 4.189 0.029 6 0 "[ . 1 . 2]" 1
54 1 4 THR HB 1 6 GLY H . . 3.750 2.402 2.107 2.690 . 0 0 "[ . 1 . 2]" 1
55 1 4 THR HB 1 6 GLY HA3 . . 4.410 3.924 3.457 4.320 . 0 0 "[ . 1 . 2]" 1
56 1 4 THR HB 1 7 GLU H . . 3.580 3.553 3.374 3.608 0.028 15 0 "[ . 1 . 2]" 1
57 1 4 THR MG 1 5 GLU H . . 4.110 3.715 3.570 3.939 . 0 0 "[ . 1 . 2]" 1
58 1 4 THR MG 1 6 GLY H . . 5.360 3.962 3.733 4.304 . 0 0 "[ . 1 . 2]" 1
59 1 4 THR MG 1 7 GLU H . . 5.130 3.946 3.757 4.310 . 0 0 "[ . 1 . 2]" 1
60 1 4 THR MG 1 7 GLU HB2 . . 4.360 3.815 3.526 4.048 . 0 0 "[ . 1 . 2]" 1
61 1 4 THR MG 1 7 GLU HG2 . . 5.420 5.394 5.114 5.482 0.062 6 0 "[ . 1 . 2]" 1
62 1 4 THR MG 1 28 ASP HB2 . . 4.040 2.893 2.640 3.398 . 0 0 "[ . 1 . 2]" 1
63 1 4 THR MG 1 28 ASP HB3 . . 4.710 3.378 3.069 3.692 . 0 0 "[ . 1 . 2]" 1
64 1 4 THR MG 1 32 GLY H . . 5.500 5.485 4.789 5.561 0.061 8 0 "[ . 1 . 2]" 1
65 1 4 THR MG 1 35 ALA H . . 5.060 4.969 4.664 5.082 0.022 17 0 "[ . 1 . 2]" 1
66 1 5 GLU H 1 5 GLU HB2 . . 3.290 2.275 2.182 2.365 . 0 0 "[ . 1 . 2]" 1
67 1 5 GLU H 1 5 GLU HB3 . . 3.520 3.541 3.496 3.564 0.044 20 0 "[ . 1 . 2]" 1
68 1 5 GLU H 1 5 GLU HG2 . . 4.090 3.619 2.656 4.016 . 0 0 "[ . 1 . 2]" 1
69 1 5 GLU H 1 5 GLU HG3 . . 4.460 3.081 2.402 4.152 . 0 0 "[ . 1 . 2]" 1
70 1 5 GLU H 1 6 GLY H . . 3.670 2.508 2.388 2.581 . 0 0 "[ . 1 . 2]" 1
71 1 5 GLU H 1 6 GLY HA2 . . 5.210 5.191 5.068 5.248 0.038 5 0 "[ . 1 . 2]" 1
72 1 5 GLU H 1 7 GLU H . . 4.910 4.346 4.115 4.472 . 0 0 "[ . 1 . 2]" 1
73 1 5 GLU HA 1 5 GLU HB3 . . 2.870 2.571 2.500 2.661 . 0 0 "[ . 1 . 2]" 1
74 1 5 GLU HA 1 5 GLU HG2 . . 3.790 2.694 2.310 3.665 . 0 0 "[ . 1 . 2]" 1
75 1 5 GLU HA 1 5 GLU HG3 . . 3.560 2.991 2.393 3.625 0.065 7 0 "[ . 1 . 2]" 1
76 1 5 GLU HA 1 7 GLU H . . 5.120 4.475 4.179 4.791 . 0 0 "[ . 1 . 2]" 1
77 1 5 GLU HA 1 8 LEU H . . 4.220 3.682 3.270 4.224 0.004 14 0 "[ . 1 . 2]" 1
78 1 5 GLU HA 1 8 LEU QD . . 3.430 2.679 2.317 3.307 . 0 0 "[ . 1 . 2]" 1
79 1 5 GLU HB2 1 6 GLY H . . 3.710 2.986 2.608 3.275 . 0 0 "[ . 1 . 2]" 1
80 1 5 GLU HB3 1 6 GLY H . . 3.820 3.709 3.487 3.856 0.036 5 0 "[ . 1 . 2]" 1
81 1 5 GLU HB3 1 9 ARG H . . 5.450 4.986 4.702 5.398 . 0 0 "[ . 1 . 2]" 1
82 1 5 GLU HG2 1 6 GLY H . . 5.500 5.111 4.679 5.424 . 0 0 "[ . 1 . 2]" 1
83 1 5 GLU HG3 1 8 LEU QD . . 5.450 4.287 2.925 5.241 . 0 0 "[ . 1 . 2]" 1
84 1 6 GLY H 1 7 GLU H . . 3.560 2.800 2.683 2.855 . 0 0 "[ . 1 . 2]" 1
85 1 6 GLY H 1 7 GLU HA . . 5.360 5.371 5.308 5.403 0.043 6 0 "[ . 1 . 2]" 1
86 1 6 GLY H 1 8 LEU HG . . 5.500 4.977 4.660 5.449 . 0 0 "[ . 1 . 2]" 1
87 1 6 GLY H 1 37 TYR QE . . 5.500 4.587 4.410 4.789 . 0 0 "[ . 1 . 2]" 1
88 1 6 GLY HA2 1 9 ARG QB . . 3.750 2.287 2.086 2.429 . 0 0 "[ . 1 . 2]" 1
89 1 6 GLY HA2 1 10 VAL H . . 4.630 3.677 3.473 3.884 . 0 0 "[ . 1 . 2]" 1
90 1 6 GLY HA2 1 10 VAL MG2 . . 5.090 3.522 3.297 3.728 . 0 0 "[ . 1 . 2]" 1
91 1 6 GLY HA2 1 37 TYR QE . . 5.060 5.027 4.868 5.094 0.034 4 0 "[ . 1 . 2]" 1
92 1 6 GLY HA2 1 66 ILE MD . . 4.670 3.176 2.424 4.303 . 0 0 "[ . 1 . 2]" 1
93 1 6 GLY HA3 1 9 ARG H . . 4.960 4.751 4.610 4.892 . 0 0 "[ . 1 . 2]" 1
94 1 6 GLY HA3 1 9 ARG QB . . 3.890 3.835 3.627 3.919 0.029 4 0 "[ . 1 . 2]" 1
95 1 6 GLY HA3 1 10 VAL MG2 . . 5.090 3.793 3.634 4.069 . 0 0 "[ . 1 . 2]" 1
96 1 6 GLY HA3 1 37 TYR QE . . 4.720 3.781 3.620 3.885 . 0 0 "[ . 1 . 2]" 1
97 1 7 GLU H 1 7 GLU HB2 . . 3.510 1.978 1.950 2.010 . 0 0 "[ . 1 . 2]" 1
98 1 7 GLU H 1 7 GLU HB3 . . 3.240 2.882 2.805 2.989 . 0 0 "[ . 1 . 2]" 1
99 1 7 GLU H 1 7 GLU HG2 . . 3.860 3.935 3.910 3.958 0.098 11 0 "[ . 1 . 2]" 1
100 1 7 GLU H 1 7 GLU HG3 . . 4.310 4.087 3.987 4.192 . 0 0 "[ . 1 . 2]" 1
101 1 7 GLU H 1 8 LEU H . . 3.290 2.941 2.827 3.101 . 0 0 "[ . 1 . 2]" 1
102 1 7 GLU H 1 8 LEU HB2 . . 5.480 5.326 5.166 5.484 0.004 2 0 "[ . 1 . 2]" 1
103 1 7 GLU H 1 8 LEU HG . . 4.950 4.170 3.997 4.410 . 0 0 "[ . 1 . 2]" 1
104 1 7 GLU H 1 26 VAL MG1 . . 5.310 4.863 4.649 5.006 . 0 0 "[ . 1 . 2]" 1
105 1 7 GLU H 1 26 VAL QG . . 5.500 4.735 4.542 4.869 . 0 0 "[ . 1 . 2]" 1
106 1 7 GLU H 1 37 TYR QE . . 4.330 2.617 2.417 2.719 . 0 0 "[ . 1 . 2]" 1
107 1 7 GLU HA 1 7 GLU HG3 . . 3.530 3.499 3.402 3.558 0.028 6 0 "[ . 1 . 2]" 1
108 1 7 GLU HA 1 9 ARG H . . 4.960 4.878 4.737 4.984 0.024 1 0 "[ . 1 . 2]" 1
109 1 7 GLU HA 1 10 VAL H . . 4.490 4.020 3.837 4.150 . 0 0 "[ . 1 . 2]" 1
110 1 7 GLU HA 1 10 VAL HB . . 3.830 3.152 2.945 3.320 . 0 0 "[ . 1 . 2]" 1
111 1 7 GLU HA 1 10 VAL MG1 . . 4.640 4.275 4.037 4.443 . 0 0 "[ . 1 . 2]" 1
112 1 7 GLU HA 1 10 VAL MG2 . . 4.370 3.931 3.634 4.103 . 0 0 "[ . 1 . 2]" 1
113 1 7 GLU HA 1 11 THR H . . 4.520 4.107 3.957 4.312 . 0 0 "[ . 1 . 2]" 1
114 1 7 GLU HA 1 26 VAL HB . . 4.490 4.001 3.729 4.341 . 0 0 "[ . 1 . 2]" 1
115 1 7 GLU HA 1 26 VAL MG1 . . 3.510 2.593 2.404 2.750 . 0 0 "[ . 1 . 2]" 1
116 1 7 GLU HA 1 37 TYR QD . . 4.550 3.207 3.011 3.481 . 0 0 "[ . 1 . 2]" 1
117 1 7 GLU HA 1 37 TYR QE . . 3.520 2.897 2.552 3.166 . 0 0 "[ . 1 . 2]" 1
118 1 7 GLU HB2 1 8 LEU H . . 3.740 3.442 3.339 3.607 . 0 0 "[ . 1 . 2]" 1
119 1 7 GLU HB2 1 37 TYR QD . . 4.140 3.891 3.732 4.032 . 0 0 "[ . 1 . 2]" 1
120 1 7 GLU HB2 1 37 TYR QE . . 4.110 2.399 2.270 2.578 . 0 0 "[ . 1 . 2]" 1
121 1 7 GLU HB3 1 7 GLU HG3 . . 2.920 2.642 2.557 2.720 . 0 0 "[ . 1 . 2]" 1
122 1 7 GLU HB3 1 8 LEU H . . 3.560 2.477 2.339 2.617 . 0 0 "[ . 1 . 2]" 1
123 1 7 GLU HB3 1 26 VAL QG . . 5.070 4.383 4.264 4.479 . 0 0 "[ . 1 . 2]" 1
124 1 7 GLU HB3 1 28 ASP H . . 5.110 4.919 4.595 5.119 0.009 3 0 "[ . 1 . 2]" 1
125 1 7 GLU HB3 1 37 TYR QD . . 4.980 5.015 4.995 5.045 0.065 2 0 "[ . 1 . 2]" 1
126 1 7 GLU HB3 1 37 TYR QE . . 4.980 4.006 3.868 4.162 . 0 0 "[ . 1 . 2]" 1
127 1 7 GLU HG2 1 8 LEU H . . 5.180 4.788 4.724 4.878 . 0 0 "[ . 1 . 2]" 1
128 1 7 GLU HG2 1 8 LEU QD . . 5.500 4.837 4.611 5.140 . 0 0 "[ . 1 . 2]" 1
129 1 7 GLU HG2 1 26 VAL QG . . 4.650 2.270 2.131 2.512 . 0 0 "[ . 1 . 2]" 1
130 1 7 GLU HG2 1 27 THR HA . . 4.950 3.492 3.257 3.681 . 0 0 "[ . 1 . 2]" 1
131 1 7 GLU HG2 1 27 THR MG . . 5.480 5.066 4.714 5.272 . 0 0 "[ . 1 . 2]" 1
132 1 7 GLU HG2 1 28 ASP H . . 4.520 3.054 2.515 3.350 . 0 0 "[ . 1 . 2]" 1
133 1 7 GLU HG2 1 28 ASP HA . . 4.660 4.062 3.592 4.335 . 0 0 "[ . 1 . 2]" 1
134 1 7 GLU HG2 1 28 ASP HB3 . . 4.130 4.035 3.641 4.170 0.040 8 0 "[ . 1 . 2]" 1
135 1 7 GLU HG2 1 37 TYR QD . . 4.370 2.481 2.307 2.714 . 0 0 "[ . 1 . 2]" 1
136 1 7 GLU HG2 1 37 TYR QE . . 3.750 3.043 2.665 3.391 . 0 0 "[ . 1 . 2]" 1
137 1 7 GLU HG3 1 26 VAL MG1 . . 4.490 3.711 3.479 3.977 . 0 0 "[ . 1 . 2]" 1
138 1 7 GLU HG3 1 27 THR HA . . 4.280 3.388 3.140 3.682 . 0 0 "[ . 1 . 2]" 1
139 1 7 GLU HG3 1 28 ASP H . . 4.110 2.298 2.042 2.518 . 0 0 "[ . 1 . 2]" 1
140 1 7 GLU HG3 1 37 TYR QD . . 4.500 3.465 3.129 3.856 . 0 0 "[ . 1 . 2]" 1
141 1 7 GLU HG3 1 37 TYR QE . . 3.820 3.320 3.032 3.642 . 0 0 "[ . 1 . 2]" 1
142 1 8 LEU H 1 8 LEU HB2 . . 3.090 2.694 2.557 2.765 . 0 0 "[ . 1 . 2]" 1
143 1 8 LEU H 1 8 LEU HB3 . . 3.520 3.550 3.538 3.559 0.039 9 0 "[ . 1 . 2]" 1
144 1 8 LEU H 1 8 LEU QD . . 3.820 2.628 2.514 2.812 . 0 0 "[ . 1 . 2]" 1
145 1 8 LEU H 1 8 LEU MD2 . . 4.060 2.709 2.567 2.975 . 0 0 "[ . 1 . 2]" 1
146 1 8 LEU H 1 8 LEU HG . . 3.140 1.881 1.828 1.930 . 0 0 "[ . 1 . 2]" 1
147 1 8 LEU H 1 11 THR H . . 5.000 4.631 4.566 4.707 . 0 0 "[ . 1 . 2]" 1
148 1 8 LEU HA 1 8 LEU QD . . 3.050 2.324 2.198 2.385 . 0 0 "[ . 1 . 2]" 1
149 1 8 LEU HA 1 8 LEU HG . . 3.970 3.431 3.248 3.520 . 0 0 "[ . 1 . 2]" 1
150 1 8 LEU HA 1 11 THR H . . 3.840 3.597 3.454 3.682 . 0 0 "[ . 1 . 2]" 1
151 1 8 LEU HA 1 11 THR HB . . 4.740 2.700 2.466 2.851 . 0 0 "[ . 1 . 2]" 1
152 1 8 LEU HA 1 11 THR MG . . 4.210 3.990 3.704 4.142 . 0 0 "[ . 1 . 2]" 1
153 1 8 LEU HA 1 12 GLN H . . 4.360 4.134 3.898 4.293 . 0 0 "[ . 1 . 2]" 1
154 1 8 LEU HA 1 12 GLN QE . . 4.990 2.942 2.633 3.397 . 0 0 "[ . 1 . 2]" 1
155 1 8 LEU HB2 1 9 ARG H . . 3.510 2.269 2.190 2.354 . 0 0 "[ . 1 . 2]" 1
156 1 8 LEU HB2 1 10 VAL H . . 4.870 4.900 4.887 4.921 0.051 14 0 "[ . 1 . 2]" 1
157 1 8 LEU QD 1 9 ARG H . . 4.590 3.808 3.771 3.865 . 0 0 "[ . 1 . 2]" 1
158 1 8 LEU QD 1 11 THR H . . 5.060 5.006 4.978 5.024 . 0 0 "[ . 1 . 2]" 1
159 1 8 LEU QD 1 11 THR HB . . 5.500 4.260 4.090 4.382 . 0 0 "[ . 1 . 2]" 1
160 1 8 LEU MD2 1 9 ARG H . . 4.940 4.421 4.376 4.473 . 0 0 "[ . 1 . 2]" 1
161 1 8 LEU MD2 1 11 THR H . . 5.160 5.182 5.166 5.197 0.037 10 0 "[ . 1 . 2]" 1
162 1 8 LEU MD2 1 12 GLN QE . . 5.500 3.954 3.508 4.304 . 0 0 "[ . 1 . 2]" 1
163 1 8 LEU HG 1 9 ARG H . . 3.600 3.678 3.639 3.754 0.154 20 0 "[ . 1 . 2]" 1
164 1 9 ARG H 1 9 ARG QB . . 2.800 2.169 2.011 2.202 . 0 0 "[ . 1 . 2]" 1
165 1 9 ARG H 1 9 ARG HD3 . . 5.110 4.756 4.437 5.355 0.245 1 0 "[ . 1 . 2]" 1
166 1 9 ARG H 1 9 ARG HG2 . . 4.430 4.461 4.428 4.505 0.075 10 0 "[ . 1 . 2]" 1
167 1 9 ARG H 1 9 ARG HG3 . . 4.640 4.437 4.327 4.461 . 0 0 "[ . 1 . 2]" 1
168 1 9 ARG H 1 10 VAL H . . 3.090 2.800 2.753 2.903 . 0 0 "[ . 1 . 2]" 1
169 1 9 ARG H 1 10 VAL HA . . 5.410 5.432 5.418 5.452 0.042 3 0 "[ . 1 . 2]" 1
170 1 9 ARG H 1 10 VAL MG2 . . 4.920 4.562 4.481 4.677 . 0 0 "[ . 1 . 2]" 1
171 1 9 ARG H 1 11 THR H . . 4.320 4.185 4.016 4.332 0.012 1 0 "[ . 1 . 2]" 1
172 1 9 ARG H 1 12 GLN H . . 4.650 4.686 4.666 4.707 0.057 5 0 "[ . 1 . 2]" 1
173 1 9 ARG HA 1 9 ARG HD2 . . 4.140 3.976 2.722 4.216 0.076 5 0 "[ . 1 . 2]" 1
174 1 9 ARG HA 1 9 ARG HD3 . . 4.480 3.368 2.998 4.329 . 0 0 "[ . 1 . 2]" 1
175 1 9 ARG HA 1 9 ARG HG2 . . 4.100 3.755 3.670 3.823 . 0 0 "[ . 1 . 2]" 1
176 1 9 ARG HA 1 11 THR H . . 4.800 4.674 4.408 4.804 0.004 3 0 "[ . 1 . 2]" 1
177 1 9 ARG HA 1 12 GLN H . . 3.890 3.582 3.372 3.859 . 0 0 "[ . 1 . 2]" 1
178 1 9 ARG HA 1 13 ILE H . . 4.910 4.500 4.285 4.694 . 0 0 "[ . 1 . 2]" 1
179 1 9 ARG QB 1 9 ARG HD2 . . 3.820 3.175 2.077 3.419 . 0 0 "[ . 1 . 2]" 1
180 1 9 ARG QB 1 9 ARG HD3 . . 3.790 2.340 2.113 3.214 . 0 0 "[ . 1 . 2]" 1
181 1 9 ARG QB 1 10 VAL H . . 3.250 2.412 2.166 2.524 . 0 0 "[ . 1 . 2]" 1
182 1 9 ARG QB 1 10 VAL MG2 . . 4.260 3.218 2.892 3.418 . 0 0 "[ . 1 . 2]" 1
183 1 9 ARG QB 1 11 THR H . . 4.900 4.691 4.476 4.789 . 0 0 "[ . 1 . 2]" 1
184 1 9 ARG HD2 1 65 GLU QG . . 4.080 3.044 2.286 4.142 0.062 10 0 "[ . 1 . 2]" 1
185 1 9 ARG HD3 1 13 ILE MD . . 5.470 4.603 3.840 5.451 . 0 0 "[ . 1 . 2]" 1
186 1 9 ARG HG2 1 10 VAL HA . . 4.180 4.164 3.871 4.335 0.155 10 0 "[ . 1 . 2]" 1
187 1 9 ARG HG3 1 10 VAL H . . 4.210 3.836 3.695 3.928 . 0 0 "[ . 1 . 2]" 1
188 1 9 ARG HG3 1 10 VAL HA . . 3.850 3.889 3.761 3.946 0.096 15 0 "[ . 1 . 2]" 1
189 1 9 ARG HG3 1 13 ILE H . . 4.840 4.633 4.353 4.875 0.035 5 0 "[ . 1 . 2]" 1
190 1 9 ARG HG3 1 13 ILE MD . . 4.370 2.930 2.410 3.368 . 0 0 "[ . 1 . 2]" 1
191 1 10 VAL H 1 10 VAL HB . . 2.990 2.376 2.328 2.435 . 0 0 "[ . 1 . 2]" 1
192 1 10 VAL H 1 10 VAL MG1 . . 4.000 3.764 3.734 3.790 . 0 0 "[ . 1 . 2]" 1
193 1 10 VAL H 1 10 VAL MG2 . . 3.140 2.408 2.316 2.497 . 0 0 "[ . 1 . 2]" 1
194 1 10 VAL H 1 11 THR H . . 2.990 2.660 2.609 2.719 . 0 0 "[ . 1 . 2]" 1
195 1 10 VAL H 1 11 THR HA . . 5.220 5.263 5.242 5.299 0.079 12 0 "[ . 1 . 2]" 1
196 1 10 VAL H 1 65 GLU QG . . 5.500 5.413 4.922 5.548 0.048 14 0 "[ . 1 . 2]" 1
197 1 10 VAL HA 1 10 VAL MG1 . . 3.260 2.553 2.477 2.606 . 0 0 "[ . 1 . 2]" 1
198 1 10 VAL HA 1 10 VAL MG2 . . 3.110 2.314 2.226 2.412 . 0 0 "[ . 1 . 2]" 1
199 1 10 VAL HA 1 13 ILE H . . 3.560 3.591 3.559 3.637 0.077 10 0 "[ . 1 . 2]" 1
200 1 10 VAL HA 1 13 ILE HB . . 3.800 3.467 3.209 3.806 0.006 10 0 "[ . 1 . 2]" 1
201 1 10 VAL HA 1 13 ILE MD . . 3.780 3.431 2.886 3.786 0.006 5 0 "[ . 1 . 2]" 1
202 1 10 VAL HA 1 13 ILE HG12 . . 5.500 5.495 5.333 5.532 0.032 5 0 "[ . 1 . 2]" 1
203 1 10 VAL HA 1 13 ILE HG13 . . 5.070 3.989 3.694 4.284 . 0 0 "[ . 1 . 2]" 1
204 1 10 VAL HA 1 14 LEU H . . 4.160 4.177 4.129 4.225 0.065 10 0 "[ . 1 . 2]" 1
205 1 10 VAL HA 1 14 LEU HG . . 4.600 4.159 4.060 4.382 . 0 0 "[ . 1 . 2]" 1
206 1 10 VAL HA 1 62 LEU MD2 . . 4.210 4.282 4.245 4.307 0.097 10 0 "[ . 1 . 2]" 1
207 1 10 VAL HB 1 11 THR H . . 3.410 2.639 2.462 2.806 . 0 0 "[ . 1 . 2]" 1
208 1 10 VAL MG1 1 11 THR H . . 4.080 3.231 3.032 3.377 . 0 0 "[ . 1 . 2]" 1
209 1 10 VAL MG1 1 11 THR HA . . 5.500 3.376 3.259 3.455 . 0 0 "[ . 1 . 2]" 1
210 1 10 VAL MG1 1 11 THR HB . . 5.120 5.097 4.944 5.130 0.010 6 0 "[ . 1 . 2]" 1
211 1 10 VAL MG1 1 14 LEU H . . 4.950 4.052 3.936 4.169 . 0 0 "[ . 1 . 2]" 1
212 1 10 VAL MG1 1 14 LEU HB2 . . 4.640 4.099 3.974 4.185 . 0 0 "[ . 1 . 2]" 1
213 1 10 VAL MG1 1 14 LEU MD1 . . 3.130 2.409 2.137 2.651 . 0 0 "[ . 1 . 2]" 1
214 1 10 VAL MG1 1 14 LEU HG . . 4.210 2.636 2.487 2.928 . 0 0 "[ . 1 . 2]" 1
215 1 10 VAL MG1 1 26 VAL HB . . 4.910 4.337 4.094 4.540 . 0 0 "[ . 1 . 2]" 1
216 1 10 VAL MG1 1 37 TYR QD . . 4.940 4.483 4.067 4.912 . 0 0 "[ . 1 . 2]" 1
217 1 10 VAL MG1 1 37 TYR QE . . 5.500 5.188 4.726 5.499 . 0 0 "[ . 1 . 2]" 1
218 1 10 VAL MG1 1 62 LEU H . . 5.500 5.027 4.848 5.230 . 0 0 "[ . 1 . 2]" 1
219 1 10 VAL MG1 1 62 LEU HA . . 5.500 4.948 4.622 5.466 . 0 0 "[ . 1 . 2]" 1
220 1 10 VAL MG1 1 62 LEU QB . . 3.280 2.713 2.367 3.245 . 0 0 "[ . 1 . 2]" 1
221 1 10 VAL MG2 1 11 THR H . . 4.260 4.013 3.936 4.088 . 0 0 "[ . 1 . 2]" 1
222 1 10 VAL MG2 1 12 GLN H . . 5.500 5.501 5.429 5.520 0.020 3 0 "[ . 1 . 2]" 1
223 1 10 VAL MG2 1 14 LEU HG . . 5.500 4.867 4.735 5.143 . 0 0 "[ . 1 . 2]" 1
224 1 10 VAL MG2 1 37 TYR QD . . 4.570 4.086 3.733 4.436 . 0 0 "[ . 1 . 2]" 1
225 1 10 VAL MG2 1 37 TYR QE . . 4.140 3.996 3.467 4.180 0.040 20 0 "[ . 1 . 2]" 1
226 1 10 VAL MG2 1 65 GLU QG . . 4.010 4.138 3.337 4.538 0.528 4 1 "[ +. 1 . 2]" 1
227 1 10 VAL MG2 1 66 ILE HB . . 3.910 3.532 3.289 3.844 . 0 0 "[ . 1 . 2]" 1
228 1 10 VAL MG2 1 66 ILE MD . . 3.660 2.942 2.360 3.663 0.003 1 0 "[ . 1 . 2]" 1
229 1 10 VAL MG2 1 66 ILE MG . . 4.170 4.101 3.839 4.196 0.026 10 0 "[ . 1 . 2]" 1
230 1 11 THR H 1 11 THR HB . . 3.280 2.571 2.434 2.658 . 0 0 "[ . 1 . 2]" 1
231 1 11 THR H 1 11 THR MG . . 3.970 3.814 3.774 3.831 . 0 0 "[ . 1 . 2]" 1
232 1 11 THR H 1 12 GLN H . . 3.720 2.834 2.652 2.917 . 0 0 "[ . 1 . 2]" 1
233 1 11 THR H 1 12 GLN QE . . 5.500 4.244 3.933 4.966 . 0 0 "[ . 1 . 2]" 1
234 1 11 THR H 1 14 LEU MD1 . . 4.740 4.341 3.936 4.630 . 0 0 "[ . 1 . 2]" 1
235 1 11 THR H 1 26 VAL HB . . 4.510 4.378 4.098 4.527 0.017 10 0 "[ . 1 . 2]" 1
236 1 11 THR H 1 26 VAL MG2 . . 3.970 3.018 2.801 3.246 . 0 0 "[ . 1 . 2]" 1
237 1 11 THR HA 1 11 THR MG . . 3.040 2.442 2.378 2.516 . 0 0 "[ . 1 . 2]" 1
238 1 11 THR HA 1 12 GLN H . . 3.470 3.543 3.516 3.564 0.094 7 0 "[ . 1 . 2]" 1
239 1 11 THR HA 1 12 GLN HA . . 5.250 4.802 4.736 4.852 . 0 0 "[ . 1 . 2]" 1
240 1 11 THR HA 1 13 ILE H . . 5.500 4.483 4.256 4.676 . 0 0 "[ . 1 . 2]" 1
241 1 11 THR HA 1 14 LEU H . . 5.250 3.500 3.305 3.738 . 0 0 "[ . 1 . 2]" 1
242 1 11 THR HA 1 14 LEU MD1 . . 4.750 2.517 2.217 2.695 . 0 0 "[ . 1 . 2]" 1
243 1 11 THR HA 1 15 LYS H . . 5.500 4.332 4.118 4.578 . 0 0 "[ . 1 . 2]" 1
244 1 11 THR HA 1 15 LYS QE . . 4.580 4.455 4.038 4.611 0.031 12 0 "[ . 1 . 2]" 1
245 1 11 THR HA 1 26 VAL QG . . 5.000 2.407 2.280 2.516 . 0 0 "[ . 1 . 2]" 1
246 1 11 THR HA 1 26 VAL MG2 . . 4.640 2.418 2.289 2.527 . 0 0 "[ . 1 . 2]" 1
247 1 11 THR HB 1 12 GLN H . . 3.870 2.709 2.541 2.837 . 0 0 "[ . 1 . 2]" 1
248 1 11 THR HB 1 14 LEU HB2 . . 5.130 5.174 5.144 5.208 0.078 4 0 "[ . 1 . 2]" 1
249 1 11 THR HB 1 26 VAL MG2 . . 3.730 3.787 3.764 3.807 0.077 16 0 "[ . 1 . 2]" 1
250 1 11 THR MG 1 12 GLN H . . 4.060 3.563 3.353 3.756 . 0 0 "[ . 1 . 2]" 1
251 1 11 THR MG 1 12 GLN HA . . 4.300 3.563 3.323 3.783 . 0 0 "[ . 1 . 2]" 1
252 1 11 THR MG 1 12 GLN QE . . 5.250 2.808 2.407 3.742 . 0 0 "[ . 1 . 2]" 1
253 1 11 THR MG 1 14 LEU HB2 . . 4.360 3.610 3.449 3.777 . 0 0 "[ . 1 . 2]" 1
254 1 11 THR MG 1 15 LYS H . . 4.540 4.201 3.889 4.480 . 0 0 "[ . 1 . 2]" 1
255 1 11 THR MG 1 15 LYS QE . . 4.170 2.037 1.832 2.292 . 0 0 "[ . 1 . 2]" 1
256 1 11 THR MG 1 15 LYS HG2 . . 3.730 3.539 3.246 3.735 0.005 12 0 "[ . 1 . 2]" 1
257 1 11 THR MG 1 25 LYS HA . . 5.390 3.668 3.185 4.197 . 0 0 "[ . 1 . 2]" 1
258 1 11 THR MG 1 26 VAL H . . 5.500 4.059 3.794 4.434 . 0 0 "[ . 1 . 2]" 1
259 1 11 THR MG 1 26 VAL QG . . 4.520 2.825 2.580 3.035 . 0 0 "[ . 1 . 2]" 1
260 1 12 GLN H 1 12 GLN HB2 . . 3.090 2.430 2.148 2.640 . 0 0 "[ . 1 . 2]" 1
261 1 12 GLN H 1 12 GLN HB3 . . 3.570 3.575 3.455 3.631 0.061 1 0 "[ . 1 . 2]" 1
262 1 12 GLN H 1 12 GLN HG2 . . 5.090 3.188 2.668 4.348 . 0 0 "[ . 1 . 2]" 1
263 1 12 GLN H 1 12 GLN HG3 . . 3.980 3.925 2.935 4.037 0.057 8 0 "[ . 1 . 2]" 1
264 1 12 GLN H 1 13 ILE H . . 2.870 2.827 2.748 2.879 0.009 18 0 "[ . 1 . 2]" 1
265 1 12 GLN HA 1 12 GLN HB3 . . 2.980 2.548 2.429 2.742 . 0 0 "[ . 1 . 2]" 1
266 1 12 GLN HA 1 12 GLN HG2 . . 3.780 3.538 2.761 3.627 . 0 0 "[ . 1 . 2]" 1
267 1 12 GLN HA 1 12 GLN HG3 . . 3.780 3.188 2.164 3.676 . 0 0 "[ . 1 . 2]" 1
268 1 12 GLN HA 1 13 ILE HG13 . . 5.370 5.217 4.967 5.366 . 0 0 "[ . 1 . 2]" 1
269 1 12 GLN HA 1 15 LYS QE . . 4.580 3.305 2.021 4.206 . 0 0 "[ . 1 . 2]" 1
270 1 12 GLN HB2 1 12 GLN HG3 . . 2.760 2.726 2.591 2.931 0.171 15 0 "[ . 1 . 2]" 1
271 1 12 GLN HB2 1 13 ILE H . . 3.780 2.802 2.549 3.209 . 0 0 "[ . 1 . 2]" 1
272 1 12 GLN HB3 1 13 ILE H . . 3.530 3.524 3.338 3.578 0.048 14 0 "[ . 1 . 2]" 1
273 1 12 GLN HB3 1 13 ILE HG13 . . 5.070 3.986 3.545 4.219 . 0 0 "[ . 1 . 2]" 1
274 1 12 GLN QE 1 15 LYS QE . . 5.270 3.248 2.574 4.913 . 0 0 "[ . 1 . 2]" 1
275 1 12 GLN HG2 1 13 ILE H . . 5.350 4.807 4.444 5.384 0.034 12 0 "[ . 1 . 2]" 1
276 1 12 GLN HG3 1 13 ILE H . . 5.250 5.146 4.902 5.252 0.002 8 0 "[ . 1 . 2]" 1
277 1 13 ILE H 1 13 ILE HB . . 3.460 2.625 2.495 2.729 . 0 0 "[ . 1 . 2]" 1
278 1 13 ILE H 1 13 ILE MD . . 3.760 3.620 3.297 3.768 0.008 15 0 "[ . 1 . 2]" 1
279 1 13 ILE H 1 13 ILE HG12 . . 3.770 3.465 3.226 3.773 0.003 12 0 "[ . 1 . 2]" 1
280 1 13 ILE H 1 13 ILE HG13 . . 2.930 2.222 2.079 2.456 . 0 0 "[ . 1 . 2]" 1
281 1 13 ILE H 1 13 ILE MG . . 3.950 3.837 3.789 3.878 . 0 0 "[ . 1 . 2]" 1
282 1 13 ILE H 1 14 LEU H . . 3.310 2.504 2.428 2.553 . 0 0 "[ . 1 . 2]" 1
283 1 13 ILE H 1 14 LEU HA . . 5.500 5.185 5.103 5.237 . 0 0 "[ . 1 . 2]" 1
284 1 13 ILE H 1 14 LEU HG . . 4.520 4.544 4.525 4.565 0.045 6 0 "[ . 1 . 2]" 1
285 1 13 ILE H 1 15 LYS H . . 4.550 4.229 4.100 4.376 . 0 0 "[ . 1 . 2]" 1
286 1 13 ILE HA 1 13 ILE MD . . 3.920 3.910 3.828 3.947 0.027 6 0 "[ . 1 . 2]" 1
287 1 13 ILE HA 1 13 ILE HG12 . . 3.310 2.650 2.509 2.763 . 0 0 "[ . 1 . 2]" 1
288 1 13 ILE HA 1 13 ILE HG13 . . 3.320 3.123 2.932 3.303 . 0 0 "[ . 1 . 2]" 1
289 1 13 ILE HA 1 13 ILE MG . . 3.070 2.262 2.209 2.323 . 0 0 "[ . 1 . 2]" 1
290 1 13 ILE HA 1 16 GLU H . . 3.790 3.283 3.131 3.503 . 0 0 "[ . 1 . 2]" 1
291 1 13 ILE HA 1 16 GLU HB2 . . 4.040 2.650 2.419 2.824 . 0 0 "[ . 1 . 2]" 1
292 1 13 ILE HA 1 16 GLU HB3 . . 4.400 4.008 3.776 4.105 . 0 0 "[ . 1 . 2]" 1
293 1 13 ILE HA 1 16 GLU HG2 . . 5.040 4.773 3.588 5.054 0.014 15 0 "[ . 1 . 2]" 1
294 1 13 ILE HA 1 16 GLU HG3 . . 4.960 3.766 3.458 4.999 0.039 1 0 "[ . 1 . 2]" 1
295 1 13 ILE HA 1 17 LYS H . . 5.080 4.155 3.980 4.344 . 0 0 "[ . 1 . 2]" 1
296 1 13 ILE HB 1 13 ILE MD . . 3.360 2.394 2.278 2.474 . 0 0 "[ . 1 . 2]" 1
297 1 13 ILE HB 1 13 ILE HG13 . . 2.580 2.520 2.441 2.611 0.031 4 0 "[ . 1 . 2]" 1
298 1 13 ILE HB 1 14 LEU H . . 3.320 2.959 2.853 3.007 . 0 0 "[ . 1 . 2]" 1
299 1 13 ILE MD 1 62 LEU HA . . 3.070 3.034 2.814 3.095 0.025 16 0 "[ . 1 . 2]" 1
300 1 13 ILE MD 1 64 GLU H . . 5.500 5.206 4.854 5.510 0.010 6 0 "[ . 1 . 2]" 1
301 1 13 ILE MD 1 65 GLU H . . 5.050 4.541 4.314 5.047 . 0 0 "[ . 1 . 2]" 1
302 1 13 ILE MD 1 65 GLU QG . . 3.550 2.083 1.960 2.303 . 0 0 "[ . 1 . 2]" 1
303 1 13 ILE HG13 1 13 ILE MG . . 3.410 3.237 3.202 3.258 . 0 0 "[ . 1 . 2]" 1
304 1 13 ILE MG 1 14 LEU H . . 3.810 3.793 3.696 3.834 0.024 1 0 "[ . 1 . 2]" 1
305 1 13 ILE MG 1 16 GLU H . . 4.820 4.157 4.022 4.392 . 0 0 "[ . 1 . 2]" 1
306 1 13 ILE MG 1 16 GLU HG2 . . 5.390 5.290 4.359 5.410 0.020 2 0 "[ . 1 . 2]" 1
307 1 13 ILE MG 1 17 LYS H . . 4.770 3.573 3.462 3.802 . 0 0 "[ . 1 . 2]" 1
308 1 13 ILE MG 1 17 LYS HE2 . . 3.910 2.650 2.012 3.852 . 0 0 "[ . 1 . 2]" 1
309 1 13 ILE MG 1 17 LYS HG2 . . 5.270 2.320 2.115 2.865 . 0 0 "[ . 1 . 2]" 1
310 1 13 ILE MG 1 17 LYS HG3 . . 4.430 3.263 3.029 3.552 . 0 0 "[ . 1 . 2]" 1
311 1 13 ILE MG 1 61 ALA HA . . 4.180 3.421 3.084 3.731 . 0 0 "[ . 1 . 2]" 1
312 1 13 ILE MG 1 61 ALA MB . . 3.840 2.870 2.586 3.333 . 0 0 "[ . 1 . 2]" 1
313 1 13 ILE MG 1 62 LEU HA . . 3.960 3.607 3.014 3.898 . 0 0 "[ . 1 . 2]" 1
314 1 14 LEU H 1 14 LEU HB2 . . 3.150 2.374 2.316 2.446 . 0 0 "[ . 1 . 2]" 1
315 1 14 LEU H 1 14 LEU HB3 . . 3.720 3.573 3.543 3.609 . 0 0 "[ . 1 . 2]" 1
316 1 14 LEU H 1 14 LEU MD1 . . 3.870 3.762 3.550 3.885 0.015 12 0 "[ . 1 . 2]" 1
317 1 14 LEU H 1 14 LEU MD2 . . 3.910 3.446 3.215 3.664 . 0 0 "[ . 1 . 2]" 1
318 1 14 LEU H 1 14 LEU HG . . 3.160 2.506 2.416 2.589 . 0 0 "[ . 1 . 2]" 1
319 1 14 LEU H 1 15 LYS H . . 3.380 2.902 2.815 3.010 . 0 0 "[ . 1 . 2]" 1
320 1 14 LEU H 1 16 GLU H . . 4.710 4.326 4.133 4.513 . 0 0 "[ . 1 . 2]" 1
321 1 14 LEU HA 1 14 LEU MD2 . . 3.100 2.058 2.036 2.075 . 0 0 "[ . 1 . 2]" 1
322 1 14 LEU HA 1 16 GLU H . . 4.450 4.065 3.916 4.237 . 0 0 "[ . 1 . 2]" 1
323 1 14 LEU HA 1 17 LYS H . . 3.920 3.327 3.178 3.490 . 0 0 "[ . 1 . 2]" 1
324 1 14 LEU HA 1 17 LYS HB2 . . 3.580 3.160 2.923 3.361 . 0 0 "[ . 1 . 2]" 1
325 1 14 LEU HA 1 18 PHE H . . 4.360 3.718 3.482 3.956 . 0 0 "[ . 1 . 2]" 1
326 1 14 LEU HA 1 18 PHE QD . . 3.330 2.661 2.534 2.998 . 0 0 "[ . 1 . 2]" 1
327 1 14 LEU HA 1 18 PHE QE . . 4.080 3.768 3.532 4.040 . 0 0 "[ . 1 . 2]" 1
328 1 14 LEU HA 1 41 ILE MD . . 5.500 4.041 3.864 4.363 . 0 0 "[ . 1 . 2]" 1
329 1 14 LEU HA 1 58 VAL MG1 . . 5.070 4.912 4.688 5.079 0.009 2 0 "[ . 1 . 2]" 1
330 1 14 LEU HA 1 61 ALA MB . . 3.790 3.210 2.706 3.543 . 0 0 "[ . 1 . 2]" 1
331 1 14 LEU HB2 1 14 LEU MD1 . . 3.620 2.321 2.272 2.386 . 0 0 "[ . 1 . 2]" 1
332 1 14 LEU HB2 1 14 LEU MD2 . . 3.530 3.270 3.236 3.277 . 0 0 "[ . 1 . 2]" 1
333 1 14 LEU HB2 1 15 LYS H . . 3.230 2.827 2.743 2.904 . 0 0 "[ . 1 . 2]" 1
334 1 14 LEU HB2 1 18 PHE QD . . 5.100 4.875 4.683 5.043 . 0 0 "[ . 1 . 2]" 1
335 1 14 LEU HB2 1 26 VAL MG2 . . 3.680 3.699 3.599 3.728 0.048 10 0 "[ . 1 . 2]" 1
336 1 14 LEU HB2 1 41 ILE MD . . 5.260 4.524 4.353 4.843 . 0 0 "[ . 1 . 2]" 1
337 1 14 LEU HB3 1 15 LYS H . . 3.420 3.478 3.452 3.496 0.076 19 0 "[ . 1 . 2]" 1
338 1 14 LEU HB3 1 18 PHE QD . . 3.840 3.459 3.238 3.721 . 0 0 "[ . 1 . 2]" 1
339 1 14 LEU MD1 1 15 LYS H . . 5.270 4.717 4.671 4.763 . 0 0 "[ . 1 . 2]" 1
340 1 14 LEU MD1 1 39 ILE MG . . 2.400 2.129 2.031 2.303 . 0 0 "[ . 1 . 2]" 1
341 1 14 LEU MD2 1 15 LYS H . . 5.320 4.756 4.706 4.795 . 0 0 "[ . 1 . 2]" 1
342 1 14 LEU MD2 1 17 LYS H . . 5.350 4.634 4.479 4.808 . 0 0 "[ . 1 . 2]" 1
343 1 14 LEU MD2 1 18 PHE H . . 4.970 4.710 4.531 4.970 0.000 18 0 "[ . 1 . 2]" 1
344 1 14 LEU MD2 1 18 PHE QD . . 3.340 2.504 2.314 2.790 . 0 0 "[ . 1 . 2]" 1
345 1 14 LEU MD2 1 18 PHE QE . . 3.210 2.587 2.411 2.841 . 0 0 "[ . 1 . 2]" 1
346 1 14 LEU MD2 1 18 PHE HZ . . 4.920 4.547 4.368 4.831 . 0 0 "[ . 1 . 2]" 1
347 1 14 LEU MD2 1 41 ILE MD . . 3.750 2.043 1.976 2.166 . 0 0 "[ . 1 . 2]" 1
348 1 14 LEU MD2 1 58 VAL MG1 . . 3.560 2.281 2.111 2.456 . 0 0 "[ . 1 . 2]" 1
349 1 14 LEU MD2 1 61 ALA MB . . 3.700 2.245 2.032 2.568 . 0 0 "[ . 1 . 2]" 1
350 1 14 LEU HG 1 15 LYS H . . 4.660 4.687 4.652 4.710 0.050 1 0 "[ . 1 . 2]" 1
351 1 14 LEU HG 1 41 ILE MD . . 5.500 4.292 4.048 4.589 . 0 0 "[ . 1 . 2]" 1
352 1 15 LYS H 1 15 LYS HB2 . . 2.770 2.760 2.690 2.809 0.039 1 0 "[ . 1 . 2]" 1
353 1 15 LYS H 1 15 LYS QB . . 3.260 2.685 2.627 2.726 . 0 0 "[ . 1 . 2]" 1
354 1 15 LYS H 1 15 LYS HD2 . . 4.720 4.546 4.409 4.713 . 0 0 "[ . 1 . 2]" 1
355 1 15 LYS H 1 15 LYS HD3 . . 4.780 4.723 4.663 4.791 0.011 15 0 "[ . 1 . 2]" 1
356 1 15 LYS H 1 15 LYS QE . . 3.990 4.009 3.905 4.059 0.069 8 0 "[ . 1 . 2]" 1
357 1 15 LYS H 1 15 LYS HG2 . . 3.500 2.570 2.439 2.725 . 0 0 "[ . 1 . 2]" 1
358 1 15 LYS H 1 15 LYS HG3 . . 4.330 2.235 2.080 2.438 . 0 0 "[ . 1 . 2]" 1
359 1 15 LYS H 1 16 GLU H . . 3.230 2.855 2.777 2.930 . 0 0 "[ . 1 . 2]" 1
360 1 15 LYS H 1 16 GLU HA . . 5.360 5.419 5.394 5.449 0.089 8 0 "[ . 1 . 2]" 1
361 1 15 LYS H 1 17 LYS H . . 4.840 4.430 4.290 4.554 . 0 0 "[ . 1 . 2]" 1
362 1 15 LYS H 1 18 PHE H . . 5.060 4.762 4.703 4.845 . 0 0 "[ . 1 . 2]" 1
363 1 15 LYS H 1 24 ILE MG . . 4.890 4.635 4.359 4.899 0.009 10 0 "[ . 1 . 2]" 1
364 1 15 LYS HA 1 15 LYS QB . . 2.710 2.296 2.263 2.331 . 0 0 "[ . 1 . 2]" 1
365 1 15 LYS HA 1 15 LYS HB3 . . 2.750 2.379 2.341 2.420 . 0 0 "[ . 1 . 2]" 1
366 1 15 LYS HA 1 15 LYS HD2 . . 4.500 4.488 4.372 4.539 0.039 14 0 "[ . 1 . 2]" 1
367 1 15 LYS HA 1 15 LYS HG2 . . 3.220 2.375 2.255 2.576 . 0 0 "[ . 1 . 2]" 1
368 1 15 LYS HA 1 15 LYS HG3 . . 3.360 3.426 3.403 3.460 0.100 3 0 "[ . 1 . 2]" 1
369 1 15 LYS HA 1 17 LYS H . . 4.850 4.814 4.477 4.878 0.028 1 0 "[ . 1 . 2]" 1
370 1 15 LYS HA 1 18 PHE H . . 4.070 3.806 3.425 3.964 . 0 0 "[ . 1 . 2]" 1
371 1 15 LYS HA 1 18 PHE HB2 . . 4.580 4.250 3.755 4.513 . 0 0 "[ . 1 . 2]" 1
372 1 15 LYS HA 1 18 PHE QD . . 5.360 5.189 4.816 5.391 0.031 4 0 "[ . 1 . 2]" 1
373 1 15 LYS HA 1 24 ILE MD . . 3.290 2.512 2.154 2.919 . 0 0 "[ . 1 . 2]" 1
374 1 15 LYS QB 1 16 GLU H . . 3.660 2.978 2.616 3.289 . 0 0 "[ . 1 . 2]" 1
375 1 15 LYS QB 1 24 ILE MD . . 4.460 3.355 3.120 3.677 . 0 0 "[ . 1 . 2]" 1
376 1 15 LYS HB2 1 16 GLU H . . 3.390 3.062 2.661 3.414 0.024 15 0 "[ . 1 . 2]" 1
377 1 15 LYS HB2 1 16 GLU HA . . 4.940 4.406 4.111 4.777 . 0 0 "[ . 1 . 2]" 1
378 1 15 LYS HD2 1 15 LYS HG3 . . 2.720 2.505 2.437 2.550 . 0 0 "[ . 1 . 2]" 1
379 1 15 LYS HD2 1 24 ILE MD . . 5.500 4.208 3.565 4.778 . 0 0 "[ . 1 . 2]" 1
380 1 15 LYS HD3 1 24 ILE MD . . 4.920 2.913 2.181 3.705 . 0 0 "[ . 1 . 2]" 1
381 1 15 LYS QE 1 15 LYS HG2 . . 3.370 2.375 2.208 2.677 . 0 0 "[ . 1 . 2]" 1
382 1 15 LYS HG2 1 16 GLU H . . 4.640 4.723 4.685 4.773 0.133 15 0 "[ . 1 . 2]" 1
383 1 15 LYS HG3 1 16 GLU H . . 5.500 4.366 3.920 4.647 . 0 0 "[ . 1 . 2]" 1
384 1 15 LYS HG3 1 24 ILE MD . . 4.460 3.842 3.593 4.271 . 0 0 "[ . 1 . 2]" 1
385 1 16 GLU H 1 16 GLU HB2 . . 2.900 1.864 1.752 1.914 . 0 0 "[ . 1 . 2]" 1
386 1 16 GLU H 1 16 GLU HB3 . . 3.590 3.180 3.101 3.212 . 0 0 "[ . 1 . 2]" 1
387 1 16 GLU H 1 16 GLU HG2 . . 3.690 3.657 3.436 3.764 0.074 15 0 "[ . 1 . 2]" 1
388 1 16 GLU H 1 16 GLU HG3 . . 3.990 2.739 2.508 4.027 0.037 1 0 "[ . 1 . 2]" 1
389 1 16 GLU H 1 17 LYS H . . 3.190 2.441 2.343 2.516 . 0 0 "[ . 1 . 2]" 1
390 1 16 GLU H 1 18 PHE H . . 4.290 3.605 3.397 3.771 . 0 0 "[ . 1 . 2]" 1
391 1 16 GLU HA 1 16 GLU HB3 . . 2.720 2.621 2.556 2.713 . 0 0 "[ . 1 . 2]" 1
392 1 16 GLU HA 1 16 GLU HG2 . . 3.690 2.504 2.176 3.714 0.024 1 0 "[ . 1 . 2]" 1
393 1 16 GLU HA 1 16 GLU HG3 . . 2.960 2.950 2.849 3.010 0.050 6 0 "[ . 1 . 2]" 1
394 1 16 GLU HA 1 18 PHE H . . 4.510 4.145 4.000 4.424 . 0 0 "[ . 1 . 2]" 1
395 1 16 GLU HA 1 19 PRO HD2 . . 4.130 4.255 4.224 4.289 0.159 7 0 "[ . 1 . 2]" 1
396 1 16 GLU HA 1 19 PRO HD3 . . 5.150 2.767 2.692 2.907 . 0 0 "[ . 1 . 2]" 1
397 1 16 GLU HB2 1 17 LYS H . . 3.550 2.594 2.466 2.740 . 0 0 "[ . 1 . 2]" 1
398 1 16 GLU HB2 1 17 LYS HG2 . . 4.290 3.866 3.696 4.098 . 0 0 "[ . 1 . 2]" 1
399 1 16 GLU HB2 1 18 PHE H . . 5.120 4.620 4.491 4.852 . 0 0 "[ . 1 . 2]" 1
400 1 16 GLU HB3 1 16 GLU HG2 . . 2.690 2.456 2.354 2.608 . 0 0 "[ . 1 . 2]" 1
401 1 16 GLU HB3 1 17 LYS H . . 3.820 3.231 2.967 3.380 . 0 0 "[ . 1 . 2]" 1
402 1 16 GLU HB3 1 17 LYS HA . . 4.500 4.156 3.834 4.365 . 0 0 "[ . 1 . 2]" 1
403 1 16 GLU HB3 1 18 PHE H . . 5.500 5.116 4.965 5.155 . 0 0 "[ . 1 . 2]" 1
404 1 16 GLU HG2 1 17 LYS H . . 5.500 4.973 4.766 5.057 . 0 0 "[ . 1 . 2]" 1
405 1 16 GLU HG3 1 17 LYS H . . 4.810 4.655 4.487 4.904 0.094 1 0 "[ . 1 . 2]" 1
406 1 17 LYS H 1 17 LYS HB2 . . 3.220 2.659 2.473 2.791 . 0 0 "[ . 1 . 2]" 1
407 1 17 LYS H 1 17 LYS HB3 . . 3.620 3.672 3.658 3.689 0.069 1 0 "[ . 1 . 2]" 1
408 1 17 LYS H 1 17 LYS HD2 . . 5.040 4.748 4.513 5.053 0.013 14 0 "[ . 1 . 2]" 1
409 1 17 LYS H 1 17 LYS HE2 . . 5.500 4.334 3.765 5.286 . 0 0 "[ . 1 . 2]" 1
410 1 17 LYS H 1 17 LYS HG2 . . 3.520 2.544 2.361 2.715 . 0 0 "[ . 1 . 2]" 1
411 1 17 LYS H 1 17 LYS HG3 . . 4.120 3.929 3.774 4.028 . 0 0 "[ . 1 . 2]" 1
412 1 17 LYS H 1 18 PHE H . . 3.130 2.475 2.364 2.607 . 0 0 "[ . 1 . 2]" 1
413 1 17 LYS H 1 18 PHE HA . . 5.500 5.124 5.025 5.244 . 0 0 "[ . 1 . 2]" 1
414 1 17 LYS H 1 18 PHE QD . . 4.780 4.107 3.919 4.283 . 0 0 "[ . 1 . 2]" 1
415 1 17 LYS H 1 19 PRO HD3 . . 5.270 3.970 3.843 4.128 . 0 0 "[ . 1 . 2]" 1
416 1 17 LYS HA 1 17 LYS HD2 . . 3.270 3.140 2.922 3.289 0.019 19 0 "[ . 1 . 2]" 1
417 1 17 LYS HA 1 17 LYS HG2 . . 3.530 3.300 2.984 3.413 . 0 0 "[ . 1 . 2]" 1
418 1 17 LYS HA 1 17 LYS HG3 . . 4.010 3.774 3.717 3.819 . 0 0 "[ . 1 . 2]" 1
419 1 17 LYS HA 1 18 PHE HA . . 5.120 4.455 4.374 4.539 . 0 0 "[ . 1 . 2]" 1
420 1 17 LYS HA 1 19 PRO HD2 . . 5.160 3.749 3.529 3.884 . 0 0 "[ . 1 . 2]" 1
421 1 17 LYS HA 1 19 PRO HD3 . . 4.120 4.000 3.908 4.119 . 0 0 "[ . 1 . 2]" 1
422 1 17 LYS HB2 1 18 PHE H . . 3.760 3.151 3.021 3.282 . 0 0 "[ . 1 . 2]" 1
423 1 17 LYS HB2 1 18 PHE QD . . 4.770 2.804 2.641 2.911 . 0 0 "[ . 1 . 2]" 1
424 1 17 LYS HB2 1 18 PHE QE . . 4.140 2.838 2.687 2.963 . 0 0 "[ . 1 . 2]" 1
425 1 17 LYS HB2 1 18 PHE HZ . . 5.250 4.324 4.115 4.544 . 0 0 "[ . 1 . 2]" 1
426 1 17 LYS HB2 1 61 ALA H . . 5.500 5.478 5.285 5.537 0.037 3 0 "[ . 1 . 2]" 1
427 1 17 LYS HB2 1 61 ALA MB . . 2.950 2.668 2.535 2.832 . 0 0 "[ . 1 . 2]" 1
428 1 17 LYS HB3 1 17 LYS HD3 . . 2.860 2.941 2.904 2.986 0.126 17 0 "[ . 1 . 2]" 1
429 1 17 LYS HB3 1 18 PHE H . . 4.070 4.056 3.957 4.099 0.029 13 0 "[ . 1 . 2]" 1
430 1 17 LYS HB3 1 18 PHE QD . . 4.020 3.985 3.735 4.041 0.021 8 0 "[ . 1 . 2]" 1
431 1 17 LYS HB3 1 18 PHE QE . . 4.460 3.557 3.130 3.890 . 0 0 "[ . 1 . 2]" 1
432 1 17 LYS HB3 1 18 PHE HZ . . 5.500 4.082 3.608 4.702 . 0 0 "[ . 1 . 2]" 1
433 1 17 LYS HE2 1 17 LYS HG2 . . 3.640 2.490 2.283 3.662 0.022 9 0 "[ . 1 . 2]" 1
434 1 17 LYS HE2 1 17 LYS HG3 . . 4.090 3.205 2.975 3.873 . 0 0 "[ . 1 . 2]" 1
435 1 17 LYS HE2 1 61 ALA HA . . 4.750 4.002 3.506 4.628 . 0 0 "[ . 1 . 2]" 1
436 1 17 LYS HG2 1 18 PHE H . . 4.710 4.559 4.361 4.714 0.004 14 0 "[ . 1 . 2]" 1
437 1 17 LYS HG2 1 18 PHE QD . . 5.130 4.914 4.575 5.141 0.011 14 0 "[ . 1 . 2]" 1
438 1 17 LYS HG2 1 18 PHE QE . . 4.730 4.773 4.757 4.792 0.062 13 0 "[ . 1 . 2]" 1
439 1 17 LYS HG2 1 61 ALA HA . . 3.310 3.335 3.238 3.365 0.055 2 0 "[ . 1 . 2]" 1
440 1 17 LYS HG3 1 18 PHE QE . . 4.920 4.043 3.843 4.184 . 0 0 "[ . 1 . 2]" 1
441 1 17 LYS HG3 1 18 PHE HZ . . 5.500 5.130 4.810 5.510 0.010 3 0 "[ . 1 . 2]" 1
442 1 17 LYS HG3 1 61 ALA HA . . 3.520 2.102 1.998 2.199 . 0 0 "[ . 1 . 2]" 1
443 1 18 PHE H 1 18 PHE HB2 . . 3.520 2.818 2.748 2.904 . 0 0 "[ . 1 . 2]" 1
444 1 18 PHE H 1 18 PHE QD . . 3.620 3.008 2.904 3.094 . 0 0 "[ . 1 . 2]" 1
445 1 18 PHE H 1 18 PHE QE . . 5.360 4.781 4.640 4.887 . 0 0 "[ . 1 . 2]" 1
446 1 18 PHE H 1 19 PRO HD2 . . 4.540 3.292 3.212 3.346 . 0 0 "[ . 1 . 2]" 1
447 1 18 PHE H 1 19 PRO HD3 . . 3.720 2.823 2.653 2.926 . 0 0 "[ . 1 . 2]" 1
448 1 18 PHE HA 1 18 PHE QD . . 3.490 2.892 2.702 3.031 . 0 0 "[ . 1 . 2]" 1
449 1 18 PHE HA 1 18 PHE QE . . 5.040 4.736 4.584 4.895 . 0 0 "[ . 1 . 2]" 1
450 1 18 PHE HA 1 19 PRO HD2 . . 3.190 2.411 2.385 2.458 . 0 0 "[ . 1 . 2]" 1
451 1 18 PHE HA 1 19 PRO HD3 . . 3.270 3.396 3.368 3.419 0.149 7 0 "[ . 1 . 2]" 1
452 1 18 PHE HA 1 19 PRO HG3 . . 4.910 4.938 4.913 4.965 0.055 19 0 "[ . 1 . 2]" 1
453 1 18 PHE HA 1 20 ARG H . . 4.590 3.155 2.851 3.361 . 0 0 "[ . 1 . 2]" 1
454 1 18 PHE HA 1 21 ALA H . . 5.350 3.891 3.584 4.043 . 0 0 "[ . 1 . 2]" 1
455 1 18 PHE HA 1 21 ALA MB . . 4.970 3.935 3.687 4.152 . 0 0 "[ . 1 . 2]" 1
456 1 18 PHE HB2 1 21 ALA H . . 4.610 4.392 4.248 4.588 . 0 0 "[ . 1 . 2]" 1
457 1 18 PHE HB2 1 21 ALA MB . . 3.690 3.017 2.817 3.165 . 0 0 "[ . 1 . 2]" 1
458 1 18 PHE HB2 1 24 ILE MG . . 4.530 2.568 2.206 2.901 . 0 0 "[ . 1 . 2]" 1
459 1 18 PHE HB2 1 41 ILE MD . . 4.170 3.361 3.102 3.543 . 0 0 "[ . 1 . 2]" 1
460 1 18 PHE HB2 1 41 ILE MG . . 5.500 3.187 2.984 3.475 . 0 0 "[ . 1 . 2]" 1
461 1 18 PHE HB3 1 21 ALA H . . 4.130 3.407 3.279 3.534 . 0 0 "[ . 1 . 2]" 1
462 1 18 PHE HB3 1 21 ALA MB . . 3.450 2.183 2.043 2.378 . 0 0 "[ . 1 . 2]" 1
463 1 18 PHE HB3 1 24 ILE MG . . 4.450 3.363 3.004 3.645 . 0 0 "[ . 1 . 2]" 1
464 1 18 PHE HB3 1 41 ILE MD . . 4.600 4.022 3.795 4.314 . 0 0 "[ . 1 . 2]" 1
465 1 18 PHE HB3 1 41 ILE MG . . 5.160 2.992 2.760 3.168 . 0 0 "[ . 1 . 2]" 1
466 1 18 PHE QD 1 19 PRO HD2 . . 5.290 4.869 4.698 4.991 . 0 0 "[ . 1 . 2]" 1
467 1 18 PHE QD 1 21 ALA H . . 4.990 4.969 4.686 5.017 0.027 16 0 "[ . 1 . 2]" 1
468 1 18 PHE QD 1 21 ALA MB . . 4.250 3.833 3.412 4.060 . 0 0 "[ . 1 . 2]" 1
469 1 18 PHE QD 1 41 ILE MD . . 3.910 2.769 2.580 2.985 . 0 0 "[ . 1 . 2]" 1
470 1 18 PHE QD 1 46 PHE HZ . . 4.780 3.895 3.678 4.143 . 0 0 "[ . 1 . 2]" 1
471 1 18 PHE QD 1 57 MET HB2 . . 5.500 5.430 5.296 5.515 0.015 9 0 "[ . 1 . 2]" 1
472 1 18 PHE QD 1 57 MET ME . . 3.850 3.969 3.842 4.108 0.258 19 0 "[ . 1 . 2]" 1
473 1 18 PHE QD 1 58 VAL HA . . 4.460 4.497 4.480 4.511 0.051 11 0 "[ . 1 . 2]" 1
474 1 18 PHE QD 1 58 VAL MG2 . . 4.160 4.274 4.089 4.460 0.300 10 0 "[ . 1 . 2]" 1
475 1 18 PHE QE 1 41 ILE MD . . 4.330 3.090 2.907 3.218 . 0 0 "[ . 1 . 2]" 1
476 1 18 PHE QE 1 41 ILE MG . . 4.530 3.948 3.745 4.084 . 0 0 "[ . 1 . 2]" 1
477 1 18 PHE QE 1 45 GLU HG2 . . 5.260 4.485 4.159 4.841 . 0 0 "[ . 1 . 2]" 1
478 1 18 PHE QE 1 45 GLU HG3 . . 4.970 3.912 3.437 4.300 . 0 0 "[ . 1 . 2]" 1
479 1 18 PHE QE 1 46 PHE QD . . 5.090 4.522 4.318 4.742 . 0 0 "[ . 1 . 2]" 1
480 1 18 PHE QE 1 46 PHE QE . . 3.780 3.086 2.819 3.326 . 0 0 "[ . 1 . 2]" 1
481 1 18 PHE QE 1 46 PHE HZ . . 4.240 2.751 2.590 2.961 . 0 0 "[ . 1 . 2]" 1
482 1 18 PHE QE 1 57 MET HA . . 5.330 4.952 4.852 5.029 . 0 0 "[ . 1 . 2]" 1
483 1 18 PHE QE 1 57 MET HB2 . . 3.980 3.206 3.020 3.340 . 0 0 "[ . 1 . 2]" 1
484 1 18 PHE QE 1 57 MET HB3 . . 3.480 2.991 2.766 3.239 . 0 0 "[ . 1 . 2]" 1
485 1 18 PHE QE 1 57 MET ME . . 3.620 2.269 2.113 2.421 . 0 0 "[ . 1 . 2]" 1
486 1 18 PHE QE 1 58 VAL H . . 4.900 4.332 4.219 4.468 . 0 0 "[ . 1 . 2]" 1
487 1 18 PHE QE 1 58 VAL HA . . 3.280 2.287 2.245 2.328 . 0 0 "[ . 1 . 2]" 1
488 1 18 PHE QE 1 58 VAL HB . . 4.900 4.944 4.927 4.964 0.064 2 0 "[ . 1 . 2]" 1
489 1 18 PHE QE 1 58 VAL MG1 . . 4.330 3.007 2.924 3.093 . 0 0 "[ . 1 . 2]" 1
490 1 18 PHE QE 1 58 VAL MG2 . . 3.800 3.195 3.074 3.311 . 0 0 "[ . 1 . 2]" 1
491 1 18 PHE QE 1 61 ALA H . . 5.020 4.426 4.326 4.542 . 0 0 "[ . 1 . 2]" 1
492 1 18 PHE QE 1 61 ALA MB . . 3.190 2.330 2.201 2.463 . 0 0 "[ . 1 . 2]" 1
493 1 18 PHE QE 1 76 THR MG . . 5.500 4.922 4.750 5.121 . 0 0 "[ . 1 . 2]" 1
494 1 18 PHE HZ 1 41 ILE MD . . 5.160 3.982 3.778 4.108 . 0 0 "[ . 1 . 2]" 1
495 1 18 PHE HZ 1 41 ILE MG . . 5.500 4.802 4.448 5.003 . 0 0 "[ . 1 . 2]" 1
496 1 18 PHE HZ 1 46 PHE QE . . 4.880 3.933 3.734 4.158 . 0 0 "[ . 1 . 2]" 1
497 1 18 PHE HZ 1 46 PHE HZ . . 4.710 3.308 2.885 3.591 . 0 0 "[ . 1 . 2]" 1
498 1 18 PHE HZ 1 57 MET H . . 5.500 4.909 4.760 5.165 . 0 0 "[ . 1 . 2]" 1
499 1 18 PHE HZ 1 57 MET HA . . 4.850 4.007 3.901 4.093 . 0 0 "[ . 1 . 2]" 1
500 1 18 PHE HZ 1 57 MET HB2 . . 3.800 2.772 2.523 2.990 . 0 0 "[ . 1 . 2]" 1
501 1 18 PHE HZ 1 57 MET HB3 . . 3.630 2.575 2.383 2.917 . 0 0 "[ . 1 . 2]" 1
502 1 18 PHE HZ 1 57 MET ME . . 4.520 3.719 3.440 3.881 . 0 0 "[ . 1 . 2]" 1
503 1 18 PHE HZ 1 57 MET HG3 . . 5.230 5.032 4.690 5.241 0.011 4 0 "[ . 1 . 2]" 1
504 1 18 PHE HZ 1 58 VAL H . . 5.010 3.327 3.172 3.543 . 0 0 "[ . 1 . 2]" 1
505 1 18 PHE HZ 1 58 VAL HA . . 3.180 2.671 2.502 2.902 . 0 0 "[ . 1 . 2]" 1
506 1 18 PHE HZ 1 58 VAL MG1 . . 4.640 3.991 3.844 4.172 . 0 0 "[ . 1 . 2]" 1
507 1 18 PHE HZ 1 58 VAL MG2 . . 3.790 2.839 2.665 2.949 . 0 0 "[ . 1 . 2]" 1
508 1 18 PHE HZ 1 61 ALA MB . . 3.750 3.526 3.203 3.755 0.005 18 0 "[ . 1 . 2]" 1
509 1 19 PRO HA 1 20 ARG HA . . 4.620 4.677 4.651 4.737 0.117 12 0 "[ . 1 . 2]" 1
510 1 19 PRO HA 1 21 ALA H . . 4.320 3.727 3.480 4.073 . 0 0 "[ . 1 . 2]" 1
511 1 19 PRO HA 1 21 ALA MB . . 5.400 4.282 4.054 4.561 . 0 0 "[ . 1 . 2]" 1
512 1 19 PRO HD2 1 20 ARG H . . 4.360 3.232 2.938 3.445 . 0 0 "[ . 1 . 2]" 1
513 1 19 PRO HD3 1 20 ARG H . . 4.400 4.135 3.939 4.269 . 0 0 "[ . 1 . 2]" 1
514 1 19 PRO HG2 1 20 ARG H . . 3.950 2.786 2.683 2.875 . 0 0 "[ . 1 . 2]" 1
515 1 19 PRO HG3 1 20 ARG H . . 4.310 4.320 4.176 4.365 0.055 6 0 "[ . 1 . 2]" 1
516 1 20 ARG H 1 20 ARG HB2 . . 3.860 2.466 2.274 2.615 . 0 0 "[ . 1 . 2]" 1
517 1 20 ARG H 1 20 ARG HB3 . . 3.590 3.616 3.557 3.657 0.067 4 0 "[ . 1 . 2]" 1
518 1 20 ARG H 1 20 ARG HD3 . . 5.410 3.946 2.305 5.042 . 0 0 "[ . 1 . 2]" 1
519 1 20 ARG H 1 20 ARG HG2 . . 4.060 2.811 2.279 4.077 0.017 8 0 "[ . 1 . 2]" 1
520 1 20 ARG H 1 20 ARG HG3 . . 3.790 3.511 2.392 3.846 0.056 8 0 "[ . 1 . 2]" 1
521 1 20 ARG H 1 21 ALA H . . 3.090 2.629 2.374 2.756 . 0 0 "[ . 1 . 2]" 1
522 1 20 ARG HA 1 20 ARG HD2 . . 4.300 3.461 2.273 4.391 0.091 10 0 "[ . 1 . 2]" 1
523 1 20 ARG HA 1 20 ARG HD3 . . 4.090 2.974 2.149 4.256 0.166 12 0 "[ . 1 . 2]" 1
524 1 20 ARG HA 1 20 ARG HG2 . . 3.430 3.080 2.138 3.516 0.086 18 0 "[ . 1 . 2]" 1
525 1 20 ARG HA 1 20 ARG HG3 . . 3.780 3.468 2.195 3.833 0.053 19 0 "[ . 1 . 2]" 1
526 1 20 ARG HB2 1 20 ARG HD2 . . 4.220 3.658 2.365 4.244 0.024 19 0 "[ . 1 . 2]" 1
527 1 20 ARG HB2 1 20 ARG HD3 . . 3.860 3.670 3.082 4.053 0.193 7 0 "[ . 1 . 2]" 1
528 1 20 ARG HB2 1 21 ALA H . . 4.870 3.490 3.270 3.691 . 0 0 "[ . 1 . 2]" 1
529 1 20 ARG HB2 1 21 ALA MB . . 4.760 4.635 4.269 4.782 0.022 8 0 "[ . 1 . 2]" 1
530 1 20 ARG HB3 1 21 ALA H . . 4.320 4.208 4.004 4.347 0.027 17 0 "[ . 1 . 2]" 1
531 1 21 ALA H 1 21 ALA MB . . 3.010 2.180 2.116 2.240 . 0 0 "[ . 1 . 2]" 1
532 1 21 ALA H 1 22 THR H . . 4.860 4.631 4.574 4.674 . 0 0 "[ . 1 . 2]" 1
533 1 21 ALA H 1 22 THR MG . . 5.500 5.421 5.145 5.545 0.045 20 0 "[ . 1 . 2]" 1
534 1 21 ALA H 1 24 ILE MG . . 5.110 4.394 4.076 4.622 . 0 0 "[ . 1 . 2]" 1
535 1 21 ALA H 1 41 ILE MG . . 5.500 4.904 4.674 5.096 . 0 0 "[ . 1 . 2]" 1
536 1 21 ALA H 1 43 SER HA . . 5.270 4.720 4.372 4.994 . 0 0 "[ . 1 . 2]" 1
537 1 21 ALA H 1 43 SER HB2 . . 5.470 3.986 3.667 4.177 . 0 0 "[ . 1 . 2]" 1
538 1 21 ALA HA 1 22 THR H . . 2.920 2.194 2.140 2.253 . 0 0 "[ . 1 . 2]" 1
539 1 21 ALA HA 1 23 ALA H . . 3.880 3.891 3.775 3.945 0.065 4 0 "[ . 1 . 2]" 1
540 1 21 ALA HA 1 41 ILE MG . . 5.250 4.141 4.009 4.308 . 0 0 "[ . 1 . 2]" 1
541 1 21 ALA HA 1 42 GLU H . . 5.500 4.271 4.132 4.422 . 0 0 "[ . 1 . 2]" 1
542 1 21 ALA HA 1 43 SER H . . 5.330 4.556 4.362 4.729 . 0 0 "[ . 1 . 2]" 1
543 1 21 ALA HA 1 43 SER HA . . 3.200 2.246 1.991 2.477 . 0 0 "[ . 1 . 2]" 1
544 1 21 ALA HA 1 43 SER HB2 . . 3.320 2.489 2.377 2.633 . 0 0 "[ . 1 . 2]" 1
545 1 21 ALA HA 1 43 SER HB3 . . 3.980 3.929 3.818 3.995 0.015 9 0 "[ . 1 . 2]" 1
546 1 21 ALA HA 1 44 GLU H . . 4.320 3.837 3.549 4.130 . 0 0 "[ . 1 . 2]" 1
547 1 21 ALA MB 1 22 THR H . . 3.620 2.680 2.523 2.787 . 0 0 "[ . 1 . 2]" 1
548 1 21 ALA MB 1 23 ALA H . . 3.710 2.804 2.442 2.974 . 0 0 "[ . 1 . 2]" 1
549 1 21 ALA MB 1 24 ILE H . . 5.500 4.496 4.252 4.655 . 0 0 "[ . 1 . 2]" 1
550 1 21 ALA MB 1 24 ILE MG . . 3.610 2.162 2.041 2.269 . 0 0 "[ . 1 . 2]" 1
551 1 21 ALA MB 1 42 GLU H . . 4.550 2.755 2.435 3.110 . 0 0 "[ . 1 . 2]" 1
552 1 21 ALA MB 1 43 SER HA . . 4.510 3.685 3.538 3.889 . 0 0 "[ . 1 . 2]" 1
553 1 21 ALA MB 1 43 SER HB2 . . 3.570 2.542 2.191 2.766 . 0 0 "[ . 1 . 2]" 1
554 1 21 ALA MB 1 43 SER HB3 . . 4.250 4.028 3.642 4.250 0.000 9 0 "[ . 1 . 2]" 1
555 1 21 ALA MB 1 44 GLU H . . 5.500 5.159 4.894 5.448 . 0 0 "[ . 1 . 2]" 1
556 1 22 THR H 1 22 THR HB . . 4.190 3.744 3.629 3.842 . 0 0 "[ . 1 . 2]" 1
557 1 22 THR H 1 22 THR MG . . 3.560 2.685 2.236 2.975 . 0 0 "[ . 1 . 2]" 1
558 1 22 THR H 1 23 ALA H . . 2.950 2.166 2.007 2.301 . 0 0 "[ . 1 . 2]" 1
559 1 22 THR H 1 42 GLU HB2 . . 4.920 4.988 4.943 5.014 0.094 19 0 "[ . 1 . 2]" 1
560 1 22 THR H 1 42 GLU HB3 . . 5.360 3.451 3.387 3.516 . 0 0 "[ . 1 . 2]" 1
561 1 22 THR H 1 43 SER H . . 5.200 4.546 4.449 4.635 . 0 0 "[ . 1 . 2]" 1
562 1 22 THR H 1 43 SER HA . . 3.580 2.879 2.775 2.967 . 0 0 "[ . 1 . 2]" 1
563 1 22 THR H 1 43 SER HB2 . . 4.210 3.966 3.872 4.025 . 0 0 "[ . 1 . 2]" 1
564 1 22 THR H 1 43 SER HB3 . . 5.220 5.274 5.223 5.318 0.098 16 0 "[ . 1 . 2]" 1
565 1 22 THR H 1 44 GLU H . . 4.760 4.695 4.399 4.799 0.039 20 0 "[ . 1 . 2]" 1
566 1 22 THR HA 1 22 THR HB . . 2.400 2.416 2.348 2.470 0.070 1 0 "[ . 1 . 2]" 1
567 1 22 THR HA 1 22 THR MG . . 2.680 2.391 2.276 2.537 . 0 0 "[ . 1 . 2]" 1
568 1 22 THR HA 1 23 ALA HA . . 4.930 4.426 4.148 4.618 . 0 0 "[ . 1 . 2]" 1
569 1 22 THR HB 1 23 ALA H . . 4.350 4.004 3.767 4.296 . 0 0 "[ . 1 . 2]" 1
570 1 22 THR MG 1 23 ALA H . . 4.740 4.101 3.783 4.345 . 0 0 "[ . 1 . 2]" 1
571 1 22 THR MG 1 43 SER HA . . 4.410 3.423 2.889 3.818 . 0 0 "[ . 1 . 2]" 1
572 1 22 THR MG 1 44 GLU H . . 5.360 3.905 3.490 4.251 . 0 0 "[ . 1 . 2]" 1
573 1 22 THR MG 1 79 PRO HB2 . . 4.250 3.675 2.922 4.260 0.010 7 0 "[ . 1 . 2]" 1
574 1 22 THR MG 1 79 PRO HD3 . . 4.970 3.702 3.086 4.079 . 0 0 "[ . 1 . 2]" 1
575 1 22 THR MG 1 79 PRO HG2 . . 3.690 3.606 3.332 3.728 0.038 4 0 "[ . 1 . 2]" 1
576 1 22 THR MG 1 79 PRO HG3 . . 4.220 2.329 2.083 2.580 . 0 0 "[ . 1 . 2]" 1
577 1 23 ALA H 1 23 ALA MB . . 3.380 2.560 2.418 2.721 . 0 0 "[ . 1 . 2]" 1
578 1 23 ALA H 1 24 ILE H . . 4.500 4.408 4.335 4.479 . 0 0 "[ . 1 . 2]" 1
579 1 23 ALA H 1 24 ILE HG12 . . 5.030 4.580 4.282 4.947 . 0 0 "[ . 1 . 2]" 1
580 1 23 ALA H 1 24 ILE MG . . 5.140 4.338 4.122 4.508 . 0 0 "[ . 1 . 2]" 1
581 1 23 ALA H 1 41 ILE HA . . 5.500 4.383 4.226 4.527 . 0 0 "[ . 1 . 2]" 1
582 1 23 ALA H 1 41 ILE MG . . 5.500 4.184 4.021 4.390 . 0 0 "[ . 1 . 2]" 1
583 1 23 ALA H 1 42 GLU H . . 3.810 2.751 2.646 2.890 . 0 0 "[ . 1 . 2]" 1
584 1 23 ALA H 1 42 GLU HB2 . . 3.790 3.862 3.824 3.894 0.104 4 0 "[ . 1 . 2]" 1
585 1 23 ALA H 1 42 GLU HB3 . . 4.470 2.287 2.209 2.366 . 0 0 "[ . 1 . 2]" 1
586 1 23 ALA H 1 43 SER HA . . 5.380 4.672 4.462 4.850 . 0 0 "[ . 1 . 2]" 1
587 1 23 ALA H 1 43 SER HB2 . . 5.190 5.064 4.914 5.191 0.001 4 0 "[ . 1 . 2]" 1
588 1 23 ALA HA 1 24 ILE H . . 2.690 2.202 2.152 2.248 . 0 0 "[ . 1 . 2]" 1
589 1 23 ALA HA 1 24 ILE HG12 . . 4.300 3.972 3.825 4.239 . 0 0 "[ . 1 . 2]" 1
590 1 23 ALA HA 1 24 ILE MG . . 5.370 4.686 4.590 4.802 . 0 0 "[ . 1 . 2]" 1
591 1 23 ALA HA 1 25 LYS QE . . 3.770 3.498 2.944 3.788 0.018 5 0 "[ . 1 . 2]" 1
592 1 23 ALA HA 1 42 GLU H . . 5.070 4.782 4.629 4.908 . 0 0 "[ . 1 . 2]" 1
593 1 23 ALA MB 1 24 ILE H . . 3.580 2.964 2.816 3.109 . 0 0 "[ . 1 . 2]" 1
594 1 23 ALA MB 1 24 ILE HA . . 4.920 3.898 3.768 3.989 . 0 0 "[ . 1 . 2]" 1
595 1 23 ALA MB 1 25 LYS H . . 5.500 4.493 4.254 4.698 . 0 0 "[ . 1 . 2]" 1
596 1 23 ALA MB 1 25 LYS QE . . 4.690 2.378 2.073 2.970 . 0 0 "[ . 1 . 2]" 1
597 1 23 ALA MB 1 41 ILE HA . . 4.740 3.322 3.050 3.600 . 0 0 "[ . 1 . 2]" 1
598 1 23 ALA MB 1 41 ILE MG . . 4.560 4.259 4.045 4.491 . 0 0 "[ . 1 . 2]" 1
599 1 23 ALA MB 1 42 GLU H . . 4.010 3.063 2.802 3.317 . 0 0 "[ . 1 . 2]" 1
600 1 23 ALA MB 1 42 GLU HA . . 5.190 4.351 4.164 4.503 . 0 0 "[ . 1 . 2]" 1
601 1 23 ALA MB 1 42 GLU HB2 . . 3.410 2.762 2.606 2.895 . 0 0 "[ . 1 . 2]" 1
602 1 23 ALA MB 1 42 GLU HB3 . . 4.640 2.281 2.159 2.380 . 0 0 "[ . 1 . 2]" 1
603 1 23 ALA MB 1 42 GLU HG2 . . 4.390 4.340 4.162 4.415 0.025 4 0 "[ . 1 . 2]" 1
604 1 24 ILE H 1 24 ILE HB . . 4.120 3.858 3.792 3.910 . 0 0 "[ . 1 . 2]" 1
605 1 24 ILE H 1 24 ILE HG12 . . 3.410 3.082 2.950 3.165 . 0 0 "[ . 1 . 2]" 1
606 1 24 ILE H 1 24 ILE HG13 . . 3.760 2.788 2.631 2.911 . 0 0 "[ . 1 . 2]" 1
607 1 24 ILE H 1 24 ILE MG . . 4.320 3.777 3.711 3.846 . 0 0 "[ . 1 . 2]" 1
608 1 24 ILE H 1 25 LYS H . . 4.770 3.852 3.665 4.025 . 0 0 "[ . 1 . 2]" 1
609 1 24 ILE H 1 25 LYS QG . . 5.460 4.208 3.881 5.032 . 0 0 "[ . 1 . 2]" 1
610 1 24 ILE HA 1 24 ILE HG12 . . 4.190 3.712 3.660 3.771 . 0 0 "[ . 1 . 2]" 1
611 1 24 ILE HA 1 24 ILE MG . . 3.220 2.179 2.155 2.204 . 0 0 "[ . 1 . 2]" 1
612 1 24 ILE HA 1 25 LYS H . . 2.740 2.128 2.072 2.175 . 0 0 "[ . 1 . 2]" 1
613 1 24 ILE HA 1 25 LYS QE . . 4.040 3.995 3.563 4.095 0.055 4 0 "[ . 1 . 2]" 1
614 1 24 ILE HA 1 39 ILE MG . . 5.500 4.544 4.335 4.772 . 0 0 "[ . 1 . 2]" 1
615 1 24 ILE HA 1 40 LYS H . . 4.560 4.594 4.574 4.610 0.050 9 0 "[ . 1 . 2]" 1
616 1 24 ILE HA 1 41 ILE HA . . 3.600 2.663 2.575 2.747 . 0 0 "[ . 1 . 2]" 1
617 1 24 ILE HA 1 41 ILE MD . . 5.130 3.980 3.807 4.189 . 0 0 "[ . 1 . 2]" 1
618 1 24 ILE HA 1 41 ILE HG12 . . 5.290 3.206 3.054 3.377 . 0 0 "[ . 1 . 2]" 1
619 1 24 ILE HA 1 42 GLU H . . 4.560 4.374 4.229 4.516 . 0 0 "[ . 1 . 2]" 1
620 1 24 ILE HG12 1 24 ILE MG . . 3.300 2.395 2.350 2.452 . 0 0 "[ . 1 . 2]" 1
621 1 24 ILE HG13 1 25 LYS QE . . 5.310 4.784 4.099 5.327 0.017 10 0 "[ . 1 . 2]" 1
622 1 24 ILE MG 1 25 LYS H . . 3.870 3.692 3.565 3.848 . 0 0 "[ . 1 . 2]" 1
623 1 24 ILE MG 1 41 ILE MD . . 4.310 2.413 2.243 2.654 . 0 0 "[ . 1 . 2]" 1
624 1 24 ILE MG 1 42 GLU H . . 4.460 3.575 3.415 3.816 . 0 0 "[ . 1 . 2]" 1
625 1 25 LYS H 1 25 LYS HB2 . . 3.900 3.935 3.917 3.961 0.061 2 0 "[ . 1 . 2]" 1
626 1 25 LYS H 1 25 LYS HB3 . . 3.700 3.425 3.304 3.704 0.004 2 0 "[ . 1 . 2]" 1
627 1 25 LYS H 1 25 LYS QE . . 5.500 3.517 3.059 3.805 . 0 0 "[ . 1 . 2]" 1
628 1 25 LYS H 1 25 LYS QG . . 4.260 2.363 2.263 3.106 . 0 0 "[ . 1 . 2]" 1
629 1 25 LYS H 1 26 VAL H . . 4.640 4.399 4.336 4.439 . 0 0 "[ . 1 . 2]" 1
630 1 25 LYS H 1 26 VAL QG . . 4.850 4.052 3.920 4.307 . 0 0 "[ . 1 . 2]" 1
631 1 25 LYS H 1 39 ILE MG . . 5.490 3.837 3.567 4.148 . 0 0 "[ . 1 . 2]" 1
632 1 25 LYS H 1 40 LYS H . . 3.760 2.994 2.932 3.053 . 0 0 "[ . 1 . 2]" 1
633 1 25 LYS H 1 40 LYS HA . . 5.500 4.891 4.805 5.000 . 0 0 "[ . 1 . 2]" 1
634 1 25 LYS H 1 41 ILE HA . . 4.290 3.941 3.836 4.075 . 0 0 "[ . 1 . 2]" 1
635 1 25 LYS H 1 41 ILE MD . . 5.500 4.718 4.542 4.870 . 0 0 "[ . 1 . 2]" 1
636 1 25 LYS H 1 41 ILE HG13 . . 5.500 5.174 5.014 5.361 . 0 0 "[ . 1 . 2]" 1
637 1 25 LYS H 1 41 ILE MG . . 5.110 4.953 4.803 5.115 0.005 2 0 "[ . 1 . 2]" 1
638 1 25 LYS HA 1 25 LYS HB3 . . 2.990 2.359 2.274 2.407 . 0 0 "[ . 1 . 2]" 1
639 1 25 LYS HA 1 25 LYS QD . . 4.400 4.420 3.992 4.454 0.054 18 0 "[ . 1 . 2]" 1
640 1 25 LYS HA 1 25 LYS QG . . 3.550 3.387 3.351 3.561 0.011 2 0 "[ . 1 . 2]" 1
641 1 25 LYS HA 1 26 VAL H . . 2.650 2.254 2.203 2.303 . 0 0 "[ . 1 . 2]" 1
642 1 25 LYS HA 1 26 VAL QG . . 4.210 3.214 3.058 3.380 . 0 0 "[ . 1 . 2]" 1
643 1 25 LYS HA 1 26 VAL MG2 . . 4.550 3.238 3.077 3.411 . 0 0 "[ . 1 . 2]" 1
644 1 25 LYS HB2 1 26 VAL H . . 4.100 2.648 2.389 2.815 . 0 0 "[ . 1 . 2]" 1
645 1 25 LYS HB3 1 25 LYS QE . . 4.950 2.100 1.931 2.206 . 0 0 "[ . 1 . 2]" 1
646 1 25 LYS HB3 1 26 VAL H . . 4.080 3.806 3.489 3.963 . 0 0 "[ . 1 . 2]" 1
647 1 25 LYS QE 1 25 LYS QG . . 3.340 2.257 2.152 2.897 . 0 0 "[ . 1 . 2]" 1
648 1 25 LYS QG 1 26 VAL H . . 3.950 3.855 3.692 3.953 0.003 18 0 "[ . 1 . 2]" 1
649 1 25 LYS QG 1 26 VAL MG2 . . 5.500 4.789 4.649 5.110 . 0 0 "[ . 1 . 2]" 1
650 1 25 LYS QG 1 40 LYS H . . 5.150 3.026 2.747 3.478 . 0 0 "[ . 1 . 2]" 1
651 1 25 LYS QG 1 40 LYS HA . . 5.500 4.438 4.185 5.219 . 0 0 "[ . 1 . 2]" 1
652 1 26 VAL H 1 26 VAL HB . . 3.290 2.782 2.628 2.922 . 0 0 "[ . 1 . 2]" 1
653 1 26 VAL H 1 26 VAL QG . . 3.630 2.704 2.571 2.813 . 0 0 "[ . 1 . 2]" 1
654 1 26 VAL H 1 26 VAL MG2 . . 3.760 2.752 2.606 2.873 . 0 0 "[ . 1 . 2]" 1
655 1 26 VAL H 1 27 THR H . . 5.140 4.469 4.354 4.556 . 0 0 "[ . 1 . 2]" 1
656 1 26 VAL H 1 39 ILE HA . . 5.000 4.925 4.840 4.979 . 0 0 "[ . 1 . 2]" 1
657 1 26 VAL H 1 39 ILE MG . . 5.500 5.258 4.820 5.416 . 0 0 "[ . 1 . 2]" 1
658 1 26 VAL HA 1 26 VAL QG . . 3.280 2.204 2.184 2.246 . 0 0 "[ . 1 . 2]" 1
659 1 26 VAL HA 1 26 VAL MG2 . . 3.140 2.583 2.517 2.622 . 0 0 "[ . 1 . 2]" 1
660 1 26 VAL HA 1 27 THR H . . 2.810 2.267 2.194 2.319 . 0 0 "[ . 1 . 2]" 1
661 1 26 VAL HA 1 27 THR MG . . 5.500 5.540 5.514 5.566 0.066 7 0 "[ . 1 . 2]" 1
662 1 26 VAL HA 1 38 GLU H . . 5.220 4.791 4.686 4.952 . 0 0 "[ . 1 . 2]" 1
663 1 26 VAL HA 1 39 ILE HA . . 3.770 2.473 2.372 2.545 . 0 0 "[ . 1 . 2]" 1
664 1 26 VAL HA 1 39 ILE MG . . 4.780 3.742 3.251 3.874 . 0 0 "[ . 1 . 2]" 1
665 1 26 VAL HA 1 40 LYS H . . 3.990 3.719 3.587 3.904 . 0 0 "[ . 1 . 2]" 1
666 1 26 VAL HB 1 27 THR H . . 4.820 3.941 3.832 4.066 . 0 0 "[ . 1 . 2]" 1
667 1 26 VAL QG 1 27 THR H . . 3.680 2.434 2.303 2.569 . 0 0 "[ . 1 . 2]" 1
668 1 26 VAL QG 1 27 THR HA . . 4.800 3.482 3.312 3.622 . 0 0 "[ . 1 . 2]" 1
669 1 26 VAL QG 1 28 ASP H . . 5.420 3.952 3.598 4.236 . 0 0 "[ . 1 . 2]" 1
670 1 26 VAL QG 1 37 TYR HA . . 4.970 4.215 4.003 4.409 . 0 0 "[ . 1 . 2]" 1
671 1 26 VAL QG 1 37 TYR HB2 . . 4.010 3.498 3.215 3.758 . 0 0 "[ . 1 . 2]" 1
672 1 26 VAL QG 1 37 TYR HB3 . . 4.210 2.509 2.274 2.740 . 0 0 "[ . 1 . 2]" 1
673 1 26 VAL QG 1 37 TYR QD . . 3.160 2.464 2.228 2.707 . 0 0 "[ . 1 . 2]" 1
674 1 26 VAL QG 1 37 TYR QE . . 4.340 3.907 3.637 4.160 . 0 0 "[ . 1 . 2]" 1
675 1 26 VAL QG 1 38 GLU H . . 5.150 3.855 3.715 4.107 . 0 0 "[ . 1 . 2]" 1
676 1 26 VAL QG 1 39 ILE HA . . 3.980 3.114 2.918 3.409 . 0 0 "[ . 1 . 2]" 1
677 1 26 VAL QG 1 40 LYS H . . 4.750 4.014 3.794 4.288 . 0 0 "[ . 1 . 2]" 1
678 1 26 VAL MG1 1 27 THR H . . 3.940 2.451 2.315 2.593 . 0 0 "[ . 1 . 2]" 1
679 1 26 VAL MG1 1 27 THR HA . . 4.590 3.521 3.343 3.671 . 0 0 "[ . 1 . 2]" 1
680 1 26 VAL MG1 1 28 ASP H . . 5.500 3.990 3.623 4.284 . 0 0 "[ . 1 . 2]" 1
681 1 26 VAL MG1 1 37 TYR HB2 . . 4.540 3.539 3.248 3.809 . 0 0 "[ . 1 . 2]" 1
682 1 26 VAL MG1 1 37 TYR QD . . 3.870 2.470 2.232 2.716 . 0 0 "[ . 1 . 2]" 1
683 1 26 VAL MG1 1 37 TYR QE . . 4.760 3.956 3.679 4.216 . 0 0 "[ . 1 . 2]" 1
684 1 27 THR H 1 27 THR HB . . 3.400 2.754 2.589 2.876 . 0 0 "[ . 1 . 2]" 1
685 1 27 THR H 1 27 THR MG . . 4.340 3.926 3.835 3.956 . 0 0 "[ . 1 . 2]" 1
686 1 27 THR H 1 28 ASP H . . 5.100 4.296 4.164 4.383 . 0 0 "[ . 1 . 2]" 1
687 1 27 THR H 1 29 ILE MD . . 5.500 5.116 5.023 5.230 . 0 0 "[ . 1 . 2]" 1
688 1 27 THR H 1 37 TYR HA . . 4.870 4.364 4.247 4.489 . 0 0 "[ . 1 . 2]" 1
689 1 27 THR H 1 37 TYR HB2 . . 4.960 4.977 4.851 5.028 0.068 6 0 "[ . 1 . 2]" 1
690 1 27 THR H 1 37 TYR QD . . 4.670 3.967 3.827 4.092 . 0 0 "[ . 1 . 2]" 1
691 1 27 THR H 1 38 GLU H . . 3.790 2.862 2.796 3.048 . 0 0 "[ . 1 . 2]" 1
692 1 27 THR H 1 38 GLU HA . . 5.500 4.561 4.476 4.738 . 0 0 "[ . 1 . 2]" 1
693 1 27 THR H 1 38 GLU HB3 . . 4.990 3.041 2.691 3.850 . 0 0 "[ . 1 . 2]" 1
694 1 27 THR H 1 38 GLU HG3 . . 5.500 5.574 5.518 5.625 0.125 6 0 "[ . 1 . 2]" 1
695 1 27 THR H 1 39 ILE HG12 . . 5.500 4.196 3.661 4.508 . 0 0 "[ . 1 . 2]" 1
696 1 27 THR H 1 39 ILE MG . . 5.390 5.289 4.796 5.403 0.013 16 0 "[ . 1 . 2]" 1
697 1 27 THR HA 1 27 THR MG . . 3.370 2.424 2.354 2.491 . 0 0 "[ . 1 . 2]" 1
698 1 27 THR HA 1 28 ASP H . . 2.910 2.117 2.058 2.167 . 0 0 "[ . 1 . 2]" 1
699 1 27 THR HA 1 28 ASP HB2 . . 4.710 4.783 4.654 4.820 0.110 10 0 "[ . 1 . 2]" 1
700 1 27 THR HA 1 28 ASP HB3 . . 4.440 4.314 4.019 4.503 0.063 2 0 "[ . 1 . 2]" 1
701 1 27 THR HA 1 37 TYR QD . . 4.970 4.266 4.093 4.455 . 0 0 "[ . 1 . 2]" 1
702 1 27 THR HB 1 28 ASP H . . 4.920 4.246 4.163 4.351 . 0 0 "[ . 1 . 2]" 1
703 1 27 THR HB 1 29 ILE MD . . 4.090 4.081 3.934 4.133 0.043 14 0 "[ . 1 . 2]" 1
704 1 27 THR HB 1 29 ILE MG . . 3.540 3.102 2.750 3.542 0.002 3 0 "[ . 1 . 2]" 1
705 1 27 THR HB 1 38 GLU H . . 4.130 3.073 2.769 3.273 . 0 0 "[ . 1 . 2]" 1
706 1 27 THR HB 1 38 GLU HB2 . . 3.790 2.893 2.226 3.842 0.052 2 0 "[ . 1 . 2]" 1
707 1 27 THR HB 1 38 GLU HB3 . . 3.050 2.101 1.961 2.207 . 0 0 "[ . 1 . 2]" 1
708 1 27 THR HB 1 38 GLU HG2 . . 5.060 4.241 3.356 4.673 . 0 0 "[ . 1 . 2]" 1
709 1 27 THR HB 1 38 GLU HG3 . . 4.700 4.647 4.466 4.765 0.065 20 0 "[ . 1 . 2]" 1
710 1 27 THR MG 1 28 ASP H . . 3.690 2.791 2.490 3.075 . 0 0 "[ . 1 . 2]" 1
711 1 27 THR MG 1 28 ASP HB2 . . 5.110 4.946 4.773 5.098 . 0 0 "[ . 1 . 2]" 1
712 1 27 THR MG 1 29 ILE H . . 5.500 4.304 3.975 4.560 . 0 0 "[ . 1 . 2]" 1
713 1 27 THR MG 1 29 ILE MD . . 3.960 3.972 3.853 3.996 0.036 8 0 "[ . 1 . 2]" 1
714 1 27 THR MG 1 29 ILE MG . . 3.490 2.131 1.995 2.395 . 0 0 "[ . 1 . 2]" 1
715 1 27 THR MG 1 37 TYR HA . . 5.500 4.638 4.418 4.786 . 0 0 "[ . 1 . 2]" 1
716 1 27 THR MG 1 37 TYR QD . . 5.500 4.967 4.843 5.182 . 0 0 "[ . 1 . 2]" 1
717 1 27 THR MG 1 38 GLU H . . 5.090 3.856 3.602 3.982 . 0 0 "[ . 1 . 2]" 1
718 1 28 ASP H 1 28 ASP HB2 . . 3.440 2.840 2.637 2.982 . 0 0 "[ . 1 . 2]" 1
719 1 28 ASP H 1 28 ASP HB3 . . 3.570 2.231 2.022 2.398 . 0 0 "[ . 1 . 2]" 1
720 1 28 ASP H 1 29 ILE H . . 5.140 4.500 4.446 4.536 . 0 0 "[ . 1 . 2]" 1
721 1 28 ASP H 1 37 TYR QD . . 4.630 3.476 3.368 3.667 . 0 0 "[ . 1 . 2]" 1
722 1 28 ASP H 1 37 TYR QE . . 4.740 4.279 4.084 4.478 . 0 0 "[ . 1 . 2]" 1
723 1 28 ASP HA 1 29 ILE H . . 2.960 2.039 1.988 2.090 . 0 0 "[ . 1 . 2]" 1
724 1 28 ASP HA 1 29 ILE HG13 . . 5.050 5.126 5.060 5.171 0.121 11 0 "[ . 1 . 2]" 1
725 1 28 ASP HA 1 30 SER H . . 3.970 3.601 3.478 3.771 . 0 0 "[ . 1 . 2]" 1
726 1 28 ASP HA 1 36 MET H . . 5.500 5.359 4.922 5.546 0.046 18 0 "[ . 1 . 2]" 1
727 1 28 ASP HA 1 37 TYR HA . . 3.460 2.659 2.536 2.858 . 0 0 "[ . 1 . 2]" 1
728 1 28 ASP HA 1 37 TYR HB2 . . 4.730 4.800 4.757 4.833 0.103 3 0 "[ . 1 . 2]" 1
729 1 28 ASP HA 1 37 TYR QD . . 3.580 2.419 2.248 2.603 . 0 0 "[ . 1 . 2]" 1
730 1 28 ASP HA 1 37 TYR QE . . 4.420 3.286 3.098 3.483 . 0 0 "[ . 1 . 2]" 1
731 1 28 ASP HA 1 38 GLU H . . 4.500 3.899 3.752 4.065 . 0 0 "[ . 1 . 2]" 1
732 1 28 ASP HB2 1 29 ILE H . . 4.860 4.101 3.953 4.276 . 0 0 "[ . 1 . 2]" 1
733 1 28 ASP HB2 1 30 SER H . . 5.500 4.462 4.281 4.685 . 0 0 "[ . 1 . 2]" 1
734 1 28 ASP HB2 1 37 TYR QD . . 5.050 3.064 2.893 3.209 . 0 0 "[ . 1 . 2]" 1
735 1 28 ASP HB2 1 37 TYR QE . . 4.370 2.126 2.078 2.189 . 0 0 "[ . 1 . 2]" 1
736 1 28 ASP HB3 1 29 ILE H . . 4.710 4.290 4.059 4.438 . 0 0 "[ . 1 . 2]" 1
737 1 28 ASP HB3 1 30 SER H . . 5.500 4.384 4.025 4.803 . 0 0 "[ . 1 . 2]" 1
738 1 28 ASP HB3 1 37 TYR QD . . 5.410 4.207 4.055 4.329 . 0 0 "[ . 1 . 2]" 1
739 1 28 ASP HB3 1 37 TYR QE . . 3.730 3.784 3.766 3.798 0.068 4 0 "[ . 1 . 2]" 1
740 1 29 ILE H 1 29 ILE MD . . 4.090 3.853 3.780 3.904 . 0 0 "[ . 1 . 2]" 1
741 1 29 ILE H 1 29 ILE HG12 . . 3.710 2.230 2.175 2.291 . 0 0 "[ . 1 . 2]" 1
742 1 29 ILE H 1 29 ILE HG13 . . 3.420 3.313 3.228 3.429 0.009 9 0 "[ . 1 . 2]" 1
743 1 29 ILE H 1 29 ILE MG . . 3.770 3.120 3.010 3.250 . 0 0 "[ . 1 . 2]" 1
744 1 29 ILE H 1 30 SER H . . 3.290 2.342 2.157 2.490 . 0 0 "[ . 1 . 2]" 1
745 1 29 ILE H 1 30 SER HB2 . . 5.270 4.137 3.145 5.275 0.005 16 0 "[ . 1 . 2]" 1
746 1 29 ILE H 1 30 SER HB3 . . 5.360 3.844 3.553 4.464 . 0 0 "[ . 1 . 2]" 1
747 1 29 ILE H 1 36 MET H . . 5.500 4.380 4.113 4.596 . 0 0 "[ . 1 . 2]" 1
748 1 29 ILE H 1 36 MET QB . . 4.530 3.451 3.277 3.767 . 0 0 "[ . 1 . 2]" 1
749 1 29 ILE H 1 37 TYR H . . 5.500 4.724 4.613 4.881 . 0 0 "[ . 1 . 2]" 1
750 1 29 ILE H 1 37 TYR HA . . 3.580 2.745 2.593 2.934 . 0 0 "[ . 1 . 2]" 1
751 1 29 ILE H 1 37 TYR QD . . 4.840 4.131 3.891 4.282 . 0 0 "[ . 1 . 2]" 1
752 1 29 ILE H 1 38 GLU H . . 4.350 4.214 4.057 4.356 0.006 2 0 "[ . 1 . 2]" 1
753 1 29 ILE HA 1 29 ILE MG . . 3.380 2.229 2.159 2.270 . 0 0 "[ . 1 . 2]" 1
754 1 29 ILE HB 1 29 ILE MD . . 3.220 2.643 2.585 2.704 . 0 0 "[ . 1 . 2]" 1
755 1 29 ILE HB 1 30 SER H . . 5.200 4.522 4.499 4.565 . 0 0 "[ . 1 . 2]" 1
756 1 29 ILE MD 1 30 SER H . . 5.500 5.373 5.246 5.509 0.009 6 0 "[ . 1 . 2]" 1
757 1 29 ILE MD 1 36 MET HG2 . . 4.120 3.841 3.064 4.166 0.046 2 0 "[ . 1 . 2]" 1
758 1 29 ILE MD 1 37 TYR H . . 5.500 3.527 3.314 3.747 . 0 0 "[ . 1 . 2]" 1
759 1 29 ILE MD 1 37 TYR HA . . 4.890 3.181 2.978 3.365 . 0 0 "[ . 1 . 2]" 1
760 1 29 ILE MD 1 37 TYR QD . . 5.500 5.204 5.017 5.366 . 0 0 "[ . 1 . 2]" 1
761 1 29 ILE MD 1 38 GLU H . . 4.860 2.778 2.608 2.913 . 0 0 "[ . 1 . 2]" 1
762 1 29 ILE MD 1 38 GLU HA . . 4.690 3.184 3.063 3.368 . 0 0 "[ . 1 . 2]" 1
763 1 29 ILE MD 1 38 GLU HB2 . . 3.780 2.183 1.996 2.387 . 0 0 "[ . 1 . 2]" 1
764 1 29 ILE MD 1 38 GLU HG2 . . 4.370 4.428 4.383 4.483 0.113 12 0 "[ . 1 . 2]" 1
765 1 29 ILE MD 1 38 GLU HG3 . . 5.300 3.468 3.119 4.166 . 0 0 "[ . 1 . 2]" 1
766 1 29 ILE MD 1 73 ARG H . . 5.340 3.740 3.387 4.073 . 0 0 "[ . 1 . 2]" 1
767 1 29 ILE MD 1 73 ARG HD2 . . 4.580 3.636 3.063 4.152 . 0 0 "[ . 1 . 2]" 1
768 1 29 ILE MD 1 73 ARG HD3 . . 4.910 4.193 3.593 4.937 0.027 1 0 "[ . 1 . 2]" 1
769 1 29 ILE HG12 1 30 SER H . . 4.970 4.169 3.973 4.383 . 0 0 "[ . 1 . 2]" 1
770 1 29 ILE HG12 1 36 MET H . . 5.500 4.865 4.625 5.114 . 0 0 "[ . 1 . 2]" 1
771 1 29 ILE HG12 1 36 MET QB . . 3.870 2.718 2.512 3.441 . 0 0 "[ . 1 . 2]" 1
772 1 29 ILE HG12 1 36 MET ME . . 5.080 4.857 3.704 5.105 0.025 16 0 "[ . 1 . 2]" 1
773 1 29 ILE HG12 1 36 MET HG2 . . 4.620 4.479 3.484 4.728 0.108 11 0 "[ . 1 . 2]" 1
774 1 29 ILE HG12 1 37 TYR HA . . 4.720 2.334 2.048 2.451 . 0 0 "[ . 1 . 2]" 1
775 1 29 ILE HG12 1 38 GLU H . . 5.450 3.347 3.134 3.474 . 0 0 "[ . 1 . 2]" 1
776 1 29 ILE HG13 1 30 SER H . . 5.030 4.487 4.297 4.700 . 0 0 "[ . 1 . 2]" 1
777 1 29 ILE HG13 1 36 MET H . . 5.290 4.909 4.695 5.149 . 0 0 "[ . 1 . 2]" 1
778 1 29 ILE HG13 1 36 MET QB . . 4.240 2.150 1.996 2.726 . 0 0 "[ . 1 . 2]" 1
779 1 29 ILE HG13 1 36 MET ME . . 5.480 3.754 2.332 4.289 . 0 0 "[ . 1 . 2]" 1
780 1 29 ILE HG13 1 37 TYR H . . 5.500 4.308 3.842 4.587 . 0 0 "[ . 1 . 2]" 1
781 1 29 ILE HG13 1 37 TYR HA . . 4.060 3.954 3.564 4.087 0.027 18 0 "[ . 1 . 2]" 1
782 1 29 ILE HG13 1 38 GLU H . . 4.900 4.878 4.707 4.925 0.025 2 0 "[ . 1 . 2]" 1
783 1 29 ILE MG 1 30 SER H . . 4.980 4.307 4.245 4.409 . 0 0 "[ . 1 . 2]" 1
784 1 29 ILE MG 1 37 TYR HA . . 4.420 3.544 3.311 3.748 . 0 0 "[ . 1 . 2]" 1
785 1 29 ILE MG 1 38 GLU H . . 4.000 3.120 2.869 3.401 . 0 0 "[ . 1 . 2]" 1
786 1 29 ILE MG 1 38 GLU HA . . 4.840 4.697 4.493 4.879 0.039 3 0 "[ . 1 . 2]" 1
787 1 29 ILE MG 1 38 GLU HB2 . . 3.730 2.846 2.577 3.292 . 0 0 "[ . 1 . 2]" 1
788 1 29 ILE MG 1 38 GLU HB3 . . 3.830 3.642 2.923 3.858 0.028 18 0 "[ . 1 . 2]" 1
789 1 30 SER H 1 30 SER HB3 . . 4.140 2.876 2.558 3.537 . 0 0 "[ . 1 . 2]" 1
790 1 30 SER H 1 31 GLY H . . 4.710 3.158 2.621 3.808 . 0 0 "[ . 1 . 2]" 1
791 1 30 SER H 1 31 GLY HA2 . . 5.500 4.317 4.026 4.875 . 0 0 "[ . 1 . 2]" 1
792 1 30 SER H 1 32 GLY H . . 5.310 5.148 4.916 5.325 0.015 2 0 "[ . 1 . 2]" 1
793 1 30 SER H 1 36 MET H . . 5.140 4.415 3.924 4.711 . 0 0 "[ . 1 . 2]" 1
794 1 30 SER H 1 36 MET QB . . 5.040 3.942 3.569 4.309 . 0 0 "[ . 1 . 2]" 1
795 1 30 SER H 1 37 TYR HA . . 5.200 5.025 4.768 5.229 0.029 2 0 "[ . 1 . 2]" 1
796 1 30 SER HA 1 31 GLY H . . 3.160 2.514 2.169 2.779 . 0 0 "[ . 1 . 2]" 1
797 1 30 SER HA 1 31 GLY HA3 . . 4.610 4.574 4.411 4.655 0.045 6 0 "[ . 1 . 2]" 1
798 1 30 SER HA 1 32 GLY H . . 3.590 3.401 3.014 3.615 0.025 20 0 "[ . 1 . 2]" 1
799 1 30 SER HA 1 34 GLY H . . 4.110 4.029 3.860 4.139 0.029 8 0 "[ . 1 . 2]" 1
800 1 30 SER HA 1 34 GLY HA2 . . 4.470 4.590 4.564 4.625 0.155 14 0 "[ . 1 . 2]" 1
801 1 30 SER HA 1 36 MET QB . . 4.430 3.673 3.156 3.983 . 0 0 "[ . 1 . 2]" 1
802 1 30 SER HB2 1 33 CYS QB . . 4.520 4.082 2.326 4.532 0.012 9 0 "[ . 1 . 2]" 1
803 1 30 SER HB2 1 35 ALA H . . 4.460 2.863 1.866 3.222 . 0 0 "[ . 1 . 2]" 1
804 1 30 SER HB2 1 35 ALA MB . . 4.050 3.817 3.455 4.076 0.026 3 0 "[ . 1 . 2]" 1
805 1 30 SER HB2 1 36 MET H . . 4.230 2.239 1.752 3.310 . 0 0 "[ . 1 . 2]" 1
806 1 30 SER HB2 1 36 MET QB . . 3.870 2.327 1.935 3.723 . 0 0 "[ . 1 . 2]" 1
807 1 30 SER HB3 1 34 GLY H . . 4.970 3.037 2.551 4.109 . 0 0 "[ . 1 . 2]" 1
808 1 30 SER HB3 1 35 ALA H . . 4.240 2.561 2.310 3.235 . 0 0 "[ . 1 . 2]" 1
809 1 30 SER HB3 1 35 ALA MB . . 4.110 4.075 3.845 4.145 0.035 18 0 "[ . 1 . 2]" 1
810 1 30 SER HB3 1 36 MET H . . 3.560 2.331 1.950 2.896 . 0 0 "[ . 1 . 2]" 1
811 1 30 SER HB3 1 36 MET QB . . 3.490 3.100 1.952 3.543 0.053 18 0 "[ . 1 . 2]" 1
812 1 30 SER HB3 1 36 MET ME . . 5.260 3.738 2.262 5.082 . 0 0 "[ . 1 . 2]" 1
813 1 31 GLY H 1 32 GLY H . . 5.210 3.043 2.406 3.230 . 0 0 "[ . 1 . 2]" 1
814 1 31 GLY HA3 1 34 GLY H . . 5.500 5.525 5.372 5.583 0.083 5 0 "[ . 1 . 2]" 1
815 1 32 GLY H 1 33 CYS H . . 3.800 2.238 1.846 2.792 . 0 0 "[ . 1 . 2]" 1
816 1 32 GLY H 1 33 CYS HB2 . . 5.110 4.284 3.445 4.859 . 0 0 "[ . 1 . 2]" 1
817 1 32 GLY H 1 33 CYS QB . . 5.170 3.961 3.392 4.476 . 0 0 "[ . 1 . 2]" 1
818 1 32 GLY H 1 34 GLY H . . 4.460 3.490 2.858 4.262 . 0 0 "[ . 1 . 2]" 1
819 1 32 GLY HA2 1 33 CYS QB . . 4.880 4.794 4.655 4.950 0.070 13 0 "[ . 1 . 2]" 1
820 1 33 CYS H 1 33 CYS HB2 . . 3.590 2.970 2.428 3.362 . 0 0 "[ . 1 . 2]" 1
821 1 33 CYS H 1 33 CYS QB . . 3.910 2.674 2.395 2.972 . 0 0 "[ . 1 . 2]" 1
822 1 33 CYS H 1 34 GLY H . . 3.690 1.800 1.693 1.923 . 0 0 "[ . 1 . 2]" 1
823 1 33 CYS H 1 34 GLY HA2 . . 4.310 3.920 3.807 4.044 . 0 0 "[ . 1 . 2]" 1
824 1 33 CYS HA 1 35 ALA H . . 4.930 4.782 4.541 4.992 0.062 16 0 "[ . 1 . 2]" 1
825 1 33 CYS QB 1 34 GLY H . . 5.020 2.849 2.514 3.217 . 0 0 "[ . 1 . 2]" 1
826 1 33 CYS QB 1 34 GLY HA2 . . 4.640 4.338 4.002 4.648 0.008 3 0 "[ . 1 . 2]" 1
827 1 33 CYS QB 1 35 ALA H . . 4.350 2.661 2.441 3.236 . 0 0 "[ . 1 . 2]" 1
828 1 33 CYS QB 1 35 ALA HA . . 4.890 4.670 4.273 4.932 0.042 16 0 "[ . 1 . 2]" 1
829 1 33 CYS QB 1 35 ALA MB . . 4.180 2.680 2.252 2.981 . 0 0 "[ . 1 . 2]" 1
830 1 33 CYS HB2 1 34 GLY H . . 4.800 3.637 2.845 4.189 . 0 0 "[ . 1 . 2]" 1
831 1 33 CYS HB2 1 35 ALA H . . 4.170 3.996 3.084 4.243 0.073 6 0 "[ . 1 . 2]" 1
832 1 34 GLY H 1 35 ALA H . . 3.470 2.744 2.502 3.018 . 0 0 "[ . 1 . 2]" 1
833 1 34 GLY H 1 35 ALA HA . . 5.500 5.375 5.176 5.527 0.027 16 0 "[ . 1 . 2]" 1
834 1 34 GLY H 1 35 ALA MB . . 5.470 4.307 4.099 4.538 . 0 0 "[ . 1 . 2]" 1
835 1 34 GLY HA2 1 35 ALA MB . . 4.660 4.534 4.440 4.630 . 0 0 "[ . 1 . 2]" 1
836 1 34 GLY HA2 1 36 MET H . . 4.990 3.536 3.139 4.018 . 0 0 "[ . 1 . 2]" 1
837 1 34 GLY HA2 1 37 TYR QE . . 4.400 4.217 4.001 4.417 0.017 8 0 "[ . 1 . 2]" 1
838 1 34 GLY HA3 1 36 MET H . . 5.500 4.848 4.383 5.303 . 0 0 "[ . 1 . 2]" 1
839 1 34 GLY HA3 1 37 TYR QE . . 4.580 4.292 3.856 4.590 0.010 7 0 "[ . 1 . 2]" 1
840 1 35 ALA H 1 35 ALA MB . . 3.160 2.286 2.186 2.466 . 0 0 "[ . 1 . 2]" 1
841 1 35 ALA H 1 36 MET H . . 3.150 2.335 2.039 2.538 . 0 0 "[ . 1 . 2]" 1
842 1 35 ALA H 1 36 MET HA . . 5.170 5.032 4.766 5.184 0.014 14 0 "[ . 1 . 2]" 1
843 1 35 ALA H 1 36 MET QB . . 5.500 4.188 3.257 4.593 . 0 0 "[ . 1 . 2]" 1
844 1 35 ALA H 1 36 MET HG3 . . 5.500 5.249 4.825 5.591 0.091 16 0 "[ . 1 . 2]" 1
845 1 35 ALA HA 1 37 TYR QD . . 5.350 4.659 4.086 5.029 . 0 0 "[ . 1 . 2]" 1
846 1 35 ALA HA 1 37 TYR QE . . 5.070 3.489 2.767 3.947 . 0 0 "[ . 1 . 2]" 1
847 1 35 ALA MB 1 36 MET H . . 3.770 3.041 2.607 3.626 . 0 0 "[ . 1 . 2]" 1
848 1 35 ALA MB 1 37 TYR QE . . 5.140 4.855 4.309 5.159 0.019 10 0 "[ . 1 . 2]" 1
849 1 35 ALA MB 1 70 HIS HD2 . . 4.940 4.878 4.596 4.965 0.025 9 0 "[ . 1 . 2]" 1
850 1 35 ALA MB 1 71 GLY HA2 . . 5.330 4.936 4.685 5.222 . 0 0 "[ . 1 . 2]" 1
851 1 36 MET H 1 36 MET QB . . 3.670 2.481 2.199 2.667 . 0 0 "[ . 1 . 2]" 1
852 1 36 MET H 1 36 MET ME . . 4.420 3.669 2.703 4.445 0.025 8 0 "[ . 1 . 2]" 1
853 1 36 MET H 1 36 MET HG3 . . 5.400 3.667 3.126 4.518 . 0 0 "[ . 1 . 2]" 1
854 1 36 MET H 1 37 TYR H . . 4.500 4.434 4.226 4.537 0.037 2 0 "[ . 1 . 2]" 1
855 1 36 MET H 1 71 GLY HA2 . . 5.500 5.535 5.449 5.599 0.099 14 0 "[ . 1 . 2]" 1
856 1 36 MET HA 1 37 TYR H . . 3.030 2.153 2.109 2.231 . 0 0 "[ . 1 . 2]" 1
857 1 36 MET HA 1 37 TYR QD . . 4.600 3.614 3.464 3.930 . 0 0 "[ . 1 . 2]" 1
858 1 36 MET HA 1 71 GLY H . . 4.550 4.446 4.162 4.567 0.017 2 0 "[ . 1 . 2]" 1
859 1 36 MET HA 1 71 GLY HA2 . . 4.770 3.374 3.030 3.611 . 0 0 "[ . 1 . 2]" 1
860 1 36 MET HA 1 71 GLY HA3 . . 4.860 2.354 2.046 2.531 . 0 0 "[ . 1 . 2]" 1
861 1 36 MET HA 1 72 LEU H . . 5.380 4.278 3.864 4.524 . 0 0 "[ . 1 . 2]" 1
862 1 36 MET HA 1 72 LEU HA . . 5.040 3.728 3.464 3.975 . 0 0 "[ . 1 . 2]" 1
863 1 36 MET HA 1 72 LEU MD1 . . 5.130 3.743 2.794 5.194 0.064 6 0 "[ . 1 . 2]" 1
864 1 36 MET HA 1 72 LEU MD2 . . 4.990 4.152 2.453 5.020 0.030 20 0 "[ . 1 . 2]" 1
865 1 36 MET QB 1 36 MET ME . . 2.890 2.285 2.059 2.878 . 0 0 "[ . 1 . 2]" 1
866 1 36 MET QB 1 37 TYR H . . 3.870 3.102 2.727 3.857 . 0 0 "[ . 1 . 2]" 1
867 1 36 MET QB 1 71 GLY HA3 . . 5.490 3.775 3.471 3.992 . 0 0 "[ . 1 . 2]" 1
868 1 36 MET ME 1 36 MET HG2 . . 3.760 2.995 2.119 3.440 . 0 0 "[ . 1 . 2]" 1
869 1 36 MET ME 1 71 GLY HA2 . . 4.610 4.318 3.883 4.632 0.022 10 0 "[ . 1 . 2]" 1
870 1 36 MET ME 1 71 GLY HA3 . . 4.770 4.647 4.259 4.851 0.081 2 0 "[ . 1 . 2]" 1
871 1 36 MET HG2 1 37 TYR H . . 4.720 4.053 3.148 4.762 0.042 13 0 "[ . 1 . 2]" 1
872 1 36 MET HG2 1 71 GLY HA2 . . 5.070 2.712 2.132 3.451 . 0 0 "[ . 1 . 2]" 1
873 1 36 MET HG2 1 71 GLY HA3 . . 5.140 3.353 2.865 3.927 . 0 0 "[ . 1 . 2]" 1
874 1 36 MET HG3 1 37 TYR H . . 4.960 4.338 4.074 4.646 . 0 0 "[ . 1 . 2]" 1
875 1 36 MET HG3 1 71 GLY HA2 . . 5.500 2.305 1.972 2.773 . 0 0 "[ . 1 . 2]" 1
876 1 36 MET HG3 1 72 LEU H . . 5.200 5.115 4.735 5.246 0.046 9 0 "[ . 1 . 2]" 1
877 1 37 TYR H 1 37 TYR HB3 . . 3.880 3.869 3.793 3.895 0.015 19 0 "[ . 1 . 2]" 1
878 1 37 TYR H 1 37 TYR QD . . 4.020 3.111 2.985 3.265 . 0 0 "[ . 1 . 2]" 1
879 1 37 TYR H 1 37 TYR QE . . 5.500 5.116 4.983 5.269 . 0 0 "[ . 1 . 2]" 1
880 1 37 TYR H 1 38 GLU H . . 5.270 4.313 4.262 4.372 . 0 0 "[ . 1 . 2]" 1
881 1 37 TYR H 1 71 GLY HA2 . . 5.460 4.684 4.383 4.965 . 0 0 "[ . 1 . 2]" 1
882 1 37 TYR H 1 72 LEU HA . . 3.460 2.337 2.073 2.562 . 0 0 "[ . 1 . 2]" 1
883 1 37 TYR H 1 72 LEU HB2 . . 5.500 4.910 4.537 5.238 . 0 0 "[ . 1 . 2]" 1
884 1 37 TYR H 1 72 LEU MD1 . . 4.350 3.534 2.865 4.389 0.039 3 0 "[ . 1 . 2]" 1
885 1 37 TYR H 1 72 LEU MD2 . . 3.960 3.218 1.807 3.984 0.024 5 0 "[ . 1 . 2]" 1
886 1 37 TYR H 1 73 ARG H . . 4.660 3.569 3.316 3.882 . 0 0 "[ . 1 . 2]" 1
887 1 37 TYR HA 1 37 TYR QD . . 3.650 3.111 3.047 3.187 . 0 0 "[ . 1 . 2]" 1
888 1 37 TYR HA 1 37 TYR QE . . 5.210 4.741 4.652 4.841 . 0 0 "[ . 1 . 2]" 1
889 1 37 TYR HA 1 38 GLU H . . 2.980 2.146 2.086 2.214 . 0 0 "[ . 1 . 2]" 1
890 1 37 TYR HA 1 72 LEU MD2 . . 5.500 4.578 3.775 5.020 . 0 0 "[ . 1 . 2]" 1
891 1 37 TYR HB2 1 38 GLU H . . 3.830 3.852 3.829 3.874 0.044 2 0 "[ . 1 . 2]" 1
892 1 37 TYR HB2 1 39 ILE MD . . 4.440 3.274 2.375 3.840 . 0 0 "[ . 1 . 2]" 1
893 1 37 TYR HB2 1 39 ILE HG12 . . 4.920 4.335 3.601 4.754 . 0 0 "[ . 1 . 2]" 1
894 1 37 TYR HB2 1 39 ILE HG13 . . 4.630 3.303 2.853 3.627 . 0 0 "[ . 1 . 2]" 1
895 1 37 TYR HB2 1 72 LEU HA . . 5.340 3.641 3.450 3.788 . 0 0 "[ . 1 . 2]" 1
896 1 37 TYR HB2 1 72 LEU MD2 . . 4.210 2.292 1.920 2.592 . 0 0 "[ . 1 . 2]" 1
897 1 37 TYR HB3 1 38 GLU H . . 4.420 2.772 2.705 2.836 . 0 0 "[ . 1 . 2]" 1
898 1 37 TYR HB3 1 39 ILE MD . . 4.260 3.744 2.991 4.265 0.005 5 0 "[ . 1 . 2]" 1
899 1 37 TYR HB3 1 39 ILE HG12 . . 5.030 3.846 2.971 4.292 . 0 0 "[ . 1 . 2]" 1
900 1 37 TYR HB3 1 72 LEU HA . . 4.730 4.849 4.767 4.927 0.197 3 0 "[ . 1 . 2]" 1
901 1 37 TYR HB3 1 72 LEU MD1 . . 4.670 4.702 4.678 4.723 0.053 1 0 "[ . 1 . 2]" 1
902 1 37 TYR HB3 1 72 LEU MD2 . . 3.790 3.517 3.210 3.789 . 0 0 "[ . 1 . 2]" 1
903 1 37 TYR QD 1 38 GLU H . . 4.280 3.971 3.883 4.052 . 0 0 "[ . 1 . 2]" 1
904 1 37 TYR QD 1 39 ILE MD . . 5.500 4.448 3.721 4.913 . 0 0 "[ . 1 . 2]" 1
905 1 37 TYR QD 1 66 ILE MD . . 5.500 4.823 4.073 6.397 0.897 1 2 "[+ . - 1 . 2]" 1
906 1 37 TYR QD 1 72 LEU HA . . 5.270 4.444 4.269 4.599 . 0 0 "[ . 1 . 2]" 1
907 1 37 TYR QD 1 72 LEU MD1 . . 4.380 2.646 2.059 3.638 . 0 0 "[ . 1 . 2]" 1
908 1 37 TYR QD 1 72 LEU MD2 . . 3.660 2.566 1.946 3.104 . 0 0 "[ . 1 . 2]" 1
909 1 37 TYR QD 1 72 LEU HG . . 4.860 3.320 2.598 4.458 . 0 0 "[ . 1 . 2]" 1
910 1 37 TYR QE 1 66 ILE MD . . 5.500 3.365 2.491 5.016 . 0 0 "[ . 1 . 2]" 1
911 1 37 TYR QE 1 72 LEU MD1 . . 4.810 4.020 3.343 4.877 0.067 7 0 "[ . 1 . 2]" 1
912 1 37 TYR QE 1 72 LEU MD2 . . 5.050 4.176 3.618 4.796 . 0 0 "[ . 1 . 2]" 1
913 1 38 GLU H 1 38 GLU HB2 . . 3.830 2.580 2.279 3.082 . 0 0 "[ . 1 . 2]" 1
914 1 38 GLU H 1 38 GLU HB3 . . 3.600 2.706 2.403 2.926 . 0 0 "[ . 1 . 2]" 1
915 1 38 GLU H 1 38 GLU HG2 . . 4.950 4.443 4.187 4.617 . 0 0 "[ . 1 . 2]" 1
916 1 38 GLU H 1 38 GLU HG3 . . 4.880 4.338 4.098 4.571 . 0 0 "[ . 1 . 2]" 1
917 1 38 GLU H 1 39 ILE H . . 4.920 4.523 4.404 4.602 . 0 0 "[ . 1 . 2]" 1
918 1 38 GLU H 1 72 LEU MD2 . . 5.500 5.158 4.544 5.512 0.012 16 0 "[ . 1 . 2]" 1
919 1 38 GLU H 1 73 ARG H . . 5.500 4.749 4.621 4.976 . 0 0 "[ . 1 . 2]" 1
920 1 38 GLU H 1 73 ARG QB . . 5.330 4.660 4.324 4.914 . 0 0 "[ . 1 . 2]" 1
921 1 38 GLU HA 1 38 GLU HG2 . . 3.800 2.779 2.523 3.290 . 0 0 "[ . 1 . 2]" 1
922 1 38 GLU HA 1 38 GLU HG3 . . 4.060 2.430 2.178 2.609 . 0 0 "[ . 1 . 2]" 1
923 1 38 GLU HA 1 39 ILE H . . 2.890 2.267 2.168 2.310 . 0 0 "[ . 1 . 2]" 1
924 1 38 GLU HA 1 39 ILE HB . . 4.810 4.647 4.312 4.801 . 0 0 "[ . 1 . 2]" 1
925 1 38 GLU HA 1 72 LEU HA . . 5.240 4.573 4.375 4.784 . 0 0 "[ . 1 . 2]" 1
926 1 38 GLU HA 1 73 ARG H . . 3.650 3.020 2.728 3.270 . 0 0 "[ . 1 . 2]" 1
927 1 38 GLU HA 1 73 ARG QB . . 3.280 2.384 2.117 2.553 . 0 0 "[ . 1 . 2]" 1
928 1 38 GLU HA 1 73 ARG HG2 . . 5.490 4.600 4.308 5.060 . 0 0 "[ . 1 . 2]" 1
929 1 38 GLU HA 1 73 ARG HG3 . . 5.500 5.407 5.159 5.561 0.061 7 0 "[ . 1 . 2]" 1
930 1 38 GLU HA 1 74 ILE HA . . 4.880 4.671 4.486 4.784 . 0 0 "[ . 1 . 2]" 1
931 1 38 GLU HA 1 75 PHE QD . . 5.460 4.286 3.992 5.451 . 0 0 "[ . 1 . 2]" 1
932 1 38 GLU HA 1 75 PHE QE . . 4.870 3.748 3.278 4.660 . 0 0 "[ . 1 . 2]" 1
933 1 38 GLU HB2 1 39 ILE H . . 4.630 4.457 4.209 4.646 0.016 6 0 "[ . 1 . 2]" 1
934 1 38 GLU HB2 1 73 ARG QB . . 4.270 3.759 2.690 4.254 . 0 0 "[ . 1 . 2]" 1
935 1 38 GLU HB2 1 75 PHE QE . . 5.030 4.722 4.073 5.045 0.015 19 0 "[ . 1 . 2]" 1
936 1 38 GLU HB3 1 39 ILE H . . 4.930 4.057 3.769 4.471 . 0 0 "[ . 1 . 2]" 1
937 1 38 GLU HB3 1 75 PHE QE . . 5.220 5.091 4.845 5.233 0.013 10 0 "[ . 1 . 2]" 1
938 1 38 GLU HG2 1 39 ILE H . . 4.280 3.041 2.594 3.565 . 0 0 "[ . 1 . 2]" 1
939 1 38 GLU HG2 1 73 ARG QB . . 4.630 3.907 3.558 4.643 0.013 20 0 "[ . 1 . 2]" 1
940 1 38 GLU HG2 1 75 PHE QD . . 4.010 3.334 2.819 4.035 0.025 20 0 "[ . 1 . 2]" 1
941 1 38 GLU HG2 1 75 PHE QE . . 3.680 2.983 2.606 3.721 0.041 12 0 "[ . 1 . 2]" 1
942 1 38 GLU HG3 1 39 ILE H . . 4.220 3.594 2.865 4.227 0.007 6 0 "[ . 1 . 2]" 1
943 1 38 GLU HG3 1 75 PHE QE . . 4.460 2.511 2.120 2.812 . 0 0 "[ . 1 . 2]" 1
944 1 39 ILE H 1 39 ILE HB . . 3.350 2.732 2.562 2.835 . 0 0 "[ . 1 . 2]" 1
945 1 39 ILE H 1 39 ILE MD . . 4.310 4.208 3.869 4.329 0.019 4 0 "[ . 1 . 2]" 1
946 1 39 ILE H 1 39 ILE HG12 . . 4.650 4.226 4.043 4.357 . 0 0 "[ . 1 . 2]" 1
947 1 39 ILE H 1 39 ILE HG13 . . 4.340 3.136 2.828 3.284 . 0 0 "[ . 1 . 2]" 1
948 1 39 ILE H 1 39 ILE MG . . 4.620 3.911 3.850 3.943 . 0 0 "[ . 1 . 2]" 1
949 1 39 ILE H 1 73 ARG H . . 4.490 3.893 3.604 4.209 . 0 0 "[ . 1 . 2]" 1
950 1 39 ILE H 1 73 ARG QB . . 4.690 3.689 3.472 3.884 . 0 0 "[ . 1 . 2]" 1
951 1 39 ILE H 1 74 ILE H . . 5.320 4.786 4.710 4.824 . 0 0 "[ . 1 . 2]" 1
952 1 39 ILE H 1 74 ILE HA . . 3.670 2.885 2.725 2.983 . 0 0 "[ . 1 . 2]" 1
953 1 39 ILE H 1 74 ILE HG13 . . 5.470 5.264 5.028 5.494 0.024 9 0 "[ . 1 . 2]" 1
954 1 39 ILE H 1 74 ILE MG . . 5.250 4.072 3.905 4.225 . 0 0 "[ . 1 . 2]" 1
955 1 39 ILE H 1 75 PHE H . . 4.470 3.989 3.879 4.097 . 0 0 "[ . 1 . 2]" 1
956 1 39 ILE H 1 75 PHE QD . . 4.670 3.005 2.762 4.450 . 0 0 "[ . 1 . 2]" 1
957 1 39 ILE H 1 75 PHE QE . . 5.130 3.865 3.614 4.580 . 0 0 "[ . 1 . 2]" 1
958 1 39 ILE HA 1 39 ILE MD . . 4.420 3.902 3.812 3.972 . 0 0 "[ . 1 . 2]" 1
959 1 39 ILE HA 1 39 ILE HG13 . . 4.070 2.993 2.947 3.056 . 0 0 "[ . 1 . 2]" 1
960 1 39 ILE HA 1 39 ILE MG . . 3.530 2.426 2.375 2.524 . 0 0 "[ . 1 . 2]" 1
961 1 39 ILE HA 1 40 LYS H . . 2.860 2.167 2.136 2.233 . 0 0 "[ . 1 . 2]" 1
962 1 39 ILE HA 1 40 LYS HA . . 5.280 4.486 4.414 4.529 . 0 0 "[ . 1 . 2]" 1
963 1 39 ILE HB 1 39 ILE MD . . 3.400 2.413 2.343 2.525 . 0 0 "[ . 1 . 2]" 1
964 1 39 ILE HB 1 40 LYS HA . . 5.500 4.919 4.623 5.071 . 0 0 "[ . 1 . 2]" 1
965 1 39 ILE HB 1 74 ILE HA . . 3.450 2.820 2.712 2.902 . 0 0 "[ . 1 . 2]" 1
966 1 39 ILE HB 1 74 ILE MD . . 3.940 3.565 3.124 3.942 0.002 2 0 "[ . 1 . 2]" 1
967 1 39 ILE HB 1 74 ILE HG12 . . 4.060 2.716 2.424 3.215 . 0 0 "[ . 1 . 2]" 1
968 1 39 ILE HB 1 74 ILE HG13 . . 5.160 4.394 4.154 4.814 . 0 0 "[ . 1 . 2]" 1
969 1 39 ILE HB 1 74 ILE MG . . 4.160 2.257 2.094 2.456 . 0 0 "[ . 1 . 2]" 1
970 1 39 ILE HB 1 75 PHE H . . 3.750 3.757 3.723 3.783 0.033 6 0 "[ . 1 . 2]" 1
971 1 39 ILE MD 1 39 ILE MG . . 2.400 2.073 2.048 2.113 . 0 0 "[ . 1 . 2]" 1
972 1 39 ILE MD 1 72 LEU MD2 . . 3.070 2.184 1.976 2.569 . 0 0 "[ . 1 . 2]" 1
973 1 39 ILE MD 1 74 ILE HG12 . . 3.940 2.807 2.585 3.079 . 0 0 "[ . 1 . 2]" 1
974 1 39 ILE MD 1 74 ILE MG . . 3.840 3.253 2.819 3.463 . 0 0 "[ . 1 . 2]" 1
975 1 39 ILE HG12 1 72 LEU MD2 . . 4.390 4.097 3.838 4.424 0.034 9 0 "[ . 1 . 2]" 1
976 1 39 ILE HG13 1 40 LYS H . . 5.020 5.044 5.014 5.071 0.051 2 0 "[ . 1 . 2]" 1
977 1 39 ILE MG 1 40 LYS H . . 3.620 2.652 2.584 2.788 . 0 0 "[ . 1 . 2]" 1
978 1 39 ILE MG 1 40 LYS HA . . 4.680 3.580 3.215 3.833 . 0 0 "[ . 1 . 2]" 1
979 1 39 ILE MG 1 41 ILE H . . 4.510 3.826 3.631 4.184 . 0 0 "[ . 1 . 2]" 1
980 1 39 ILE MG 1 41 ILE HA . . 5.500 4.537 4.320 4.869 . 0 0 "[ . 1 . 2]" 1
981 1 39 ILE MG 1 41 ILE MD . . 3.680 2.404 2.213 2.659 . 0 0 "[ . 1 . 2]" 1
982 1 39 ILE MG 1 41 ILE HG12 . . 3.540 2.587 2.391 2.868 . 0 0 "[ . 1 . 2]" 1
983 1 39 ILE MG 1 41 ILE HG13 . . 4.060 2.336 2.195 2.611 . 0 0 "[ . 1 . 2]" 1
984 1 39 ILE MG 1 74 ILE HG12 . . 4.480 4.010 3.709 4.399 . 0 0 "[ . 1 . 2]" 1
985 1 39 ILE MG 1 75 PHE H . . 4.670 3.714 3.522 3.960 . 0 0 "[ . 1 . 2]" 1
986 1 40 LYS H 1 40 LYS HB2 . . 3.450 2.635 2.502 3.240 . 0 0 "[ . 1 . 2]" 1
987 1 40 LYS H 1 40 LYS QB . . 3.370 2.552 2.465 2.828 . 0 0 "[ . 1 . 2]" 1
988 1 40 LYS H 1 40 LYS HG2 . . 4.570 4.559 4.496 4.624 0.054 18 0 "[ . 1 . 2]" 1
989 1 40 LYS H 1 40 LYS HG3 . . 5.490 3.659 3.400 5.122 . 0 0 "[ . 1 . 2]" 1
990 1 40 LYS H 1 41 ILE H . . 5.170 4.253 4.168 4.371 . 0 0 "[ . 1 . 2]" 1
991 1 40 LYS H 1 41 ILE HG12 . . 5.340 3.887 3.688 4.079 . 0 0 "[ . 1 . 2]" 1
992 1 40 LYS HA 1 40 LYS QD . . 4.910 4.006 3.488 4.093 . 0 0 "[ . 1 . 2]" 1
993 1 40 LYS HA 1 40 LYS HG2 . . 3.960 2.662 2.217 3.500 . 0 0 "[ . 1 . 2]" 1
994 1 40 LYS HA 1 40 LYS HG3 . . 3.840 2.705 2.518 3.370 . 0 0 "[ . 1 . 2]" 1
995 1 40 LYS HA 1 41 ILE H . . 2.860 2.082 2.027 2.136 . 0 0 "[ . 1 . 2]" 1
996 1 40 LYS HA 1 41 ILE HA . . 5.220 4.374 4.325 4.417 . 0 0 "[ . 1 . 2]" 1
997 1 40 LYS HA 1 74 ILE HA . . 4.880 4.481 4.200 4.573 . 0 0 "[ . 1 . 2]" 1
998 1 40 LYS HA 1 74 ILE MG . . 5.500 4.096 3.702 4.245 . 0 0 "[ . 1 . 2]" 1
999 1 40 LYS HA 1 75 PHE H . . 3.440 3.061 2.728 3.146 . 0 0 "[ . 1 . 2]" 1
1000 1 40 LYS HA 1 75 PHE HB2 . . 3.890 2.074 1.998 2.203 . 0 0 "[ . 1 . 2]" 1
1001 1 40 LYS HA 1 75 PHE HB3 . . 3.540 3.278 3.135 3.557 0.017 20 0 "[ . 1 . 2]" 1
1002 1 40 LYS HA 1 75 PHE QD . . 4.600 3.734 3.212 3.840 . 0 0 "[ . 1 . 2]" 1
1003 1 40 LYS HA 1 76 THR HA . . 4.760 4.724 4.522 4.784 0.024 2 0 "[ . 1 . 2]" 1
1004 1 40 LYS HA 1 76 THR MG . . 5.500 4.799 4.396 4.980 . 0 0 "[ . 1 . 2]" 1
1005 1 40 LYS QB 1 40 LYS QD . . 3.110 2.169 2.087 2.263 . 0 0 "[ . 1 . 2]" 1
1006 1 40 LYS QB 1 41 ILE H . . 4.220 3.469 3.067 3.855 . 0 0 "[ . 1 . 2]" 1
1007 1 40 LYS QB 1 75 PHE HB2 . . 4.630 3.511 2.364 3.802 . 0 0 "[ . 1 . 2]" 1
1008 1 40 LYS QB 1 75 PHE HB3 . . 4.570 4.095 3.316 4.474 . 0 0 "[ . 1 . 2]" 1
1009 1 40 LYS QB 1 75 PHE QD . . 4.530 4.409 2.404 4.771 0.241 2 0 "[ . 1 . 2]" 1
1010 1 40 LYS HE2 1 40 LYS HG2 . . 3.790 2.573 2.376 3.259 . 0 0 "[ . 1 . 2]" 1
1011 1 40 LYS HE2 1 75 PHE QD . . 5.210 4.070 3.378 5.096 . 0 0 "[ . 1 . 2]" 1
1012 1 40 LYS HE3 1 40 LYS HG2 . . 4.110 3.057 2.759 3.847 . 0 0 "[ . 1 . 2]" 1
1013 1 40 LYS HG2 1 75 PHE HB2 . . 4.540 2.445 2.243 3.478 . 0 0 "[ . 1 . 2]" 1
1014 1 40 LYS HG2 1 75 PHE HB3 . . 4.100 2.714 2.318 4.111 0.011 20 0 "[ . 1 . 2]" 1
1015 1 40 LYS HG2 1 75 PHE QD . . 4.400 3.581 3.325 4.172 . 0 0 "[ . 1 . 2]" 1
1016 1 40 LYS HG3 1 41 ILE H . . 5.410 4.644 3.779 4.873 . 0 0 "[ . 1 . 2]" 1
1017 1 40 LYS HG3 1 75 PHE H . . 4.970 4.270 3.898 5.002 0.032 18 0 "[ . 1 . 2]" 1
1018 1 40 LYS HG3 1 75 PHE HB2 . . 3.960 2.531 2.237 2.788 . 0 0 "[ . 1 . 2]" 1
1019 1 40 LYS HG3 1 75 PHE HB3 . . 3.640 3.529 2.473 3.671 0.031 5 0 "[ . 1 . 2]" 1
1020 1 40 LYS HG3 1 75 PHE QD . . 4.000 2.818 2.426 3.650 . 0 0 "[ . 1 . 2]" 1
1021 1 40 LYS HG3 1 75 PHE QE . . 5.210 4.423 4.062 5.246 0.036 18 0 "[ . 1 . 2]" 1
1022 1 41 ILE H 1 41 ILE HB . . 3.710 2.821 2.724 2.975 . 0 0 "[ . 1 . 2]" 1
1023 1 41 ILE H 1 41 ILE MD . . 4.970 4.300 4.219 4.421 . 0 0 "[ . 1 . 2]" 1
1024 1 41 ILE H 1 41 ILE HG12 . . 4.530 3.265 3.211 3.393 . 0 0 "[ . 1 . 2]" 1
1025 1 41 ILE H 1 41 ILE MG . . 3.890 3.941 3.921 3.979 0.089 9 0 "[ . 1 . 2]" 1
1026 1 41 ILE H 1 42 GLU H . . 5.190 4.444 4.410 4.483 . 0 0 "[ . 1 . 2]" 1
1027 1 41 ILE H 1 42 GLU HA . . 5.050 5.061 5.004 5.082 0.032 11 0 "[ . 1 . 2]" 1
1028 1 41 ILE H 1 46 PHE QE . . 5.330 5.312 5.149 5.345 0.015 4 0 "[ . 1 . 2]" 1
1029 1 41 ILE H 1 58 VAL MG1 . . 5.200 4.788 4.677 4.880 . 0 0 "[ . 1 . 2]" 1
1030 1 41 ILE H 1 74 ILE MG . . 4.760 4.087 3.964 4.260 . 0 0 "[ . 1 . 2]" 1
1031 1 41 ILE H 1 75 PHE H . . 4.200 3.859 3.762 3.936 . 0 0 "[ . 1 . 2]" 1
1032 1 41 ILE H 1 75 PHE HB2 . . 4.880 3.517 3.330 3.662 . 0 0 "[ . 1 . 2]" 1
1033 1 41 ILE H 1 75 PHE HB3 . . 4.610 4.124 3.881 4.404 . 0 0 "[ . 1 . 2]" 1
1034 1 41 ILE H 1 75 PHE QD . . 5.300 5.278 5.010 5.345 0.045 9 0 "[ . 1 . 2]" 1
1035 1 41 ILE H 1 76 THR HA . . 3.640 3.063 2.898 3.182 . 0 0 "[ . 1 . 2]" 1
1036 1 41 ILE H 1 76 THR MG . . 4.450 3.597 3.359 3.697 . 0 0 "[ . 1 . 2]" 1
1037 1 41 ILE HA 1 41 ILE MD . . 4.730 3.606 3.531 3.672 . 0 0 "[ . 1 . 2]" 1
1038 1 41 ILE HA 1 41 ILE HG13 . . 3.390 3.476 3.456 3.489 0.099 1 0 "[ . 1 . 2]" 1
1039 1 41 ILE HA 1 42 GLU H . . 2.880 2.388 2.338 2.433 . 0 0 "[ . 1 . 2]" 1
1040 1 41 ILE HA 1 42 GLU HA . . 5.400 4.653 4.603 4.691 . 0 0 "[ . 1 . 2]" 1
1041 1 41 ILE HA 1 42 GLU HB2 . . 5.070 4.641 4.518 4.758 . 0 0 "[ . 1 . 2]" 1
1042 1 41 ILE HA 1 42 GLU HB3 . . 4.780 4.523 4.369 4.601 . 0 0 "[ . 1 . 2]" 1
1043 1 41 ILE HA 1 46 PHE QE . . 5.260 4.860 4.683 5.014 . 0 0 "[ . 1 . 2]" 1
1044 1 41 ILE HA 1 58 VAL MG1 . . 5.500 5.401 5.319 5.505 0.005 11 0 "[ . 1 . 2]" 1
1045 1 41 ILE HB 1 42 GLU H . . 3.850 3.670 3.552 3.757 . 0 0 "[ . 1 . 2]" 1
1046 1 41 ILE HB 1 46 PHE QE . . 3.470 2.745 2.538 2.826 . 0 0 "[ . 1 . 2]" 1
1047 1 41 ILE HB 1 46 PHE HZ . . 4.130 3.890 3.710 4.101 . 0 0 "[ . 1 . 2]" 1
1048 1 41 ILE HB 1 58 VAL MG2 . . 4.950 3.310 3.083 3.533 . 0 0 "[ . 1 . 2]" 1
1049 1 41 ILE HB 1 74 ILE MG . . 5.500 4.262 4.070 4.499 . 0 0 "[ . 1 . 2]" 1
1050 1 41 ILE HB 1 76 THR HA . . 4.460 3.043 2.755 3.246 . 0 0 "[ . 1 . 2]" 1
1051 1 41 ILE HB 1 77 SER H . . 5.500 4.269 4.104 4.484 . 0 0 "[ . 1 . 2]" 1
1052 1 41 ILE MD 1 41 ILE MG . . 3.270 1.985 1.977 1.994 . 0 0 "[ . 1 . 2]" 1
1053 1 41 ILE MD 1 42 GLU H . . 5.410 4.667 4.572 4.730 . 0 0 "[ . 1 . 2]" 1
1054 1 41 ILE MD 1 46 PHE QD . . 5.500 5.614 5.376 5.754 0.254 20 0 "[ . 1 . 2]" 1
1055 1 41 ILE MD 1 46 PHE QE . . 4.260 3.707 3.449 3.877 . 0 0 "[ . 1 . 2]" 1
1056 1 41 ILE MD 1 46 PHE HZ . . 3.880 3.416 3.094 3.625 . 0 0 "[ . 1 . 2]" 1
1057 1 41 ILE MD 1 58 VAL HB . . 5.500 4.086 4.037 4.148 . 0 0 "[ . 1 . 2]" 1
1058 1 41 ILE MD 1 58 VAL MG1 . . 3.110 1.875 1.856 1.895 . 0 0 "[ . 1 . 2]" 1
1059 1 41 ILE MD 1 58 VAL MG2 . . 3.360 2.285 2.215 2.460 . 0 0 "[ . 1 . 2]" 1
1060 1 41 ILE HG12 1 46 PHE QE . . 5.340 5.282 5.141 5.358 0.018 20 0 "[ . 1 . 2]" 1
1061 1 41 ILE HG12 1 58 VAL MG1 . . 3.490 3.547 3.524 3.574 0.084 8 0 "[ . 1 . 2]" 1
1062 1 41 ILE HG12 1 75 PHE H . . 5.500 5.538 5.521 5.560 0.060 20 0 "[ . 1 . 2]" 1
1063 1 41 ILE MG 1 42 GLU H . . 3.950 2.091 1.988 2.173 . 0 0 "[ . 1 . 2]" 1
1064 1 41 ILE MG 1 42 GLU HA . . 4.840 3.428 3.280 3.607 . 0 0 "[ . 1 . 2]" 1
1065 1 41 ILE MG 1 43 SER H . . 5.500 4.040 3.772 4.346 . 0 0 "[ . 1 . 2]" 1
1066 1 41 ILE MG 1 43 SER HB2 . . 4.270 2.982 2.792 3.325 . 0 0 "[ . 1 . 2]" 1
1067 1 41 ILE MG 1 43 SER HB3 . . 4.520 3.782 3.574 4.118 . 0 0 "[ . 1 . 2]" 1
1068 1 41 ILE MG 1 46 PHE QD . . 4.410 3.669 3.494 3.806 . 0 0 "[ . 1 . 2]" 1
1069 1 41 ILE MG 1 46 PHE QE . . 3.300 2.112 2.048 2.186 . 0 0 "[ . 1 . 2]" 1
1070 1 41 ILE MG 1 46 PHE HZ . . 3.720 3.254 2.984 3.456 . 0 0 "[ . 1 . 2]" 1
1071 1 41 ILE MG 1 76 THR HA . . 4.550 4.177 3.913 4.354 . 0 0 "[ . 1 . 2]" 1
1072 1 41 ILE MG 1 77 SER H . . 5.170 4.408 4.166 4.655 . 0 0 "[ . 1 . 2]" 1
1073 1 42 GLU H 1 42 GLU HB2 . . 3.740 3.377 3.324 3.431 . 0 0 "[ . 1 . 2]" 1
1074 1 42 GLU H 1 42 GLU HB3 . . 3.850 2.798 2.681 2.893 . 0 0 "[ . 1 . 2]" 1
1075 1 42 GLU H 1 42 GLU HG2 . . 4.720 4.544 4.443 4.645 . 0 0 "[ . 1 . 2]" 1
1076 1 42 GLU H 1 42 GLU HG3 . . 5.000 4.857 4.785 4.908 . 0 0 "[ . 1 . 2]" 1
1077 1 42 GLU H 1 43 SER HA . . 5.500 4.757 4.657 4.889 . 0 0 "[ . 1 . 2]" 1
1078 1 42 GLU H 1 43 SER HB2 . . 5.500 3.935 3.770 4.065 . 0 0 "[ . 1 . 2]" 1
1079 1 42 GLU H 1 43 SER HB3 . . 5.500 5.117 4.892 5.266 . 0 0 "[ . 1 . 2]" 1
1080 1 42 GLU H 1 46 PHE QE . . 5.500 4.124 3.777 4.334 . 0 0 "[ . 1 . 2]" 1
1081 1 42 GLU H 1 76 THR HA . . 5.230 4.826 4.619 4.958 . 0 0 "[ . 1 . 2]" 1
1082 1 42 GLU HA 1 42 GLU HG2 . . 3.850 3.321 3.132 3.469 . 0 0 "[ . 1 . 2]" 1
1083 1 42 GLU HA 1 42 GLU HG3 . . 3.300 2.656 2.540 2.771 . 0 0 "[ . 1 . 2]" 1
1084 1 42 GLU HA 1 43 SER H . . 3.040 2.268 2.213 2.303 . 0 0 "[ . 1 . 2]" 1
1085 1 42 GLU HA 1 46 PHE QD . . 4.340 3.125 2.796 3.317 . 0 0 "[ . 1 . 2]" 1
1086 1 42 GLU HA 1 46 PHE QE . . 4.670 3.835 3.585 4.091 . 0 0 "[ . 1 . 2]" 1
1087 1 42 GLU HA 1 76 THR HA . . 4.600 3.578 3.484 3.666 . 0 0 "[ . 1 . 2]" 1
1088 1 42 GLU HA 1 76 THR MG . . 5.500 4.589 4.314 4.747 . 0 0 "[ . 1 . 2]" 1
1089 1 42 GLU HA 1 77 SER H . . 3.430 2.211 2.041 2.372 . 0 0 "[ . 1 . 2]" 1
1090 1 42 GLU HA 1 77 SER HB2 . . 5.430 4.361 3.944 4.966 . 0 0 "[ . 1 . 2]" 1
1091 1 42 GLU HA 1 77 SER HB3 . . 5.130 4.881 3.629 5.092 . 0 0 "[ . 1 . 2]" 1
1092 1 42 GLU HA 1 78 VAL H . . 5.230 4.857 4.555 4.998 . 0 0 "[ . 1 . 2]" 1
1093 1 42 GLU HA 1 78 VAL HA . . 4.340 3.970 3.849 4.079 . 0 0 "[ . 1 . 2]" 1
1094 1 42 GLU HA 1 78 VAL MG2 . . 5.500 5.552 5.523 5.579 0.079 1 0 "[ . 1 . 2]" 1
1095 1 42 GLU HA 1 79 PRO HD2 . . 5.500 5.493 5.269 5.569 0.069 3 0 "[ . 1 . 2]" 1
1096 1 42 GLU HA 1 79 PRO HD3 . . 5.120 4.389 4.119 4.611 . 0 0 "[ . 1 . 2]" 1
1097 1 42 GLU HB2 1 43 SER H . . 4.570 4.358 4.270 4.424 . 0 0 "[ . 1 . 2]" 1
1098 1 42 GLU HB3 1 76 THR HA . . 5.500 5.697 5.667 5.736 0.236 6 0 "[ . 1 . 2]" 1
1099 1 42 GLU HB3 1 77 SER H . . 5.250 4.826 4.463 5.063 . 0 0 "[ . 1 . 2]" 1
1100 1 42 GLU HG2 1 43 SER H . . 5.050 3.400 3.046 3.645 . 0 0 "[ . 1 . 2]" 1
1101 1 42 GLU HG2 1 78 VAL HA . . 4.940 3.600 3.223 3.972 . 0 0 "[ . 1 . 2]" 1
1102 1 42 GLU HG2 1 79 PRO HA . . 5.190 4.740 4.156 5.122 . 0 0 "[ . 1 . 2]" 1
1103 1 42 GLU HG2 1 79 PRO HD3 . . 4.460 2.311 2.070 2.493 . 0 0 "[ . 1 . 2]" 1
1104 1 42 GLU HG3 1 43 SER H . . 4.440 3.196 3.051 3.358 . 0 0 "[ . 1 . 2]" 1
1105 1 42 GLU HG3 1 77 SER HA . . 4.890 4.383 4.185 4.625 . 0 0 "[ . 1 . 2]" 1
1106 1 42 GLU HG3 1 77 SER HB2 . . 4.810 2.898 2.363 4.185 . 0 0 "[ . 1 . 2]" 1
1107 1 42 GLU HG3 1 77 SER HB3 . . 4.510 4.160 2.975 4.513 0.003 11 0 "[ . 1 . 2]" 1
1108 1 42 GLU HG3 1 78 VAL HA . . 4.120 3.016 2.910 3.133 . 0 0 "[ . 1 . 2]" 1
1109 1 42 GLU HG3 1 78 VAL MG1 . . 5.500 5.004 4.838 5.170 . 0 0 "[ . 1 . 2]" 1
1110 1 42 GLU HG3 1 79 PRO HA . . 4.860 4.795 4.309 4.939 0.079 10 0 "[ . 1 . 2]" 1
1111 1 42 GLU HG3 1 79 PRO HD3 . . 4.350 2.916 2.433 3.157 . 0 0 "[ . 1 . 2]" 1
1112 1 43 SER H 1 43 SER HB2 . . 3.860 3.342 3.224 3.384 . 0 0 "[ . 1 . 2]" 1
1113 1 43 SER H 1 43 SER HB3 . . 4.180 2.992 2.847 3.180 . 0 0 "[ . 1 . 2]" 1
1114 1 43 SER H 1 44 GLU H . . 5.240 4.323 4.224 4.377 . 0 0 "[ . 1 . 2]" 1
1115 1 43 SER H 1 46 PHE H . . 5.260 4.128 3.988 4.241 . 0 0 "[ . 1 . 2]" 1
1116 1 43 SER H 1 46 PHE HB3 . . 5.070 4.635 4.384 4.817 . 0 0 "[ . 1 . 2]" 1
1117 1 43 SER H 1 46 PHE QD . . 3.490 2.230 2.068 2.398 . 0 0 "[ . 1 . 2]" 1
1118 1 43 SER H 1 46 PHE QE . . 4.280 3.963 3.768 4.136 . 0 0 "[ . 1 . 2]" 1
1119 1 43 SER H 1 77 SER H . . 4.440 3.667 3.513 3.815 . 0 0 "[ . 1 . 2]" 1
1120 1 43 SER H 1 78 VAL H . . 5.450 4.730 4.526 4.887 . 0 0 "[ . 1 . 2]" 1
1121 1 43 SER H 1 78 VAL HA . . 3.720 2.572 2.426 2.748 . 0 0 "[ . 1 . 2]" 1
1122 1 43 SER H 1 78 VAL MG1 . . 5.500 4.995 4.837 5.167 . 0 0 "[ . 1 . 2]" 1
1123 1 43 SER H 1 78 VAL MG2 . . 4.620 3.892 3.842 3.931 . 0 0 "[ . 1 . 2]" 1
1124 1 43 SER H 1 79 PRO HD2 . . 4.530 3.683 3.441 3.882 . 0 0 "[ . 1 . 2]" 1
1125 1 43 SER H 1 79 PRO HD3 . . 3.960 3.156 2.736 3.436 . 0 0 "[ . 1 . 2]" 1
1126 1 43 SER HA 1 43 SER HB2 . . 2.990 2.562 2.507 2.657 . 0 0 "[ . 1 . 2]" 1
1127 1 43 SER HA 1 44 GLU H . . 3.090 2.184 2.088 2.287 . 0 0 "[ . 1 . 2]" 1
1128 1 43 SER HA 1 44 GLU HG2 . . 5.500 5.140 4.021 5.565 0.065 19 0 "[ . 1 . 2]" 1
1129 1 43 SER HA 1 45 GLU H . . 4.380 4.025 3.863 4.234 . 0 0 "[ . 1 . 2]" 1
1130 1 43 SER HA 1 46 PHE H . . 5.050 4.980 4.896 5.052 0.002 13 0 "[ . 1 . 2]" 1
1131 1 43 SER HB2 1 44 GLU H . . 4.440 4.100 3.945 4.258 . 0 0 "[ . 1 . 2]" 1
1132 1 43 SER HB2 1 45 GLU H . . 4.990 4.358 4.109 4.513 . 0 0 "[ . 1 . 2]" 1
1133 1 43 SER HB2 1 46 PHE H . . 4.970 5.042 5.007 5.070 0.100 12 0 "[ . 1 . 2]" 1
1134 1 43 SER HB2 1 46 PHE QD . . 4.780 3.635 3.459 3.780 . 0 0 "[ . 1 . 2]" 1
1135 1 43 SER HB2 1 46 PHE QE . . 4.730 3.579 3.153 3.867 . 0 0 "[ . 1 . 2]" 1
1136 1 43 SER HB3 1 44 GLU H . . 5.090 3.871 3.630 4.065 . 0 0 "[ . 1 . 2]" 1
1137 1 43 SER HB3 1 45 GLU H . . 4.620 3.174 2.977 3.372 . 0 0 "[ . 1 . 2]" 1
1138 1 43 SER HB3 1 45 GLU HB3 . . 5.020 4.532 4.221 4.850 . 0 0 "[ . 1 . 2]" 1
1139 1 43 SER HB3 1 45 GLU HG2 . . 4.830 2.405 2.219 2.626 . 0 0 "[ . 1 . 2]" 1
1140 1 43 SER HB3 1 45 GLU HG3 . . 4.960 3.957 3.724 4.204 . 0 0 "[ . 1 . 2]" 1
1141 1 43 SER HB3 1 46 PHE H . . 4.240 3.386 3.350 3.484 . 0 0 "[ . 1 . 2]" 1
1142 1 43 SER HB3 1 46 PHE QD . . 4.210 2.696 2.457 3.171 . 0 0 "[ . 1 . 2]" 1
1143 1 44 GLU H 1 44 GLU HB2 . . 3.400 2.513 1.937 3.485 0.085 5 0 "[ . 1 . 2]" 1
1144 1 44 GLU H 1 44 GLU HB3 . . 3.550 2.985 2.220 3.550 0.000 1 0 "[ . 1 . 2]" 1
1145 1 44 GLU H 1 44 GLU HG2 . . 4.210 3.316 2.085 3.902 . 0 0 "[ . 1 . 2]" 1
1146 1 44 GLU H 1 44 GLU HG3 . . 4.430 3.341 2.361 4.297 . 0 0 "[ . 1 . 2]" 1
1147 1 44 GLU H 1 45 GLU H . . 4.360 2.865 2.719 3.016 . 0 0 "[ . 1 . 2]" 1
1148 1 44 GLU H 1 45 GLU HA . . 5.500 5.448 5.352 5.547 0.047 20 0 "[ . 1 . 2]" 1
1149 1 44 GLU H 1 46 PHE H . . 5.500 4.524 4.430 4.631 . 0 0 "[ . 1 . 2]" 1
1150 1 44 GLU H 1 78 VAL MG2 . . 5.500 3.939 3.860 4.039 . 0 0 "[ . 1 . 2]" 1
1151 1 44 GLU H 1 79 PRO HD2 . . 4.750 3.210 2.996 3.391 . 0 0 "[ . 1 . 2]" 1
1152 1 44 GLU H 1 79 PRO HD3 . . 4.950 3.902 3.665 4.086 . 0 0 "[ . 1 . 2]" 1
1153 1 44 GLU H 1 79 PRO HG3 . . 4.860 3.613 3.277 3.951 . 0 0 "[ . 1 . 2]" 1
1154 1 44 GLU HA 1 44 GLU HB2 . . 2.830 2.682 2.235 2.952 0.122 14 0 "[ . 1 . 2]" 1
1155 1 44 GLU HA 1 44 GLU HB3 . . 3.000 2.696 2.442 3.029 0.029 17 0 "[ . 1 . 2]" 1
1156 1 44 GLU HA 1 44 GLU HG2 . . 3.700 2.761 2.173 3.779 0.079 11 0 "[ . 1 . 2]" 1
1157 1 44 GLU HA 1 44 GLU HG3 . . 3.890 3.332 2.747 3.765 . 0 0 "[ . 1 . 2]" 1
1158 1 44 GLU HA 1 46 PHE H . . 3.880 3.866 3.735 3.917 0.037 14 0 "[ . 1 . 2]" 1
1159 1 44 GLU HA 1 78 VAL HA . . 4.230 3.885 3.649 4.056 . 0 0 "[ . 1 . 2]" 1
1160 1 44 GLU HA 1 78 VAL MG1 . . 4.680 4.728 4.710 4.756 0.076 17 0 "[ . 1 . 2]" 1
1161 1 44 GLU HA 1 78 VAL MG2 . . 3.450 2.006 1.946 2.065 . 0 0 "[ . 1 . 2]" 1
1162 1 44 GLU HA 1 79 PRO HD2 . . 3.570 2.140 1.989 2.206 . 0 0 "[ . 1 . 2]" 1
1163 1 44 GLU HA 1 79 PRO HD3 . . 3.820 3.823 3.710 3.870 0.050 15 0 "[ . 1 . 2]" 1
1164 1 44 GLU HA 1 79 PRO HG3 . . 3.990 4.019 3.993 4.070 0.080 6 0 "[ . 1 . 2]" 1
1165 1 44 GLU HB2 1 45 GLU H . . 4.870 3.624 2.805 4.399 . 0 0 "[ . 1 . 2]" 1
1166 1 44 GLU HB2 1 79 PRO HD3 . . 5.480 5.357 4.873 5.568 0.088 3 0 "[ . 1 . 2]" 1
1167 1 44 GLU HB3 1 45 GLU H . . 5.080 3.671 2.970 4.311 . 0 0 "[ . 1 . 2]" 1
1168 1 44 GLU HG2 1 78 VAL MG2 . . 5.240 4.105 3.433 5.176 . 0 0 "[ . 1 . 2]" 1
1169 1 44 GLU HG3 1 45 GLU H . . 5.350 4.551 2.881 5.418 0.068 15 0 "[ . 1 . 2]" 1
1170 1 45 GLU H 1 45 GLU HG2 . . 4.520 2.418 2.290 2.537 . 0 0 "[ . 1 . 2]" 1
1171 1 45 GLU H 1 45 GLU HG3 . . 3.870 3.812 3.719 3.879 0.009 6 0 "[ . 1 . 2]" 1
1172 1 45 GLU H 1 46 PHE H . . 3.720 2.712 2.459 2.906 . 0 0 "[ . 1 . 2]" 1
1173 1 45 GLU H 1 47 LYS H . . 5.450 4.854 4.686 4.990 . 0 0 "[ . 1 . 2]" 1
1174 1 45 GLU HA 1 45 GLU HB3 . . 2.890 2.505 2.387 2.561 . 0 0 "[ . 1 . 2]" 1
1175 1 45 GLU HA 1 45 GLU HG2 . . 3.600 3.650 3.613 3.662 0.062 4 0 "[ . 1 . 2]" 1
1176 1 45 GLU HA 1 45 GLU HG3 . . 4.090 3.838 3.753 4.119 0.029 20 0 "[ . 1 . 2]" 1
1177 1 45 GLU HA 1 47 LYS H . . 4.320 3.708 3.436 3.921 . 0 0 "[ . 1 . 2]" 1
1178 1 45 GLU HB2 1 46 PHE H . . 4.980 4.306 4.115 4.372 . 0 0 "[ . 1 . 2]" 1
1179 1 45 GLU HG2 1 46 PHE H . . 5.250 2.599 2.470 2.709 . 0 0 "[ . 1 . 2]" 1
1180 1 45 GLU HG2 1 46 PHE HB2 . . 4.090 3.936 3.854 4.055 . 0 0 "[ . 1 . 2]" 1
1181 1 45 GLU HG2 1 46 PHE HB3 . . 4.940 5.017 4.984 5.042 0.102 8 0 "[ . 1 . 2]" 1
1182 1 45 GLU HG2 1 46 PHE QD . . 3.940 3.707 3.643 3.809 . 0 0 "[ . 1 . 2]" 1
1183 1 45 GLU HG2 1 46 PHE QE . . 5.300 4.453 4.291 4.645 . 0 0 "[ . 1 . 2]" 1
1184 1 45 GLU HG2 1 57 MET ME . . 4.950 3.622 3.311 3.812 . 0 0 "[ . 1 . 2]" 1
1185 1 45 GLU HG3 1 46 PHE H . . 4.400 3.639 3.491 3.996 . 0 0 "[ . 1 . 2]" 1
1186 1 45 GLU HG3 1 46 PHE QD . . 5.500 3.745 3.494 4.187 . 0 0 "[ . 1 . 2]" 1
1187 1 46 PHE H 1 46 PHE HB2 . . 3.870 2.174 2.109 2.254 . 0 0 "[ . 1 . 2]" 1
1188 1 46 PHE H 1 46 PHE HB3 . . 3.610 3.472 3.431 3.526 . 0 0 "[ . 1 . 2]" 1
1189 1 46 PHE H 1 46 PHE QD . . 4.110 3.456 3.372 3.560 . 0 0 "[ . 1 . 2]" 1
1190 1 46 PHE H 1 47 LYS H . . 3.220 2.954 2.697 3.140 . 0 0 "[ . 1 . 2]" 1
1191 1 46 PHE H 1 47 LYS HA . . 5.050 5.053 4.903 5.125 0.075 16 0 "[ . 1 . 2]" 1
1192 1 46 PHE H 1 47 LYS QB . . 5.000 4.765 4.521 4.890 . 0 0 "[ . 1 . 2]" 1
1193 1 46 PHE H 1 47 LYS QG . . 5.200 4.189 3.986 4.451 . 0 0 "[ . 1 . 2]" 1
1194 1 46 PHE H 1 78 VAL MG1 . . 4.450 4.455 4.385 4.491 0.041 1 0 "[ . 1 . 2]" 1
1195 1 46 PHE H 1 78 VAL MG2 . . 4.390 2.837 2.721 2.951 . 0 0 "[ . 1 . 2]" 1
1196 1 46 PHE HA 1 46 PHE QD . . 2.910 2.166 2.103 2.229 . 0 0 "[ . 1 . 2]" 1
1197 1 46 PHE HA 1 47 LYS HA . . 5.210 4.769 4.630 4.891 . 0 0 "[ . 1 . 2]" 1
1198 1 46 PHE HA 1 49 LYS HB2 . . 4.050 3.293 2.934 3.824 . 0 0 "[ . 1 . 2]" 1
1199 1 46 PHE HA 1 49 LYS HG2 . . 4.240 3.159 2.830 3.551 . 0 0 "[ . 1 . 2]" 1
1200 1 46 PHE HA 1 57 MET ME . . 4.930 3.748 3.127 4.275 . 0 0 "[ . 1 . 2]" 1
1201 1 46 PHE HB2 1 47 LYS H . . 4.860 3.944 3.655 4.076 . 0 0 "[ . 1 . 2]" 1
1202 1 46 PHE HB2 1 49 LYS HB2 . . 5.500 5.306 4.752 5.531 0.031 12 0 "[ . 1 . 2]" 1
1203 1 46 PHE HB2 1 78 VAL MG1 . . 4.080 3.658 3.552 3.743 . 0 0 "[ . 1 . 2]" 1
1204 1 46 PHE HB2 1 78 VAL MG2 . . 4.320 3.148 2.909 3.294 . 0 0 "[ . 1 . 2]" 1
1205 1 46 PHE HB3 1 47 LYS H . . 4.410 4.285 4.127 4.404 . 0 0 "[ . 1 . 2]" 1
1206 1 46 PHE HB3 1 54 GLN HA . . 5.320 4.749 4.574 4.881 . 0 0 "[ . 1 . 2]" 1
1207 1 46 PHE HB3 1 54 GLN HB3 . . 4.130 4.088 3.867 4.170 0.040 8 0 "[ . 1 . 2]" 1
1208 1 46 PHE HB3 1 78 VAL HA . . 4.780 4.660 4.294 4.806 0.026 7 0 "[ . 1 . 2]" 1
1209 1 46 PHE HB3 1 78 VAL MG1 . . 3.610 3.632 3.500 3.656 0.046 12 0 "[ . 1 . 2]" 1
1210 1 46 PHE HB3 1 78 VAL MG2 . . 4.160 4.060 3.855 4.191 0.031 18 0 "[ . 1 . 2]" 1
1211 1 46 PHE QD 1 49 LYS HB2 . . 4.920 3.529 3.245 4.015 . 0 0 "[ . 1 . 2]" 1
1212 1 46 PHE QD 1 49 LYS HD2 . . 5.250 4.472 4.133 4.912 . 0 0 "[ . 1 . 2]" 1
1213 1 46 PHE QD 1 54 GLN H . . 5.170 5.034 4.801 5.178 0.008 14 0 "[ . 1 . 2]" 1
1214 1 46 PHE QD 1 54 GLN HA . . 3.800 2.664 2.425 2.941 . 0 0 "[ . 1 . 2]" 1
1215 1 46 PHE QD 1 54 GLN HB2 . . 5.500 4.720 4.526 4.928 . 0 0 "[ . 1 . 2]" 1
1216 1 46 PHE QD 1 54 GLN HB3 . . 4.650 3.569 3.345 3.781 . 0 0 "[ . 1 . 2]" 1
1217 1 46 PHE QD 1 54 GLN QG . . 3.910 2.386 2.219 2.696 . 0 0 "[ . 1 . 2]" 1
1218 1 46 PHE QD 1 57 MET HB3 . . 5.500 5.354 5.144 5.511 0.011 13 0 "[ . 1 . 2]" 1
1219 1 46 PHE QD 1 57 MET ME . . 4.150 2.993 2.293 3.477 . 0 0 "[ . 1 . 2]" 1
1220 1 46 PHE QD 1 76 THR HA . . 4.700 4.558 4.410 4.714 0.014 4 0 "[ . 1 . 2]" 1
1221 1 46 PHE QD 1 76 THR HB . . 4.110 3.604 3.372 3.807 . 0 0 "[ . 1 . 2]" 1
1222 1 46 PHE QD 1 76 THR MG . . 4.550 3.841 3.594 4.143 . 0 0 "[ . 1 . 2]" 1
1223 1 46 PHE QD 1 77 SER H . . 4.000 3.385 3.167 3.787 . 0 0 "[ . 1 . 2]" 1
1224 1 46 PHE QD 1 78 VAL H . . 5.500 5.414 5.235 5.508 0.008 19 0 "[ . 1 . 2]" 1
1225 1 46 PHE QD 1 78 VAL MG1 . . 5.200 4.891 4.724 4.979 . 0 0 "[ . 1 . 2]" 1
1226 1 46 PHE QD 1 78 VAL MG2 . . 4.560 4.437 4.205 4.613 0.053 16 0 "[ . 1 . 2]" 1
1227 1 46 PHE QD 1 79 PRO HD2 . . 5.500 5.335 5.095 5.497 . 0 0 "[ . 1 . 2]" 1
1228 1 46 PHE QD 1 79 PRO HD3 . . 5.440 5.229 4.704 5.461 0.021 4 0 "[ . 1 . 2]" 1
1229 1 46 PHE QE 1 54 GLN HA . . 4.100 2.567 2.308 2.873 . 0 0 "[ . 1 . 2]" 1
1230 1 46 PHE QE 1 57 MET H . . 4.960 4.013 3.827 4.194 . 0 0 "[ . 1 . 2]" 1
1231 1 46 PHE QE 1 57 MET HB2 . . 4.320 2.225 2.108 2.314 . 0 0 "[ . 1 . 2]" 1
1232 1 46 PHE QE 1 57 MET HB3 . . 4.390 3.467 3.196 3.728 . 0 0 "[ . 1 . 2]" 1
1233 1 46 PHE QE 1 57 MET ME . . 4.120 2.647 2.207 2.903 . 0 0 "[ . 1 . 2]" 1
1234 1 46 PHE QE 1 57 MET HG2 . . 4.230 4.248 4.133 4.273 0.043 11 0 "[ . 1 . 2]" 1
1235 1 46 PHE QE 1 57 MET HG3 . . 3.770 3.247 2.526 3.743 . 0 0 "[ . 1 . 2]" 1
1236 1 46 PHE QE 1 58 VAL MG1 . . 5.500 4.762 4.692 4.883 . 0 0 "[ . 1 . 2]" 1
1237 1 46 PHE QE 1 58 VAL MG2 . . 3.800 3.026 2.898 3.196 . 0 0 "[ . 1 . 2]" 1
1238 1 46 PHE QE 1 76 THR HA . . 4.310 4.104 3.908 4.268 . 0 0 "[ . 1 . 2]" 1
1239 1 46 PHE QE 1 76 THR MG . . 3.830 2.805 2.511 3.063 . 0 0 "[ . 1 . 2]" 1
1240 1 46 PHE QE 1 77 SER H . . 4.200 4.094 3.798 4.206 0.006 9 0 "[ . 1 . 2]" 1
1241 1 46 PHE HZ 1 54 GLN HA . . 5.440 4.610 4.350 5.001 . 0 0 "[ . 1 . 2]" 1
1242 1 46 PHE HZ 1 57 MET HB2 . . 5.000 3.363 3.133 3.593 . 0 0 "[ . 1 . 2]" 1
1243 1 46 PHE HZ 1 57 MET ME . . 5.500 3.910 3.596 4.205 . 0 0 "[ . 1 . 2]" 1
1244 1 46 PHE HZ 1 58 VAL HA . . 5.450 4.567 4.396 4.738 . 0 0 "[ . 1 . 2]" 1
1245 1 46 PHE HZ 1 58 VAL MG1 . . 5.190 4.165 4.066 4.307 . 0 0 "[ . 1 . 2]" 1
1246 1 46 PHE HZ 1 58 VAL MG2 . . 3.500 2.112 2.043 2.229 . 0 0 "[ . 1 . 2]" 1
1247 1 46 PHE HZ 1 76 THR HA . . 5.500 5.491 5.400 5.525 0.025 6 0 "[ . 1 . 2]" 1
1248 1 46 PHE HZ 1 76 THR HB . . 5.240 4.540 4.344 4.798 . 0 0 "[ . 1 . 2]" 1
1249 1 46 PHE HZ 1 76 THR MG . . 3.910 2.939 2.771 3.109 . 0 0 "[ . 1 . 2]" 1
1250 1 47 LYS H 1 47 LYS QB . . 2.980 2.768 2.610 2.943 . 0 0 "[ . 1 . 2]" 1
1251 1 47 LYS H 1 47 LYS QG . . 4.030 1.941 1.785 2.113 . 0 0 "[ . 1 . 2]" 1
1252 1 47 LYS H 1 48 GLU H . . 4.590 2.697 2.379 2.932 . 0 0 "[ . 1 . 2]" 1
1253 1 47 LYS H 1 49 LYS QE . . 5.370 5.388 5.299 5.422 0.052 16 0 "[ . 1 . 2]" 1
1254 1 47 LYS H 1 78 VAL MG1 . . 4.300 3.719 3.403 4.015 . 0 0 "[ . 1 . 2]" 1
1255 1 47 LYS H 1 78 VAL MG2 . . 4.070 2.591 2.350 2.953 . 0 0 "[ . 1 . 2]" 1
1256 1 47 LYS HA 1 47 LYS QG . . 3.380 3.375 3.319 3.419 0.039 7 0 "[ . 1 . 2]" 1
1257 1 47 LYS HA 1 78 VAL MG1 . . 3.530 2.085 1.977 2.244 . 0 0 "[ . 1 . 2]" 1
1258 1 47 LYS HA 1 78 VAL MG2 . . 3.470 2.905 2.434 3.291 . 0 0 "[ . 1 . 2]" 1
1259 1 47 LYS QB 1 47 LYS HE2 . . 4.630 3.935 3.764 4.266 . 0 0 "[ . 1 . 2]" 1
1260 1 47 LYS QB 1 47 LYS HE3 . . 4.370 4.068 3.904 4.309 . 0 0 "[ . 1 . 2]" 1
1261 1 47 LYS QB 1 48 GLU H . . 4.470 3.480 3.218 3.828 . 0 0 "[ . 1 . 2]" 1
1262 1 47 LYS QB 1 78 VAL MG2 . . 3.750 2.105 1.978 2.255 . 0 0 "[ . 1 . 2]" 1
1263 1 47 LYS QB 1 80 LYS QE . . 4.780 2.640 2.119 3.787 . 0 0 "[ . 1 . 2]" 1
1264 1 47 LYS HD2 1 48 GLU HB3 . . 4.390 4.300 3.590 4.459 0.069 18 0 "[ . 1 . 2]" 1
1265 1 47 LYS HD2 1 80 LYS QE . . 3.900 3.845 3.278 3.937 0.037 3 0 "[ . 1 . 2]" 1
1266 1 47 LYS HD3 1 80 LYS QE . . 4.190 3.244 2.504 3.795 . 0 0 "[ . 1 . 2]" 1
1267 1 47 LYS HE2 1 47 LYS QG . . 3.740 2.353 2.077 3.265 . 0 0 "[ . 1 . 2]" 1
1268 1 47 LYS HE2 1 48 GLU H . . 5.500 4.963 3.848 5.559 0.059 1 0 "[ . 1 . 2]" 1
1269 1 47 LYS HE3 1 47 LYS QG . . 3.720 2.394 2.045 3.166 . 0 0 "[ . 1 . 2]" 1
1270 1 47 LYS HE3 1 48 GLU HB3 . . 4.630 4.418 3.631 4.688 0.058 12 0 "[ . 1 . 2]" 1
1271 1 47 LYS HE3 1 78 VAL MG2 . . 5.300 5.297 5.023 5.371 0.071 4 0 "[ . 1 . 2]" 1
1272 1 47 LYS QG 1 48 GLU H . . 5.500 2.383 1.963 3.330 . 0 0 "[ . 1 . 2]" 1
1273 1 47 LYS QG 1 48 GLU HB2 . . 4.840 4.029 2.913 4.703 . 0 0 "[ . 1 . 2]" 1
1274 1 47 LYS QG 1 48 GLU QG . . 4.240 4.226 2.605 6.206 1.966 7 10 "[ ***.*+ * -*.** 2]" 1
1275 1 47 LYS QG 1 78 VAL MG2 . . 4.180 2.990 2.524 3.653 . 0 0 "[ . 1 . 2]" 1
1276 1 48 GLU H 1 48 GLU QG . . 4.850 3.124 1.858 4.134 . 0 0 "[ . 1 . 2]" 1
1277 1 48 GLU H 1 48 GLU HG3 . . 5.500 3.925 2.700 4.714 . 0 0 "[ . 1 . 2]" 1
1278 1 48 GLU H 1 49 LYS H . . 3.720 2.879 2.233 3.294 . 0 0 "[ . 1 . 2]" 1
1279 1 48 GLU HA 1 48 GLU QG . . 3.670 2.895 2.231 3.478 . 0 0 "[ . 1 . 2]" 1
1280 1 48 GLU HA 1 49 LYS H . . 3.510 2.927 2.631 3.476 . 0 0 "[ . 1 . 2]" 1
1281 1 48 GLU HB2 1 49 LYS H . . 4.930 4.495 4.187 4.609 . 0 0 "[ . 1 . 2]" 1
1282 1 48 GLU QG 1 49 LYS HA . . 5.380 4.576 4.084 4.975 . 0 0 "[ . 1 . 2]" 1
1283 1 49 LYS H 1 49 LYS HB2 . . 3.440 2.613 2.450 2.723 . 0 0 "[ . 1 . 2]" 1
1284 1 49 LYS H 1 49 LYS HB3 . . 3.800 3.755 3.589 3.817 0.017 2 0 "[ . 1 . 2]" 1
1285 1 49 LYS H 1 49 LYS HG2 . . 4.080 2.848 2.072 3.165 . 0 0 "[ . 1 . 2]" 1
1286 1 49 LYS H 1 49 LYS HG3 . . 4.190 4.071 3.552 4.260 0.070 16 0 "[ . 1 . 2]" 1
1287 1 49 LYS H 1 50 ARG H . . 5.430 4.443 4.322 4.717 . 0 0 "[ . 1 . 2]" 1
1288 1 49 LYS HA 1 49 LYS HD2 . . 4.140 3.554 3.373 3.852 . 0 0 "[ . 1 . 2]" 1
1289 1 49 LYS HA 1 49 LYS HD3 . . 3.210 2.198 2.049 2.353 . 0 0 "[ . 1 . 2]" 1
1290 1 49 LYS HA 1 49 LYS HG3 . . 4.060 3.860 3.781 3.988 . 0 0 "[ . 1 . 2]" 1
1291 1 49 LYS HA 1 50 ARG H . . 3.010 2.148 2.070 2.247 . 0 0 "[ . 1 . 2]" 1
1292 1 49 LYS HA 1 50 ARG HA . . 4.410 4.444 4.412 4.474 0.064 16 0 "[ . 1 . 2]" 1
1293 1 49 LYS HA 1 50 ARG HG3 . . 5.240 4.465 3.807 5.284 0.044 3 0 "[ . 1 . 2]" 1
1294 1 49 LYS HA 1 53 GLN H . . 5.500 5.165 4.981 5.450 . 0 0 "[ . 1 . 2]" 1
1295 1 49 LYS HA 1 53 GLN HB2 . . 4.080 2.872 2.642 3.285 . 0 0 "[ . 1 . 2]" 1
1296 1 49 LYS HA 1 53 GLN HE22 . . 3.920 3.278 2.948 3.978 0.058 12 0 "[ . 1 . 2]" 1
1297 1 49 LYS HB2 1 50 ARG H . . 4.510 4.129 4.003 4.257 . 0 0 "[ . 1 . 2]" 1
1298 1 49 LYS HB2 1 54 GLN QG . . 3.770 2.206 2.081 2.379 . 0 0 "[ . 1 . 2]" 1
1299 1 49 LYS HB3 1 49 LYS HD3 . . 3.530 2.833 2.705 2.988 . 0 0 "[ . 1 . 2]" 1
1300 1 49 LYS HB3 1 50 ARG H . . 4.750 3.170 3.010 3.312 . 0 0 "[ . 1 . 2]" 1
1301 1 49 LYS HB3 1 53 GLN HB2 . . 3.870 2.433 2.293 2.611 . 0 0 "[ . 1 . 2]" 1
1302 1 49 LYS HB3 1 53 GLN HB3 . . 3.910 3.166 2.522 3.574 . 0 0 "[ . 1 . 2]" 1
1303 1 49 LYS HB3 1 54 GLN H . . 4.330 2.982 2.771 3.260 . 0 0 "[ . 1 . 2]" 1
1304 1 49 LYS HB3 1 54 GLN QG . . 3.700 2.446 2.282 2.641 . 0 0 "[ . 1 . 2]" 1
1305 1 49 LYS HD2 1 50 ARG H . . 5.500 4.808 4.518 5.307 . 0 0 "[ . 1 . 2]" 1
1306 1 49 LYS HD2 1 53 GLN HB2 . . 5.120 3.389 3.011 4.141 . 0 0 "[ . 1 . 2]" 1
1307 1 49 LYS HD2 1 54 GLN QG . . 4.570 4.472 4.156 4.615 0.045 2 0 "[ . 1 . 2]" 1
1308 1 49 LYS HD3 1 53 GLN HA . . 5.300 5.133 4.751 5.325 0.025 6 0 "[ . 1 . 2]" 1
1309 1 49 LYS HD3 1 53 GLN HB2 . . 4.070 3.176 2.839 3.618 . 0 0 "[ . 1 . 2]" 1
1310 1 49 LYS HD3 1 53 GLN HB3 . . 3.280 2.778 2.498 2.940 . 0 0 "[ . 1 . 2]" 1
1311 1 49 LYS HD3 1 53 GLN HE22 . . 5.300 3.530 2.971 4.982 . 0 0 "[ . 1 . 2]" 1
1312 1 49 LYS HD3 1 53 GLN HG2 . . 5.290 5.138 4.638 5.305 0.015 20 0 "[ . 1 . 2]" 1
1313 1 49 LYS QE 1 49 LYS HG2 . . 3.300 2.178 2.070 2.286 . 0 0 "[ . 1 . 2]" 1
1314 1 49 LYS QE 1 49 LYS HG3 . . 3.600 2.576 2.276 3.246 . 0 0 "[ . 1 . 2]" 1
1315 1 49 LYS QE 1 50 ARG H . . 5.500 5.539 5.308 5.578 0.078 18 0 "[ . 1 . 2]" 1
1316 1 49 LYS QE 1 53 GLN HE21 . . 5.500 5.167 4.292 5.506 0.006 13 0 "[ . 1 . 2]" 1
1317 1 49 LYS HG2 1 50 ARG H . . 5.490 5.118 4.942 5.280 . 0 0 "[ . 1 . 2]" 1
1318 1 49 LYS HG2 1 54 GLN QG . . 4.720 4.082 3.900 4.386 . 0 0 "[ . 1 . 2]" 1
1319 1 49 LYS HG3 1 50 ARG H . . 5.390 5.377 5.221 5.433 0.043 2 0 "[ . 1 . 2]" 1
1320 1 50 ARG H 1 50 ARG HB2 . . 3.970 2.697 2.544 2.809 . 0 0 "[ . 1 . 2]" 1
1321 1 50 ARG H 1 50 ARG HB3 . . 3.250 3.450 3.434 3.471 0.221 16 0 "[ . 1 . 2]" 1
1322 1 50 ARG H 1 50 ARG QD . . 4.700 3.709 2.791 4.082 . 0 0 "[ . 1 . 2]" 1
1323 1 50 ARG H 1 50 ARG HG2 . . 3.610 2.456 1.830 3.060 . 0 0 "[ . 1 . 2]" 1
1324 1 50 ARG H 1 50 ARG HG3 . . 3.830 2.639 2.097 3.416 . 0 0 "[ . 1 . 2]" 1
1325 1 50 ARG H 1 52 VAL QG . . 5.500 4.288 4.121 4.386 . 0 0 "[ . 1 . 2]" 1
1326 1 50 ARG H 1 53 GLN H . . 4.690 3.674 3.482 3.848 . 0 0 "[ . 1 . 2]" 1
1327 1 50 ARG H 1 53 GLN HB2 . . 3.980 2.236 2.128 2.495 . 0 0 "[ . 1 . 2]" 1
1328 1 50 ARG H 1 53 GLN HB3 . . 4.410 3.755 3.578 4.016 . 0 0 "[ . 1 . 2]" 1
1329 1 50 ARG H 1 53 GLN HE21 . . 5.500 4.611 3.723 5.522 0.022 20 0 "[ . 1 . 2]" 1
1330 1 50 ARG H 1 53 GLN HE22 . . 5.380 2.982 2.592 3.807 . 0 0 "[ . 1 . 2]" 1
1331 1 50 ARG H 1 53 GLN HG2 . . 4.390 4.403 4.313 4.447 0.057 19 0 "[ . 1 . 2]" 1
1332 1 50 ARG H 1 53 GLN HG3 . . 4.950 2.912 2.759 3.056 . 0 0 "[ . 1 . 2]" 1
1333 1 50 ARG HA 1 50 ARG QD . . 3.730 3.372 2.302 3.775 0.045 19 0 "[ . 1 . 2]" 1
1334 1 50 ARG HA 1 50 ARG HG2 . . 3.680 2.969 2.595 3.578 . 0 0 "[ . 1 . 2]" 1
1335 1 50 ARG HA 1 50 ARG HG3 . . 4.180 3.767 3.558 4.112 . 0 0 "[ . 1 . 2]" 1
1336 1 50 ARG HA 1 52 VAL H . . 5.410 4.723 4.641 4.845 . 0 0 "[ . 1 . 2]" 1
1337 1 50 ARG HA 1 52 VAL QG . . 5.330 4.521 4.423 4.648 . 0 0 "[ . 1 . 2]" 1
1338 1 50 ARG HA 1 53 GLN H . . 5.060 4.538 4.483 4.605 . 0 0 "[ . 1 . 2]" 1
1339 1 50 ARG HA 1 54 GLN QG . . 5.230 4.595 4.366 4.778 . 0 0 "[ . 1 . 2]" 1
1340 1 50 ARG HB2 1 50 ARG QD . . 3.710 2.890 2.339 3.470 . 0 0 "[ . 1 . 2]" 1
1341 1 50 ARG HB2 1 51 THR HB . . 4.420 4.512 4.485 4.558 0.138 16 0 "[ . 1 . 2]" 1
1342 1 50 ARG HB2 1 53 GLN H . . 3.810 2.225 2.052 2.359 . 0 0 "[ . 1 . 2]" 1
1343 1 50 ARG HB3 1 50 ARG QD . . 3.550 2.255 2.118 2.468 . 0 0 "[ . 1 . 2]" 1
1344 1 50 ARG HB3 1 52 VAL H . . 4.800 3.386 3.184 3.576 . 0 0 "[ . 1 . 2]" 1
1345 1 50 ARG HB3 1 52 VAL QG . . 5.140 2.865 2.682 3.112 . 0 0 "[ . 1 . 2]" 1
1346 1 50 ARG HB3 1 53 GLN H . . 3.700 3.723 3.621 3.764 0.064 17 0 "[ . 1 . 2]" 1
1347 1 50 ARG QD 1 52 VAL QG . . 4.760 3.293 2.374 4.333 . 0 0 "[ . 1 . 2]" 1
1348 1 50 ARG HG3 1 52 VAL H . . 5.500 5.318 4.751 5.531 0.031 2 0 "[ . 1 . 2]" 1
1349 1 50 ARG HG3 1 52 VAL QG . . 5.500 3.506 2.888 3.893 . 0 0 "[ . 1 . 2]" 1
1350 1 50 ARG HG3 1 53 GLN H . . 5.500 4.202 3.825 4.488 . 0 0 "[ . 1 . 2]" 1
1351 1 50 ARG HG3 1 53 GLN HG2 . . 4.390 4.223 3.937 4.421 0.031 6 0 "[ . 1 . 2]" 1
1352 1 51 THR HA 1 51 THR MG . . 3.010 2.455 2.338 2.559 . 0 0 "[ . 1 . 2]" 1
1353 1 51 THR HA 1 52 VAL H . . 3.540 3.566 3.553 3.577 0.037 6 0 "[ . 1 . 2]" 1
1354 1 51 THR HA 1 52 VAL QG . . 4.870 4.748 4.722 4.764 . 0 0 "[ . 1 . 2]" 1
1355 1 51 THR HA 1 53 GLN H . . 4.980 4.457 4.270 4.656 . 0 0 "[ . 1 . 2]" 1
1356 1 51 THR HB 1 52 VAL H . . 4.070 2.223 2.042 2.409 . 0 0 "[ . 1 . 2]" 1
1357 1 51 THR HB 1 52 VAL QG . . 5.040 3.677 3.345 3.910 . 0 0 "[ . 1 . 2]" 1
1358 1 51 THR HB 1 53 GLN H . . 5.290 4.751 4.624 4.890 . 0 0 "[ . 1 . 2]" 1
1359 1 51 THR MG 1 52 VAL H . . 4.300 3.120 2.984 3.327 . 0 0 "[ . 1 . 2]" 1
1360 1 51 THR MG 1 53 GLN H . . 5.500 5.008 4.911 5.108 . 0 0 "[ . 1 . 2]" 1
1361 1 51 THR MG 1 54 GLN H . . 5.210 4.906 4.687 5.082 . 0 0 "[ . 1 . 2]" 1
1362 1 51 THR MG 1 54 GLN HB2 . . 4.430 4.222 3.824 4.440 0.010 2 0 "[ . 1 . 2]" 1
1363 1 51 THR MG 1 55 HIS HB2 . . 4.800 4.466 4.222 4.756 . 0 0 "[ . 1 . 2]" 1
1364 1 51 THR MG 1 55 HIS HD2 . . 4.880 4.772 4.354 4.907 0.027 19 0 "[ . 1 . 2]" 1
1365 1 51 THR MG 1 55 HIS HE1 . . 4.810 2.436 2.190 2.763 . 0 0 "[ . 1 . 2]" 1
1366 1 52 VAL H 1 52 VAL HB . . 3.250 2.496 2.434 2.596 . 0 0 "[ . 1 . 2]" 1
1367 1 52 VAL H 1 52 VAL QG . . 3.480 1.973 1.840 2.050 . 0 0 "[ . 1 . 2]" 1
1368 1 52 VAL H 1 53 GLN H . . 3.230 2.827 2.735 2.885 . 0 0 "[ . 1 . 2]" 1
1369 1 52 VAL HA 1 52 VAL HB . . 2.920 2.408 2.336 2.468 . 0 0 "[ . 1 . 2]" 1
1370 1 52 VAL HA 1 52 VAL QG . . 3.140 2.336 2.299 2.388 . 0 0 "[ . 1 . 2]" 1
1371 1 52 VAL HA 1 55 HIS HB2 . . 3.450 2.634 2.441 2.838 . 0 0 "[ . 1 . 2]" 1
1372 1 52 VAL HA 1 55 HIS HB3 . . 4.480 4.248 4.008 4.489 0.009 8 0 "[ . 1 . 2]" 1
1373 1 52 VAL HA 1 56 GLN H . . 4.160 3.908 3.688 4.008 . 0 0 "[ . 1 . 2]" 1
1374 1 52 VAL HB 1 53 GLN H . . 4.010 4.030 4.008 4.047 0.037 19 0 "[ . 1 . 2]" 1
1375 1 52 VAL QG 1 53 GLN H . . 3.730 2.209 2.138 2.248 . 0 0 "[ . 1 . 2]" 1
1376 1 52 VAL QG 1 53 GLN HA . . 4.220 3.238 3.158 3.349 . 0 0 "[ . 1 . 2]" 1
1377 1 52 VAL QG 1 53 GLN HB2 . . 5.500 3.802 3.671 3.886 . 0 0 "[ . 1 . 2]" 1
1378 1 52 VAL QG 1 53 GLN HG2 . . 4.770 2.591 2.326 3.717 . 0 0 "[ . 1 . 2]" 1
1379 1 52 VAL QG 1 53 GLN HG3 . . 4.290 2.742 2.483 3.103 . 0 0 "[ . 1 . 2]" 1
1380 1 52 VAL QG 1 54 GLN H . . 5.080 4.172 4.104 4.298 . 0 0 "[ . 1 . 2]" 1
1381 1 52 VAL QG 1 56 GLN H . . 4.840 3.840 3.677 3.971 . 0 0 "[ . 1 . 2]" 1
1382 1 52 VAL QG 1 56 GLN HB3 . . 4.490 4.130 3.122 4.308 . 0 0 "[ . 1 . 2]" 1
1383 1 52 VAL QG 1 56 GLN HG2 . . 5.180 4.769 4.392 4.992 . 0 0 "[ . 1 . 2]" 1
1384 1 53 GLN H 1 53 GLN HB2 . . 3.400 2.568 2.417 2.661 . 0 0 "[ . 1 . 2]" 1
1385 1 53 GLN H 1 53 GLN HB3 . . 3.800 3.663 3.600 3.700 . 0 0 "[ . 1 . 2]" 1
1386 1 53 GLN H 1 53 GLN HE22 . . 5.500 5.001 4.810 5.345 . 0 0 "[ . 1 . 2]" 1
1387 1 53 GLN H 1 53 GLN HG2 . . 4.450 3.059 2.822 3.785 . 0 0 "[ . 1 . 2]" 1
1388 1 53 GLN H 1 53 GLN HG3 . . 3.690 2.822 2.581 3.283 . 0 0 "[ . 1 . 2]" 1
1389 1 53 GLN H 1 54 GLN H . . 3.030 2.634 2.536 2.755 . 0 0 "[ . 1 . 2]" 1
1390 1 53 GLN H 1 54 GLN HA . . 5.500 5.329 5.265 5.412 . 0 0 "[ . 1 . 2]" 1
1391 1 53 GLN HA 1 53 GLN HG2 . . 3.810 2.379 2.254 2.452 . 0 0 "[ . 1 . 2]" 1
1392 1 53 GLN HA 1 53 GLN HG3 . . 3.980 3.523 3.149 3.689 . 0 0 "[ . 1 . 2]" 1
1393 1 53 GLN HA 1 55 HIS H . . 4.670 4.631 4.491 4.686 0.016 5 0 "[ . 1 . 2]" 1
1394 1 53 GLN HA 1 56 GLN HB3 . . 3.020 2.598 2.233 3.022 0.002 8 0 "[ . 1 . 2]" 1
1395 1 53 GLN HB2 1 54 GLN H . . 4.470 3.080 2.767 3.323 . 0 0 "[ . 1 . 2]" 1
1396 1 53 GLN HB3 1 53 GLN HG2 . . 2.670 2.706 2.563 2.814 0.144 20 0 "[ . 1 . 2]" 1
1397 1 53 GLN HG2 1 54 GLN H . . 5.190 4.903 4.742 5.131 . 0 0 "[ . 1 . 2]" 1
1398 1 53 GLN HG3 1 54 GLN H . . 5.020 4.789 4.654 5.028 0.008 8 0 "[ . 1 . 2]" 1
1399 1 54 GLN H 1 54 GLN HB2 . . 2.980 2.482 2.417 2.579 . 0 0 "[ . 1 . 2]" 1
1400 1 54 GLN H 1 54 GLN HB3 . . 3.910 3.634 3.592 3.680 . 0 0 "[ . 1 . 2]" 1
1401 1 54 GLN H 1 54 GLN QG . . 3.090 2.466 2.331 2.559 . 0 0 "[ . 1 . 2]" 1
1402 1 54 GLN H 1 55 HIS H . . 3.100 2.717 2.564 2.830 . 0 0 "[ . 1 . 2]" 1
1403 1 54 GLN HA 1 54 GLN QG . . 4.000 2.485 2.409 2.557 . 0 0 "[ . 1 . 2]" 1
1404 1 54 GLN HA 1 57 MET ME . . 4.370 4.071 3.326 4.405 0.035 12 0 "[ . 1 . 2]" 1
1405 1 54 GLN HA 1 57 MET HG3 . . 3.990 3.317 2.610 3.761 . 0 0 "[ . 1 . 2]" 1
1406 1 54 GLN HB2 1 54 GLN HE22 . . 5.500 4.466 3.790 4.565 . 0 0 "[ . 1 . 2]" 1
1407 1 54 GLN HB2 1 54 GLN QG . . 2.760 2.403 2.372 2.462 . 0 0 "[ . 1 . 2]" 1
1408 1 54 GLN HB2 1 55 HIS H . . 3.310 2.416 2.318 2.490 . 0 0 "[ . 1 . 2]" 1
1409 1 54 GLN HB2 1 55 HIS HB2 . . 5.050 4.812 4.683 4.947 . 0 0 "[ . 1 . 2]" 1
1410 1 54 GLN HB2 1 55 HIS HD2 . . 4.930 4.533 4.285 4.706 . 0 0 "[ . 1 . 2]" 1
1411 1 54 GLN HB2 1 76 THR MG . . 4.230 3.543 3.354 3.720 . 0 0 "[ . 1 . 2]" 1
1412 1 54 GLN HB3 1 55 HIS H . . 4.000 3.408 3.301 3.537 . 0 0 "[ . 1 . 2]" 1
1413 1 54 GLN HB3 1 55 HIS HD2 . . 4.770 4.727 4.486 4.806 0.036 15 0 "[ . 1 . 2]" 1
1414 1 54 GLN HB3 1 76 THR H . . 5.500 5.438 4.916 5.516 0.016 14 0 "[ . 1 . 2]" 1
1415 1 54 GLN HB3 1 76 THR HB . . 3.920 2.738 2.423 2.938 . 0 0 "[ . 1 . 2]" 1
1416 1 54 GLN HB3 1 76 THR MG . . 4.650 2.397 2.298 2.542 . 0 0 "[ . 1 . 2]" 1
1417 1 54 GLN QG 1 55 HIS H . . 4.820 4.138 4.087 4.192 . 0 0 "[ . 1 . 2]" 1
1418 1 55 HIS H 1 55 HIS HB2 . . 3.320 2.480 2.390 2.575 . 0 0 "[ . 1 . 2]" 1
1419 1 55 HIS H 1 55 HIS HB3 . . 3.620 3.599 3.573 3.627 0.007 7 0 "[ . 1 . 2]" 1
1420 1 55 HIS HA 1 55 HIS HD2 . . 3.310 2.310 2.212 2.437 . 0 0 "[ . 1 . 2]" 1
1421 1 55 HIS HA 1 58 VAL H . . 3.830 3.649 3.504 3.799 . 0 0 "[ . 1 . 2]" 1
1422 1 55 HIS HA 1 58 VAL HB . . 3.370 3.181 3.022 3.394 0.024 8 0 "[ . 1 . 2]" 1
1423 1 55 HIS HA 1 58 VAL MG2 . . 3.570 2.858 2.553 3.075 . 0 0 "[ . 1 . 2]" 1
1424 1 55 HIS HA 1 59 ASN H . . 4.600 4.291 4.108 4.424 . 0 0 "[ . 1 . 2]" 1
1425 1 55 HIS HA 1 59 ASN HB2 . . 5.310 5.147 5.062 5.290 . 0 0 "[ . 1 . 2]" 1
1426 1 55 HIS HA 1 59 ASN HD21 . . 5.500 4.087 3.870 4.394 . 0 0 "[ . 1 . 2]" 1
1427 1 55 HIS HA 1 74 ILE MD . . 3.950 3.424 3.275 3.657 . 0 0 "[ . 1 . 2]" 1
1428 1 55 HIS HA 1 74 ILE HG13 . . 5.500 5.505 5.324 5.538 0.038 20 0 "[ . 1 . 2]" 1
1429 1 55 HIS HA 1 74 ILE MG . . 3.620 3.320 3.030 3.625 0.005 9 0 "[ . 1 . 2]" 1
1430 1 55 HIS HA 1 76 THR MG . . 4.100 3.263 2.999 3.487 . 0 0 "[ . 1 . 2]" 1
1431 1 55 HIS HB2 1 56 GLN H . . 3.560 2.510 2.313 2.650 . 0 0 "[ . 1 . 2]" 1
1432 1 55 HIS HB2 1 74 ILE MD . . 5.240 4.925 4.658 5.242 0.002 18 0 "[ . 1 . 2]" 1
1433 1 55 HIS HB3 1 56 GLN H . . 3.870 3.387 3.235 3.540 . 0 0 "[ . 1 . 2]" 1
1434 1 55 HIS HB3 1 58 VAL H . . 5.500 5.382 5.235 5.506 0.006 11 0 "[ . 1 . 2]" 1
1435 1 55 HIS HB3 1 59 ASN HD21 . . 5.100 2.673 2.403 3.072 . 0 0 "[ . 1 . 2]" 1
1436 1 55 HIS HB3 1 74 ILE MD . . 4.240 3.434 3.128 3.789 . 0 0 "[ . 1 . 2]" 1
1437 1 55 HIS HB3 1 74 ILE MG . . 5.150 4.505 4.051 4.800 . 0 0 "[ . 1 . 2]" 1
1438 1 55 HIS HD2 1 58 VAL MG1 . . 5.500 4.909 4.578 5.271 . 0 0 "[ . 1 . 2]" 1
1439 1 55 HIS HD2 1 74 ILE H . . 5.460 5.063 4.873 5.256 . 0 0 "[ . 1 . 2]" 1
1440 1 55 HIS HD2 1 74 ILE HB . . 3.640 2.618 2.481 2.805 . 0 0 "[ . 1 . 2]" 1
1441 1 55 HIS HD2 1 74 ILE MD . . 5.060 3.731 3.506 3.930 . 0 0 "[ . 1 . 2]" 1
1442 1 55 HIS HD2 1 74 ILE HG13 . . 4.780 4.798 4.685 4.830 0.050 15 0 "[ . 1 . 2]" 1
1443 1 55 HIS HD2 1 74 ILE MG . . 3.710 2.874 2.441 3.581 . 0 0 "[ . 1 . 2]" 1
1444 1 55 HIS HD2 1 76 THR H . . 5.090 4.604 3.892 4.994 . 0 0 "[ . 1 . 2]" 1
1445 1 55 HIS HD2 1 76 THR MG . . 3.570 2.948 2.602 3.313 . 0 0 "[ . 1 . 2]" 1
1446 1 56 GLN H 1 56 GLN HB2 . . 3.060 2.545 2.388 3.187 0.127 8 0 "[ . 1 . 2]" 1
1447 1 56 GLN H 1 56 GLN HB3 . . 3.110 2.355 1.975 2.463 . 0 0 "[ . 1 . 2]" 1
1448 1 56 GLN H 1 59 ASN HB2 . . 4.400 4.455 4.435 4.481 0.081 16 0 "[ . 1 . 2]" 1
1449 1 56 GLN H 1 59 ASN HD22 . . 5.140 4.182 4.033 4.372 . 0 0 "[ . 1 . 2]" 1
1450 1 56 GLN HA 1 56 GLN HB2 . . 2.910 2.355 2.131 2.424 . 0 0 "[ . 1 . 2]" 1
1451 1 56 GLN HA 1 56 GLN HE22 . . 5.130 4.600 4.180 4.945 . 0 0 "[ . 1 . 2]" 1
1452 1 56 GLN HA 1 56 GLN HG2 . . 3.820 3.850 3.817 3.871 0.051 7 0 "[ . 1 . 2]" 1
1453 1 56 GLN HA 1 56 GLN HG3 . . 3.540 3.399 3.238 3.557 0.017 18 0 "[ . 1 . 2]" 1
1454 1 56 GLN HA 1 59 ASN H . . 3.920 3.433 3.235 3.589 . 0 0 "[ . 1 . 2]" 1
1455 1 56 GLN HA 1 59 ASN HB2 . . 3.080 2.218 2.097 2.330 . 0 0 "[ . 1 . 2]" 1
1456 1 56 GLN HA 1 59 ASN HD21 . . 5.180 4.429 4.303 4.472 . 0 0 "[ . 1 . 2]" 1
1457 1 56 GLN HA 1 59 ASN HD22 . . 4.430 3.404 3.050 3.616 . 0 0 "[ . 1 . 2]" 1
1458 1 56 GLN HB3 1 57 MET HG2 . . 5.380 4.428 3.653 5.181 . 0 0 "[ . 1 . 2]" 1
1459 1 56 GLN HE22 1 57 MET HA . . 4.970 4.727 3.465 5.041 0.071 8 0 "[ . 1 . 2]" 1
1460 1 56 GLN HE22 1 60 GLN HB2 . . 5.500 3.612 2.734 4.706 . 0 0 "[ . 1 . 2]" 1
1461 1 56 GLN HG3 1 57 MET H . . 3.630 3.437 3.103 3.640 0.010 10 0 "[ . 1 . 2]" 1
1462 1 56 GLN HG3 1 57 MET HA . . 3.600 3.517 3.206 3.614 0.014 12 0 "[ . 1 . 2]" 1
1463 1 57 MET H 1 57 MET HB2 . . 3.510 2.604 2.489 2.856 . 0 0 "[ . 1 . 2]" 1
1464 1 57 MET H 1 57 MET HB3 . . 4.010 3.609 3.565 3.667 . 0 0 "[ . 1 . 2]" 1
1465 1 57 MET H 1 57 MET ME . . 5.120 4.560 4.343 4.695 . 0 0 "[ . 1 . 2]" 1
1466 1 57 MET H 1 57 MET HG2 . . 3.250 2.959 2.357 3.285 0.035 16 0 "[ . 1 . 2]" 1
1467 1 57 MET H 1 57 MET HG3 . . 3.890 2.187 1.893 2.898 . 0 0 "[ . 1 . 2]" 1
1468 1 57 MET H 1 58 VAL H . . 3.150 2.681 2.581 2.769 . 0 0 "[ . 1 . 2]" 1
1469 1 57 MET H 1 58 VAL MG2 . . 5.280 3.804 3.582 3.959 . 0 0 "[ . 1 . 2]" 1
1470 1 57 MET H 1 59 ASN H . . 4.310 3.991 3.882 4.146 . 0 0 "[ . 1 . 2]" 1
1471 1 57 MET HA 1 57 MET HB2 . . 3.020 3.041 3.023 3.049 0.029 14 0 "[ . 1 . 2]" 1
1472 1 57 MET HA 1 57 MET HG2 . . 3.650 2.578 2.475 2.712 . 0 0 "[ . 1 . 2]" 1
1473 1 57 MET HA 1 60 GLN H . . 3.720 3.706 3.581 3.766 0.046 2 0 "[ . 1 . 2]" 1
1474 1 57 MET HB2 1 57 MET ME . . 5.040 2.881 2.649 3.091 . 0 0 "[ . 1 . 2]" 1
1475 1 57 MET HB2 1 58 VAL H . . 3.500 2.546 2.345 2.792 . 0 0 "[ . 1 . 2]" 1
1476 1 57 MET HB2 1 58 VAL MG2 . . 4.410 2.985 2.832 3.141 . 0 0 "[ . 1 . 2]" 1
1477 1 57 MET HB3 1 57 MET ME . . 3.490 2.409 2.264 2.712 . 0 0 "[ . 1 . 2]" 1
1478 1 57 MET HB3 1 58 VAL H . . 4.190 3.690 3.496 3.979 . 0 0 "[ . 1 . 2]" 1
1479 1 57 MET HB3 1 58 VAL MG2 . . 4.710 4.139 3.949 4.382 . 0 0 "[ . 1 . 2]" 1
1480 1 57 MET ME 1 57 MET HG2 . . 3.660 2.900 2.434 3.458 . 0 0 "[ . 1 . 2]" 1
1481 1 57 MET ME 1 57 MET HG3 . . 3.490 3.059 2.452 3.445 . 0 0 "[ . 1 . 2]" 1
1482 1 57 MET HG2 1 58 VAL H . . 4.760 4.715 4.454 4.864 0.104 3 0 "[ . 1 . 2]" 1
1483 1 57 MET HG3 1 58 VAL H . . 4.880 4.150 3.992 4.599 . 0 0 "[ . 1 . 2]" 1
1484 1 58 VAL H 1 58 VAL HB . . 3.010 2.728 2.646 2.815 . 0 0 "[ . 1 . 2]" 1
1485 1 58 VAL H 1 58 VAL MG1 . . 4.150 3.799 3.750 3.847 . 0 0 "[ . 1 . 2]" 1
1486 1 58 VAL H 1 58 VAL MG2 . . 3.150 1.947 1.870 2.066 . 0 0 "[ . 1 . 2]" 1
1487 1 58 VAL H 1 59 ASN H . . 3.190 2.519 2.423 2.623 . 0 0 "[ . 1 . 2]" 1
1488 1 58 VAL H 1 74 ILE MD . . 4.960 4.561 4.419 4.739 . 0 0 "[ . 1 . 2]" 1
1489 1 58 VAL H 1 74 ILE MG . . 5.090 4.593 4.364 4.836 . 0 0 "[ . 1 . 2]" 1
1490 1 58 VAL H 1 76 THR MG . . 5.460 4.326 4.227 4.472 . 0 0 "[ . 1 . 2]" 1
1491 1 58 VAL HA 1 58 VAL MG1 . . 2.890 2.233 2.183 2.275 . 0 0 "[ . 1 . 2]" 1
1492 1 58 VAL HA 1 58 VAL MG2 . . 3.170 2.615 2.548 2.704 . 0 0 "[ . 1 . 2]" 1
1493 1 58 VAL HA 1 60 GLN H . . 5.050 4.714 4.592 4.855 . 0 0 "[ . 1 . 2]" 1
1494 1 58 VAL HA 1 61 ALA H . . 3.910 3.547 3.403 3.690 . 0 0 "[ . 1 . 2]" 1
1495 1 58 VAL HA 1 61 ALA MB . . 3.470 2.660 2.491 2.788 . 0 0 "[ . 1 . 2]" 1
1496 1 58 VAL HA 1 62 LEU H . . 5.230 5.205 5.106 5.267 0.037 8 0 "[ . 1 . 2]" 1
1497 1 58 VAL HA 1 74 ILE MD . . 5.180 4.563 4.437 4.743 . 0 0 "[ . 1 . 2]" 1
1498 1 58 VAL HA 1 74 ILE MG . . 5.330 4.643 4.547 4.708 . 0 0 "[ . 1 . 2]" 1
1499 1 58 VAL HB 1 59 ASN H . . 3.260 2.892 2.735 3.085 . 0 0 "[ . 1 . 2]" 1
1500 1 58 VAL HB 1 74 ILE MD . . 3.530 2.514 2.366 2.726 . 0 0 "[ . 1 . 2]" 1
1501 1 58 VAL HB 1 74 ILE MG . . 3.960 2.331 2.166 2.535 . 0 0 "[ . 1 . 2]" 1
1502 1 58 VAL MG1 1 59 ASN H . . 4.140 3.984 3.873 4.070 . 0 0 "[ . 1 . 2]" 1
1503 1 58 VAL MG1 1 59 ASN HB2 . . 5.500 5.534 5.518 5.554 0.054 6 0 "[ . 1 . 2]" 1
1504 1 58 VAL MG1 1 61 ALA H . . 5.300 4.793 4.623 4.931 . 0 0 "[ . 1 . 2]" 1
1505 1 58 VAL MG1 1 74 ILE MD . . 3.320 2.321 2.157 2.618 . 0 0 "[ . 1 . 2]" 1
1506 1 58 VAL MG1 1 74 ILE MG . . 3.480 2.085 2.012 2.132 . 0 0 "[ . 1 . 2]" 1
1507 1 58 VAL MG1 1 76 THR HA . . 5.500 5.591 5.575 5.607 0.107 3 0 "[ . 1 . 2]" 1
1508 1 58 VAL MG2 1 59 ASN H . . 4.180 3.699 3.528 3.856 . 0 0 "[ . 1 . 2]" 1
1509 1 58 VAL MG2 1 59 ASN HD21 . . 5.500 5.383 5.373 5.400 . 0 0 "[ . 1 . 2]" 1
1510 1 58 VAL MG2 1 59 ASN HD22 . . 5.340 4.260 4.150 4.387 . 0 0 "[ . 1 . 2]" 1
1511 1 58 VAL MG2 1 74 ILE MG . . 3.870 2.488 2.320 2.691 . 0 0 "[ . 1 . 2]" 1
1512 1 58 VAL MG2 1 76 THR HA . . 5.500 4.582 4.488 4.702 . 0 0 "[ . 1 . 2]" 1
1513 1 58 VAL MG2 1 76 THR MG . . 3.540 2.048 1.970 2.125 . 0 0 "[ . 1 . 2]" 1
1514 1 59 ASN H 1 59 ASN HB2 . . 3.260 2.125 2.030 2.186 . 0 0 "[ . 1 . 2]" 1
1515 1 59 ASN H 1 59 ASN QB . . 3.110 2.106 2.015 2.165 . 0 0 "[ . 1 . 2]" 1
1516 1 59 ASN H 1 59 ASN HB3 . . 3.500 3.460 3.385 3.505 0.005 18 0 "[ . 1 . 2]" 1
1517 1 59 ASN H 1 59 ASN HD21 . . 5.060 4.081 3.868 4.257 . 0 0 "[ . 1 . 2]" 1
1518 1 59 ASN H 1 59 ASN HD22 . . 4.680 2.401 2.178 2.587 . 0 0 "[ . 1 . 2]" 1
1519 1 59 ASN H 1 60 GLN H . . 3.450 2.645 2.431 2.864 . 0 0 "[ . 1 . 2]" 1
1520 1 59 ASN H 1 60 GLN HA . . 5.410 5.256 5.109 5.412 0.002 18 0 "[ . 1 . 2]" 1
1521 1 59 ASN H 1 60 GLN HB3 . . 5.500 5.277 4.735 5.560 0.060 1 0 "[ . 1 . 2]" 1
1522 1 59 ASN H 1 62 LEU H . . 5.500 5.521 5.477 5.567 0.067 2 0 "[ . 1 . 2]" 1
1523 1 59 ASN H 1 74 ILE MD . . 4.380 3.656 3.471 3.883 . 0 0 "[ . 1 . 2]" 1
1524 1 59 ASN H 1 74 ILE MG . . 5.300 4.735 4.503 5.006 . 0 0 "[ . 1 . 2]" 1
1525 1 59 ASN HA 1 59 ASN HB2 . . 3.010 3.020 3.000 3.032 0.022 20 0 "[ . 1 . 2]" 1
1526 1 59 ASN HA 1 59 ASN HD21 . . 4.620 4.012 3.917 4.100 . 0 0 "[ . 1 . 2]" 1
1527 1 59 ASN HA 1 59 ASN HD22 . . 4.090 3.316 3.108 3.521 . 0 0 "[ . 1 . 2]" 1
1528 1 59 ASN HA 1 62 LEU H . . 4.920 4.125 3.918 4.324 . 0 0 "[ . 1 . 2]" 1
1529 1 59 ASN HA 1 62 LEU MD1 . . 3.690 2.780 2.569 3.020 . 0 0 "[ . 1 . 2]" 1
1530 1 59 ASN HA 1 63 LYS HB2 . . 4.730 4.554 4.176 4.752 0.022 3 0 "[ . 1 . 2]" 1
1531 1 59 ASN HA 1 74 ILE MD . . 5.390 3.173 3.024 3.363 . 0 0 "[ . 1 . 2]" 1
1532 1 59 ASN QB 1 60 GLN H . . 3.470 2.529 2.362 2.616 . 0 0 "[ . 1 . 2]" 1
1533 1 59 ASN HB2 1 60 GLN H . . 3.580 2.668 2.531 2.748 . 0 0 "[ . 1 . 2]" 1
1534 1 59 ASN HB2 1 74 ILE MD . . 4.850 4.200 4.111 4.344 . 0 0 "[ . 1 . 2]" 1
1535 1 59 ASN HB3 1 59 ASN HD22 . . 4.040 3.539 3.489 3.580 . 0 0 "[ . 1 . 2]" 1
1536 1 59 ASN HB3 1 60 GLN H . . 3.600 3.139 2.827 3.320 . 0 0 "[ . 1 . 2]" 1
1537 1 59 ASN HB3 1 62 LEU MD1 . . 5.070 4.614 4.322 4.877 . 0 0 "[ . 1 . 2]" 1
1538 1 59 ASN HB3 1 74 ILE MD . . 4.990 4.578 4.491 4.692 . 0 0 "[ . 1 . 2]" 1
1539 1 59 ASN HD21 1 69 MET HB3 . . 5.500 4.242 3.746 4.469 . 0 0 "[ . 1 . 2]" 1
1540 1 59 ASN HD21 1 74 ILE HB . . 5.440 4.203 3.819 4.625 . 0 0 "[ . 1 . 2]" 1
1541 1 59 ASN HD21 1 74 ILE MD . . 4.460 2.260 2.069 2.358 . 0 0 "[ . 1 . 2]" 1
1542 1 59 ASN HD22 1 74 ILE MD . . 4.760 2.423 2.340 2.554 . 0 0 "[ . 1 . 2]" 1
1543 1 60 GLN H 1 60 GLN HB2 . . 3.120 2.000 1.903 2.096 . 0 0 "[ . 1 . 2]" 1
1544 1 60 GLN H 1 60 GLN HB3 . . 3.200 2.952 2.394 3.308 0.108 1 0 "[ . 1 . 2]" 1
1545 1 60 GLN H 1 60 GLN QG . . 3.580 3.419 2.511 3.772 0.192 19 0 "[ . 1 . 2]" 1
1546 1 60 GLN H 1 61 ALA H . . 3.200 2.760 2.688 2.866 . 0 0 "[ . 1 . 2]" 1
1547 1 60 GLN H 1 61 ALA MB . . 5.070 4.355 4.271 4.450 . 0 0 "[ . 1 . 2]" 1
1548 1 60 GLN H 1 62 LEU H . . 4.730 4.685 4.536 4.749 0.019 14 0 "[ . 1 . 2]" 1
1549 1 60 GLN H 1 63 LYS H . . 5.490 4.887 4.763 4.989 . 0 0 "[ . 1 . 2]" 1
1550 1 60 GLN H 1 74 ILE MD . . 5.500 5.532 5.491 5.588 0.088 9 0 "[ . 1 . 2]" 1
1551 1 60 GLN HA 1 60 GLN QG . . 3.390 2.621 2.195 3.011 . 0 0 "[ . 1 . 2]" 1
1552 1 60 GLN HA 1 62 LEU H . . 4.740 4.142 3.776 4.349 . 0 0 "[ . 1 . 2]" 1
1553 1 60 GLN HA 1 63 LYS H . . 3.830 3.180 2.956 3.419 . 0 0 "[ . 1 . 2]" 1
1554 1 60 GLN HA 1 63 LYS HB2 . . 3.730 2.689 2.475 3.173 . 0 0 "[ . 1 . 2]" 1
1555 1 60 GLN HA 1 63 LYS HB3 . . 3.710 2.420 2.128 2.626 . 0 0 "[ . 1 . 2]" 1
1556 1 60 GLN HA 1 63 LYS QD . . 3.860 3.418 2.840 3.889 0.029 2 0 "[ . 1 . 2]" 1
1557 1 60 GLN HA 1 63 LYS QE . . 5.160 3.314 2.054 4.589 . 0 0 "[ . 1 . 2]" 1
1558 1 60 GLN HA 1 63 LYS HG2 . . 4.650 4.394 3.986 4.672 0.022 13 0 "[ . 1 . 2]" 1
1559 1 60 GLN HA 1 63 LYS HG3 . . 4.920 4.929 4.727 4.993 0.073 11 0 "[ . 1 . 2]" 1
1560 1 60 GLN HA 1 64 GLU H . . 4.870 4.791 4.379 4.925 0.055 20 0 "[ . 1 . 2]" 1
1561 1 60 GLN HB2 1 60 GLN HE22 . . 5.500 4.296 3.762 4.665 . 0 0 "[ . 1 . 2]" 1
1562 1 60 GLN HB2 1 61 ALA H . . 3.750 3.613 2.959 3.839 0.089 3 0 "[ . 1 . 2]" 1
1563 1 60 GLN HB3 1 61 ALA H . . 3.500 3.216 2.712 3.558 0.058 6 0 "[ . 1 . 2]" 1
1564 1 60 GLN HB3 1 61 ALA HA . . 4.540 4.130 3.825 4.361 . 0 0 "[ . 1 . 2]" 1
1565 1 60 GLN HB3 1 61 ALA MB . . 4.880 4.383 3.915 4.745 . 0 0 "[ . 1 . 2]" 1
1566 1 60 GLN HB3 1 62 LEU H . . 5.400 5.335 5.164 5.417 0.017 11 0 "[ . 1 . 2]" 1
1567 1 60 GLN HE21 1 63 LYS HB3 . . 4.940 4.112 3.221 4.945 0.005 12 0 "[ . 1 . 2]" 1
1568 1 60 GLN HE21 1 63 LYS QE . . 4.640 4.053 2.514 4.655 0.015 16 0 "[ . 1 . 2]" 1
1569 1 60 GLN HE22 1 63 LYS HB3 . . 4.410 4.035 3.139 4.463 0.053 10 0 "[ . 1 . 2]" 1
1570 1 60 GLN QG 1 61 ALA H . . 4.830 4.549 3.951 4.875 0.045 6 0 "[ . 1 . 2]" 1
1571 1 61 ALA H 1 61 ALA MB . . 2.910 2.188 2.152 2.232 . 0 0 "[ . 1 . 2]" 1
1572 1 61 ALA H 1 62 LEU H . . 3.190 2.775 2.737 2.828 . 0 0 "[ . 1 . 2]" 1
1573 1 61 ALA H 1 62 LEU HA . . 5.370 5.414 5.391 5.445 0.075 9 0 "[ . 1 . 2]" 1
1574 1 61 ALA H 1 62 LEU QB . . 5.260 5.127 5.024 5.205 . 0 0 "[ . 1 . 2]" 1
1575 1 61 ALA H 1 62 LEU MD1 . . 3.630 3.627 3.492 3.665 0.035 2 0 "[ . 1 . 2]" 1
1576 1 61 ALA MB 1 62 LEU H . . 3.280 2.614 2.434 2.884 . 0 0 "[ . 1 . 2]" 1
1577 1 61 ALA MB 1 62 LEU HA . . 5.110 4.184 4.074 4.341 . 0 0 "[ . 1 . 2]" 1
1578 1 61 ALA MB 1 62 LEU MD1 . . 3.930 2.751 2.353 3.059 . 0 0 "[ . 1 . 2]" 1
1579 1 61 ALA MB 1 63 LYS H . . 5.430 4.384 4.251 4.516 . 0 0 "[ . 1 . 2]" 1
1580 1 62 LEU H 1 62 LEU QB . . 2.990 2.911 2.823 2.996 0.006 6 0 "[ . 1 . 2]" 1
1581 1 62 LEU H 1 62 LEU MD1 . . 3.720 1.979 1.879 2.074 . 0 0 "[ . 1 . 2]" 1
1582 1 62 LEU H 1 62 LEU MD2 . . 3.990 3.730 3.586 3.834 . 0 0 "[ . 1 . 2]" 1
1583 1 62 LEU H 1 62 LEU HG . . 4.590 4.002 3.901 4.111 . 0 0 "[ . 1 . 2]" 1
1584 1 62 LEU H 1 63 LYS H . . 3.300 2.165 2.025 2.307 . 0 0 "[ . 1 . 2]" 1
1585 1 62 LEU H 1 63 LYS HB2 . . 4.320 4.314 4.235 4.343 0.023 15 0 "[ . 1 . 2]" 1
1586 1 62 LEU H 1 64 GLU H . . 5.420 4.606 4.317 4.871 . 0 0 "[ . 1 . 2]" 1
1587 1 62 LEU HA 1 62 LEU MD1 . . 4.470 3.610 3.579 3.632 . 0 0 "[ . 1 . 2]" 1
1588 1 62 LEU HA 1 63 LYS HA . . 4.900 4.913 4.874 4.954 0.054 3 0 "[ . 1 . 2]" 1
1589 1 62 LEU HA 1 64 GLU H . . 4.340 3.595 3.465 3.688 . 0 0 "[ . 1 . 2]" 1
1590 1 62 LEU HA 1 65 GLU H . . 3.990 3.437 3.179 3.951 . 0 0 "[ . 1 . 2]" 1
1591 1 62 LEU HA 1 65 GLU HB2 . . 4.860 3.083 2.754 4.104 . 0 0 "[ . 1 . 2]" 1
1592 1 62 LEU HA 1 65 GLU HB3 . . 4.550 4.012 2.836 4.620 0.070 14 0 "[ . 1 . 2]" 1
1593 1 62 LEU HA 1 65 GLU QG . . 3.890 3.886 2.957 4.006 0.116 7 0 "[ . 1 . 2]" 1
1594 1 62 LEU HA 1 66 ILE H . . 4.460 4.194 3.957 4.386 . 0 0 "[ . 1 . 2]" 1
1595 1 62 LEU QB 1 62 LEU MD1 . . 3.050 2.510 2.445 2.568 . 0 0 "[ . 1 . 2]" 1
1596 1 62 LEU QB 1 62 LEU MD2 . . 2.930 2.169 2.132 2.217 . 0 0 "[ . 1 . 2]" 1
1597 1 62 LEU QB 1 63 LYS H . . 3.960 3.966 3.919 3.993 0.033 9 0 "[ . 1 . 2]" 1
1598 1 62 LEU QB 1 64 GLU H . . 4.860 4.912 4.883 4.936 0.076 7 0 "[ . 1 . 2]" 1
1599 1 62 LEU QB 1 66 ILE H . . 4.350 3.680 3.417 3.923 . 0 0 "[ . 1 . 2]" 1
1600 1 62 LEU MD1 1 63 LYS HA . . 4.350 3.678 3.423 3.974 . 0 0 "[ . 1 . 2]" 1
1601 1 62 LEU MD2 1 63 LYS H . . 5.070 3.601 3.385 3.780 . 0 0 "[ . 1 . 2]" 1
1602 1 62 LEU MD2 1 63 LYS HA . . 4.240 3.146 2.921 3.422 . 0 0 "[ . 1 . 2]" 1
1603 1 62 LEU MD2 1 65 GLU H . . 4.780 4.054 3.846 4.247 . 0 0 "[ . 1 . 2]" 1
1604 1 62 LEU MD2 1 66 ILE H . . 4.400 2.807 2.481 3.081 . 0 0 "[ . 1 . 2]" 1
1605 1 62 LEU MD2 1 66 ILE HB . . 3.320 2.213 2.057 2.341 . 0 0 "[ . 1 . 2]" 1
1606 1 62 LEU MD2 1 67 LYS HA . . 3.970 4.055 4.013 4.098 0.128 6 0 "[ . 1 . 2]" 1
1607 1 62 LEU MD2 1 69 MET ME . . 3.740 3.159 1.958 3.758 0.018 8 0 "[ . 1 . 2]" 1
1608 1 62 LEU HG 1 63 LYS H . . 5.310 5.174 4.977 5.325 0.015 7 0 "[ . 1 . 2]" 1
1609 1 63 LYS H 1 63 LYS HB2 . . 3.160 2.536 2.430 2.665 . 0 0 "[ . 1 . 2]" 1
1610 1 63 LYS H 1 63 LYS HB3 . . 3.290 2.383 2.117 2.466 . 0 0 "[ . 1 . 2]" 1
1611 1 63 LYS H 1 63 LYS QE . . 5.430 4.580 4.115 5.507 0.077 10 0 "[ . 1 . 2]" 1
1612 1 63 LYS H 1 63 LYS HG2 . . 4.370 4.363 4.115 4.412 0.042 7 0 "[ . 1 . 2]" 1
1613 1 63 LYS H 1 63 LYS HG3 . . 4.560 4.415 4.344 4.446 . 0 0 "[ . 1 . 2]" 1
1614 1 63 LYS H 1 64 GLU H . . 3.700 2.941 2.848 2.995 . 0 0 "[ . 1 . 2]" 1
1615 1 63 LYS H 1 64 GLU HA . . 5.370 5.409 5.381 5.431 0.061 3 0 "[ . 1 . 2]" 1
1616 1 63 LYS H 1 65 GLU H . . 5.120 4.264 4.134 4.396 . 0 0 "[ . 1 . 2]" 1
1617 1 63 LYS H 1 66 ILE H . . 5.100 4.894 4.754 5.113 0.013 19 0 "[ . 1 . 2]" 1
1618 1 63 LYS HA 1 63 LYS HB2 . . 3.010 2.398 2.353 2.445 . 0 0 "[ . 1 . 2]" 1
1619 1 63 LYS HA 1 63 LYS QD . . 4.060 3.981 3.691 4.162 0.102 1 0 "[ . 1 . 2]" 1
1620 1 63 LYS HA 1 63 LYS HG2 . . 3.680 3.463 3.304 3.686 0.006 4 0 "[ . 1 . 2]" 1
1621 1 63 LYS HA 1 63 LYS HG3 . . 3.640 2.543 2.385 2.834 . 0 0 "[ . 1 . 2]" 1
1622 1 63 LYS HA 1 65 GLU H . . 4.610 3.948 3.646 4.229 . 0 0 "[ . 1 . 2]" 1
1623 1 63 LYS HA 1 66 ILE H . . 4.140 3.786 3.485 4.155 0.015 13 0 "[ . 1 . 2]" 1
1624 1 63 LYS HA 1 67 LYS H . . 5.390 4.666 4.313 4.918 . 0 0 "[ . 1 . 2]" 1
1625 1 63 LYS HB2 1 63 LYS QE . . 4.140 2.697 1.962 4.003 . 0 0 "[ . 1 . 2]" 1
1626 1 63 LYS HB3 1 63 LYS QD . . 3.170 2.846 2.437 3.183 0.013 2 0 "[ . 1 . 2]" 1
1627 1 63 LYS HB3 1 64 GLU H . . 3.880 2.839 2.652 2.991 . 0 0 "[ . 1 . 2]" 1
1628 1 63 LYS QE 1 63 LYS HG3 . . 3.610 2.818 2.242 3.474 . 0 0 "[ . 1 . 2]" 1
1629 1 63 LYS QE 1 64 GLU H . . 5.500 5.114 4.310 5.529 0.029 17 0 "[ . 1 . 2]" 1
1630 1 63 LYS HG2 1 64 GLU H . . 4.570 3.600 3.266 3.818 . 0 0 "[ . 1 . 2]" 1
1631 1 63 LYS HG2 1 67 LYS HA . . 4.370 4.412 4.372 4.452 0.082 10 0 "[ . 1 . 2]" 1
1632 1 63 LYS HG3 1 64 GLU H . . 4.570 4.338 4.271 4.394 . 0 0 "[ . 1 . 2]" 1
1633 1 63 LYS HG3 1 64 GLU HA . . 4.090 4.181 4.152 4.216 0.126 14 0 "[ . 1 . 2]" 1
1634 1 63 LYS HG3 1 64 GLU HG3 . . 5.020 4.611 4.085 5.025 0.005 11 0 "[ . 1 . 2]" 1
1635 1 64 GLU H 1 64 GLU HB2 . . 3.640 2.114 2.005 2.312 . 0 0 "[ . 1 . 2]" 1
1636 1 64 GLU H 1 64 GLU HB3 . . 3.240 3.380 3.294 3.427 0.187 1 0 "[ . 1 . 2]" 1
1637 1 64 GLU H 1 64 GLU HG2 . . 4.090 3.849 3.207 4.138 0.048 11 0 "[ . 1 . 2]" 1
1638 1 64 GLU H 1 64 GLU HG3 . . 3.980 2.775 2.247 3.244 . 0 0 "[ . 1 . 2]" 1
1639 1 64 GLU H 1 65 GLU H . . 3.290 2.546 2.405 2.769 . 0 0 "[ . 1 . 2]" 1
1640 1 64 GLU H 1 66 ILE H . . 5.490 4.366 4.073 4.718 . 0 0 "[ . 1 . 2]" 1
1641 1 64 GLU HA 1 64 GLU HB2 . . 2.970 3.003 2.971 3.022 0.052 6 0 "[ . 1 . 2]" 1
1642 1 64 GLU HA 1 64 GLU HG3 . . 3.400 2.779 2.522 3.239 . 0 0 "[ . 1 . 2]" 1
1643 1 64 GLU HB2 1 65 GLU H . . 4.960 3.492 2.859 3.884 . 0 0 "[ . 1 . 2]" 1
1644 1 64 GLU HB3 1 65 GLU H . . 4.820 4.001 3.503 4.382 . 0 0 "[ . 1 . 2]" 1
1645 1 64 GLU HG3 1 65 GLU H . . 5.140 4.863 4.504 5.149 0.009 14 0 "[ . 1 . 2]" 1
1646 1 65 GLU H 1 65 GLU QB . . 3.580 2.201 2.066 2.334 . 0 0 "[ . 1 . 2]" 1
1647 1 65 GLU H 1 65 GLU HB3 . . 3.390 3.087 2.333 3.485 0.095 13 0 "[ . 1 . 2]" 1
1648 1 65 GLU H 1 65 GLU QG . . 3.920 3.686 2.901 3.956 0.036 5 0 "[ . 1 . 2]" 1
1649 1 65 GLU H 1 66 ILE H . . 3.080 2.289 2.062 2.606 . 0 0 "[ . 1 . 2]" 1
1650 1 65 GLU HA 1 65 GLU QG . . 3.430 2.839 2.519 3.178 . 0 0 "[ . 1 . 2]" 1
1651 1 65 GLU QB 1 66 ILE H . . 4.150 2.386 2.238 2.532 . 0 0 "[ . 1 . 2]" 1
1652 1 65 GLU QB 1 66 ILE MD . . 4.040 3.907 3.402 4.081 0.041 8 0 "[ . 1 . 2]" 1
1653 1 65 GLU HB3 1 66 ILE H . . 3.120 2.741 2.283 3.130 0.010 13 0 "[ . 1 . 2]" 1
1654 1 65 GLU QG 1 66 ILE H . . 4.690 4.024 3.022 4.405 . 0 0 "[ . 1 . 2]" 1
1655 1 66 ILE H 1 66 ILE HB . . 2.910 2.831 2.642 2.932 0.022 7 0 "[ . 1 . 2]" 1
1656 1 66 ILE H 1 66 ILE MD . . 5.270 4.202 3.476 4.569 . 0 0 "[ . 1 . 2]" 1
1657 1 66 ILE H 1 66 ILE HG12 . . 4.010 3.660 2.471 4.056 0.046 10 0 "[ . 1 . 2]" 1
1658 1 66 ILE H 1 66 ILE HG13 . . 3.840 3.353 3.075 3.919 0.079 18 0 "[ . 1 . 2]" 1
1659 1 66 ILE H 1 66 ILE MG . . 3.980 3.928 3.774 3.973 . 0 0 "[ . 1 . 2]" 1
1660 1 66 ILE HA 1 66 ILE MD . . 3.790 3.514 2.428 3.851 0.061 6 0 "[ . 1 . 2]" 1
1661 1 66 ILE HA 1 66 ILE HG12 . . 3.940 2.719 2.237 3.570 . 0 0 "[ . 1 . 2]" 1
1662 1 66 ILE HA 1 66 ILE MG . . 3.200 2.383 2.217 2.655 . 0 0 "[ . 1 . 2]" 1
1663 1 66 ILE HA 1 67 LYS H . . 3.070 2.271 2.164 2.365 . 0 0 "[ . 1 . 2]" 1
1664 1 66 ILE HA 1 67 LYS HG2 . . 5.500 4.580 3.885 5.542 0.042 6 0 "[ . 1 . 2]" 1
1665 1 66 ILE HB 1 67 LYS H . . 4.600 4.353 3.977 4.505 . 0 0 "[ . 1 . 2]" 1
1666 1 66 ILE MD 1 67 LYS H . . 5.420 5.165 4.452 5.478 0.058 8 0 "[ . 1 . 2]" 1
1667 1 66 ILE MG 1 67 LYS H . . 4.170 3.100 2.711 3.582 . 0 0 "[ . 1 . 2]" 1
1668 1 66 ILE MG 1 67 LYS HA . . 4.410 4.276 4.015 4.443 0.033 19 0 "[ . 1 . 2]" 1
1669 1 66 ILE MG 1 68 GLU H . . 3.500 2.341 2.076 2.757 . 0 0 "[ . 1 . 2]" 1
1670 1 66 ILE MG 1 68 GLU HA . . 4.550 4.483 4.236 4.588 0.038 2 0 "[ . 1 . 2]" 1
1671 1 66 ILE MG 1 69 MET H . . 5.500 4.885 4.522 5.426 . 0 0 "[ . 1 . 2]" 1
1672 1 67 LYS H 1 67 LYS HB2 . . 3.410 3.044 1.944 3.555 0.145 7 0 "[ . 1 . 2]" 1
1673 1 67 LYS H 1 67 LYS HB3 . . 3.760 2.998 2.298 3.729 . 0 0 "[ . 1 . 2]" 1
1674 1 67 LYS H 1 67 LYS QD . . 4.650 3.935 3.226 4.467 . 0 0 "[ . 1 . 2]" 1
1675 1 67 LYS H 1 67 LYS HG2 . . 4.110 2.832 1.980 3.908 . 0 0 "[ . 1 . 2]" 1
1676 1 67 LYS H 1 67 LYS HG3 . . 4.080 2.942 1.806 4.125 0.045 6 0 "[ . 1 . 2]" 1
1677 1 67 LYS H 1 68 GLU H . . 3.480 2.634 2.299 2.806 . 0 0 "[ . 1 . 2]" 1
1678 1 67 LYS HA 1 67 LYS HB2 . . 2.840 2.637 2.322 2.985 0.145 9 0 "[ . 1 . 2]" 1
1679 1 67 LYS HA 1 67 LYS QE . . 4.820 4.465 3.919 4.854 0.034 2 0 "[ . 1 . 2]" 1
1680 1 67 LYS HA 1 67 LYS HG2 . . 4.100 3.345 2.485 3.911 . 0 0 "[ . 1 . 2]" 1
1681 1 67 LYS HA 1 67 LYS HG3 . . 3.720 3.512 2.942 3.785 0.065 8 0 "[ . 1 . 2]" 1
1682 1 67 LYS HA 1 68 GLU H . . 3.560 3.353 3.142 3.514 . 0 0 "[ . 1 . 2]" 1
1683 1 67 LYS HA 1 69 MET ME . . 3.940 2.651 2.223 3.226 . 0 0 "[ . 1 . 2]" 1
1684 1 67 LYS HB2 1 68 GLU H . . 4.080 3.801 2.902 4.185 0.105 8 0 "[ . 1 . 2]" 1
1685 1 67 LYS HG3 1 68 GLU H . . 5.450 3.880 2.810 5.504 0.054 6 0 "[ . 1 . 2]" 1
1686 1 68 GLU H 1 68 GLU HB2 . . 3.790 2.282 1.889 3.647 . 0 0 "[ . 1 . 2]" 1
1687 1 68 GLU H 1 68 GLU HB3 . . 3.130 3.163 2.532 3.318 0.188 16 0 "[ . 1 . 2]" 1
1688 1 68 GLU H 1 68 GLU QG . . 3.990 2.737 1.801 3.760 . 0 0 "[ . 1 . 2]" 1
1689 1 68 GLU H 1 68 GLU HG3 . . 3.940 3.373 1.969 4.029 0.089 2 0 "[ . 1 . 2]" 1
1690 1 68 GLU H 1 69 MET H . . 4.780 3.659 3.447 4.003 . 0 0 "[ . 1 . 2]" 1
1691 1 68 GLU H 1 69 MET ME . . 5.270 4.477 3.768 5.218 . 0 0 "[ . 1 . 2]" 1
1692 1 68 GLU HA 1 68 GLU HB2 . . 2.940 2.878 2.345 3.002 0.062 17 0 "[ . 1 . 2]" 1
1693 1 68 GLU HA 1 68 GLU QG . . 3.580 2.596 2.093 3.392 . 0 0 "[ . 1 . 2]" 1
1694 1 68 GLU HA 1 69 MET H . . 3.570 2.724 2.359 2.964 . 0 0 "[ . 1 . 2]" 1
1695 1 68 GLU HA 1 70 HIS H . . 4.940 3.313 3.090 3.627 . 0 0 "[ . 1 . 2]" 1
1696 1 68 GLU HB2 1 70 HIS H . . 5.140 5.034 4.127 5.223 0.083 4 0 "[ . 1 . 2]" 1
1697 1 69 MET H 1 69 MET HG3 . . 4.690 3.243 2.226 4.066 . 0 0 "[ . 1 . 2]" 1
1698 1 69 MET HA 1 69 MET HG2 . . 4.010 3.251 2.459 3.603 . 0 0 "[ . 1 . 2]" 1
1699 1 69 MET HA 1 69 MET HG3 . . 3.670 2.345 2.060 2.837 . 0 0 "[ . 1 . 2]" 1
1700 1 69 MET HA 1 71 GLY H . . 4.770 3.130 2.817 3.737 . 0 0 "[ . 1 . 2]" 1
1701 1 69 MET HA 1 72 LEU HB2 . . 4.230 2.496 2.084 3.656 . 0 0 "[ . 1 . 2]" 1
1702 1 69 MET HA 1 72 LEU MD1 . . 3.730 2.494 1.983 3.456 . 0 0 "[ . 1 . 2]" 1
1703 1 69 MET HA 1 72 LEU MD2 . . 5.140 3.626 3.354 3.843 . 0 0 "[ . 1 . 2]" 1
1704 1 69 MET HA 1 72 LEU HG . . 4.480 3.605 2.056 4.514 0.034 10 0 "[ . 1 . 2]" 1
1705 1 69 MET HG2 1 72 LEU HB2 . . 3.920 3.476 2.747 3.963 0.043 8 0 "[ . 1 . 2]" 1
1706 1 69 MET HG2 1 72 LEU MD1 . . 5.360 3.283 2.173 4.568 . 0 0 "[ . 1 . 2]" 1
1707 1 69 MET HG3 1 72 LEU MD1 . . 5.350 2.582 2.041 3.237 . 0 0 "[ . 1 . 2]" 1
1708 1 69 MET HG3 1 72 LEU MD2 . . 3.830 3.225 2.185 3.883 0.053 6 0 "[ . 1 . 2]" 1
1709 1 70 HIS H 1 71 GLY H . . 4.720 2.573 2.345 2.758 . 0 0 "[ . 1 . 2]" 1
1710 1 70 HIS H 1 71 GLY HA2 . . 5.500 5.312 5.126 5.511 0.011 10 0 "[ . 1 . 2]" 1
1711 1 70 HIS HA 1 71 GLY H . . 3.400 3.452 3.404 3.478 0.078 3 0 "[ . 1 . 2]" 1
1712 1 70 HIS HA 1 72 LEU H . . 4.460 4.096 3.778 4.470 0.010 17 0 "[ . 1 . 2]" 1
1713 1 70 HIS HB2 1 71 GLY H . . 4.200 4.076 3.858 4.247 0.047 18 0 "[ . 1 . 2]" 1
1714 1 70 HIS HB3 1 71 GLY H . . 4.680 3.619 2.628 4.493 . 0 0 "[ . 1 . 2]" 1
1715 1 71 GLY H 1 72 LEU H . . 4.500 2.495 2.155 2.937 . 0 0 "[ . 1 . 2]" 1
1716 1 71 GLY H 1 72 LEU MD1 . . 5.500 3.814 2.842 5.330 . 0 0 "[ . 1 . 2]" 1
1717 1 71 GLY H 1 72 LEU MD2 . . 5.500 5.079 4.058 5.555 0.055 18 0 "[ . 1 . 2]" 1
1718 1 71 GLY H 1 72 LEU HG . . 5.500 4.824 3.630 5.502 0.002 16 0 "[ . 1 . 2]" 1
1719 1 71 GLY HA2 1 72 LEU H . . 3.450 3.463 3.395 3.509 0.059 16 0 "[ . 1 . 2]" 1
1720 1 71 GLY HA3 1 72 LEU H . . 3.210 3.103 2.869 3.231 0.021 4 0 "[ . 1 . 2]" 1
1721 1 71 GLY HA3 1 72 LEU HA . . 4.900 4.292 4.109 4.426 . 0 0 "[ . 1 . 2]" 1
1722 1 71 GLY HA3 1 72 LEU MD1 . . 5.100 3.761 2.545 5.188 0.088 2 0 "[ . 1 . 2]" 1
1723 1 72 LEU H 1 72 LEU HB2 . . 3.460 2.446 2.318 2.555 . 0 0 "[ . 1 . 2]" 1
1724 1 72 LEU H 1 72 LEU HB3 . . 4.020 3.634 3.560 3.714 . 0 0 "[ . 1 . 2]" 1
1725 1 72 LEU H 1 72 LEU MD1 . . 4.450 3.034 2.226 4.066 . 0 0 "[ . 1 . 2]" 1
1726 1 72 LEU H 1 72 LEU MD2 . . 4.670 3.887 3.062 4.435 . 0 0 "[ . 1 . 2]" 1
1727 1 72 LEU H 1 72 LEU HG . . 4.010 3.377 2.558 3.934 . 0 0 "[ . 1 . 2]" 1
1728 1 72 LEU H 1 73 ARG H . . 4.780 4.470 4.227 4.591 . 0 0 "[ . 1 . 2]" 1
1729 1 72 LEU HA 1 72 LEU MD1 . . 4.070 3.173 2.877 3.597 . 0 0 "[ . 1 . 2]" 1
1730 1 72 LEU HA 1 72 LEU MD2 . . 3.290 2.867 1.941 3.368 0.078 14 0 "[ . 1 . 2]" 1
1731 1 72 LEU HA 1 72 LEU HG . . 4.140 2.472 2.017 3.348 . 0 0 "[ . 1 . 2]" 1
1732 1 72 LEU HA 1 73 ARG H . . 2.890 1.993 1.845 2.104 . 0 0 "[ . 1 . 2]" 1
1733 1 72 LEU HA 1 73 ARG HA . . 5.120 4.423 4.331 4.491 . 0 0 "[ . 1 . 2]" 1
1734 1 72 LEU HA 1 73 ARG QB . . 4.440 3.833 3.610 4.097 . 0 0 "[ . 1 . 2]" 1
1735 1 72 LEU HA 1 74 ILE H . . 5.500 5.461 5.168 5.556 0.056 17 0 "[ . 1 . 2]" 1
1736 1 72 LEU HB2 1 72 LEU MD1 . . 3.660 2.474 2.370 2.597 . 0 0 "[ . 1 . 2]" 1
1737 1 72 LEU HB2 1 73 ARG H . . 4.990 4.195 4.031 4.426 . 0 0 "[ . 1 . 2]" 1
1738 1 72 LEU HB3 1 72 LEU MD2 . . 3.570 2.271 2.137 2.514 . 0 0 "[ . 1 . 2]" 1
1739 1 72 LEU HB3 1 73 ARG H . . 3.990 3.110 2.763 3.554 . 0 0 "[ . 1 . 2]" 1
1740 1 72 LEU HB3 1 74 ILE HG13 . . 4.810 3.242 2.934 3.570 . 0 0 "[ . 1 . 2]" 1
1741 1 72 LEU HB3 1 74 ILE MG . . 5.500 4.786 4.127 5.222 . 0 0 "[ . 1 . 2]" 1
1742 1 72 LEU MD1 1 73 ARG H . . 4.550 4.590 4.561 4.624 0.074 20 0 "[ . 1 . 2]" 1
1743 1 72 LEU MD2 1 73 ARG H . . 4.420 3.813 3.134 4.423 0.003 20 0 "[ . 1 . 2]" 1
1744 1 72 LEU MD2 1 74 ILE MG . . 5.180 5.015 4.596 5.246 0.066 6 0 "[ . 1 . 2]" 1
1745 1 72 LEU HG 1 73 ARG H . . 5.190 4.104 3.463 5.185 . 0 0 "[ . 1 . 2]" 1
1746 1 73 ARG H 1 73 ARG QB . . 3.400 2.461 2.316 2.639 . 0 0 "[ . 1 . 2]" 1
1747 1 73 ARG H 1 73 ARG HD2 . . 5.500 5.181 4.880 5.473 . 0 0 "[ . 1 . 2]" 1
1748 1 73 ARG H 1 73 ARG HG2 . . 5.130 4.577 4.492 4.647 . 0 0 "[ . 1 . 2]" 1
1749 1 73 ARG H 1 73 ARG HG3 . . 5.010 4.569 4.208 4.744 . 0 0 "[ . 1 . 2]" 1
1750 1 73 ARG H 1 74 ILE H . . 4.930 4.088 3.828 4.419 . 0 0 "[ . 1 . 2]" 1
1751 1 73 ARG H 1 74 ILE HG12 . . 5.150 3.911 3.443 4.476 . 0 0 "[ . 1 . 2]" 1
1752 1 73 ARG HA 1 73 ARG HD2 . . 4.420 4.382 4.290 4.468 0.048 8 0 "[ . 1 . 2]" 1
1753 1 73 ARG HA 1 73 ARG HD3 . . 4.410 4.472 4.441 4.493 0.083 1 0 "[ . 1 . 2]" 1
1754 1 73 ARG HA 1 73 ARG HG2 . . 4.180 2.678 2.478 2.781 . 0 0 "[ . 1 . 2]" 1
1755 1 73 ARG HA 1 74 ILE H . . 2.760 2.179 2.115 2.229 . 0 0 "[ . 1 . 2]" 1
1756 1 73 ARG HA 1 74 ILE HB . . 5.080 4.998 4.870 5.099 0.019 9 0 "[ . 1 . 2]" 1
1757 1 73 ARG HA 1 74 ILE HG12 . . 4.730 4.454 4.189 4.640 . 0 0 "[ . 1 . 2]" 1
1758 1 73 ARG HA 1 75 PHE QE . . 5.080 4.484 4.163 4.753 . 0 0 "[ . 1 . 2]" 1
1759 1 73 ARG QB 1 73 ARG HD2 . . 3.780 2.386 2.277 2.507 . 0 0 "[ . 1 . 2]" 1
1760 1 73 ARG QB 1 73 ARG HD3 . . 3.760 2.613 2.280 3.349 . 0 0 "[ . 1 . 2]" 1
1761 1 73 ARG QB 1 74 ILE H . . 4.010 3.985 3.770 4.027 0.017 3 0 "[ . 1 . 2]" 1
1762 1 73 ARG QB 1 75 PHE QE . . 3.620 2.898 2.415 3.593 . 0 0 "[ . 1 . 2]" 1
1763 1 73 ARG HD2 1 75 PHE QE . . 4.080 3.737 2.439 4.110 0.030 20 0 "[ . 1 . 2]" 1
1764 1 73 ARG HD3 1 75 PHE QE . . 4.080 2.780 2.240 4.008 . 0 0 "[ . 1 . 2]" 1
1765 1 73 ARG HG2 1 74 ILE H . . 4.710 3.616 3.167 4.099 . 0 0 "[ . 1 . 2]" 1
1766 1 73 ARG HG2 1 75 PHE QE . . 5.350 2.448 2.326 2.547 . 0 0 "[ . 1 . 2]" 1
1767 1 73 ARG HG3 1 74 ILE H . . 4.880 4.084 3.745 4.388 . 0 0 "[ . 1 . 2]" 1
1768 1 73 ARG HG3 1 75 PHE QE . . 4.020 4.030 4.018 4.048 0.028 10 0 "[ . 1 . 2]" 1
1769 1 74 ILE H 1 74 ILE HB . . 3.120 2.878 2.783 3.014 . 0 0 "[ . 1 . 2]" 1
1770 1 74 ILE H 1 74 ILE MD . . 5.070 3.980 3.916 4.196 . 0 0 "[ . 1 . 2]" 1
1771 1 74 ILE H 1 74 ILE HG12 . . 3.660 3.294 3.086 3.603 . 0 0 "[ . 1 . 2]" 1
1772 1 74 ILE H 1 74 ILE HG13 . . 4.270 2.403 2.294 2.718 . 0 0 "[ . 1 . 2]" 1
1773 1 74 ILE H 1 74 ILE MG . . 4.270 3.947 3.909 4.021 . 0 0 "[ . 1 . 2]" 1
1774 1 74 ILE H 1 75 PHE H . . 4.670 4.429 4.338 4.496 . 0 0 "[ . 1 . 2]" 1
1775 1 74 ILE H 1 75 PHE QE . . 5.370 4.772 4.478 5.074 . 0 0 "[ . 1 . 2]" 1
1776 1 74 ILE HA 1 74 ILE HG12 . . 3.870 2.858 2.701 3.083 . 0 0 "[ . 1 . 2]" 1
1777 1 74 ILE HA 1 74 ILE HG13 . . 3.700 3.524 3.434 3.635 . 0 0 "[ . 1 . 2]" 1
1778 1 74 ILE HA 1 74 ILE MG . . 3.330 2.309 2.248 2.342 . 0 0 "[ . 1 . 2]" 1
1779 1 74 ILE HA 1 75 PHE H . . 2.830 1.884 1.836 1.933 . 0 0 "[ . 1 . 2]" 1
1780 1 74 ILE HA 1 75 PHE HA . . 4.750 4.281 4.232 4.318 . 0 0 "[ . 1 . 2]" 1
1781 1 74 ILE HA 1 75 PHE HB3 . . 4.860 5.044 5.016 5.082 0.222 20 0 "[ . 1 . 2]" 1
1782 1 74 ILE HA 1 75 PHE QD . . 5.090 2.865 2.549 3.955 . 0 0 "[ . 1 . 2]" 1
1783 1 74 ILE HB 1 74 ILE MD . . 2.400 2.423 2.409 2.437 0.037 15 0 "[ . 1 . 2]" 1
1784 1 74 ILE HB 1 75 PHE H . . 4.160 3.714 3.625 3.875 . 0 0 "[ . 1 . 2]" 1
1785 1 74 ILE MD 1 74 ILE MG . . 3.210 2.029 2.005 2.054 . 0 0 "[ . 1 . 2]" 1
1786 1 74 ILE HG12 1 74 ILE MG . . 3.350 2.552 2.377 2.664 . 0 0 "[ . 1 . 2]" 1
1787 1 74 ILE HG12 1 75 PHE H . . 5.480 4.453 4.275 4.760 . 0 0 "[ . 1 . 2]" 1
1788 1 74 ILE HG13 1 74 ILE MG . . 3.220 3.218 3.181 3.232 0.012 13 0 "[ . 1 . 2]" 1
1789 1 74 ILE MG 1 75 PHE H . . 3.590 2.198 2.103 2.389 . 0 0 "[ . 1 . 2]" 1
1790 1 74 ILE MG 1 75 PHE HA . . 4.900 3.933 3.740 4.309 . 0 0 "[ . 1 . 2]" 1
1791 1 74 ILE MG 1 75 PHE HB2 . . 5.380 4.088 3.962 4.213 . 0 0 "[ . 1 . 2]" 1
1792 1 74 ILE MG 1 75 PHE QD . . 5.500 4.274 4.081 4.660 . 0 0 "[ . 1 . 2]" 1
1793 1 74 ILE MG 1 76 THR H . . 4.530 4.365 4.093 4.555 0.025 12 0 "[ . 1 . 2]" 1
1794 1 74 ILE MG 1 76 THR HA . . 4.800 4.629 4.428 4.823 0.023 6 0 "[ . 1 . 2]" 1
1795 1 74 ILE MG 1 76 THR MG . . 3.240 2.467 2.174 2.859 . 0 0 "[ . 1 . 2]" 1
1796 1 75 PHE H 1 75 PHE HB2 . . 3.970 2.308 2.214 2.398 . 0 0 "[ . 1 . 2]" 1
1797 1 75 PHE H 1 75 PHE HB3 . . 3.680 3.511 3.445 3.574 . 0 0 "[ . 1 . 2]" 1
1798 1 75 PHE H 1 75 PHE QD . . 3.790 2.826 2.608 3.377 . 0 0 "[ . 1 . 2]" 1
1799 1 75 PHE H 1 75 PHE QE . . 4.850 4.884 4.866 4.902 0.052 13 0 "[ . 1 . 2]" 1
1800 1 75 PHE H 1 76 THR H . . 4.550 4.252 3.921 4.375 . 0 0 "[ . 1 . 2]" 1
1801 1 75 PHE H 1 76 THR MG . . 5.050 3.830 3.646 4.092 . 0 0 "[ . 1 . 2]" 1
1802 1 75 PHE HA 1 75 PHE QD . . 3.790 2.908 2.413 3.225 . 0 0 "[ . 1 . 2]" 1
1803 1 75 PHE HA 1 75 PHE QE . . 4.860 4.725 4.482 4.883 0.023 19 0 "[ . 1 . 2]" 1
1804 1 75 PHE HA 1 76 THR H . . 2.780 2.187 2.117 2.271 . 0 0 "[ . 1 . 2]" 1
1805 1 75 PHE HA 1 76 THR HA . . 5.100 4.595 4.546 4.643 . 0 0 "[ . 1 . 2]" 1
1806 1 75 PHE HA 1 76 THR MG . . 5.210 4.048 3.880 4.372 . 0 0 "[ . 1 . 2]" 1
1807 1 75 PHE HB2 1 76 THR H . . 4.920 4.335 4.195 4.529 . 0 0 "[ . 1 . 2]" 1
1808 1 75 PHE HB3 1 76 THR H . . 4.530 3.557 3.277 4.087 . 0 0 "[ . 1 . 2]" 1
1809 1 75 PHE QD 1 76 THR H . . 4.840 4.387 4.029 4.655 . 0 0 "[ . 1 . 2]" 1
1810 1 76 THR H 1 76 THR HB . . 3.880 3.779 3.590 3.862 . 0 0 "[ . 1 . 2]" 1
1811 1 76 THR H 1 76 THR MG . . 4.080 3.178 2.835 3.354 . 0 0 "[ . 1 . 2]" 1
1812 1 76 THR HA 1 76 THR MG . . 3.160 2.383 2.312 2.450 . 0 0 "[ . 1 . 2]" 1
1813 1 76 THR HA 1 77 SER H . . 2.810 2.154 2.065 2.243 . 0 0 "[ . 1 . 2]" 1
1814 1 76 THR HA 1 77 SER HA . . 4.540 4.456 4.399 4.527 . 0 0 "[ . 1 . 2]" 1
1815 1 76 THR HA 1 77 SER HB2 . . 5.420 5.484 5.051 5.556 0.136 5 0 "[ . 1 . 2]" 1
1816 1 76 THR HA 1 77 SER HB3 . . 5.310 4.851 4.341 5.255 . 0 0 "[ . 1 . 2]" 1
1817 1 76 THR HB 1 77 SER H . . 3.540 2.691 2.488 3.009 . 0 0 "[ . 1 . 2]" 1
1818 1 76 THR HB 1 77 SER HA . . 3.930 3.959 3.944 3.978 0.048 17 0 "[ . 1 . 2]" 1
1819 1 76 THR MG 1 77 SER H . . 3.950 3.606 3.458 3.752 . 0 0 "[ . 1 . 2]" 1
1820 1 77 SER H 1 77 SER HB3 . . 3.970 3.673 2.761 3.913 . 0 0 "[ . 1 . 2]" 1
1821 1 77 SER H 1 78 VAL MG1 . . 5.500 5.308 5.063 5.519 0.019 14 0 "[ . 1 . 2]" 1
1822 1 77 SER HA 1 77 SER HB3 . . 2.900 2.341 2.253 2.944 0.044 4 0 "[ . 1 . 2]" 1
1823 1 77 SER HA 1 78 VAL H . . 2.860 2.557 2.447 2.628 . 0 0 "[ . 1 . 2]" 1
1824 1 77 SER HB2 1 78 VAL H . . 3.070 2.266 2.069 3.101 0.031 4 0 "[ . 1 . 2]" 1
1825 1 77 SER HB2 1 78 VAL MG1 . . 4.680 4.297 4.125 4.724 0.044 4 0 "[ . 1 . 2]" 1
1826 1 77 SER HB3 1 78 VAL H . . 3.360 3.373 3.149 3.416 0.056 5 0 "[ . 1 . 2]" 1
1827 1 77 SER HB3 1 78 VAL MG1 . . 5.430 5.003 4.783 5.335 . 0 0 "[ . 1 . 2]" 1
1828 1 78 VAL H 1 78 VAL HB . . 3.530 3.335 3.254 3.490 . 0 0 "[ . 1 . 2]" 1
1829 1 78 VAL H 1 78 VAL MG1 . . 3.240 2.381 2.272 2.574 . 0 0 "[ . 1 . 2]" 1
1830 1 78 VAL H 1 78 VAL MG2 . . 4.050 3.975 3.935 4.054 0.004 4 0 "[ . 1 . 2]" 1
1831 1 78 VAL H 1 79 PRO HA . . 5.390 4.835 4.576 4.969 . 0 0 "[ . 1 . 2]" 1
1832 1 78 VAL H 1 79 PRO HD3 . . 5.350 4.576 4.342 4.740 . 0 0 "[ . 1 . 2]" 1
1833 1 78 VAL HA 1 78 VAL MG2 . . 3.570 2.351 2.276 2.427 . 0 0 "[ . 1 . 2]" 1
1834 1 78 VAL HA 1 79 PRO HD2 . . 3.210 2.289 2.164 2.434 . 0 0 "[ . 1 . 2]" 1
1835 1 78 VAL HA 1 79 PRO HD3 . . 3.170 2.258 2.192 2.320 . 0 0 "[ . 1 . 2]" 1
1836 1 78 VAL HA 1 79 PRO HG2 . . 4.670 4.443 4.359 4.527 . 0 0 "[ . 1 . 2]" 1
1837 1 78 VAL HA 1 79 PRO HG3 . . 4.330 4.384 4.363 4.403 0.073 3 0 "[ . 1 . 2]" 1
1838 1 78 VAL MG1 1 79 PRO HD2 . . 4.720 4.276 4.159 4.379 . 0 0 "[ . 1 . 2]" 1
1839 1 78 VAL MG1 1 79 PRO HD3 . . 5.010 4.824 4.745 4.897 . 0 0 "[ . 1 . 2]" 1
1840 1 78 VAL MG2 1 79 PRO HA . . 5.500 4.212 3.990 4.359 . 0 0 "[ . 1 . 2]" 1
1841 1 78 VAL MG2 1 79 PRO HD2 . . 3.540 2.038 1.960 2.192 . 0 0 "[ . 1 . 2]" 1
1842 1 78 VAL MG2 1 79 PRO HD3 . . 3.710 3.345 3.185 3.504 . 0 0 "[ . 1 . 2]" 1
1843 1 78 VAL MG2 1 79 PRO HG3 . . 5.260 4.392 4.284 4.571 . 0 0 "[ . 1 . 2]" 1
1844 1 79 PRO HA 1 80 LYS H . . 2.750 2.120 1.943 2.263 . 0 0 "[ . 1 . 2]" 1
1845 1 79 PRO HA 1 80 LYS HB3 . . 4.870 4.736 4.332 4.969 0.099 8 0 "[ . 1 . 2]" 1
1846 1 79 PRO HA 1 81 ARG H . . 5.360 4.622 3.864 5.407 0.047 10 0 "[ . 1 . 2]" 1
1847 1 79 PRO HB2 1 80 LYS H . . 4.120 3.736 3.373 4.123 0.003 4 0 "[ . 1 . 2]" 1
1848 1 79 PRO HB2 1 81 ARG H . . 5.240 4.470 3.730 5.273 0.033 7 0 "[ . 1 . 2]" 1
1849 1 79 PRO HB3 1 80 LYS H . . 4.180 4.144 3.932 4.254 0.074 16 0 "[ . 1 . 2]" 1
1850 1 80 LYS H 1 80 LYS HB3 . . 3.370 2.987 2.581 3.423 0.053 8 0 "[ . 1 . 2]" 1
1851 1 80 LYS H 1 80 LYS HG2 . . 4.250 4.237 3.621 4.385 0.135 2 0 "[ . 1 . 2]" 1
1852 1 80 LYS H 1 80 LYS HG3 . . 4.710 4.608 3.774 4.773 0.063 3 0 "[ . 1 . 2]" 1
1853 1 80 LYS H 1 81 ARG H . . 4.040 3.113 2.274 3.832 . 0 0 "[ . 1 . 2]" 1
1854 1 80 LYS HA 1 80 LYS QE . . 4.430 4.126 3.509 4.442 0.012 4 0 "[ . 1 . 2]" 1
1855 1 80 LYS HA 1 80 LYS HG2 . . 4.040 2.775 2.183 3.387 . 0 0 "[ . 1 . 2]" 1
1856 1 80 LYS HA 1 80 LYS HG3 . . 3.760 3.022 2.400 3.682 . 0 0 "[ . 1 . 2]" 1
1857 1 80 LYS HA 1 81 ARG H . . 2.830 2.506 2.083 2.897 0.067 18 0 "[ . 1 . 2]" 1
1858 1 80 LYS HB3 1 80 LYS QE . . 4.220 3.875 2.285 4.251 0.031 3 0 "[ . 1 . 2]" 1
1859 1 80 LYS HB3 1 81 ARG H . . 4.510 4.359 4.000 4.536 0.026 16 0 "[ . 1 . 2]" 1
1860 1 80 LYS HB3 1 81 ARG HA . . 5.500 5.037 4.503 5.502 0.002 9 0 "[ . 1 . 2]" 1
1861 1 81 ARG H 1 81 ARG HB2 . . 3.700 2.814 2.268 3.729 0.029 7 0 "[ . 1 . 2]" 1
1862 1 81 ARG H 1 81 ARG HB3 . . 3.570 2.891 2.189 3.649 0.079 12 0 "[ . 1 . 2]" 1
1863 1 81 ARG H 1 81 ARG QD . . 5.260 4.365 2.925 4.892 . 0 0 "[ . 1 . 2]" 1
1864 1 81 ARG H 1 81 ARG QG . . 4.910 3.478 2.108 4.164 . 0 0 "[ . 1 . 2]" 1
1865 1 81 ARG HA 1 81 ARG QG . . 3.230 2.603 2.236 3.301 0.071 5 0 "[ . 1 . 2]" 1
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