NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
414894 |
2d7n   |
10329 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2d7n
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 1770
_Distance_constraint_stats_list.Viol_count 410
_Distance_constraint_stats_list.Viol_total 64.037
_Distance_constraint_stats_list.Viol_max 0.050
_Distance_constraint_stats_list.Viol_rms 0.0014
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0001
_Distance_constraint_stats_list.Viol_average_violations_only 0.0078
_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 6 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 LEU 0.047 0.010 12 0 "[ . 1 . 2]"
1 9 ARG 0.030 0.005 8 0 "[ . 1 . 2]"
1 10 PRO 0.018 0.006 5 0 "[ . 1 . 2]"
1 11 PHE 0.054 0.008 12 0 "[ . 1 . 2]"
1 12 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 LEU 0.009 0.005 7 0 "[ . 1 . 2]"
1 14 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 ILE 0.094 0.008 17 0 "[ . 1 . 2]"
1 16 PRO 0.036 0.009 3 0 "[ . 1 . 2]"
1 17 PHE 0.030 0.005 9 0 "[ . 1 . 2]"
1 18 ALA 0.015 0.005 9 0 "[ . 1 . 2]"
1 19 VAL 0.011 0.004 17 0 "[ . 1 . 2]"
1 20 GLN 0.004 0.004 17 0 "[ . 1 . 2]"
1 21 LYS 0.024 0.019 2 0 "[ . 1 . 2]"
1 22 GLY 0.027 0.019 2 0 "[ . 1 . 2]"
1 23 GLU 0.054 0.028 18 0 "[ . 1 . 2]"
1 24 LEU 0.075 0.028 18 0 "[ . 1 . 2]"
1 25 THR 0.002 0.001 19 0 "[ . 1 . 2]"
1 26 GLY 0.006 0.003 10 0 "[ . 1 . 2]"
1 27 GLU 0.002 0.001 10 0 "[ . 1 . 2]"
1 28 VAL 0.009 0.003 10 0 "[ . 1 . 2]"
1 29 ARG 0.004 0.003 8 0 "[ . 1 . 2]"
1 30 MET 0.042 0.011 6 0 "[ . 1 . 2]"
1 31 PRO 0.008 0.002 17 0 "[ . 1 . 2]"
1 32 SER 0.026 0.014 2 0 "[ . 1 . 2]"
1 33 GLY 0.002 0.001 6 0 "[ . 1 . 2]"
1 34 LYS 0.323 0.034 15 0 "[ . 1 . 2]"
1 35 THR 0.013 0.009 16 0 "[ . 1 . 2]"
1 36 ALA 0.005 0.003 10 0 "[ . 1 . 2]"
1 37 ARG 0.005 0.005 7 0 "[ . 1 . 2]"
1 38 PRO 0.816 0.050 14 0 "[ . 1 . 2]"
1 39 ASN 0.812 0.050 14 0 "[ . 1 . 2]"
1 40 ILE 0.016 0.008 18 0 "[ . 1 . 2]"
1 41 THR 0.225 0.023 14 0 "[ . 1 . 2]"
1 42 ASP 0.141 0.015 14 0 "[ . 1 . 2]"
1 43 ASN 0.001 0.001 9 0 "[ . 1 . 2]"
1 44 LYS 0.011 0.006 16 0 "[ . 1 . 2]"
1 45 ASP 0.001 0.001 9 0 "[ . 1 . 2]"
1 46 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 THR 0.007 0.005 11 0 "[ . 1 . 2]"
1 48 ILE 0.094 0.009 3 0 "[ . 1 . 2]"
1 49 THR 0.001 0.001 16 0 "[ . 1 . 2]"
1 50 VAL 0.030 0.005 7 0 "[ . 1 . 2]"
1 51 ARG 0.024 0.004 1 0 "[ . 1 . 2]"
1 52 TYR 0.041 0.006 10 0 "[ . 1 . 2]"
1 53 ALA 0.406 0.034 13 0 "[ . 1 . 2]"
1 54 PRO 0.391 0.034 13 0 "[ . 1 . 2]"
1 55 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 GLU 0.029 0.010 12 0 "[ . 1 . 2]"
1 57 LYS 0.086 0.040 13 0 "[ . 1 . 2]"
1 58 GLY 0.007 0.002 17 0 "[ . 1 . 2]"
1 59 LEU 0.007 0.003 12 0 "[ . 1 . 2]"
1 60 HIS 0.020 0.006 15 0 "[ . 1 . 2]"
1 61 GLN 0.017 0.005 15 0 "[ . 1 . 2]"
1 62 MET 0.011 0.004 16 0 "[ . 1 . 2]"
1 63 GLY 0.052 0.009 18 0 "[ . 1 . 2]"
1 64 ILE 0.020 0.007 15 0 "[ . 1 . 2]"
1 65 LYS 0.049 0.007 15 0 "[ . 1 . 2]"
1 66 TYR 0.014 0.003 19 0 "[ . 1 . 2]"
1 67 ASP 0.020 0.009 18 0 "[ . 1 . 2]"
1 68 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 ASN 0.014 0.009 18 0 "[ . 1 . 2]"
1 70 HIS 0.449 0.032 17 0 "[ . 1 . 2]"
1 71 ILE 0.153 0.014 6 0 "[ . 1 . 2]"
1 72 PRO 0.094 0.014 6 0 "[ . 1 . 2]"
1 73 GLY 0.138 0.041 14 0 "[ . 1 . 2]"
1 74 SER 0.173 0.041 14 0 "[ . 1 . 2]"
1 75 PRO 0.465 0.032 17 0 "[ . 1 . 2]"
1 76 LEU 0.041 0.016 15 0 "[ . 1 . 2]"
1 77 GLN 0.057 0.016 15 0 "[ . 1 . 2]"
1 78 PHE 0.022 0.005 12 0 "[ . 1 . 2]"
1 79 TYR 0.018 0.006 15 0 "[ . 1 . 2]"
1 80 VAL 0.001 0.001 2 0 "[ . 1 . 2]"
1 81 ASP 0.002 0.002 11 0 "[ . 1 . 2]"
1 82 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 ILE 0.009 0.004 1 0 "[ . 1 . 2]"
1 84 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 6 SER HA 1 6 SER QB . . 2.730 2.336 2.189 2.490 . 0 0 "[ . 1 . 2]" 1
2 1 6 SER QB 1 8 LEU MD1 . . 4.440 3.506 2.876 4.389 . 0 0 "[ . 1 . 2]" 1
3 1 6 SER QB 1 8 LEU HG . . 4.080 3.426 2.568 3.957 . 0 0 "[ . 1 . 2]" 1
4 1 7 GLY H 1 8 LEU H . . 4.690 3.739 1.903 4.593 . 0 0 "[ . 1 . 2]" 1
5 1 7 GLY QA 1 8 LEU H . . 2.850 2.245 2.115 2.733 . 0 0 "[ . 1 . 2]" 1
6 1 7 GLY QA 1 8 LEU HA . . 4.360 3.956 3.935 3.997 . 0 0 "[ . 1 . 2]" 1
7 1 7 GLY QA 1 8 LEU HG . . 4.080 3.757 3.345 3.942 . 0 0 "[ . 1 . 2]" 1
8 1 7 GLY QA 1 9 ARG H . . 5.500 5.304 5.169 5.475 . 0 0 "[ . 1 . 2]" 1
9 1 7 GLY QA 1 83 ILE MD . . 3.710 2.314 2.025 2.631 . 0 0 "[ . 1 . 2]" 1
10 1 8 LEU H 1 8 LEU HB2 . . 3.100 2.783 2.692 2.884 . 0 0 "[ . 1 . 2]" 1
11 1 8 LEU H 1 8 LEU HB3 . . 3.900 3.835 3.785 3.897 . 0 0 "[ . 1 . 2]" 1
12 1 8 LEU H 1 8 LEU MD1 . . 4.240 3.962 3.828 4.119 . 0 0 "[ . 1 . 2]" 1
13 1 8 LEU H 1 8 LEU MD2 . . 3.930 3.781 3.528 3.921 . 0 0 "[ . 1 . 2]" 1
14 1 8 LEU H 1 8 LEU HG . . 3.370 2.836 2.713 3.040 . 0 0 "[ . 1 . 2]" 1
15 1 8 LEU H 1 9 ARG H . . 4.370 4.307 4.196 4.370 . 0 0 "[ . 1 . 2]" 1
16 1 8 LEU H 1 83 ILE MD . . 4.690 2.483 2.165 3.106 . 0 0 "[ . 1 . 2]" 1
17 1 8 LEU H 1 83 ILE HG12 . . 4.570 4.361 4.147 4.572 0.002 2 0 "[ . 1 . 2]" 1
18 1 8 LEU H 1 83 ILE HG13 . . 3.510 3.291 3.136 3.498 . 0 0 "[ . 1 . 2]" 1
19 1 8 LEU HA 1 8 LEU MD1 . . 4.010 3.940 3.895 3.963 . 0 0 "[ . 1 . 2]" 1
20 1 8 LEU HA 1 8 LEU MD2 . . 2.910 2.184 2.024 2.462 . 0 0 "[ . 1 . 2]" 1
21 1 8 LEU HA 1 8 LEU HG . . 4.060 3.174 3.073 3.343 . 0 0 "[ . 1 . 2]" 1
22 1 8 LEU HA 1 9 ARG H . . 2.950 2.160 2.140 2.199 . 0 0 "[ . 1 . 2]" 1
23 1 8 LEU HA 1 9 ARG HB2 . . 4.690 4.365 4.318 4.474 . 0 0 "[ . 1 . 2]" 1
24 1 8 LEU HA 1 80 VAL MG1 . . 4.060 3.530 3.314 3.701 . 0 0 "[ . 1 . 2]" 1
25 1 8 LEU HA 1 83 ILE HB . . 5.050 4.623 4.364 4.851 . 0 0 "[ . 1 . 2]" 1
26 1 8 LEU HA 1 83 ILE MD . . 4.620 3.410 3.155 3.807 . 0 0 "[ . 1 . 2]" 1
27 1 8 LEU HA 1 83 ILE HG12 . . 4.780 3.407 3.121 3.901 . 0 0 "[ . 1 . 2]" 1
28 1 8 LEU HA 1 83 ILE HG13 . . 4.540 2.264 2.001 2.525 . 0 0 "[ . 1 . 2]" 1
29 1 8 LEU HB2 1 8 LEU MD1 . . 3.130 2.267 2.107 2.370 . 0 0 "[ . 1 . 2]" 1
30 1 8 LEU HB2 1 9 ARG H . . 4.150 4.060 3.927 4.144 . 0 0 "[ . 1 . 2]" 1
31 1 8 LEU HB2 1 54 PRO HB2 . . 4.170 3.593 3.427 3.668 . 0 0 "[ . 1 . 2]" 1
32 1 8 LEU HB2 1 54 PRO HB3 . . 5.030 5.000 4.813 5.038 0.008 12 0 "[ . 1 . 2]" 1
33 1 8 LEU HB2 1 54 PRO HD2 . . 4.690 4.092 3.897 4.264 . 0 0 "[ . 1 . 2]" 1
34 1 8 LEU HB2 1 54 PRO HG2 . . 3.920 2.436 2.259 2.506 . 0 0 "[ . 1 . 2]" 1
35 1 8 LEU HB2 1 54 PRO HG3 . . 4.580 4.101 3.956 4.165 . 0 0 "[ . 1 . 2]" 1
36 1 8 LEU HB2 1 80 VAL MG1 . . 3.540 3.010 2.811 3.181 . 0 0 "[ . 1 . 2]" 1
37 1 8 LEU HB3 1 8 LEU MD1 . . 3.140 2.415 2.331 2.565 . 0 0 "[ . 1 . 2]" 1
38 1 8 LEU HB3 1 8 LEU MD2 . . 3.020 2.305 2.119 2.420 . 0 0 "[ . 1 . 2]" 1
39 1 8 LEU HB3 1 9 ARG H . . 3.510 3.240 3.025 3.416 . 0 0 "[ . 1 . 2]" 1
40 1 8 LEU HB3 1 54 PRO HB2 . . 4.620 3.613 3.430 3.838 . 0 0 "[ . 1 . 2]" 1
41 1 8 LEU HB3 1 54 PRO HG2 . . 4.250 2.765 2.579 2.993 . 0 0 "[ . 1 . 2]" 1
42 1 8 LEU MD1 1 54 PRO HB2 . . 3.720 2.359 2.233 2.538 . 0 0 "[ . 1 . 2]" 1
43 1 8 LEU MD1 1 54 PRO HB3 . . 4.060 3.940 3.833 4.048 . 0 0 "[ . 1 . 2]" 1
44 1 8 LEU MD1 1 54 PRO HG2 . . 4.140 3.046 2.822 3.210 . 0 0 "[ . 1 . 2]" 1
45 1 8 LEU MD1 1 54 PRO HG3 . . 4.810 4.113 3.969 4.257 . 0 0 "[ . 1 . 2]" 1
46 1 8 LEU MD1 1 55 THR H . . 4.900 3.687 3.362 3.909 . 0 0 "[ . 1 . 2]" 1
47 1 8 LEU MD1 1 55 THR HA . . 3.590 2.854 2.494 3.188 . 0 0 "[ . 1 . 2]" 1
48 1 8 LEU MD1 1 56 GLU H . . 3.780 2.868 2.639 3.108 . 0 0 "[ . 1 . 2]" 1
49 1 8 LEU MD1 1 56 GLU HA . . 3.920 2.205 1.967 2.517 . 0 0 "[ . 1 . 2]" 1
50 1 8 LEU MD1 1 56 GLU QB . . 4.620 3.688 3.576 3.856 . 0 0 "[ . 1 . 2]" 1
51 1 8 LEU MD1 1 57 LYS H . . 4.120 2.990 2.470 3.292 . 0 0 "[ . 1 . 2]" 1
52 1 8 LEU MD1 1 57 LYS HA . . 4.210 3.039 2.510 3.358 . 0 0 "[ . 1 . 2]" 1
53 1 8 LEU MD1 1 57 LYS QB . . 4.180 3.292 2.786 4.025 . 0 0 "[ . 1 . 2]" 1
54 1 8 LEU MD1 1 80 VAL MG1 . . 3.140 2.120 1.933 2.398 . 0 0 "[ . 1 . 2]" 1
55 1 8 LEU MD2 1 9 ARG H . . 3.830 3.786 3.673 3.835 0.005 8 0 "[ . 1 . 2]" 1
56 1 8 LEU MD2 1 56 GLU HA . . 3.970 3.766 3.411 3.980 0.010 12 0 "[ . 1 . 2]" 1
57 1 8 LEU MD2 1 57 LYS H . . 4.530 3.504 2.780 3.981 . 0 0 "[ . 1 . 2]" 1
58 1 8 LEU MD2 1 57 LYS HA . . 4.210 3.038 2.675 3.601 . 0 0 "[ . 1 . 2]" 1
59 1 8 LEU MD2 1 57 LYS QB . . 3.530 2.322 1.946 3.514 . 0 0 "[ . 1 . 2]" 1
60 1 8 LEU MD2 1 57 LYS QD . . 4.080 3.289 2.754 3.675 . 0 0 "[ . 1 . 2]" 1
61 1 8 LEU MD2 1 82 ALA HA . . 4.050 2.196 1.939 2.605 . 0 0 "[ . 1 . 2]" 1
62 1 8 LEU MD2 1 83 ILE H . . 4.020 3.591 3.205 3.861 . 0 0 "[ . 1 . 2]" 1
63 1 8 LEU HG 1 56 GLU HA . . 4.750 4.491 4.142 4.711 . 0 0 "[ . 1 . 2]" 1
64 1 9 ARG H 1 9 ARG HB2 . . 3.230 2.253 2.188 2.380 . 0 0 "[ . 1 . 2]" 1
65 1 9 ARG H 1 9 ARG HB3 . . 3.650 3.528 3.494 3.572 . 0 0 "[ . 1 . 2]" 1
66 1 9 ARG H 1 9 ARG QD . . 4.760 3.808 3.308 4.371 . 0 0 "[ . 1 . 2]" 1
67 1 9 ARG H 1 9 ARG HG2 . . 4.180 3.877 3.652 4.042 . 0 0 "[ . 1 . 2]" 1
68 1 9 ARG H 1 9 ARG HG3 . . 4.080 2.725 2.416 2.997 . 0 0 "[ . 1 . 2]" 1
69 1 9 ARG H 1 10 PRO HD2 . . 5.000 4.780 4.766 4.795 . 0 0 "[ . 1 . 2]" 1
70 1 9 ARG H 1 10 PRO HD3 . . 5.000 4.923 4.868 4.983 . 0 0 "[ . 1 . 2]" 1
71 1 9 ARG H 1 80 VAL MG1 . . 4.240 3.632 3.399 3.934 . 0 0 "[ . 1 . 2]" 1
72 1 9 ARG H 1 83 ILE MD . . 4.870 3.578 3.316 3.834 . 0 0 "[ . 1 . 2]" 1
73 1 9 ARG H 1 83 ILE HG13 . . 4.230 2.659 2.363 2.989 . 0 0 "[ . 1 . 2]" 1
74 1 9 ARG HA 1 9 ARG HD2 . . 4.760 4.631 4.416 4.765 0.005 7 0 "[ . 1 . 2]" 1
75 1 9 ARG HA 1 9 ARG HD3 . . 4.760 4.453 3.926 4.597 . 0 0 "[ . 1 . 2]" 1
76 1 9 ARG HA 1 9 ARG HG2 . . 3.990 2.489 2.168 2.772 . 0 0 "[ . 1 . 2]" 1
77 1 9 ARG HA 1 9 ARG HG3 . . 3.840 2.743 2.498 3.128 . 0 0 "[ . 1 . 2]" 1
78 1 9 ARG HA 1 10 PRO HD2 . . 3.140 2.241 2.197 2.305 . 0 0 "[ . 1 . 2]" 1
79 1 9 ARG HA 1 10 PRO HD3 . . 3.140 2.257 2.252 2.269 . 0 0 "[ . 1 . 2]" 1
80 1 9 ARG HA 1 10 PRO QG . . 3.950 3.907 3.882 3.944 . 0 0 "[ . 1 . 2]" 1
81 1 9 ARG HA 1 54 PRO HG2 . . 5.500 5.484 5.419 5.503 0.003 16 0 "[ . 1 . 2]" 1
82 1 9 ARG HA 1 83 ILE MD . . 3.880 2.826 2.580 3.069 . 0 0 "[ . 1 . 2]" 1
83 1 9 ARG HA 1 83 ILE HG12 . . 4.700 2.469 2.096 2.873 . 0 0 "[ . 1 . 2]" 1
84 1 9 ARG HA 1 83 ILE HG13 . . 4.600 3.762 3.348 4.166 . 0 0 "[ . 1 . 2]" 1
85 1 9 ARG HB2 1 9 ARG HD2 . . 3.830 3.227 2.204 3.726 . 0 0 "[ . 1 . 2]" 1
86 1 9 ARG HB2 1 9 ARG QD . . 3.240 2.356 2.154 2.647 . 0 0 "[ . 1 . 2]" 1
87 1 9 ARG HB2 1 9 ARG HD3 . . 3.830 2.581 2.223 3.534 . 0 0 "[ . 1 . 2]" 1
88 1 9 ARG HB2 1 10 PRO QD . . 4.340 3.843 3.767 3.913 . 0 0 "[ . 1 . 2]" 1
89 1 9 ARG HB2 1 80 VAL MG1 . . 5.170 4.196 3.899 4.457 . 0 0 "[ . 1 . 2]" 1
90 1 9 ARG HB2 1 81 ASP H . . 4.510 4.193 3.729 4.448 . 0 0 "[ . 1 . 2]" 1
91 1 9 ARG HB2 1 83 ILE HG12 . . 5.500 3.659 3.371 4.014 . 0 0 "[ . 1 . 2]" 1
92 1 9 ARG HB3 1 9 ARG HD2 . . 3.870 3.536 2.504 3.849 . 0 0 "[ . 1 . 2]" 1
93 1 9 ARG HB3 1 9 ARG QD . . 3.360 2.697 2.234 3.114 . 0 0 "[ . 1 . 2]" 1
94 1 9 ARG HB3 1 9 ARG HD3 . . 3.870 2.817 2.338 3.315 . 0 0 "[ . 1 . 2]" 1
95 1 9 ARG HB3 1 10 PRO HA . . 5.150 4.851 4.802 4.914 . 0 0 "[ . 1 . 2]" 1
96 1 9 ARG HB3 1 10 PRO HD2 . . 4.340 2.593 2.477 2.742 . 0 0 "[ . 1 . 2]" 1
97 1 9 ARG HB3 1 10 PRO QD . . 3.750 2.559 2.448 2.700 . 0 0 "[ . 1 . 2]" 1
98 1 9 ARG HB3 1 10 PRO HD3 . . 4.340 3.932 3.839 4.045 . 0 0 "[ . 1 . 2]" 1
99 1 9 ARG HB3 1 83 ILE HG12 . . 4.900 4.215 3.980 4.501 . 0 0 "[ . 1 . 2]" 1
100 1 9 ARG HG2 1 10 PRO HD2 . . 4.480 2.749 2.556 3.074 . 0 0 "[ . 1 . 2]" 1
101 1 9 ARG HG2 1 10 PRO QD . . 3.770 2.693 2.510 2.999 . 0 0 "[ . 1 . 2]" 1
102 1 9 ARG HG2 1 10 PRO HD3 . . 4.480 3.864 3.645 4.219 . 0 0 "[ . 1 . 2]" 1
103 1 9 ARG HG2 1 83 ILE HG12 . . 4.440 3.014 2.219 3.629 . 0 0 "[ . 1 . 2]" 1
104 1 9 ARG HG3 1 10 PRO QD . . 4.060 3.835 3.631 4.048 . 0 0 "[ . 1 . 2]" 1
105 1 9 ARG HG3 1 83 ILE HA . . 3.940 2.311 2.013 2.907 . 0 0 "[ . 1 . 2]" 1
106 1 9 ARG HG3 1 83 ILE HG12 . . 4.870 2.038 1.999 2.173 . 0 0 "[ . 1 . 2]" 1
107 1 9 ARG HG3 1 83 ILE HG13 . . 4.040 3.413 2.745 3.726 . 0 0 "[ . 1 . 2]" 1
108 1 10 PRO HA 1 11 PHE H . . 3.000 2.403 2.365 2.455 . 0 0 "[ . 1 . 2]" 1
109 1 10 PRO HA 1 52 TYR H . . 5.230 4.839 4.616 5.148 . 0 0 "[ . 1 . 2]" 1
110 1 10 PRO HA 1 53 ALA HA . . 4.140 3.033 2.862 3.209 . 0 0 "[ . 1 . 2]" 1
111 1 10 PRO HA 1 53 ALA MB . . 4.340 4.173 3.990 4.319 . 0 0 "[ . 1 . 2]" 1
112 1 10 PRO HA 1 54 PRO HD2 . . 3.650 2.442 2.346 2.545 . 0 0 "[ . 1 . 2]" 1
113 1 10 PRO HA 1 54 PRO HD3 . . 3.640 3.238 3.090 3.362 . 0 0 "[ . 1 . 2]" 1
114 1 10 PRO HA 1 54 PRO HG2 . . 4.330 4.067 3.907 4.185 . 0 0 "[ . 1 . 2]" 1
115 1 10 PRO HA 1 54 PRO HG3 . . 4.490 4.011 3.857 4.112 . 0 0 "[ . 1 . 2]" 1
116 1 10 PRO HB2 1 11 PHE H . . 3.760 2.607 2.479 2.704 . 0 0 "[ . 1 . 2]" 1
117 1 10 PRO HB2 1 52 TYR H . . 4.870 4.368 3.962 4.630 . 0 0 "[ . 1 . 2]" 1
118 1 10 PRO HB3 1 11 PHE H . . 3.810 3.451 3.387 3.500 . 0 0 "[ . 1 . 2]" 1
119 1 10 PRO HB3 1 53 ALA HA . . 4.170 3.986 3.588 4.173 0.003 8 0 "[ . 1 . 2]" 1
120 1 10 PRO HB3 1 54 PRO HD2 . . 4.790 4.260 4.068 4.394 . 0 0 "[ . 1 . 2]" 1
121 1 10 PRO HB3 1 54 PRO HD3 . . 5.410 5.232 5.009 5.399 . 0 0 "[ . 1 . 2]" 1
122 1 10 PRO QD 1 83 ILE MD . . 3.880 3.397 2.920 3.604 . 0 0 "[ . 1 . 2]" 1
123 1 10 PRO HD2 1 83 ILE MD . . 4.460 4.323 3.993 4.464 0.004 1 0 "[ . 1 . 2]" 1
124 1 10 PRO HD3 1 83 ILE MD . . 4.460 3.554 3.002 3.804 . 0 0 "[ . 1 . 2]" 1
125 1 10 PRO QG 1 11 PHE H . . 4.220 4.162 4.074 4.226 0.006 5 0 "[ . 1 . 2]" 1
126 1 11 PHE H 1 11 PHE HB2 . . 3.490 2.897 2.773 3.034 . 0 0 "[ . 1 . 2]" 1
127 1 11 PHE H 1 11 PHE HB3 . . 3.500 2.629 2.513 2.773 . 0 0 "[ . 1 . 2]" 1
128 1 11 PHE H 1 11 PHE QD . . 4.450 4.274 4.186 4.329 . 0 0 "[ . 1 . 2]" 1
129 1 11 PHE H 1 12 ASN H . . 4.430 4.078 3.932 4.251 . 0 0 "[ . 1 . 2]" 1
130 1 11 PHE H 1 51 ARG HA . . 4.630 4.213 4.132 4.382 . 0 0 "[ . 1 . 2]" 1
131 1 11 PHE H 1 52 TYR H . . 3.740 2.726 2.593 2.940 . 0 0 "[ . 1 . 2]" 1
132 1 11 PHE H 1 52 TYR HB2 . . 5.500 5.326 4.985 5.505 0.005 16 0 "[ . 1 . 2]" 1
133 1 11 PHE H 1 52 TYR HB3 . . 4.390 3.891 3.501 4.105 . 0 0 "[ . 1 . 2]" 1
134 1 11 PHE H 1 53 ALA HA . . 3.800 3.797 3.720 3.808 0.008 12 0 "[ . 1 . 2]" 1
135 1 11 PHE H 1 54 PRO HD2 . . 4.080 3.840 3.705 3.949 . 0 0 "[ . 1 . 2]" 1
136 1 11 PHE H 1 54 PRO HD3 . . 3.820 3.463 3.326 3.672 . 0 0 "[ . 1 . 2]" 1
137 1 11 PHE HA 1 11 PHE QD . . 4.090 2.688 2.298 3.105 . 0 0 "[ . 1 . 2]" 1
138 1 11 PHE HA 1 12 ASN H . . 2.880 2.192 2.140 2.224 . 0 0 "[ . 1 . 2]" 1
139 1 11 PHE HA 1 52 TYR H . . 4.680 4.575 4.507 4.651 . 0 0 "[ . 1 . 2]" 1
140 1 11 PHE HB2 1 12 ASN H . . 4.750 4.515 4.443 4.576 . 0 0 "[ . 1 . 2]" 1
141 1 11 PHE HB2 1 52 TYR H . . 4.400 4.020 3.805 4.235 . 0 0 "[ . 1 . 2]" 1
142 1 11 PHE HB2 1 52 TYR HB2 . . 5.150 4.913 4.653 5.135 . 0 0 "[ . 1 . 2]" 1
143 1 11 PHE HB2 1 52 TYR HB3 . . 4.080 3.160 2.898 3.383 . 0 0 "[ . 1 . 2]" 1
144 1 11 PHE HB2 1 78 PHE QD . . 4.140 3.660 3.405 3.987 . 0 0 "[ . 1 . 2]" 1
145 1 11 PHE HB3 1 12 ASN H . . 4.630 4.396 4.197 4.480 . 0 0 "[ . 1 . 2]" 1
146 1 11 PHE HB3 1 52 TYR H . . 4.060 2.490 2.213 2.669 . 0 0 "[ . 1 . 2]" 1
147 1 11 PHE HB3 1 52 TYR HB2 . . 4.710 3.666 3.546 3.755 . 0 0 "[ . 1 . 2]" 1
148 1 11 PHE HB3 1 52 TYR HB3 . . 4.060 2.016 1.998 2.072 . 0 0 "[ . 1 . 2]" 1
149 1 11 PHE HB3 1 78 PHE QD . . 5.380 4.995 4.682 5.322 . 0 0 "[ . 1 . 2]" 1
150 1 11 PHE QD 1 12 ASN H . . 4.300 4.034 3.662 4.241 . 0 0 "[ . 1 . 2]" 1
151 1 11 PHE QD 1 13 LEU H . . 4.820 4.350 3.587 4.788 . 0 0 "[ . 1 . 2]" 1
152 1 11 PHE QD 1 13 LEU HB2 . . 5.350 4.860 4.658 5.053 . 0 0 "[ . 1 . 2]" 1
153 1 11 PHE QD 1 50 VAL MG1 . . 4.280 2.504 2.173 2.796 . 0 0 "[ . 1 . 2]" 1
154 1 11 PHE QD 1 52 TYR H . . 4.100 3.576 3.110 3.901 . 0 0 "[ . 1 . 2]" 1
155 1 11 PHE QD 1 52 TYR HB3 . . 4.360 2.985 2.532 3.310 . 0 0 "[ . 1 . 2]" 1
156 1 11 PHE QD 1 76 LEU MD2 . . 5.500 4.905 4.516 5.355 . 0 0 "[ . 1 . 2]" 1
157 1 11 PHE QD 1 78 PHE QB . . 4.430 3.153 2.910 3.345 . 0 0 "[ . 1 . 2]" 1
158 1 11 PHE QE 1 13 LEU HB2 . . 4.630 4.001 3.626 4.273 . 0 0 "[ . 1 . 2]" 1
159 1 11 PHE QE 1 13 LEU HB3 . . 4.520 3.085 2.429 3.627 . 0 0 "[ . 1 . 2]" 1
160 1 11 PHE QE 1 13 LEU MD2 . . 4.000 3.041 2.686 3.383 . 0 0 "[ . 1 . 2]" 1
161 1 11 PHE QE 1 50 VAL MG1 . . 4.010 2.466 2.067 3.044 . 0 0 "[ . 1 . 2]" 1
162 1 11 PHE QE 1 50 VAL MG2 . . 4.730 3.761 3.253 4.357 . 0 0 "[ . 1 . 2]" 1
163 1 11 PHE QE 1 76 LEU MD1 . . 3.940 2.747 2.057 3.089 . 0 0 "[ . 1 . 2]" 1
164 1 11 PHE QE 1 76 LEU MD2 . . 4.440 3.018 2.557 3.541 . 0 0 "[ . 1 . 2]" 1
165 1 11 PHE QE 1 78 PHE QB . . 4.400 2.051 1.908 2.386 . 0 0 "[ . 1 . 2]" 1
166 1 11 PHE QE 1 78 PHE QD . . 4.330 3.202 2.709 3.645 . 0 0 "[ . 1 . 2]" 1
167 1 11 PHE HZ 1 13 LEU HB2 . . 4.740 4.035 3.503 4.344 . 0 0 "[ . 1 . 2]" 1
168 1 11 PHE HZ 1 13 LEU HB3 . . 4.990 3.759 3.305 4.285 . 0 0 "[ . 1 . 2]" 1
169 1 11 PHE HZ 1 13 LEU MD2 . . 3.840 2.619 2.067 3.104 . 0 0 "[ . 1 . 2]" 1
170 1 11 PHE HZ 1 76 LEU MD1 . . 4.040 2.167 1.972 2.494 . 0 0 "[ . 1 . 2]" 1
171 1 11 PHE HZ 1 76 LEU MD2 . . 3.720 2.993 2.100 3.687 . 0 0 "[ . 1 . 2]" 1
172 1 12 ASN H 1 12 ASN HB2 . . 3.930 3.574 2.847 3.797 . 0 0 "[ . 1 . 2]" 1
173 1 12 ASN H 1 12 ASN QB . . 3.430 2.984 2.769 3.111 . 0 0 "[ . 1 . 2]" 1
174 1 12 ASN H 1 12 ASN HB3 . . 3.930 3.295 2.965 3.813 . 0 0 "[ . 1 . 2]" 1
175 1 12 ASN H 1 12 ASN HD21 . . 4.820 3.633 2.169 4.591 . 0 0 "[ . 1 . 2]" 1
176 1 12 ASN H 1 12 ASN QD . . 4.240 3.267 2.144 4.034 . 0 0 "[ . 1 . 2]" 1
177 1 12 ASN H 1 12 ASN HD22 . . 4.820 3.801 2.992 4.471 . 0 0 "[ . 1 . 2]" 1
178 1 12 ASN H 1 13 LEU H . . 4.330 4.209 4.059 4.296 . 0 0 "[ . 1 . 2]" 1
179 1 12 ASN HA 1 13 LEU H . . 2.820 2.147 2.140 2.165 . 0 0 "[ . 1 . 2]" 1
180 1 12 ASN HA 1 13 LEU HB2 . . 4.990 4.859 4.816 4.918 . 0 0 "[ . 1 . 2]" 1
181 1 12 ASN HA 1 49 THR MG . . 5.080 3.824 3.685 3.933 . 0 0 "[ . 1 . 2]" 1
182 1 12 ASN HA 1 50 VAL HB . . 4.890 4.377 4.155 4.543 . 0 0 "[ . 1 . 2]" 1
183 1 12 ASN HA 1 51 ARG H . . 5.290 5.183 5.029 5.269 . 0 0 "[ . 1 . 2]" 1
184 1 12 ASN HA 1 51 ARG HA . . 3.710 3.115 2.878 3.268 . 0 0 "[ . 1 . 2]" 1
185 1 12 ASN HA 1 51 ARG QG . . 4.450 3.222 3.044 3.404 . 0 0 "[ . 1 . 2]" 1
186 1 12 ASN HA 1 52 TYR H . . 4.590 4.409 4.233 4.555 . 0 0 "[ . 1 . 2]" 1
187 1 12 ASN QB 1 13 LEU H . . 3.770 3.430 3.311 3.551 . 0 0 "[ . 1 . 2]" 1
188 1 12 ASN QB 1 49 THR MG . . 4.250 3.685 3.538 3.874 . 0 0 "[ . 1 . 2]" 1
189 1 12 ASN QB 1 51 ARG QG . . 4.050 3.165 3.007 3.331 . 0 0 "[ . 1 . 2]" 1
190 1 12 ASN HB2 1 13 LEU H . . 4.380 3.701 3.471 4.189 . 0 0 "[ . 1 . 2]" 1
191 1 12 ASN HB2 1 49 THR MG . . 4.950 4.093 3.811 4.949 . 0 0 "[ . 1 . 2]" 1
192 1 12 ASN HB2 1 51 ARG QG . . 4.650 4.178 3.721 4.622 . 0 0 "[ . 1 . 2]" 1
193 1 12 ASN HB3 1 13 LEU H . . 4.380 4.176 3.505 4.362 . 0 0 "[ . 1 . 2]" 1
194 1 12 ASN HB3 1 49 THR MG . . 4.950 4.393 3.630 4.862 . 0 0 "[ . 1 . 2]" 1
195 1 12 ASN HB3 1 51 ARG QG . . 4.650 3.288 3.112 3.499 . 0 0 "[ . 1 . 2]" 1
196 1 13 LEU H 1 13 LEU HB2 . . 3.590 3.470 3.387 3.564 . 0 0 "[ . 1 . 2]" 1
197 1 13 LEU H 1 13 LEU HB3 . . 3.590 2.699 2.609 2.779 . 0 0 "[ . 1 . 2]" 1
198 1 13 LEU H 1 13 LEU HG . . 4.530 4.263 4.194 4.301 . 0 0 "[ . 1 . 2]" 1
199 1 13 LEU H 1 14 VAL H . . 4.760 4.359 4.239 4.432 . 0 0 "[ . 1 . 2]" 1
200 1 13 LEU H 1 49 THR MG . . 3.830 3.483 3.289 3.670 . 0 0 "[ . 1 . 2]" 1
201 1 13 LEU H 1 50 VAL H . . 3.640 2.836 2.664 2.978 . 0 0 "[ . 1 . 2]" 1
202 1 13 LEU H 1 50 VAL HB . . 4.010 2.993 2.790 3.220 . 0 0 "[ . 1 . 2]" 1
203 1 13 LEU H 1 50 VAL MG1 . . 4.550 4.195 4.066 4.415 . 0 0 "[ . 1 . 2]" 1
204 1 13 LEU H 1 50 VAL MG2 . . 4.530 4.165 3.995 4.422 . 0 0 "[ . 1 . 2]" 1
205 1 13 LEU H 1 51 ARG HA . . 4.560 4.369 4.167 4.493 . 0 0 "[ . 1 . 2]" 1
206 1 13 LEU H 1 51 ARG QG . . 4.570 4.356 4.155 4.503 . 0 0 "[ . 1 . 2]" 1
207 1 13 LEU HA 1 13 LEU MD1 . . 3.380 2.266 2.087 2.666 . 0 0 "[ . 1 . 2]" 1
208 1 13 LEU HA 1 13 LEU MD2 . . 4.710 3.979 3.936 4.016 . 0 0 "[ . 1 . 2]" 1
209 1 13 LEU HA 1 14 VAL H . . 3.130 2.266 2.163 2.338 . 0 0 "[ . 1 . 2]" 1
210 1 13 LEU HA 1 14 VAL HB . . 4.830 4.611 4.580 4.655 . 0 0 "[ . 1 . 2]" 1
211 1 13 LEU HA 1 14 VAL MG2 . . 4.360 3.492 3.308 3.660 . 0 0 "[ . 1 . 2]" 1
212 1 13 LEU HB2 1 50 VAL HB . . 4.690 4.647 4.444 4.695 0.005 7 0 "[ . 1 . 2]" 1
213 1 13 LEU HB3 1 13 LEU MD1 . . 3.500 3.171 3.127 3.184 . 0 0 "[ . 1 . 2]" 1
214 1 13 LEU HB3 1 13 LEU MD2 . . 3.430 2.202 2.032 2.358 . 0 0 "[ . 1 . 2]" 1
215 1 13 LEU HB3 1 14 VAL H . . 4.580 4.050 3.889 4.271 . 0 0 "[ . 1 . 2]" 1
216 1 13 LEU HB3 1 50 VAL H . . 4.620 4.125 3.959 4.317 . 0 0 "[ . 1 . 2]" 1
217 1 13 LEU HB3 1 50 VAL HB . . 3.810 2.937 2.730 3.000 . 0 0 "[ . 1 . 2]" 1
218 1 13 LEU MD1 1 14 VAL H . . 3.230 2.099 1.809 2.736 . 0 0 "[ . 1 . 2]" 1
219 1 13 LEU MD1 1 15 ILE HG13 . . 4.190 3.893 3.567 4.139 . 0 0 "[ . 1 . 2]" 1
220 1 13 LEU MD2 1 15 ILE HG13 . . 3.960 2.848 2.504 3.267 . 0 0 "[ . 1 . 2]" 1
221 1 13 LEU HG 1 14 VAL H . . 4.190 2.645 2.449 2.935 . 0 0 "[ . 1 . 2]" 1
222 1 13 LEU HG 1 15 ILE H . . 4.620 3.677 3.292 3.953 . 0 0 "[ . 1 . 2]" 1
223 1 13 LEU HG 1 15 ILE HG13 . . 3.860 2.634 2.406 2.821 . 0 0 "[ . 1 . 2]" 1
224 1 13 LEU HG 1 50 VAL HB . . 4.470 4.313 4.115 4.468 . 0 0 "[ . 1 . 2]" 1
225 1 13 LEU HG 1 50 VAL MG2 . . 3.800 3.723 3.546 3.802 0.002 1 0 "[ . 1 . 2]" 1
226 1 14 VAL H 1 14 VAL HB . . 3.430 2.631 2.542 2.707 . 0 0 "[ . 1 . 2]" 1
227 1 14 VAL H 1 14 VAL MG1 . . 4.160 3.847 3.807 3.882 . 0 0 "[ . 1 . 2]" 1
228 1 14 VAL H 1 14 VAL MG2 . . 3.440 2.730 2.504 2.887 . 0 0 "[ . 1 . 2]" 1
229 1 14 VAL H 1 15 ILE H . . 4.570 4.201 4.040 4.332 . 0 0 "[ . 1 . 2]" 1
230 1 14 VAL HA 1 14 VAL MG1 . . 3.410 2.378 2.288 2.456 . 0 0 "[ . 1 . 2]" 1
231 1 14 VAL HA 1 14 VAL MG2 . . 3.290 2.356 2.279 2.434 . 0 0 "[ . 1 . 2]" 1
232 1 14 VAL HA 1 15 ILE H . . 2.970 2.152 2.140 2.189 . 0 0 "[ . 1 . 2]" 1
233 1 14 VAL HA 1 15 ILE HB . . 4.940 4.731 4.700 4.780 . 0 0 "[ . 1 . 2]" 1
234 1 14 VAL HA 1 48 ILE H . . 4.710 4.135 3.982 4.306 . 0 0 "[ . 1 . 2]" 1
235 1 14 VAL HA 1 49 THR HA . . 3.680 2.417 2.277 2.608 . 0 0 "[ . 1 . 2]" 1
236 1 14 VAL HA 1 50 VAL H . . 4.270 3.398 3.218 3.543 . 0 0 "[ . 1 . 2]" 1
237 1 14 VAL HB 1 15 ILE H . . 4.500 4.337 4.235 4.430 . 0 0 "[ . 1 . 2]" 1
238 1 14 VAL MG1 1 15 ILE H . . 3.430 2.907 2.582 3.206 . 0 0 "[ . 1 . 2]" 1
239 1 14 VAL MG1 1 17 PHE H . . 4.930 4.688 4.618 4.769 . 0 0 "[ . 1 . 2]" 1
240 1 14 VAL MG1 1 43 ASN HD21 . . 4.300 4.066 3.844 4.243 . 0 0 "[ . 1 . 2]" 1
241 1 14 VAL MG1 1 43 ASN HD22 . . 4.250 3.680 3.488 3.813 . 0 0 "[ . 1 . 2]" 1
242 1 14 VAL MG1 1 47 THR HA . . 4.090 3.971 3.837 4.066 . 0 0 "[ . 1 . 2]" 1
243 1 14 VAL MG1 1 47 THR HB . . 3.140 2.145 2.020 2.319 . 0 0 "[ . 1 . 2]" 1
244 1 14 VAL MG1 1 48 ILE H . . 3.810 2.759 2.650 2.945 . 0 0 "[ . 1 . 2]" 1
245 1 14 VAL MG1 1 49 THR HA . . 4.250 3.453 3.282 3.733 . 0 0 "[ . 1 . 2]" 1
246 1 14 VAL MG2 1 43 ASN HD22 . . 4.600 4.259 4.012 4.411 . 0 0 "[ . 1 . 2]" 1
247 1 14 VAL MG2 1 49 THR HA . . 3.750 2.730 2.504 3.151 . 0 0 "[ . 1 . 2]" 1
248 1 14 VAL MG2 1 49 THR HG1 . . 4.070 3.053 2.415 3.664 . 0 0 "[ . 1 . 2]" 1
249 1 15 ILE H 1 15 ILE HB . . 3.500 2.599 2.537 2.641 . 0 0 "[ . 1 . 2]" 1
250 1 15 ILE H 1 15 ILE MD . . 3.740 3.550 3.370 3.657 . 0 0 "[ . 1 . 2]" 1
251 1 15 ILE H 1 15 ILE HG12 . . 3.720 3.675 3.569 3.728 0.008 17 0 "[ . 1 . 2]" 1
252 1 15 ILE H 1 15 ILE HG13 . . 3.940 2.306 2.182 2.405 . 0 0 "[ . 1 . 2]" 1
253 1 15 ILE H 1 15 ILE MG . . 4.300 3.816 3.786 3.841 . 0 0 "[ . 1 . 2]" 1
254 1 15 ILE H 1 16 PRO HD2 . . 5.090 4.831 4.823 4.837 . 0 0 "[ . 1 . 2]" 1
255 1 15 ILE H 1 16 PRO QD . . 4.450 4.292 4.260 4.311 . 0 0 "[ . 1 . 2]" 1
256 1 15 ILE H 1 16 PRO HD3 . . 5.090 4.805 4.744 4.842 . 0 0 "[ . 1 . 2]" 1
257 1 15 ILE H 1 47 THR HB . . 4.530 4.423 4.246 4.530 . 0 0 "[ . 1 . 2]" 1
258 1 15 ILE H 1 48 ILE H . . 3.520 3.234 3.116 3.367 . 0 0 "[ . 1 . 2]" 1
259 1 15 ILE H 1 48 ILE MD . . 4.200 3.803 3.602 3.920 . 0 0 "[ . 1 . 2]" 1
260 1 15 ILE H 1 48 ILE HG12 . . 4.550 3.233 3.020 3.421 . 0 0 "[ . 1 . 2]" 1
261 1 15 ILE H 1 48 ILE HG13 . . 4.050 2.527 2.250 2.646 . 0 0 "[ . 1 . 2]" 1
262 1 15 ILE H 1 49 THR HA . . 3.820 3.720 3.624 3.815 . 0 0 "[ . 1 . 2]" 1
263 1 15 ILE H 1 50 VAL H . . 4.770 4.377 4.140 4.646 . 0 0 "[ . 1 . 2]" 1
264 1 15 ILE H 1 50 VAL MG2 . . 4.280 3.581 3.361 3.884 . 0 0 "[ . 1 . 2]" 1
265 1 15 ILE HA 1 15 ILE MD . . 4.440 3.904 3.869 3.935 . 0 0 "[ . 1 . 2]" 1
266 1 15 ILE HA 1 15 ILE HG12 . . 4.110 2.705 2.614 2.807 . 0 0 "[ . 1 . 2]" 1
267 1 15 ILE HA 1 15 ILE HG13 . . 4.080 2.968 2.923 3.011 . 0 0 "[ . 1 . 2]" 1
268 1 15 ILE HA 1 15 ILE MG . . 3.500 2.386 2.356 2.426 . 0 0 "[ . 1 . 2]" 1
269 1 15 ILE HA 1 16 PRO HD2 . . 3.380 2.088 2.056 2.113 . 0 0 "[ . 1 . 2]" 1
270 1 15 ILE HA 1 16 PRO HD3 . . 3.380 2.263 2.257 2.272 . 0 0 "[ . 1 . 2]" 1
271 1 15 ILE HB 1 15 ILE MD . . 3.260 2.316 2.196 2.401 . 0 0 "[ . 1 . 2]" 1
272 1 15 ILE HB 1 16 PRO QD . . 4.760 3.859 3.822 3.908 . 0 0 "[ . 1 . 2]" 1
273 1 15 ILE HB 1 48 ILE H . . 4.310 3.964 3.887 4.095 . 0 0 "[ . 1 . 2]" 1
274 1 15 ILE HB 1 48 ILE MD . . 3.470 2.265 2.101 2.432 . 0 0 "[ . 1 . 2]" 1
275 1 15 ILE HB 1 48 ILE HG12 . . 3.650 2.324 2.207 2.407 . 0 0 "[ . 1 . 2]" 1
276 1 15 ILE HB 1 48 ILE HG13 . . 3.650 2.529 2.375 2.614 . 0 0 "[ . 1 . 2]" 1
277 1 15 ILE HB 1 71 ILE MD . . 4.890 3.634 3.478 3.923 . 0 0 "[ . 1 . 2]" 1
278 1 15 ILE MD 1 15 ILE MG . . 2.600 2.187 2.071 2.362 . 0 0 "[ . 1 . 2]" 1
279 1 15 ILE MD 1 48 ILE MD . . 2.930 2.236 1.976 2.481 . 0 0 "[ . 1 . 2]" 1
280 1 15 ILE MD 1 48 ILE HG12 . . 4.150 3.842 3.659 3.989 . 0 0 "[ . 1 . 2]" 1
281 1 15 ILE MD 1 48 ILE HG13 . . 4.540 3.271 3.006 3.486 . 0 0 "[ . 1 . 2]" 1
282 1 15 ILE MD 1 50 VAL MG2 . . 2.720 2.180 1.999 2.386 . 0 0 "[ . 1 . 2]" 1
283 1 15 ILE MD 1 64 ILE QG . . 3.580 3.076 2.893 3.312 . 0 0 "[ . 1 . 2]" 1
284 1 15 ILE MD 1 71 ILE MD . . 3.250 2.283 2.117 2.622 . 0 0 "[ . 1 . 2]" 1
285 1 15 ILE HG12 1 16 PRO HD2 . . 5.210 3.798 3.675 3.892 . 0 0 "[ . 1 . 2]" 1
286 1 15 ILE HG12 1 16 PRO QD . . 4.530 3.647 3.533 3.736 . 0 0 "[ . 1 . 2]" 1
287 1 15 ILE HG12 1 16 PRO HD3 . . 5.210 4.709 4.584 4.820 . 0 0 "[ . 1 . 2]" 1
288 1 15 ILE HG12 1 48 ILE HG13 . . 4.940 4.902 4.808 4.945 0.005 1 0 "[ . 1 . 2]" 1
289 1 15 ILE HG13 1 16 PRO HD2 . . 5.270 4.693 4.659 4.743 . 0 0 "[ . 1 . 2]" 1
290 1 15 ILE HG13 1 16 PRO QD . . 4.540 4.373 4.344 4.417 . 0 0 "[ . 1 . 2]" 1
291 1 15 ILE HG13 1 16 PRO HD3 . . 5.270 5.221 5.174 5.268 . 0 0 "[ . 1 . 2]" 1
292 1 15 ILE HG13 1 48 ILE HG12 . . 4.470 4.386 4.178 4.475 0.005 4 0 "[ . 1 . 2]" 1
293 1 15 ILE MG 1 16 PRO HD2 . . 3.550 1.954 1.900 2.043 . 0 0 "[ . 1 . 2]" 1
294 1 15 ILE MG 1 16 PRO QD . . 3.090 1.940 1.887 2.026 . 0 0 "[ . 1 . 2]" 1
295 1 15 ILE MG 1 16 PRO HD3 . . 3.550 3.290 3.232 3.350 . 0 0 "[ . 1 . 2]" 1
296 1 15 ILE MG 1 16 PRO HG2 . . 4.600 3.114 3.037 3.169 . 0 0 "[ . 1 . 2]" 1
297 1 15 ILE MG 1 16 PRO QG . . 4.020 3.022 2.950 3.070 . 0 0 "[ . 1 . 2]" 1
298 1 15 ILE MG 1 16 PRO HG3 . . 4.600 4.079 4.004 4.134 . 0 0 "[ . 1 . 2]" 1
299 1 15 ILE MG 1 17 PHE H . . 3.930 3.847 3.757 3.934 0.004 17 0 "[ . 1 . 2]" 1
300 1 15 ILE MG 1 17 PHE HB2 . . 3.730 2.888 2.780 3.037 . 0 0 "[ . 1 . 2]" 1
301 1 15 ILE MG 1 17 PHE HB3 . . 4.030 3.569 3.305 3.724 . 0 0 "[ . 1 . 2]" 1
302 1 15 ILE MG 1 48 ILE MD . . 3.260 3.069 2.892 3.218 . 0 0 "[ . 1 . 2]" 1
303 1 15 ILE MG 1 48 ILE HG12 . . 3.620 3.578 3.471 3.626 0.006 18 0 "[ . 1 . 2]" 1
304 1 15 ILE MG 1 48 ILE HG13 . . 4.220 4.152 4.008 4.226 0.006 5 0 "[ . 1 . 2]" 1
305 1 15 ILE MG 1 71 ILE MD . . 3.250 2.636 2.378 2.963 . 0 0 "[ . 1 . 2]" 1
306 1 16 PRO HA 1 17 PHE H . . 2.860 2.380 2.333 2.407 . 0 0 "[ . 1 . 2]" 1
307 1 16 PRO HA 1 17 PHE HA . . 4.800 4.351 4.339 4.366 . 0 0 "[ . 1 . 2]" 1
308 1 16 PRO HA 1 17 PHE HB3 . . 5.160 5.092 4.929 5.162 0.002 1 0 "[ . 1 . 2]" 1
309 1 16 PRO HA 1 47 THR HA . . 3.390 2.879 2.687 2.961 . 0 0 "[ . 1 . 2]" 1
310 1 16 PRO HA 1 47 THR HB . . 3.890 3.342 3.102 3.526 . 0 0 "[ . 1 . 2]" 1
311 1 16 PRO HA 1 47 THR MG . . 3.050 2.261 2.038 2.589 . 0 0 "[ . 1 . 2]" 1
312 1 16 PRO HA 1 48 ILE H . . 4.100 4.042 3.933 4.109 0.009 3 0 "[ . 1 . 2]" 1
313 1 16 PRO QB 1 17 PHE H . . 3.960 3.884 3.845 3.903 . 0 0 "[ . 1 . 2]" 1
314 1 16 PRO QB 1 47 THR HA . . 4.710 4.649 4.486 4.715 0.005 11 0 "[ . 1 . 2]" 1
315 1 16 PRO QB 1 47 THR MG . . 3.750 3.338 3.149 3.614 . 0 0 "[ . 1 . 2]" 1
316 1 17 PHE H 1 17 PHE HB2 . . 3.920 3.272 3.197 3.439 . 0 0 "[ . 1 . 2]" 1
317 1 17 PHE H 1 17 PHE HB3 . . 3.770 2.922 2.840 3.065 . 0 0 "[ . 1 . 2]" 1
318 1 17 PHE H 1 17 PHE QD . . 4.560 4.436 4.410 4.467 . 0 0 "[ . 1 . 2]" 1
319 1 17 PHE H 1 18 ALA H . . 4.050 4.024 3.881 4.055 0.005 9 0 "[ . 1 . 2]" 1
320 1 17 PHE H 1 47 THR H . . 4.810 4.732 4.659 4.805 . 0 0 "[ . 1 . 2]" 1
321 1 17 PHE H 1 47 THR HA . . 2.950 1.967 1.898 2.053 . 0 0 "[ . 1 . 2]" 1
322 1 17 PHE H 1 47 THR HB . . 3.950 3.747 3.534 3.892 . 0 0 "[ . 1 . 2]" 1
323 1 17 PHE H 1 47 THR MG . . 3.920 3.418 3.237 3.581 . 0 0 "[ . 1 . 2]" 1
324 1 17 PHE H 1 48 ILE H . . 3.680 3.148 2.982 3.326 . 0 0 "[ . 1 . 2]" 1
325 1 17 PHE H 1 48 ILE MD . . 4.940 4.433 4.217 4.764 . 0 0 "[ . 1 . 2]" 1
326 1 17 PHE H 1 48 ILE HG12 . . 4.570 3.351 3.167 3.556 . 0 0 "[ . 1 . 2]" 1
327 1 17 PHE H 1 48 ILE HG13 . . 5.310 4.958 4.737 5.233 . 0 0 "[ . 1 . 2]" 1
328 1 17 PHE H 1 48 ILE MG . . 4.410 3.373 3.260 3.492 . 0 0 "[ . 1 . 2]" 1
329 1 17 PHE HA 1 17 PHE QD . . 3.560 2.178 2.024 2.351 . 0 0 "[ . 1 . 2]" 1
330 1 17 PHE HA 1 17 PHE QE . . 4.620 4.358 4.256 4.475 . 0 0 "[ . 1 . 2]" 1
331 1 17 PHE HA 1 18 ALA H . . 2.590 2.141 2.138 2.153 . 0 0 "[ . 1 . 2]" 1
332 1 17 PHE HA 1 18 ALA MB . . 4.150 3.973 3.922 4.019 . 0 0 "[ . 1 . 2]" 1
333 1 17 PHE HB2 1 18 ALA H . . 4.500 4.388 4.288 4.437 . 0 0 "[ . 1 . 2]" 1
334 1 17 PHE HB2 1 48 ILE MD . . 4.240 3.721 3.434 4.054 . 0 0 "[ . 1 . 2]" 1
335 1 17 PHE HB2 1 48 ILE HG12 . . 4.660 4.026 3.801 4.381 . 0 0 "[ . 1 . 2]" 1
336 1 17 PHE HB2 1 48 ILE MG . . 4.440 4.230 4.098 4.391 . 0 0 "[ . 1 . 2]" 1
337 1 17 PHE HB2 1 71 ILE MD . . 4.050 3.944 3.643 4.047 . 0 0 "[ . 1 . 2]" 1
338 1 17 PHE HB2 1 72 PRO HG2 . . 5.010 3.034 2.875 3.150 . 0 0 "[ . 1 . 2]" 1
339 1 17 PHE HB3 1 18 ALA H . . 4.480 4.277 4.165 4.392 . 0 0 "[ . 1 . 2]" 1
340 1 17 PHE HB3 1 48 ILE MD . . 3.940 2.657 2.281 3.135 . 0 0 "[ . 1 . 2]" 1
341 1 17 PHE HB3 1 48 ILE HG12 . . 4.480 2.881 2.676 3.166 . 0 0 "[ . 1 . 2]" 1
342 1 17 PHE HB3 1 48 ILE HG13 . . 4.870 4.506 4.283 4.773 . 0 0 "[ . 1 . 2]" 1
343 1 17 PHE HB3 1 48 ILE MG . . 3.820 2.761 2.653 2.921 . 0 0 "[ . 1 . 2]" 1
344 1 17 PHE HB3 1 71 ILE MD . . 4.220 4.045 3.835 4.208 . 0 0 "[ . 1 . 2]" 1
345 1 17 PHE HB3 1 72 PRO HG2 . . 4.740 4.683 4.496 4.744 0.004 11 0 "[ . 1 . 2]" 1
346 1 17 PHE QD 1 18 ALA H . . 3.870 3.187 2.889 3.440 . 0 0 "[ . 1 . 2]" 1
347 1 17 PHE QD 1 19 VAL MG2 . . 3.400 2.912 2.630 3.296 . 0 0 "[ . 1 . 2]" 1
348 1 17 PHE QD 1 24 LEU MD1 . . 4.000 2.264 2.010 2.507 . 0 0 "[ . 1 . 2]" 1
349 1 17 PHE QD 1 24 LEU MD2 . . 3.980 3.471 3.006 3.761 . 0 0 "[ . 1 . 2]" 1
350 1 17 PHE QD 1 48 ILE MD . . 4.050 2.668 2.168 3.367 . 0 0 "[ . 1 . 2]" 1
351 1 17 PHE QD 1 48 ILE MG . . 3.860 2.935 2.522 3.251 . 0 0 "[ . 1 . 2]" 1
352 1 17 PHE QD 1 71 ILE HA . . 4.930 4.679 4.549 4.923 . 0 0 "[ . 1 . 2]" 1
353 1 17 PHE QD 1 71 ILE HB . . 4.260 3.500 3.298 3.748 . 0 0 "[ . 1 . 2]" 1
354 1 17 PHE QD 1 71 ILE MD . . 4.230 3.743 3.342 4.088 . 0 0 "[ . 1 . 2]" 1
355 1 17 PHE QD 1 71 ILE MG . . 4.410 2.852 2.548 3.057 . 0 0 "[ . 1 . 2]" 1
356 1 17 PHE QD 1 72 PRO HD2 . . 4.270 3.238 3.029 3.548 . 0 0 "[ . 1 . 2]" 1
357 1 17 PHE QD 1 72 PRO HD3 . . 4.640 3.867 3.473 4.317 . 0 0 "[ . 1 . 2]" 1
358 1 17 PHE QE 1 19 VAL MG2 . . 3.640 3.221 2.797 3.489 . 0 0 "[ . 1 . 2]" 1
359 1 17 PHE QE 1 66 TYR HB2 . . 4.890 2.112 2.020 2.330 . 0 0 "[ . 1 . 2]" 1
360 1 17 PHE QE 1 66 TYR HB3 . . 4.970 3.038 2.778 3.456 . 0 0 "[ . 1 . 2]" 1
361 1 17 PHE QE 1 71 ILE HB . . 4.490 3.911 3.597 4.251 . 0 0 "[ . 1 . 2]" 1
362 1 17 PHE QE 1 71 ILE MG . . 4.090 2.481 1.969 2.744 . 0 0 "[ . 1 . 2]" 1
363 1 17 PHE QE 1 72 PRO HD2 . . 4.450 3.509 3.166 3.795 . 0 0 "[ . 1 . 2]" 1
364 1 17 PHE QE 1 72 PRO HD3 . . 4.510 3.322 2.873 3.929 . 0 0 "[ . 1 . 2]" 1
365 1 17 PHE QE 1 72 PRO HG3 . . 4.900 3.376 2.758 4.026 . 0 0 "[ . 1 . 2]" 1
366 1 17 PHE HZ 1 66 TYR HB2 . . 4.820 3.578 3.121 4.040 . 0 0 "[ . 1 . 2]" 1
367 1 17 PHE HZ 1 66 TYR HB3 . . 4.650 3.182 2.842 3.391 . 0 0 "[ . 1 . 2]" 1
368 1 17 PHE HZ 1 66 TYR QD . . 4.010 2.927 2.093 3.249 . 0 0 "[ . 1 . 2]" 1
369 1 17 PHE HZ 1 71 ILE MG . . 4.350 3.603 3.191 3.969 . 0 0 "[ . 1 . 2]" 1
370 1 18 ALA H 1 18 ALA MB . . 2.850 2.160 2.063 2.258 . 0 0 "[ . 1 . 2]" 1
371 1 18 ALA H 1 19 VAL H . . 4.840 4.611 4.547 4.635 . 0 0 "[ . 1 . 2]" 1
372 1 18 ALA HA 1 19 VAL H . . 2.660 2.246 2.166 2.333 . 0 0 "[ . 1 . 2]" 1
373 1 18 ALA HA 1 19 VAL HB . . 4.670 4.505 4.435 4.619 . 0 0 "[ . 1 . 2]" 1
374 1 18 ALA HA 1 19 VAL MG2 . . 3.640 3.522 3.377 3.627 . 0 0 "[ . 1 . 2]" 1
375 1 18 ALA HA 1 46 GLY H . . 4.070 3.282 3.061 3.570 . 0 0 "[ . 1 . 2]" 1
376 1 18 ALA HA 1 46 GLY QA . . 4.010 2.257 2.067 2.511 . 0 0 "[ . 1 . 2]" 1
377 1 18 ALA MB 1 19 VAL H . . 3.240 2.796 2.557 3.054 . 0 0 "[ . 1 . 2]" 1
378 1 18 ALA MB 1 20 GLN HE21 . . 4.560 2.624 2.146 3.235 . 0 0 "[ . 1 . 2]" 1
379 1 18 ALA MB 1 20 GLN QE . . 3.840 2.422 1.814 3.167 . 0 0 "[ . 1 . 2]" 1
380 1 18 ALA MB 1 20 GLN HE22 . . 4.560 3.262 1.850 4.505 . 0 0 "[ . 1 . 2]" 1
381 1 18 ALA MB 1 20 GLN QG . . 4.280 3.531 2.955 4.024 . 0 0 "[ . 1 . 2]" 1
382 1 18 ALA MB 1 46 GLY HA2 . . 4.000 2.130 1.927 2.473 . 0 0 "[ . 1 . 2]" 1
383 1 18 ALA MB 1 46 GLY QA . . 3.450 2.111 1.911 2.442 . 0 0 "[ . 1 . 2]" 1
384 1 18 ALA MB 1 46 GLY HA3 . . 4.000 3.469 3.161 3.774 . 0 0 "[ . 1 . 2]" 1
385 1 19 VAL H 1 19 VAL HB . . 2.970 2.778 2.533 2.967 . 0 0 "[ . 1 . 2]" 1
386 1 19 VAL H 1 19 VAL MG1 . . 4.360 3.888 3.794 3.961 . 0 0 "[ . 1 . 2]" 1
387 1 19 VAL H 1 19 VAL MG2 . . 3.130 2.951 2.639 3.130 . 10 0 "[ . 1 . 2]" 1
388 1 19 VAL H 1 20 GLN H . . 4.670 4.077 3.859 4.327 . 0 0 "[ . 1 . 2]" 1
389 1 19 VAL H 1 20 GLN QE . . 4.690 3.582 2.504 4.497 . 0 0 "[ . 1 . 2]" 1
390 1 19 VAL H 1 66 TYR QE . . 5.500 5.443 5.303 5.501 0.001 13 0 "[ . 1 . 2]" 1
391 1 19 VAL HA 1 19 VAL MG1 . . 3.100 2.410 2.320 2.483 . 0 0 "[ . 1 . 2]" 1
392 1 19 VAL HA 1 19 VAL MG2 . . 3.080 2.351 2.270 2.422 . 0 0 "[ . 1 . 2]" 1
393 1 19 VAL HA 1 20 GLN H . . 2.980 2.154 2.141 2.199 . 0 0 "[ . 1 . 2]" 1
394 1 19 VAL HA 1 20 GLN QG . . 4.390 4.109 3.737 4.380 . 0 0 "[ . 1 . 2]" 1
395 1 19 VAL HA 1 24 LEU MD1 . . 4.860 4.378 4.031 4.805 . 0 0 "[ . 1 . 2]" 1
396 1 19 VAL HA 1 66 TYR QE . . 4.030 2.716 2.493 2.941 . 0 0 "[ . 1 . 2]" 1
397 1 19 VAL HB 1 20 GLN H . . 4.770 4.332 4.207 4.444 . 0 0 "[ . 1 . 2]" 1
398 1 19 VAL HB 1 20 GLN HA . . 5.100 4.848 4.740 5.011 . 0 0 "[ . 1 . 2]" 1
399 1 19 VAL HB 1 24 LEU MD1 . . 4.770 4.458 4.078 4.772 0.002 2 0 "[ . 1 . 2]" 1
400 1 19 VAL HB 1 42 ASP HA . . 4.690 4.368 3.988 4.611 . 0 0 "[ . 1 . 2]" 1
401 1 19 VAL HB 1 44 LYS H . . 4.330 3.789 3.446 4.134 . 0 0 "[ . 1 . 2]" 1
402 1 19 VAL HB 1 44 LYS HA . . 4.100 3.735 3.277 4.102 0.002 19 0 "[ . 1 . 2]" 1
403 1 19 VAL HB 1 48 ILE MG . . 4.530 3.339 2.836 3.739 . 0 0 "[ . 1 . 2]" 1
404 1 19 VAL MG1 1 20 GLN H . . 3.570 2.799 2.348 3.160 . 0 0 "[ . 1 . 2]" 1
405 1 19 VAL MG1 1 20 GLN HA . . 4.570 3.658 3.253 4.028 . 0 0 "[ . 1 . 2]" 1
406 1 19 VAL MG1 1 22 GLY H . . 4.350 3.168 2.383 4.208 . 0 0 "[ . 1 . 2]" 1
407 1 19 VAL MG1 1 42 ASP HB2 . . 4.780 3.921 3.223 4.247 . 0 0 "[ . 1 . 2]" 1
408 1 19 VAL MG1 1 42 ASP QB . . 3.900 3.677 3.106 3.871 . 0 0 "[ . 1 . 2]" 1
409 1 19 VAL MG1 1 42 ASP HB3 . . 4.780 4.468 4.063 4.728 . 0 0 "[ . 1 . 2]" 1
410 1 19 VAL MG1 1 66 TYR QD . . 3.950 3.204 2.771 3.611 . 0 0 "[ . 1 . 2]" 1
411 1 19 VAL MG1 1 66 TYR QE . . 3.290 2.072 1.840 2.329 . 0 0 "[ . 1 . 2]" 1
412 1 19 VAL MG2 1 20 GLN H . . 4.220 4.093 3.969 4.224 0.004 17 0 "[ . 1 . 2]" 1
413 1 19 VAL MG2 1 24 LEU MD1 . . 3.020 2.060 1.800 2.291 . 0 0 "[ . 1 . 2]" 1
414 1 19 VAL MG2 1 24 LEU MD2 . . 3.040 2.671 2.453 3.005 . 0 0 "[ . 1 . 2]" 1
415 1 19 VAL MG2 1 24 LEU HG . . 4.570 4.400 4.035 4.572 0.002 1 0 "[ . 1 . 2]" 1
416 1 19 VAL MG2 1 46 GLY H . . 5.500 5.267 4.991 5.492 . 0 0 "[ . 1 . 2]" 1
417 1 20 GLN H 1 20 GLN QB . . 3.390 2.575 2.330 2.772 . 0 0 "[ . 1 . 2]" 1
418 1 20 GLN H 1 20 GLN HG2 . . 4.470 3.761 2.546 4.363 . 0 0 "[ . 1 . 2]" 1
419 1 20 GLN H 1 20 GLN HG3 . . 4.470 3.553 2.936 4.205 . 0 0 "[ . 1 . 2]" 1
420 1 20 GLN H 1 22 GLY H . . 4.640 3.573 2.800 3.968 . 0 0 "[ . 1 . 2]" 1
421 1 20 GLN H 1 66 TYR QE . . 4.240 3.338 2.764 3.834 . 0 0 "[ . 1 . 2]" 1
422 1 20 GLN HA 1 20 GLN HG2 . . 3.960 3.165 2.614 3.610 . 0 0 "[ . 1 . 2]" 1
423 1 20 GLN HA 1 20 GLN QG . . 3.390 2.634 2.420 3.063 . 0 0 "[ . 1 . 2]" 1
424 1 20 GLN HA 1 20 GLN HG3 . . 3.960 3.027 2.462 3.805 . 0 0 "[ . 1 . 2]" 1
425 1 20 GLN QB 1 21 LYS H . . 3.890 2.585 1.901 3.590 . 0 0 "[ . 1 . 2]" 1
426 1 20 GLN QB 1 21 LYS QG . . 4.270 3.196 2.541 4.255 . 0 0 "[ . 1 . 2]" 1
427 1 20 GLN QB 1 22 GLY H . . 4.730 4.244 3.509 4.684 . 0 0 "[ . 1 . 2]" 1
428 1 20 GLN HB2 1 21 LYS H . . 4.460 3.025 1.918 4.393 . 0 0 "[ . 1 . 2]" 1
429 1 20 GLN HB2 1 22 GLY H . . 5.500 4.546 3.593 5.188 . 0 0 "[ . 1 . 2]" 1
430 1 20 GLN HB3 1 21 LYS H . . 4.460 3.238 2.772 3.807 . 0 0 "[ . 1 . 2]" 1
431 1 20 GLN HB3 1 22 GLY H . . 5.500 5.215 4.781 5.492 . 0 0 "[ . 1 . 2]" 1
432 1 21 LYS H 1 21 LYS QG . . 4.880 2.732 1.954 3.365 . 0 0 "[ . 1 . 2]" 1
433 1 21 LYS HA 1 21 LYS QD . . 4.450 3.478 1.987 4.405 . 0 0 "[ . 1 . 2]" 1
434 1 21 LYS HA 1 21 LYS HG2 . . 4.180 2.881 2.238 3.791 . 0 0 "[ . 1 . 2]" 1
435 1 21 LYS HA 1 21 LYS QG . . 3.570 2.707 2.196 3.343 . 0 0 "[ . 1 . 2]" 1
436 1 21 LYS HA 1 21 LYS HG3 . . 4.180 3.449 2.672 3.894 . 0 0 "[ . 1 . 2]" 1
437 1 21 LYS HB2 1 22 GLY H . . 4.590 3.852 2.458 4.501 . 0 0 "[ . 1 . 2]" 1
438 1 21 LYS HB3 1 22 GLY H . . 4.590 4.148 3.053 4.609 0.019 2 0 "[ . 1 . 2]" 1
439 1 21 LYS QE 1 21 LYS QG . . 3.190 2.288 2.032 2.648 . 0 0 "[ . 1 . 2]" 1
440 1 21 LYS QG 1 22 GLY H . . 5.060 4.153 1.828 4.786 . 0 0 "[ . 1 . 2]" 1
441 1 22 GLY H 1 23 GLU H . . 4.720 4.532 4.357 4.642 . 0 0 "[ . 1 . 2]" 1
442 1 22 GLY H 1 66 TYR QE . . 4.100 3.583 3.190 4.031 . 0 0 "[ . 1 . 2]" 1
443 1 22 GLY HA2 1 23 GLU H . . 2.820 2.300 2.199 2.439 . 0 0 "[ . 1 . 2]" 1
444 1 22 GLY HA2 1 23 GLU HB2 . . 4.830 4.465 4.333 4.592 . 0 0 "[ . 1 . 2]" 1
445 1 22 GLY HA2 1 23 GLU QB . . 4.190 4.047 4.023 4.077 . 0 0 "[ . 1 . 2]" 1
446 1 22 GLY HA2 1 23 GLU HB3 . . 4.830 4.641 4.497 4.802 . 0 0 "[ . 1 . 2]" 1
447 1 22 GLY HA2 1 66 TYR QD . . 5.500 5.170 4.906 5.452 . 0 0 "[ . 1 . 2]" 1
448 1 22 GLY HA2 1 66 TYR QE . . 4.370 4.119 3.851 4.354 . 0 0 "[ . 1 . 2]" 1
449 1 22 GLY HA2 1 67 ASP HB2 . . 3.900 3.312 2.795 3.795 . 0 0 "[ . 1 . 2]" 1
450 1 22 GLY HA2 1 67 ASP HB3 . . 5.410 4.879 4.320 5.412 0.002 8 0 "[ . 1 . 2]" 1
451 1 22 GLY HA3 1 23 GLU H . . 3.110 2.877 2.697 3.036 . 0 0 "[ . 1 . 2]" 1
452 1 22 GLY HA3 1 23 GLU HA . . 4.690 4.569 4.485 4.650 . 0 0 "[ . 1 . 2]" 1
453 1 22 GLY HA3 1 66 TYR QD . . 5.000 3.921 3.648 4.234 . 0 0 "[ . 1 . 2]" 1
454 1 22 GLY HA3 1 66 TYR QE . . 4.100 2.592 2.299 2.906 . 0 0 "[ . 1 . 2]" 1
455 1 23 GLU H 1 23 GLU HB2 . . 3.180 2.828 2.655 3.014 . 0 0 "[ . 1 . 2]" 1
456 1 23 GLU H 1 23 GLU HB3 . . 3.180 2.469 2.359 2.595 . 0 0 "[ . 1 . 2]" 1
457 1 23 GLU H 1 23 GLU HG2 . . 4.730 4.435 4.280 4.691 . 0 0 "[ . 1 . 2]" 1
458 1 23 GLU H 1 23 GLU QG . . 4.040 3.985 3.925 4.038 . 0 0 "[ . 1 . 2]" 1
459 1 23 GLU H 1 23 GLU HG3 . . 4.730 4.531 4.269 4.674 . 0 0 "[ . 1 . 2]" 1
460 1 23 GLU H 1 24 LEU H . . 4.490 4.390 4.221 4.518 0.028 18 0 "[ . 1 . 2]" 1
461 1 23 GLU H 1 66 TYR HA . . 4.840 4.535 4.394 4.773 . 0 0 "[ . 1 . 2]" 1
462 1 23 GLU H 1 66 TYR QD . . 4.850 4.628 3.880 4.788 . 0 0 "[ . 1 . 2]" 1
463 1 23 GLU H 1 66 TYR QE . . 4.630 4.507 3.595 4.631 0.001 10 0 "[ . 1 . 2]" 1
464 1 23 GLU H 1 67 ASP H . . 3.750 3.220 2.833 3.504 . 0 0 "[ . 1 . 2]" 1
465 1 23 GLU H 1 67 ASP HA . . 3.700 3.310 3.072 3.701 0.001 1 0 "[ . 1 . 2]" 1
466 1 23 GLU H 1 67 ASP HB2 . . 4.690 2.833 2.644 3.221 . 0 0 "[ . 1 . 2]" 1
467 1 23 GLU H 1 67 ASP HB3 . . 5.330 4.498 4.316 4.902 . 0 0 "[ . 1 . 2]" 1
468 1 23 GLU HA 1 23 GLU HG2 . . 4.130 3.329 2.885 3.834 . 0 0 "[ . 1 . 2]" 1
469 1 23 GLU HA 1 23 GLU QG . . 3.490 2.513 2.299 3.063 . 0 0 "[ . 1 . 2]" 1
470 1 23 GLU HA 1 23 GLU HG3 . . 4.130 2.614 2.341 3.220 . 0 0 "[ . 1 . 2]" 1
471 1 23 GLU HA 1 24 LEU H . . 2.580 2.156 2.140 2.185 . 0 0 "[ . 1 . 2]" 1
472 1 23 GLU HA 1 24 LEU HA . . 5.050 4.397 4.379 4.428 . 0 0 "[ . 1 . 2]" 1
473 1 23 GLU HA 1 24 LEU HB2 . . 4.630 4.274 4.148 4.407 . 0 0 "[ . 1 . 2]" 1
474 1 23 GLU HA 1 24 LEU HB3 . . 5.020 4.949 4.922 4.986 . 0 0 "[ . 1 . 2]" 1
475 1 23 GLU QB 1 67 ASP H . . 4.350 3.111 2.742 3.755 . 0 0 "[ . 1 . 2]" 1
476 1 23 GLU QB 1 67 ASP HA . . 4.120 3.025 2.576 3.758 . 0 0 "[ . 1 . 2]" 1
477 1 23 GLU HB2 1 24 LEU H . . 4.530 4.291 4.033 4.519 . 0 0 "[ . 1 . 2]" 1
478 1 23 GLU HB3 1 24 LEU H . . 4.530 4.293 4.084 4.491 . 0 0 "[ . 1 . 2]" 1
479 1 23 GLU QG 1 24 LEU H . . 3.680 2.947 2.443 3.386 . 0 0 "[ . 1 . 2]" 1
480 1 23 GLU QG 1 25 THR MG . . 3.340 2.134 1.949 2.334 . 0 0 "[ . 1 . 2]" 1
481 1 23 GLU HG2 1 24 LEU H . . 4.260 3.658 2.866 4.267 0.007 18 0 "[ . 1 . 2]" 1
482 1 23 GLU HG2 1 25 THR MG . . 4.130 2.279 1.965 2.926 . 0 0 "[ . 1 . 2]" 1
483 1 23 GLU HG3 1 24 LEU H . . 4.260 3.207 2.460 3.857 . 0 0 "[ . 1 . 2]" 1
484 1 23 GLU HG3 1 25 THR MG . . 4.130 2.861 2.140 3.427 . 0 0 "[ . 1 . 2]" 1
485 1 24 LEU H 1 24 LEU HB2 . . 3.090 2.560 2.371 2.680 . 0 0 "[ . 1 . 2]" 1
486 1 24 LEU H 1 24 LEU HB3 . . 3.160 2.840 2.807 2.905 . 0 0 "[ . 1 . 2]" 1
487 1 24 LEU H 1 24 LEU MD1 . . 4.150 4.063 3.885 4.134 . 0 0 "[ . 1 . 2]" 1
488 1 24 LEU H 1 24 LEU HG . . 4.780 4.578 4.523 4.614 . 0 0 "[ . 1 . 2]" 1
489 1 24 LEU H 1 25 THR H . . 4.490 4.231 4.107 4.391 . 0 0 "[ . 1 . 2]" 1
490 1 24 LEU H 1 66 TYR QD . . 4.890 4.534 4.244 4.793 . 0 0 "[ . 1 . 2]" 1
491 1 24 LEU HA 1 24 LEU MD1 . . 3.350 2.511 2.423 2.615 . 0 0 "[ . 1 . 2]" 1
492 1 24 LEU HA 1 24 LEU MD2 . . 3.910 3.798 3.783 3.814 . 0 0 "[ . 1 . 2]" 1
493 1 24 LEU HA 1 24 LEU HG . . 3.470 2.506 2.472 2.543 . 0 0 "[ . 1 . 2]" 1
494 1 24 LEU HA 1 25 THR H . . 2.680 2.155 2.138 2.179 . 0 0 "[ . 1 . 2]" 1
495 1 24 LEU HA 1 25 THR HA . . 4.620 4.395 4.391 4.402 . 0 0 "[ . 1 . 2]" 1
496 1 24 LEU HA 1 65 LYS H . . 4.940 4.274 4.103 4.669 . 0 0 "[ . 1 . 2]" 1
497 1 24 LEU HA 1 66 TYR H . . 5.500 4.965 4.836 5.181 . 0 0 "[ . 1 . 2]" 1
498 1 24 LEU HA 1 66 TYR HA . . 3.660 2.613 2.505 2.776 . 0 0 "[ . 1 . 2]" 1
499 1 24 LEU HA 1 66 TYR QD . . 4.060 3.365 2.931 3.489 . 0 0 "[ . 1 . 2]" 1
500 1 24 LEU HA 1 67 ASP H . . 4.300 3.802 3.629 4.002 . 0 0 "[ . 1 . 2]" 1
501 1 24 LEU HB2 1 24 LEU MD1 . . 3.240 2.092 2.027 2.143 . 0 0 "[ . 1 . 2]" 1
502 1 24 LEU HB2 1 24 LEU MD2 . . 3.050 2.646 2.575 2.710 . 0 0 "[ . 1 . 2]" 1
503 1 24 LEU HB2 1 25 THR H . . 4.620 4.539 4.475 4.584 . 0 0 "[ . 1 . 2]" 1
504 1 24 LEU HB2 1 40 ILE MD . . 4.590 4.346 4.071 4.550 . 0 0 "[ . 1 . 2]" 1
505 1 24 LEU HB2 1 40 ILE MG . . 4.570 4.176 3.578 4.369 . 0 0 "[ . 1 . 2]" 1
506 1 24 LEU HB2 1 48 ILE MD . . 5.250 4.918 4.535 5.175 . 0 0 "[ . 1 . 2]" 1
507 1 24 LEU HB2 1 64 ILE MG . . 5.500 4.824 4.596 4.982 . 0 0 "[ . 1 . 2]" 1
508 1 24 LEU HB2 1 66 TYR QD . . 4.410 3.083 2.909 3.341 . 0 0 "[ . 1 . 2]" 1
509 1 24 LEU HB3 1 24 LEU MD1 . . 3.130 3.119 3.107 3.134 0.004 11 0 "[ . 1 . 2]" 1
510 1 24 LEU HB3 1 24 LEU MD2 . . 3.130 2.054 1.967 2.184 . 0 0 "[ . 1 . 2]" 1
511 1 24 LEU HB3 1 25 THR H . . 4.280 4.157 4.052 4.242 . 0 0 "[ . 1 . 2]" 1
512 1 24 LEU HB3 1 40 ILE MD . . 3.200 2.931 2.589 3.185 . 0 0 "[ . 1 . 2]" 1
513 1 24 LEU HB3 1 40 ILE MG . . 3.350 3.105 2.556 3.322 . 0 0 "[ . 1 . 2]" 1
514 1 24 LEU HB3 1 48 ILE MD . . 5.050 4.758 4.365 5.038 . 0 0 "[ . 1 . 2]" 1
515 1 24 LEU HB3 1 64 ILE MG . . 5.370 4.384 4.055 4.557 . 0 0 "[ . 1 . 2]" 1
516 1 24 LEU HB3 1 66 TYR QD . . 4.930 4.657 4.529 4.861 . 0 0 "[ . 1 . 2]" 1
517 1 24 LEU MD1 1 25 THR H . . 4.310 3.989 3.829 4.087 . 0 0 "[ . 1 . 2]" 1
518 1 24 LEU MD1 1 48 ILE MG . . 3.150 2.918 2.267 3.118 . 0 0 "[ . 1 . 2]" 1
519 1 24 LEU MD1 1 66 TYR HA . . 3.930 2.787 2.647 3.329 . 0 0 "[ . 1 . 2]" 1
520 1 24 LEU MD1 1 66 TYR HB2 . . 3.700 2.074 1.961 2.462 . 0 0 "[ . 1 . 2]" 1
521 1 24 LEU MD1 1 66 TYR HB3 . . 4.060 3.630 3.524 3.939 . 0 0 "[ . 1 . 2]" 1
522 1 24 LEU MD1 1 66 TYR QD . . 3.450 1.842 1.771 1.971 . 0 0 "[ . 1 . 2]" 1
523 1 24 LEU MD1 1 66 TYR QE . . 4.020 3.350 3.181 3.437 . 0 0 "[ . 1 . 2]" 1
524 1 24 LEU MD1 1 67 ASP H . . 4.670 4.564 4.461 4.671 0.001 17 0 "[ . 1 . 2]" 1
525 1 24 LEU MD2 1 48 ILE HB . . 4.120 2.769 2.522 2.935 . 0 0 "[ . 1 . 2]" 1
526 1 24 LEU MD2 1 48 ILE MD . . 3.080 1.893 1.702 2.079 . 0 0 "[ . 1 . 2]" 1
527 1 24 LEU MD2 1 48 ILE MG . . 3.390 2.202 1.991 2.519 . 0 0 "[ . 1 . 2]" 1
528 1 24 LEU MD2 1 64 ILE MG . . 2.980 2.659 2.036 2.924 . 0 0 "[ . 1 . 2]" 1
529 1 24 LEU MD2 1 71 ILE MG . . 3.950 3.642 3.290 3.947 . 0 0 "[ . 1 . 2]" 1
530 1 24 LEU HG 1 25 THR H . . 3.660 3.320 3.070 3.525 . 0 0 "[ . 1 . 2]" 1
531 1 24 LEU HG 1 64 ILE MG . . 4.250 2.432 2.235 2.585 . 0 0 "[ . 1 . 2]" 1
532 1 24 LEU HG 1 66 TYR HA . . 4.940 4.264 4.065 4.424 . 0 0 "[ . 1 . 2]" 1
533 1 24 LEU HG 1 66 TYR QD . . 4.160 4.151 4.106 4.163 0.003 19 0 "[ . 1 . 2]" 1
534 1 25 THR H 1 25 THR HB . . 4.000 3.769 3.730 3.850 . 0 0 "[ . 1 . 2]" 1
535 1 25 THR H 1 25 THR MG . . 3.590 2.979 2.742 3.130 . 0 0 "[ . 1 . 2]" 1
536 1 25 THR H 1 26 GLY H . . 4.670 4.483 4.445 4.518 . 0 0 "[ . 1 . 2]" 1
537 1 25 THR H 1 40 ILE MD . . 4.290 3.998 3.595 4.173 . 0 0 "[ . 1 . 2]" 1
538 1 25 THR H 1 64 ILE MG . . 4.050 3.458 3.177 3.596 . 0 0 "[ . 1 . 2]" 1
539 1 25 THR H 1 65 LYS H . . 3.520 3.050 2.892 3.169 . 0 0 "[ . 1 . 2]" 1
540 1 25 THR H 1 65 LYS HA . . 4.990 4.903 4.804 4.981 . 0 0 "[ . 1 . 2]" 1
541 1 25 THR H 1 65 LYS HB2 . . 4.460 3.675 3.493 3.887 . 0 0 "[ . 1 . 2]" 1
542 1 25 THR H 1 65 LYS HB3 . . 4.710 4.167 3.992 4.372 . 0 0 "[ . 1 . 2]" 1
543 1 25 THR H 1 66 TYR HA . . 3.940 3.719 3.600 3.857 . 0 0 "[ . 1 . 2]" 1
544 1 25 THR H 1 66 TYR QD . . 5.390 5.305 4.822 5.390 . 0 0 "[ . 1 . 2]" 1
545 1 25 THR HA 1 25 THR MG . . 3.150 2.289 2.162 2.407 . 0 0 "[ . 1 . 2]" 1
546 1 25 THR HA 1 26 GLY H . . 2.880 2.420 2.326 2.544 . 0 0 "[ . 1 . 2]" 1
547 1 25 THR HA 1 40 ILE MD . . 3.900 2.893 2.341 3.142 . 0 0 "[ . 1 . 2]" 1
548 1 25 THR HB 1 26 GLY H . . 3.100 2.362 2.087 2.591 . 0 0 "[ . 1 . 2]" 1
549 1 25 THR HB 1 26 GLY HA3 . . 4.830 4.743 4.573 4.831 0.001 19 0 "[ . 1 . 2]" 1
550 1 25 THR MG 1 26 GLY H . . 3.870 3.584 3.423 3.713 . 0 0 "[ . 1 . 2]" 1
551 1 25 THR MG 1 65 LYS H . . 5.500 5.194 5.115 5.278 . 0 0 "[ . 1 . 2]" 1
552 1 26 GLY H 1 27 GLU H . . 4.440 4.397 4.382 4.409 . 0 0 "[ . 1 . 2]" 1
553 1 26 GLY H 1 37 ARG QG . . 4.510 3.776 3.502 3.984 . 0 0 "[ . 1 . 2]" 1
554 1 26 GLY H 1 38 PRO HD2 . . 4.430 4.123 3.948 4.259 . 0 0 "[ . 1 . 2]" 1
555 1 26 GLY H 1 38 PRO QG . . 4.530 3.820 3.619 4.027 . 0 0 "[ . 1 . 2]" 1
556 1 26 GLY H 1 40 ILE MD . . 3.750 3.377 3.131 3.600 . 0 0 "[ . 1 . 2]" 1
557 1 26 GLY H 1 64 ILE MD . . 4.720 3.995 3.845 4.263 . 0 0 "[ . 1 . 2]" 1
558 1 26 GLY H 1 65 LYS H . . 4.950 4.861 4.593 4.948 . 0 0 "[ . 1 . 2]" 1
559 1 26 GLY HA2 1 27 GLU H . . 2.980 2.509 2.434 2.581 . 0 0 "[ . 1 . 2]" 1
560 1 26 GLY HA2 1 38 PRO HD2 . . 5.100 4.879 4.667 4.986 . 0 0 "[ . 1 . 2]" 1
561 1 26 GLY HA2 1 38 PRO QG . . 4.460 4.096 3.971 4.204 . 0 0 "[ . 1 . 2]" 1
562 1 26 GLY HA2 1 40 ILE MD . . 4.290 4.236 4.036 4.291 0.001 8 0 "[ . 1 . 2]" 1
563 1 26 GLY HA2 1 63 GLY H . . 4.760 4.602 4.404 4.702 . 0 0 "[ . 1 . 2]" 1
564 1 26 GLY HA2 1 64 ILE HA . . 4.060 2.243 2.096 2.385 . 0 0 "[ . 1 . 2]" 1
565 1 26 GLY HA2 1 64 ILE MD . . 4.150 2.762 2.597 2.886 . 0 0 "[ . 1 . 2]" 1
566 1 26 GLY HA2 1 64 ILE MG . . 4.400 3.614 3.437 3.828 . 0 0 "[ . 1 . 2]" 1
567 1 26 GLY HA2 1 65 LYS H . . 3.840 3.522 3.144 3.641 . 0 0 "[ . 1 . 2]" 1
568 1 26 GLY HA3 1 27 GLU H . . 3.180 2.620 2.547 2.700 . 0 0 "[ . 1 . 2]" 1
569 1 26 GLY HA3 1 38 PRO QG . . 3.900 2.809 2.656 2.919 . 0 0 "[ . 1 . 2]" 1
570 1 26 GLY HA3 1 40 ILE MD . . 3.620 3.118 2.953 3.199 . 0 0 "[ . 1 . 2]" 1
571 1 26 GLY HA3 1 64 ILE HA . . 4.130 2.787 2.666 2.921 . 0 0 "[ . 1 . 2]" 1
572 1 26 GLY HA3 1 64 ILE MD . . 3.870 1.939 1.857 2.125 . 0 0 "[ . 1 . 2]" 1
573 1 26 GLY HA3 1 64 ILE QG . . 4.960 4.020 3.874 4.217 . 0 0 "[ . 1 . 2]" 1
574 1 26 GLY HA3 1 64 ILE MG . . 4.590 3.400 3.127 3.631 . 0 0 "[ . 1 . 2]" 1
575 1 26 GLY HA3 1 65 LYS H . . 4.360 4.259 4.041 4.363 0.003 10 0 "[ . 1 . 2]" 1
576 1 27 GLU H 1 27 GLU QB . . 3.260 2.741 2.667 2.794 . 0 0 "[ . 1 . 2]" 1
577 1 27 GLU H 1 27 GLU HG2 . . 4.390 4.330 4.258 4.378 . 0 0 "[ . 1 . 2]" 1
578 1 27 GLU H 1 28 VAL H . . 4.460 4.318 4.250 4.394 . 0 0 "[ . 1 . 2]" 1
579 1 27 GLU H 1 28 VAL HA . . 4.890 4.652 4.591 4.733 . 0 0 "[ . 1 . 2]" 1
580 1 27 GLU H 1 38 PRO HD2 . . 4.320 3.861 3.642 4.041 . 0 0 "[ . 1 . 2]" 1
581 1 27 GLU H 1 38 PRO HD3 . . 4.220 3.980 3.773 4.164 . 0 0 "[ . 1 . 2]" 1
582 1 27 GLU H 1 38 PRO QG . . 4.030 3.056 2.865 3.273 . 0 0 "[ . 1 . 2]" 1
583 1 27 GLU H 1 62 MET HA . . 4.270 4.077 3.936 4.200 . 0 0 "[ . 1 . 2]" 1
584 1 27 GLU H 1 62 MET HG2 . . 4.640 4.500 4.222 4.640 0.000 20 0 "[ . 1 . 2]" 1
585 1 27 GLU H 1 62 MET HG3 . . 4.470 3.642 3.353 3.972 . 0 0 "[ . 1 . 2]" 1
586 1 27 GLU H 1 63 GLY H . . 3.550 2.741 2.509 2.873 . 0 0 "[ . 1 . 2]" 1
587 1 27 GLU H 1 63 GLY HA3 . . 4.270 4.156 4.005 4.242 . 0 0 "[ . 1 . 2]" 1
588 1 27 GLU H 1 64 ILE HA . . 3.980 3.824 3.693 3.921 . 0 0 "[ . 1 . 2]" 1
589 1 27 GLU H 1 64 ILE MD . . 4.380 2.949 2.791 3.296 . 0 0 "[ . 1 . 2]" 1
590 1 27 GLU H 1 64 ILE MG . . 5.430 5.174 4.979 5.349 . 0 0 "[ . 1 . 2]" 1
591 1 27 GLU HA 1 27 GLU HG2 . . 3.870 3.377 3.300 3.477 . 0 0 "[ . 1 . 2]" 1
592 1 27 GLU HA 1 27 GLU HG3 . . 4.110 2.687 2.618 2.788 . 0 0 "[ . 1 . 2]" 1
593 1 27 GLU HA 1 28 VAL H . . 2.990 2.269 2.207 2.351 . 0 0 "[ . 1 . 2]" 1
594 1 27 GLU HA 1 28 VAL HB . . 4.830 4.555 4.444 4.694 . 0 0 "[ . 1 . 2]" 1
595 1 27 GLU HA 1 28 VAL MG2 . . 4.100 3.561 3.340 3.668 . 0 0 "[ . 1 . 2]" 1
596 1 27 GLU HA 1 37 ARG HB3 . . 5.500 5.359 5.143 5.490 . 0 0 "[ . 1 . 2]" 1
597 1 27 GLU HA 1 37 ARG HG2 . . 4.220 3.908 3.673 4.160 . 0 0 "[ . 1 . 2]" 1
598 1 27 GLU HA 1 37 ARG HG3 . . 4.220 3.687 3.443 3.929 . 0 0 "[ . 1 . 2]" 1
599 1 27 GLU HA 1 38 PRO HD2 . . 4.300 2.052 2.006 2.107 . 0 0 "[ . 1 . 2]" 1
600 1 27 GLU HA 1 38 PRO HD3 . . 4.120 2.122 2.027 2.252 . 0 0 "[ . 1 . 2]" 1
601 1 27 GLU HA 1 38 PRO QG . . 5.050 3.097 3.031 3.311 . 0 0 "[ . 1 . 2]" 1
602 1 27 GLU QB 1 28 VAL H . . 4.350 3.483 3.358 3.588 . 0 0 "[ . 1 . 2]" 1
603 1 27 GLU QB 1 38 PRO HD2 . . 4.330 3.829 3.738 3.941 . 0 0 "[ . 1 . 2]" 1
604 1 27 GLU QB 1 38 PRO HD3 . . 4.940 4.159 4.073 4.270 . 0 0 "[ . 1 . 2]" 1
605 1 27 GLU HG2 1 28 VAL H . . 4.020 2.814 2.517 3.126 . 0 0 "[ . 1 . 2]" 1
606 1 27 GLU HG2 1 35 THR HB . . 3.750 3.575 3.301 3.742 . 0 0 "[ . 1 . 2]" 1
607 1 27 GLU HG2 1 35 THR MG . . 4.000 3.876 3.620 3.999 . 0 0 "[ . 1 . 2]" 1
608 1 27 GLU HG2 1 36 ALA H . . 4.700 4.621 4.408 4.701 0.001 10 0 "[ . 1 . 2]" 1
609 1 27 GLU HG3 1 28 VAL H . . 3.450 2.293 1.932 2.524 . 0 0 "[ . 1 . 2]" 1
610 1 27 GLU HG3 1 35 THR HB . . 3.690 3.027 2.850 3.203 . 0 0 "[ . 1 . 2]" 1
611 1 27 GLU HG3 1 35 THR MG . . 4.260 4.119 3.891 4.261 0.001 17 0 "[ . 1 . 2]" 1
612 1 27 GLU HG3 1 36 ALA H . . 4.090 3.857 3.668 3.984 . 0 0 "[ . 1 . 2]" 1
613 1 27 GLU HG3 1 38 PRO HD3 . . 5.380 4.071 3.923 4.302 . 0 0 "[ . 1 . 2]" 1
614 1 28 VAL H 1 28 VAL HB . . 3.250 2.630 2.512 2.732 . 0 0 "[ . 1 . 2]" 1
615 1 28 VAL H 1 28 VAL MG1 . . 4.150 3.838 3.776 3.891 . 0 0 "[ . 1 . 2]" 1
616 1 28 VAL H 1 28 VAL MG2 . . 3.660 2.845 2.620 3.072 . 0 0 "[ . 1 . 2]" 1
617 1 28 VAL H 1 29 ARG H . . 4.700 4.460 4.374 4.515 . 0 0 "[ . 1 . 2]" 1
618 1 28 VAL H 1 35 THR HA . . 5.020 4.930 4.799 5.017 . 0 0 "[ . 1 . 2]" 1
619 1 28 VAL H 1 35 THR HB . . 4.250 4.160 3.796 4.252 0.002 18 0 "[ . 1 . 2]" 1
620 1 28 VAL H 1 36 ALA H . . 3.460 3.266 3.138 3.348 . 0 0 "[ . 1 . 2]" 1
621 1 28 VAL H 1 37 ARG HA . . 3.960 3.143 2.953 3.339 . 0 0 "[ . 1 . 2]" 1
622 1 28 VAL H 1 38 PRO HD2 . . 4.400 3.570 3.355 3.741 . 0 0 "[ . 1 . 2]" 1
623 1 28 VAL H 1 38 PRO HD3 . . 4.160 2.342 2.066 2.592 . 0 0 "[ . 1 . 2]" 1
624 1 28 VAL H 1 38 PRO QG . . 4.800 3.932 3.711 4.131 . 0 0 "[ . 1 . 2]" 1
625 1 28 VAL H 1 62 MET HA . . 5.280 4.929 4.810 5.049 . 0 0 "[ . 1 . 2]" 1
626 1 28 VAL HA 1 28 VAL MG1 . . 3.540 2.356 2.267 2.502 . 0 0 "[ . 1 . 2]" 1
627 1 28 VAL HA 1 28 VAL MG2 . . 3.500 2.318 2.217 2.472 . 0 0 "[ . 1 . 2]" 1
628 1 28 VAL HA 1 29 ARG H . . 3.000 2.233 2.185 2.295 . 0 0 "[ . 1 . 2]" 1
629 1 28 VAL HA 1 36 ALA H . . 4.950 4.805 4.709 4.901 . 0 0 "[ . 1 . 2]" 1
630 1 28 VAL HA 1 62 MET HA . . 3.760 2.595 2.475 2.733 . 0 0 "[ . 1 . 2]" 1
631 1 28 VAL HA 1 62 MET HG3 . . 4.840 4.216 3.922 4.388 . 0 0 "[ . 1 . 2]" 1
632 1 28 VAL HA 1 63 GLY H . . 3.930 3.894 3.758 3.932 0.002 11 0 "[ . 1 . 2]" 1
633 1 28 VAL HB 1 29 ARG H . . 4.270 3.952 3.732 4.124 . 0 0 "[ . 1 . 2]" 1
634 1 28 VAL HB 1 35 THR HA . . 5.500 4.896 4.732 5.046 . 0 0 "[ . 1 . 2]" 1
635 1 28 VAL HB 1 36 ALA H . . 3.370 3.147 2.913 3.281 . 0 0 "[ . 1 . 2]" 1
636 1 28 VAL MG1 1 29 ARG H . . 3.420 2.046 1.879 2.298 . 0 0 "[ . 1 . 2]" 1
637 1 28 VAL MG1 1 29 ARG HA . . 3.760 3.584 3.303 3.744 . 0 0 "[ . 1 . 2]" 1
638 1 28 VAL MG1 1 30 MET H . . 4.590 3.864 3.416 4.253 . 0 0 "[ . 1 . 2]" 1
639 1 28 VAL MG1 1 30 MET HA . . 4.760 3.938 3.746 4.128 . 0 0 "[ . 1 . 2]" 1
640 1 28 VAL MG1 1 30 MET ME . . 4.590 4.023 3.533 4.463 . 0 0 "[ . 1 . 2]" 1
641 1 28 VAL MG1 1 36 ALA H . . 4.480 3.743 3.433 4.208 . 0 0 "[ . 1 . 2]" 1
642 1 28 VAL MG1 1 36 ALA MB . . 4.140 3.621 3.366 3.977 . 0 0 "[ . 1 . 2]" 1
643 1 28 VAL MG1 1 52 TYR QD . . 5.050 3.441 3.179 3.647 . 0 0 "[ . 1 . 2]" 1
644 1 28 VAL MG1 1 52 TYR QE . . 3.850 2.747 2.597 2.906 . 0 0 "[ . 1 . 2]" 1
645 1 28 VAL MG1 1 60 HIS HB2 . . 4.670 3.577 3.307 3.835 . 0 0 "[ . 1 . 2]" 1
646 1 28 VAL MG1 1 60 HIS QB . . 3.830 2.372 2.143 2.550 . 0 0 "[ . 1 . 2]" 1
647 1 28 VAL MG1 1 60 HIS HB3 . . 4.670 2.408 2.165 2.593 . 0 0 "[ . 1 . 2]" 1
648 1 28 VAL MG1 1 60 HIS HD2 . . 3.090 2.572 2.300 2.873 . 0 0 "[ . 1 . 2]" 1
649 1 28 VAL MG1 1 61 GLN H . . 4.230 3.418 3.191 3.631 . 0 0 "[ . 1 . 2]" 1
650 1 28 VAL MG1 1 62 MET HA . . 4.530 3.916 3.665 4.175 . 0 0 "[ . 1 . 2]" 1
651 1 28 VAL MG1 1 78 PHE QE . . 4.360 3.200 2.651 3.720 . 0 0 "[ . 1 . 2]" 1
652 1 28 VAL MG1 1 78 PHE HZ . . 3.210 2.361 1.932 3.092 . 0 0 "[ . 1 . 2]" 1
653 1 28 VAL MG2 1 29 ARG H . . 4.120 3.857 3.697 4.043 . 0 0 "[ . 1 . 2]" 1
654 1 28 VAL MG2 1 36 ALA H . . 4.680 4.574 4.402 4.683 0.003 10 0 "[ . 1 . 2]" 1
655 1 28 VAL MG2 1 36 ALA MB . . 4.270 3.938 3.720 4.093 . 0 0 "[ . 1 . 2]" 1
656 1 28 VAL MG2 1 38 PRO HA . . 4.060 3.229 3.086 3.564 . 0 0 "[ . 1 . 2]" 1
657 1 28 VAL MG2 1 38 PRO HB2 . . 4.110 3.471 3.344 3.602 . 0 0 "[ . 1 . 2]" 1
658 1 28 VAL MG2 1 38 PRO HB3 . . 3.510 2.048 1.937 2.224 . 0 0 "[ . 1 . 2]" 1
659 1 28 VAL MG2 1 38 PRO HD2 . . 4.110 3.595 3.393 3.804 . 0 0 "[ . 1 . 2]" 1
660 1 28 VAL MG2 1 38 PRO HD3 . . 3.640 2.136 1.975 2.429 . 0 0 "[ . 1 . 2]" 1
661 1 28 VAL MG2 1 38 PRO QG . . 3.930 2.356 2.078 2.508 . 0 0 "[ . 1 . 2]" 1
662 1 28 VAL MG2 1 39 ASN H . . 5.500 4.660 4.509 4.852 . 0 0 "[ . 1 . 2]" 1
663 1 28 VAL MG2 1 52 TYR HB2 . . 4.420 2.998 2.718 3.111 . 0 0 "[ . 1 . 2]" 1
664 1 28 VAL MG2 1 52 TYR HB3 . . 4.900 3.783 3.524 3.952 . 0 0 "[ . 1 . 2]" 1
665 1 28 VAL MG2 1 52 TYR QD . . 4.420 2.883 2.576 3.123 . 0 0 "[ . 1 . 2]" 1
666 1 28 VAL MG2 1 52 TYR QE . . 4.290 3.352 3.106 3.689 . 0 0 "[ . 1 . 2]" 1
667 1 28 VAL MG2 1 62 MET HA . . 4.060 3.095 2.860 3.300 . 0 0 "[ . 1 . 2]" 1
668 1 28 VAL MG2 1 62 MET HB2 . . 4.620 2.821 2.441 3.053 . 0 0 "[ . 1 . 2]" 1
669 1 28 VAL MG2 1 62 MET QB . . 3.960 2.784 2.421 3.004 . 0 0 "[ . 1 . 2]" 1
670 1 28 VAL MG2 1 62 MET HB3 . . 4.620 4.298 4.016 4.477 . 0 0 "[ . 1 . 2]" 1
671 1 28 VAL MG2 1 62 MET ME . . 3.170 2.159 1.821 2.589 . 0 0 "[ . 1 . 2]" 1
672 1 28 VAL MG2 1 62 MET HG2 . . 4.550 4.356 4.170 4.518 . 0 0 "[ . 1 . 2]" 1
673 1 28 VAL MG2 1 62 MET HG3 . . 3.640 2.914 2.674 3.101 . 0 0 "[ . 1 . 2]" 1
674 1 28 VAL MG2 1 78 PHE QE . . 4.140 3.573 3.265 3.833 . 0 0 "[ . 1 . 2]" 1
675 1 28 VAL MG2 1 78 PHE HZ . . 4.280 3.043 2.667 3.557 . 0 0 "[ . 1 . 2]" 1
676 1 29 ARG H 1 29 ARG HB2 . . 3.580 3.078 2.703 3.374 . 0 0 "[ . 1 . 2]" 1
677 1 29 ARG H 1 29 ARG HB3 . . 3.580 2.681 2.419 2.966 . 0 0 "[ . 1 . 2]" 1
678 1 29 ARG H 1 29 ARG QG . . 4.660 4.054 3.826 4.272 . 0 0 "[ . 1 . 2]" 1
679 1 29 ARG H 1 30 MET H . . 4.690 4.233 4.101 4.408 . 0 0 "[ . 1 . 2]" 1
680 1 29 ARG H 1 61 GLN H . . 3.720 2.678 2.449 2.899 . 0 0 "[ . 1 . 2]" 1
681 1 29 ARG H 1 61 GLN HB2 . . 4.770 4.623 4.309 4.764 . 0 0 "[ . 1 . 2]" 1
682 1 29 ARG H 1 61 GLN HB3 . . 3.840 3.524 3.198 3.747 . 0 0 "[ . 1 . 2]" 1
683 1 29 ARG H 1 62 MET HA . . 4.050 3.979 3.806 4.053 0.003 8 0 "[ . 1 . 2]" 1
684 1 29 ARG HA 1 29 ARG QD . . 3.050 2.350 2.017 2.806 . 0 0 "[ . 1 . 2]" 1
685 1 29 ARG HA 1 29 ARG QG . . 3.800 2.814 2.262 3.209 . 0 0 "[ . 1 . 2]" 1
686 1 29 ARG HA 1 30 MET H . . 2.900 2.146 2.141 2.170 . 0 0 "[ . 1 . 2]" 1
687 1 29 ARG HA 1 30 MET HA . . 4.560 4.394 4.382 4.411 . 0 0 "[ . 1 . 2]" 1
688 1 29 ARG HA 1 35 THR HA . . 3.550 2.485 2.317 2.604 . 0 0 "[ . 1 . 2]" 1
689 1 29 ARG HA 1 35 THR HB . . 3.810 3.670 3.426 3.799 . 0 0 "[ . 1 . 2]" 1
690 1 29 ARG HA 1 35 THR MG . . 2.880 2.616 2.348 2.830 . 0 0 "[ . 1 . 2]" 1
691 1 29 ARG HA 1 36 ALA H . . 3.710 3.602 3.468 3.688 . 0 0 "[ . 1 . 2]" 1
692 1 29 ARG QB 1 29 ARG QD . . 2.970 2.433 2.195 2.773 . 0 0 "[ . 1 . 2]" 1
693 1 29 ARG QB 1 30 MET H . . 4.140 3.810 3.650 3.894 . 0 0 "[ . 1 . 2]" 1
694 1 29 ARG QB 1 35 THR MG . . 3.930 2.940 2.322 3.513 . 0 0 "[ . 1 . 2]" 1
695 1 29 ARG QB 1 61 GLN H . . 3.790 2.788 2.454 3.200 . 0 0 "[ . 1 . 2]" 1
696 1 29 ARG QB 1 61 GLN HB2 . . 3.950 3.233 2.979 3.559 . 0 0 "[ . 1 . 2]" 1
697 1 29 ARG QB 1 61 GLN HB3 . . 3.430 2.301 2.042 2.939 . 0 0 "[ . 1 . 2]" 1
698 1 29 ARG HB2 1 29 ARG QD . . 3.790 2.829 2.229 3.479 . 0 0 "[ . 1 . 2]" 1
699 1 29 ARG HB2 1 35 THR MG . . 4.550 3.010 2.340 3.686 . 0 0 "[ . 1 . 2]" 1
700 1 29 ARG HB2 1 61 GLN H . . 4.420 4.270 3.624 4.417 . 0 0 "[ . 1 . 2]" 1
701 1 29 ARG HB2 1 61 GLN HB3 . . 3.950 3.328 2.623 3.647 . 0 0 "[ . 1 . 2]" 1
702 1 29 ARG HB3 1 29 ARG QD . . 3.790 3.031 2.341 3.486 . 0 0 "[ . 1 . 2]" 1
703 1 29 ARG HB3 1 35 THR MG . . 4.550 4.228 3.883 4.443 . 0 0 "[ . 1 . 2]" 1
704 1 29 ARG HB3 1 61 GLN H . . 4.420 2.832 2.496 3.311 . 0 0 "[ . 1 . 2]" 1
705 1 29 ARG HB3 1 61 GLN HB3 . . 3.950 2.381 2.055 3.203 . 0 0 "[ . 1 . 2]" 1
706 1 29 ARG QD 1 30 MET H . . 4.530 2.393 1.887 2.935 . 0 0 "[ . 1 . 2]" 1
707 1 29 ARG QD 1 30 MET ME . . 4.670 4.502 3.962 4.662 . 0 0 "[ . 1 . 2]" 1
708 1 29 ARG QD 1 30 MET QG . . 4.080 3.326 3.008 3.661 . 0 0 "[ . 1 . 2]" 1
709 1 29 ARG QD 1 35 THR MG . . 3.850 2.346 1.798 3.169 . 0 0 "[ . 1 . 2]" 1
710 1 29 ARG QG 1 30 MET H . . 3.790 3.473 2.899 3.757 . 0 0 "[ . 1 . 2]" 1
711 1 29 ARG QG 1 35 THR HA . . 5.500 4.469 3.261 5.150 . 0 0 "[ . 1 . 2]" 1
712 1 29 ARG QG 1 35 THR MG . . 3.720 2.957 1.838 3.710 . 0 0 "[ . 1 . 2]" 1
713 1 29 ARG QG 1 61 GLN H . . 5.500 4.174 3.292 5.253 . 0 0 "[ . 1 . 2]" 1
714 1 30 MET H 1 30 MET HB2 . . 3.750 3.655 3.626 3.720 . 0 0 "[ . 1 . 2]" 1
715 1 30 MET H 1 30 MET HB3 . . 3.570 2.691 2.550 2.883 . 0 0 "[ . 1 . 2]" 1
716 1 30 MET H 1 30 MET ME . . 3.790 2.995 2.737 3.246 . 0 0 "[ . 1 . 2]" 1
717 1 30 MET H 1 30 MET QG . . 3.240 2.067 1.890 2.217 . 0 0 "[ . 1 . 2]" 1
718 1 30 MET H 1 31 PRO HD2 . . 4.990 4.809 4.798 4.820 . 0 0 "[ . 1 . 2]" 1
719 1 30 MET H 1 34 LYS H . . 3.780 3.760 3.679 3.791 0.011 6 0 "[ . 1 . 2]" 1
720 1 30 MET H 1 35 THR HA . . 3.970 2.929 2.816 3.122 . 0 0 "[ . 1 . 2]" 1
721 1 30 MET H 1 35 THR HB . . 5.210 5.076 4.858 5.193 . 0 0 "[ . 1 . 2]" 1
722 1 30 MET H 1 35 THR MG . . 4.160 3.551 3.346 3.760 . 0 0 "[ . 1 . 2]" 1
723 1 30 MET H 1 36 ALA H . . 4.970 4.303 4.076 4.712 . 0 0 "[ . 1 . 2]" 1
724 1 30 MET HA 1 30 MET ME . . 4.460 4.366 4.173 4.450 . 0 0 "[ . 1 . 2]" 1
725 1 30 MET HA 1 30 MET QG . . 3.590 3.334 3.323 3.338 . 0 0 "[ . 1 . 2]" 1
726 1 30 MET HA 1 31 PRO HD2 . . 3.710 2.361 2.335 2.388 . 0 0 "[ . 1 . 2]" 1
727 1 30 MET HA 1 31 PRO HD3 . . 3.330 2.286 2.278 2.295 . 0 0 "[ . 1 . 2]" 1
728 1 30 MET HA 1 31 PRO HG2 . . 4.540 4.481 4.460 4.502 . 0 0 "[ . 1 . 2]" 1
729 1 30 MET HA 1 31 PRO HG3 . . 4.590 4.449 4.435 4.465 . 0 0 "[ . 1 . 2]" 1
730 1 30 MET HA 1 60 HIS HA . . 4.430 3.571 3.372 3.751 . 0 0 "[ . 1 . 2]" 1
731 1 30 MET HA 1 60 HIS HD2 . . 4.250 2.238 2.012 2.595 . 0 0 "[ . 1 . 2]" 1
732 1 30 MET HA 1 61 GLN H . . 4.690 4.535 4.330 4.691 0.001 19 0 "[ . 1 . 2]" 1
733 1 30 MET HB2 1 30 MET ME . . 3.700 3.478 3.270 3.656 . 0 0 "[ . 1 . 2]" 1
734 1 30 MET HB2 1 31 PRO HD3 . . 5.500 3.479 3.427 3.544 . 0 0 "[ . 1 . 2]" 1
735 1 30 MET HB2 1 31 PRO HG2 . . 5.450 3.906 3.839 3.971 . 0 0 "[ . 1 . 2]" 1
736 1 30 MET HB2 1 32 SER H . . 4.810 2.692 2.567 2.808 . 0 0 "[ . 1 . 2]" 1
737 1 30 MET HB2 1 34 LYS H . . 4.950 4.649 4.570 4.777 . 0 0 "[ . 1 . 2]" 1
738 1 30 MET HB2 1 60 HIS HD2 . . 4.500 3.546 3.117 3.877 . 0 0 "[ . 1 . 2]" 1
739 1 30 MET HB3 1 30 MET ME . . 3.470 2.376 2.203 2.532 . 0 0 "[ . 1 . 2]" 1
740 1 30 MET HB3 1 32 SER H . . 4.270 4.161 4.099 4.241 . 0 0 "[ . 1 . 2]" 1
741 1 30 MET HB3 1 33 GLY H . . 5.310 5.030 4.936 5.115 . 0 0 "[ . 1 . 2]" 1
742 1 30 MET HB3 1 34 LYS H . . 4.850 4.722 4.591 4.849 . 0 0 "[ . 1 . 2]" 1
743 1 30 MET HB3 1 35 THR HA . . 4.910 4.663 4.449 4.833 . 0 0 "[ . 1 . 2]" 1
744 1 30 MET HB3 1 60 HIS HD2 . . 4.840 2.842 2.585 3.141 . 0 0 "[ . 1 . 2]" 1
745 1 30 MET ME 1 30 MET QG . . 3.400 2.214 2.137 2.309 . 0 0 "[ . 1 . 2]" 1
746 1 30 MET ME 1 33 GLY H . . 4.950 4.783 4.582 4.930 . 0 0 "[ . 1 . 2]" 1
747 1 30 MET ME 1 34 LYS H . . 4.290 3.775 3.546 4.017 . 0 0 "[ . 1 . 2]" 1
748 1 30 MET ME 1 34 LYS HB2 . . 3.600 2.299 2.004 2.566 . 0 0 "[ . 1 . 2]" 1
749 1 30 MET ME 1 35 THR H . . 4.410 3.344 2.910 3.599 . 0 0 "[ . 1 . 2]" 1
750 1 30 MET ME 1 35 THR HA . . 3.860 2.914 2.217 3.097 . 0 0 "[ . 1 . 2]" 1
751 1 30 MET ME 1 36 ALA H . . 3.670 3.455 3.099 3.616 . 0 0 "[ . 1 . 2]" 1
752 1 30 MET ME 1 36 ALA MB . . 2.810 2.498 2.206 2.730 . 0 0 "[ . 1 . 2]" 1
753 1 30 MET ME 1 52 TYR QE . . 4.460 4.292 4.011 4.448 . 0 0 "[ . 1 . 2]" 1
754 1 30 MET ME 1 55 THR H . . 4.940 4.279 3.847 4.839 . 0 0 "[ . 1 . 2]" 1
755 1 30 MET QG 1 31 PRO HA . . 4.700 4.511 4.381 4.667 . 0 0 "[ . 1 . 2]" 1
756 1 30 MET QG 1 31 PRO HD2 . . 3.880 3.622 3.498 3.768 . 0 0 "[ . 1 . 2]" 1
757 1 30 MET QG 1 31 PRO HD3 . . 4.770 4.607 4.513 4.704 . 0 0 "[ . 1 . 2]" 1
758 1 30 MET QG 1 32 SER H . . 3.580 2.125 1.926 2.357 . 0 0 "[ . 1 . 2]" 1
759 1 30 MET QG 1 32 SER HA . . 4.620 4.130 3.962 4.281 . 0 0 "[ . 1 . 2]" 1
760 1 30 MET QG 1 32 SER QB . . 4.100 2.080 1.974 2.680 . 0 0 "[ . 1 . 2]" 1
761 1 30 MET QG 1 33 GLY H . . 3.880 2.162 2.086 2.309 . 0 0 "[ . 1 . 2]" 1
762 1 30 MET QG 1 34 LYS H . . 3.180 2.078 2.006 2.163 . 0 0 "[ . 1 . 2]" 1
763 1 30 MET QG 1 34 LYS HA . . 4.170 4.087 4.005 4.159 . 0 0 "[ . 1 . 2]" 1
764 1 30 MET QG 1 35 THR MG . . 5.110 4.126 3.995 4.333 . 0 0 "[ . 1 . 2]" 1
765 1 31 PRO HA 1 33 GLY H . . 4.370 4.129 4.017 4.260 . 0 0 "[ . 1 . 2]" 1
766 1 31 PRO QB 1 32 SER H . . 3.800 3.548 3.451 3.631 . 0 0 "[ . 1 . 2]" 1
767 1 31 PRO HB2 1 32 SER H . . 4.670 3.750 3.630 3.853 . 0 0 "[ . 1 . 2]" 1
768 1 31 PRO HB2 1 58 GLY HA3 . . 5.020 4.434 4.177 4.615 . 0 0 "[ . 1 . 2]" 1
769 1 31 PRO HB3 1 32 SER H . . 4.670 4.382 4.313 4.441 . 0 0 "[ . 1 . 2]" 1
770 1 31 PRO HB3 1 58 GLY HA3 . . 5.020 4.088 3.825 4.405 . 0 0 "[ . 1 . 2]" 1
771 1 31 PRO HD2 1 32 SER H . . 4.170 2.806 2.723 2.894 . 0 0 "[ . 1 . 2]" 1
772 1 31 PRO HD2 1 56 GLU HB2 . . 4.720 3.939 3.352 4.713 . 0 0 "[ . 1 . 2]" 1
773 1 31 PRO HD2 1 56 GLU QB . . 3.990 3.395 3.028 3.756 . 0 0 "[ . 1 . 2]" 1
774 1 31 PRO HD2 1 56 GLU HB3 . . 4.720 3.943 3.078 4.494 . 0 0 "[ . 1 . 2]" 1
775 1 31 PRO HD2 1 60 HIS HE1 . . 4.980 3.526 3.184 3.808 . 0 0 "[ . 1 . 2]" 1
776 1 31 PRO HD3 1 58 GLY HA3 . . 4.440 4.194 3.899 4.442 0.002 17 0 "[ . 1 . 2]" 1
777 1 31 PRO HD3 1 60 HIS HA . . 4.610 3.325 3.055 3.627 . 0 0 "[ . 1 . 2]" 1
778 1 31 PRO HD3 1 60 HIS HE1 . . 4.570 3.671 3.297 4.004 . 0 0 "[ . 1 . 2]" 1
779 1 31 PRO HG2 1 32 SER H . . 4.130 2.968 2.777 3.141 . 0 0 "[ . 1 . 2]" 1
780 1 31 PRO HG2 1 32 SER HA . . 4.390 4.231 4.156 4.307 . 0 0 "[ . 1 . 2]" 1
781 1 31 PRO HG2 1 56 GLU QB . . 3.590 3.332 3.039 3.592 0.002 11 0 "[ . 1 . 2]" 1
782 1 31 PRO HG2 1 58 GLY HA2 . . 5.500 5.474 5.355 5.502 0.002 4 0 "[ . 1 . 2]" 1
783 1 31 PRO HG2 1 58 GLY HA3 . . 4.180 3.735 3.621 3.766 . 0 0 "[ . 1 . 2]" 1
784 1 31 PRO HG3 1 32 SER H . . 4.470 4.329 4.185 4.461 . 0 0 "[ . 1 . 2]" 1
785 1 31 PRO HG3 1 56 GLU QB . . 4.620 4.316 4.027 4.529 . 0 0 "[ . 1 . 2]" 1
786 1 31 PRO HG3 1 58 GLY HA2 . . 4.340 4.097 3.910 4.194 . 0 0 "[ . 1 . 2]" 1
787 1 31 PRO HG3 1 58 GLY HA3 . . 3.850 2.375 2.183 2.495 . 0 0 "[ . 1 . 2]" 1
788 1 31 PRO HG3 1 59 LEU H . . 4.230 3.688 3.460 4.009 . 0 0 "[ . 1 . 2]" 1
789 1 32 SER H 1 32 SER HB2 . . 3.580 2.553 2.186 3.556 . 0 0 "[ . 1 . 2]" 1
790 1 32 SER H 1 32 SER QB . . 2.960 2.234 2.165 2.320 . 0 0 "[ . 1 . 2]" 1
791 1 32 SER H 1 32 SER HB3 . . 3.580 2.859 2.271 3.571 . 0 0 "[ . 1 . 2]" 1
792 1 32 SER H 1 33 GLY H . . 3.380 2.611 2.497 2.718 . 0 0 "[ . 1 . 2]" 1
793 1 32 SER H 1 34 LYS H . . 4.250 3.934 3.773 4.060 . 0 0 "[ . 1 . 2]" 1
794 1 32 SER H 1 56 GLU QB . . 4.810 4.091 3.711 4.479 . 0 0 "[ . 1 . 2]" 1
795 1 32 SER QB 1 33 GLY H . . 3.630 2.738 2.523 3.402 . 0 0 "[ . 1 . 2]" 1
796 1 32 SER QB 1 34 LYS H . . 4.000 3.421 3.172 4.014 0.014 2 0 "[ . 1 . 2]" 1
797 1 32 SER HB2 1 33 GLY H . . 4.440 3.536 2.704 4.070 . 0 0 "[ . 1 . 2]" 1
798 1 32 SER HB3 1 33 GLY H . . 4.440 3.053 2.566 3.654 . 0 0 "[ . 1 . 2]" 1
799 1 33 GLY H 1 34 LYS H . . 3.150 1.818 1.798 1.845 . 0 0 "[ . 1 . 2]" 1
800 1 33 GLY H 1 34 LYS HA . . 4.610 4.589 4.567 4.611 0.001 17 0 "[ . 1 . 2]" 1
801 1 33 GLY H 1 34 LYS HG3 . . 4.190 3.919 3.527 4.191 0.001 6 0 "[ . 1 . 2]" 1
802 1 33 GLY QA 1 34 LYS HG3 . . 4.250 3.929 3.701 4.112 . 0 0 "[ . 1 . 2]" 1
803 1 33 GLY HA2 1 34 LYS HG2 . . 4.990 4.783 4.680 4.970 . 0 0 "[ . 1 . 2]" 1
804 1 33 GLY HA3 1 34 LYS HG2 . . 4.990 3.985 3.878 4.113 . 0 0 "[ . 1 . 2]" 1
805 1 34 LYS H 1 34 LYS HB2 . . 3.050 2.885 2.749 3.022 . 0 0 "[ . 1 . 2]" 1
806 1 34 LYS H 1 34 LYS HB3 . . 4.200 3.890 3.818 3.943 . 0 0 "[ . 1 . 2]" 1
807 1 34 LYS H 1 34 LYS HD2 . . 5.500 5.339 5.029 5.465 . 0 0 "[ . 1 . 2]" 1
808 1 34 LYS H 1 34 LYS HD3 . . 5.500 5.238 5.059 5.394 . 0 0 "[ . 1 . 2]" 1
809 1 34 LYS H 1 34 LYS QE . . 5.100 4.907 4.301 5.116 0.016 10 0 "[ . 1 . 2]" 1
810 1 34 LYS H 1 34 LYS HG2 . . 3.620 3.525 3.288 3.604 . 0 0 "[ . 1 . 2]" 1
811 1 34 LYS H 1 34 LYS HG3 . . 3.260 3.090 2.833 3.243 . 0 0 "[ . 1 . 2]" 1
812 1 34 LYS H 1 35 THR H . . 4.510 4.388 4.370 4.410 . 0 0 "[ . 1 . 2]" 1
813 1 34 LYS HA 1 34 LYS QD . . 4.040 3.963 3.695 4.074 0.034 15 0 "[ . 1 . 2]" 1
814 1 34 LYS HA 1 34 LYS HG2 . . 3.470 2.567 2.467 2.706 . 0 0 "[ . 1 . 2]" 1
815 1 34 LYS HA 1 34 LYS HG3 . . 3.810 3.531 3.449 3.607 . 0 0 "[ . 1 . 2]" 1
816 1 34 LYS HA 1 35 THR H . . 2.740 2.612 2.547 2.642 . 0 0 "[ . 1 . 2]" 1
817 1 34 LYS HA 1 35 THR HA . . 4.870 4.516 4.493 4.534 . 0 0 "[ . 1 . 2]" 1
818 1 34 LYS HA 1 35 THR MG . . 4.100 3.417 3.217 3.639 . 0 0 "[ . 1 . 2]" 1
819 1 34 LYS HB2 1 34 LYS QE . . 4.420 3.316 2.142 4.272 . 0 0 "[ . 1 . 2]" 1
820 1 34 LYS HB2 1 35 THR H . . 3.610 3.018 2.846 3.184 . 0 0 "[ . 1 . 2]" 1
821 1 34 LYS HB3 1 34 LYS HD2 . . 3.970 3.102 2.191 3.570 . 0 0 "[ . 1 . 2]" 1
822 1 34 LYS HB3 1 34 LYS QD . . 3.490 2.266 2.057 2.428 . 0 0 "[ . 1 . 2]" 1
823 1 34 LYS HB3 1 34 LYS HD3 . . 3.970 2.682 2.088 3.569 . 0 0 "[ . 1 . 2]" 1
824 1 34 LYS HB3 1 34 LYS QE . . 3.990 2.692 2.104 3.640 . 0 0 "[ . 1 . 2]" 1
825 1 34 LYS HB3 1 35 THR H . . 3.140 2.135 2.054 2.225 . 0 0 "[ . 1 . 2]" 1
826 1 34 LYS QE 1 34 LYS HG2 . . 3.740 2.591 2.065 3.485 . 0 0 "[ . 1 . 2]" 1
827 1 34 LYS QE 1 34 LYS HG3 . . 3.400 2.953 2.209 3.407 0.007 10 0 "[ . 1 . 2]" 1
828 1 34 LYS QE 1 35 THR H . . 5.500 4.187 3.351 5.444 . 0 0 "[ . 1 . 2]" 1
829 1 34 LYS HG2 1 35 THR H . . 4.410 4.338 4.244 4.419 0.009 16 0 "[ . 1 . 2]" 1
830 1 34 LYS HG3 1 35 THR H . . 4.960 4.800 4.757 4.885 . 0 0 "[ . 1 . 2]" 1
831 1 35 THR H 1 35 THR HB . . 4.060 3.883 3.848 3.922 . 0 0 "[ . 1 . 2]" 1
832 1 35 THR H 1 35 THR MG . . 3.520 3.064 2.935 3.227 . 0 0 "[ . 1 . 2]" 1
833 1 35 THR H 1 36 ALA H . . 4.470 4.367 4.308 4.428 . 0 0 "[ . 1 . 2]" 1
834 1 35 THR H 1 36 ALA HA . . 5.110 4.818 4.757 4.890 . 0 0 "[ . 1 . 2]" 1
835 1 35 THR HA 1 35 THR MG . . 3.210 2.321 2.200 2.447 . 0 0 "[ . 1 . 2]" 1
836 1 35 THR HA 1 36 ALA H . . 2.870 2.234 2.187 2.316 . 0 0 "[ . 1 . 2]" 1
837 1 35 THR HA 1 36 ALA MB . . 4.420 3.848 3.781 3.897 . 0 0 "[ . 1 . 2]" 1
838 1 35 THR HB 1 36 ALA H . . 3.130 2.868 2.614 3.051 . 0 0 "[ . 1 . 2]" 1
839 1 35 THR MG 1 36 ALA H . . 4.060 3.866 3.781 3.966 . 0 0 "[ . 1 . 2]" 1
840 1 36 ALA H 1 36 ALA MB . . 3.210 2.580 2.516 2.690 . 0 0 "[ . 1 . 2]" 1
841 1 36 ALA HA 1 37 ARG H . . 3.070 2.260 2.160 2.445 . 0 0 "[ . 1 . 2]" 1
842 1 36 ALA HA 1 37 ARG HB2 . . 4.420 4.217 4.158 4.265 . 0 0 "[ . 1 . 2]" 1
843 1 36 ALA HA 1 37 ARG HB3 . . 5.500 5.027 4.983 5.109 . 0 0 "[ . 1 . 2]" 1
844 1 36 ALA MB 1 37 ARG H . . 3.290 2.807 2.442 3.094 . 0 0 "[ . 1 . 2]" 1
845 1 36 ALA MB 1 52 TYR QE . . 3.270 2.364 2.036 2.762 . 0 0 "[ . 1 . 2]" 1
846 1 37 ARG H 1 37 ARG HB2 . . 3.280 2.404 2.283 2.612 . 0 0 "[ . 1 . 2]" 1
847 1 37 ARG H 1 37 ARG HB3 . . 3.770 2.815 2.779 2.844 . 0 0 "[ . 1 . 2]" 1
848 1 37 ARG H 1 37 ARG HG2 . . 4.790 4.525 4.485 4.589 . 0 0 "[ . 1 . 2]" 1
849 1 37 ARG H 1 37 ARG QG . . 4.100 3.951 3.885 4.046 . 0 0 "[ . 1 . 2]" 1
850 1 37 ARG H 1 37 ARG HG3 . . 4.790 4.359 4.239 4.539 . 0 0 "[ . 1 . 2]" 1
851 1 37 ARG HA 1 37 ARG HD2 . . 4.760 4.554 4.417 4.724 . 0 0 "[ . 1 . 2]" 1
852 1 37 ARG HA 1 37 ARG QD . . 4.160 4.058 3.965 4.105 . 0 0 "[ . 1 . 2]" 1
853 1 37 ARG HA 1 37 ARG HD3 . . 4.760 4.574 4.336 4.714 . 0 0 "[ . 1 . 2]" 1
854 1 37 ARG HA 1 37 ARG HG2 . . 3.870 2.600 2.510 2.799 . 0 0 "[ . 1 . 2]" 1
855 1 37 ARG HA 1 37 ARG HG3 . . 3.870 2.633 2.417 2.726 . 0 0 "[ . 1 . 2]" 1
856 1 37 ARG HA 1 38 PRO HD2 . . 3.410 1.988 1.975 2.010 . 0 0 "[ . 1 . 2]" 1
857 1 37 ARG HA 1 38 PRO HD3 . . 3.480 2.315 2.298 2.326 . 0 0 "[ . 1 . 2]" 1
858 1 37 ARG HA 1 38 PRO QG . . 4.340 3.783 3.779 3.791 . 0 0 "[ . 1 . 2]" 1
859 1 37 ARG HB2 1 37 ARG HD2 . . 3.980 3.326 2.624 3.786 . 0 0 "[ . 1 . 2]" 1
860 1 37 ARG HB2 1 37 ARG QD . . 3.340 2.771 2.298 3.161 . 0 0 "[ . 1 . 2]" 1
861 1 37 ARG HB2 1 37 ARG HD3 . . 3.980 3.269 2.330 3.884 . 0 0 "[ . 1 . 2]" 1
862 1 37 ARG HB2 1 38 PRO HD2 . . 4.590 4.208 4.157 4.253 . 0 0 "[ . 1 . 2]" 1
863 1 37 ARG HB3 1 37 ARG HD2 . . 3.750 2.888 2.189 3.755 0.005 7 0 "[ . 1 . 2]" 1
864 1 37 ARG HB3 1 37 ARG QD . . 3.260 2.394 2.161 2.866 . 0 0 "[ . 1 . 2]" 1
865 1 37 ARG HB3 1 37 ARG HD3 . . 3.750 3.084 2.199 3.615 . 0 0 "[ . 1 . 2]" 1
866 1 37 ARG HB3 1 38 PRO HD2 . . 4.540 4.105 4.061 4.159 . 0 0 "[ . 1 . 2]" 1
867 1 37 ARG QG 1 38 PRO HD2 . . 3.840 2.317 2.199 2.455 . 0 0 "[ . 1 . 2]" 1
868 1 37 ARG QG 1 38 PRO HD3 . . 4.240 3.701 3.622 3.780 . 0 0 "[ . 1 . 2]" 1
869 1 37 ARG HG2 1 38 PRO HD2 . . 4.580 2.398 2.248 2.614 . 0 0 "[ . 1 . 2]" 1
870 1 37 ARG HG2 1 38 PRO HD3 . . 5.020 3.953 3.822 4.166 . 0 0 "[ . 1 . 2]" 1
871 1 37 ARG HG3 1 38 PRO HD2 . . 4.580 3.111 2.823 3.256 . 0 0 "[ . 1 . 2]" 1
872 1 37 ARG HG3 1 38 PRO HD3 . . 5.020 4.479 4.189 4.617 . 0 0 "[ . 1 . 2]" 1
873 1 38 PRO HA 1 39 ASN H . . 3.080 2.722 2.698 2.728 . 0 0 "[ . 1 . 2]" 1
874 1 38 PRO HA 1 52 TYR HB2 . . 4.750 3.195 3.100 3.257 . 0 0 "[ . 1 . 2]" 1
875 1 38 PRO HA 1 52 TYR HB3 . . 4.940 4.889 4.799 4.942 0.002 3 0 "[ . 1 . 2]" 1
876 1 38 PRO HA 1 52 TYR QD . . 4.500 2.543 2.227 2.870 . 0 0 "[ . 1 . 2]" 1
877 1 38 PRO HA 1 53 ALA H . . 4.760 4.414 4.239 4.569 . 0 0 "[ . 1 . 2]" 1
878 1 38 PRO HB2 1 39 ASN H . . 3.470 1.905 1.896 1.953 . 0 0 "[ . 1 . 2]" 1
879 1 38 PRO HB2 1 39 ASN HA . . 4.380 4.115 4.099 4.139 . 0 0 "[ . 1 . 2]" 1
880 1 38 PRO HB2 1 40 ILE QG . . 4.750 3.719 3.649 3.762 . 0 0 "[ . 1 . 2]" 1
881 1 38 PRO HB2 1 50 VAL MG1 . . 3.410 3.157 2.958 3.282 . 0 0 "[ . 1 . 2]" 1
882 1 38 PRO HB2 1 52 TYR HB2 . . 4.670 3.315 3.151 3.377 . 0 0 "[ . 1 . 2]" 1
883 1 38 PRO HB2 1 52 TYR HB3 . . 4.930 4.901 4.758 4.936 0.006 10 0 "[ . 1 . 2]" 1
884 1 38 PRO HB2 1 62 MET ME . . 4.010 3.024 2.660 3.733 . 0 0 "[ . 1 . 2]" 1
885 1 38 PRO HB2 1 64 ILE MD . . 5.160 4.061 3.930 4.169 . 0 0 "[ . 1 . 2]" 1
886 1 38 PRO HB3 1 39 ASN H . . 3.430 3.147 3.144 3.164 . 0 0 "[ . 1 . 2]" 1
887 1 38 PRO HB3 1 39 ASN HA . . 5.500 5.539 5.533 5.550 0.050 14 0 "[ . 1 . 2]" 1
888 1 38 PRO HB3 1 50 VAL MG1 . . 4.260 3.876 3.698 4.023 . 0 0 "[ . 1 . 2]" 1
889 1 38 PRO HB3 1 52 TYR HB2 . . 4.350 2.522 2.443 2.586 . 0 0 "[ . 1 . 2]" 1
890 1 38 PRO HB3 1 52 TYR HB3 . . 4.500 4.148 4.073 4.213 . 0 0 "[ . 1 . 2]" 1
891 1 38 PRO HB3 1 62 MET ME . . 3.500 2.565 2.270 3.178 . 0 0 "[ . 1 . 2]" 1
892 1 38 PRO HB3 1 64 ILE MD . . 4.850 4.615 4.441 4.704 . 0 0 "[ . 1 . 2]" 1
893 1 38 PRO QG 1 39 ASN H . . 4.430 3.601 3.592 3.647 . 0 0 "[ . 1 . 2]" 1
894 1 38 PRO QG 1 40 ILE MD . . 4.050 3.457 3.259 3.601 . 0 0 "[ . 1 . 2]" 1
895 1 38 PRO QG 1 50 VAL MG1 . . 4.070 3.910 3.762 4.060 . 0 0 "[ . 1 . 2]" 1
896 1 38 PRO QG 1 62 MET ME . . 3.870 2.953 2.524 3.543 . 0 0 "[ . 1 . 2]" 1
897 1 38 PRO QG 1 62 MET HG2 . . 4.690 4.488 4.287 4.628 . 0 0 "[ . 1 . 2]" 1
898 1 38 PRO QG 1 62 MET HG3 . . 4.280 3.032 2.859 3.242 . 0 0 "[ . 1 . 2]" 1
899 1 38 PRO QG 1 63 GLY H . . 4.900 4.592 4.395 4.771 . 0 0 "[ . 1 . 2]" 1
900 1 38 PRO QG 1 64 ILE MD . . 3.770 2.962 2.804 3.050 . 0 0 "[ . 1 . 2]" 1
901 1 39 ASN H 1 39 ASN HB2 . . 3.190 2.631 2.588 2.660 . 0 0 "[ . 1 . 2]" 1
902 1 39 ASN H 1 39 ASN HB3 . . 3.830 3.680 3.658 3.705 . 0 0 "[ . 1 . 2]" 1
903 1 39 ASN H 1 40 ILE HA . . 5.240 4.822 4.761 4.873 . 0 0 "[ . 1 . 2]" 1
904 1 39 ASN H 1 40 ILE QG . . 4.890 3.733 3.690 3.793 . 0 0 "[ . 1 . 2]" 1
905 1 39 ASN H 1 50 VAL HA . . 5.500 4.668 4.506 4.822 . 0 0 "[ . 1 . 2]" 1
906 1 39 ASN H 1 50 VAL MG1 . . 4.310 3.472 3.275 3.644 . 0 0 "[ . 1 . 2]" 1
907 1 39 ASN H 1 51 ARG HB2 . . 4.500 4.396 4.240 4.485 . 0 0 "[ . 1 . 2]" 1
908 1 39 ASN H 1 51 ARG HB3 . . 4.860 4.840 4.755 4.864 0.004 1 0 "[ . 1 . 2]" 1
909 1 39 ASN H 1 52 TYR HA . . 3.850 3.684 3.482 3.789 . 0 0 "[ . 1 . 2]" 1
910 1 39 ASN H 1 52 TYR HB2 . . 4.320 3.562 3.440 3.656 . 0 0 "[ . 1 . 2]" 1
911 1 39 ASN H 1 52 TYR QD . . 4.850 4.546 4.348 4.761 . 0 0 "[ . 1 . 2]" 1
912 1 39 ASN H 1 62 MET ME . . 5.350 4.184 3.874 4.875 . 0 0 "[ . 1 . 2]" 1
913 1 39 ASN HA 1 40 ILE H . . 2.880 2.224 2.165 2.253 . 0 0 "[ . 1 . 2]" 1
914 1 39 ASN HA 1 40 ILE HB . . 4.820 4.600 4.535 4.668 . 0 0 "[ . 1 . 2]" 1
915 1 39 ASN HA 1 40 ILE QG . . 4.580 3.437 3.265 3.559 . 0 0 "[ . 1 . 2]" 1
916 1 39 ASN HA 1 51 ARG H . . 4.960 4.729 4.634 4.827 . 0 0 "[ . 1 . 2]" 1
917 1 39 ASN HB2 1 40 ILE H . . 4.340 4.213 4.147 4.348 0.008 18 0 "[ . 1 . 2]" 1
918 1 39 ASN HB2 1 51 ARG H . . 4.070 3.607 3.466 3.779 . 0 0 "[ . 1 . 2]" 1
919 1 39 ASN HB2 1 51 ARG HB2 . . 4.080 3.006 2.768 3.142 . 0 0 "[ . 1 . 2]" 1
920 1 39 ASN HB2 1 51 ARG HB3 . . 3.770 3.254 3.136 3.354 . 0 0 "[ . 1 . 2]" 1
921 1 39 ASN HB3 1 40 ILE H . . 3.330 3.032 2.921 3.284 . 0 0 "[ . 1 . 2]" 1
922 1 39 ASN HB3 1 51 ARG H . . 4.270 3.929 3.822 4.171 . 0 0 "[ . 1 . 2]" 1
923 1 39 ASN HB3 1 51 ARG HB2 . . 4.040 3.035 2.872 3.136 . 0 0 "[ . 1 . 2]" 1
924 1 39 ASN HB3 1 51 ARG HB3 . . 4.010 3.952 3.899 4.004 . 0 0 "[ . 1 . 2]" 1
925 1 40 ILE H 1 40 ILE HB . . 3.340 2.802 2.705 2.896 . 0 0 "[ . 1 . 2]" 1
926 1 40 ILE H 1 40 ILE MD . . 4.350 3.808 3.569 3.942 . 0 0 "[ . 1 . 2]" 1
927 1 40 ILE H 1 40 ILE HG12 . . 4.710 4.246 4.164 4.345 . 0 0 "[ . 1 . 2]" 1
928 1 40 ILE H 1 40 ILE QG . . 3.960 2.860 2.734 2.984 . 0 0 "[ . 1 . 2]" 1
929 1 40 ILE H 1 40 ILE HG13 . . 4.710 2.907 2.773 3.039 . 0 0 "[ . 1 . 2]" 1
930 1 40 ILE H 1 40 ILE MG . . 4.140 3.914 3.878 3.956 . 0 0 "[ . 1 . 2]" 1
931 1 40 ILE H 1 41 THR H . . 4.340 4.249 4.131 4.296 . 0 0 "[ . 1 . 2]" 1
932 1 40 ILE HA 1 40 ILE MD . . 4.110 3.908 3.888 3.941 . 0 0 "[ . 1 . 2]" 1
933 1 40 ILE HA 1 40 ILE HG12 . . 4.060 2.816 2.730 2.872 . 0 0 "[ . 1 . 2]" 1
934 1 40 ILE HA 1 40 ILE QG . . 3.510 2.499 2.464 2.557 . 0 0 "[ . 1 . 2]" 1
935 1 40 ILE HA 1 40 ILE HG13 . . 4.060 2.796 2.724 2.880 . 0 0 "[ . 1 . 2]" 1
936 1 40 ILE HA 1 40 ILE MG . . 3.150 2.324 2.223 2.441 . 0 0 "[ . 1 . 2]" 1
937 1 40 ILE HB 1 40 ILE MD . . 2.980 2.175 2.101 2.318 . 0 0 "[ . 1 . 2]" 1
938 1 40 ILE HB 1 41 THR H . . 4.490 4.154 4.033 4.238 . 0 0 "[ . 1 . 2]" 1
939 1 40 ILE MD 1 65 LYS H . . 4.540 4.274 4.059 4.453 . 0 0 "[ . 1 . 2]" 1
940 1 40 ILE QG 1 41 THR H . . 4.750 4.207 4.146 4.260 . 0 0 "[ . 1 . 2]" 1
941 1 40 ILE QG 1 50 VAL HA . . 4.360 3.094 2.920 3.432 . 0 0 "[ . 1 . 2]" 1
942 1 40 ILE QG 1 50 VAL MG2 . . 3.440 2.830 2.641 2.978 . 0 0 "[ . 1 . 2]" 1
943 1 40 ILE QG 1 51 ARG H . . 4.210 3.867 3.694 4.122 . 0 0 "[ . 1 . 2]" 1
944 1 40 ILE HG12 1 50 VAL MG2 . . 4.210 2.884 2.684 3.050 . 0 0 "[ . 1 . 2]" 1
945 1 40 ILE HG13 1 50 VAL MG2 . . 4.210 4.118 3.916 4.211 0.001 20 0 "[ . 1 . 2]" 1
946 1 40 ILE MG 1 41 THR H . . 3.200 2.441 2.227 2.650 . 0 0 "[ . 1 . 2]" 1
947 1 40 ILE MG 1 41 THR HA . . 4.490 3.903 3.744 4.021 . 0 0 "[ . 1 . 2]" 1
948 1 40 ILE MG 1 48 ILE HA . . 4.630 3.953 3.856 4.158 . 0 0 "[ . 1 . 2]" 1
949 1 40 ILE MG 1 48 ILE HB . . 3.400 2.534 2.445 2.687 . 0 0 "[ . 1 . 2]" 1
950 1 40 ILE MG 1 48 ILE MD . . 2.850 2.708 2.542 2.838 . 0 0 "[ . 1 . 2]" 1
951 1 40 ILE MG 1 48 ILE HG13 . . 5.020 3.892 3.582 4.187 . 0 0 "[ . 1 . 2]" 1
952 1 40 ILE MG 1 49 THR H . . 4.040 3.201 3.003 3.545 . 0 0 "[ . 1 . 2]" 1
953 1 40 ILE MG 1 50 VAL MG2 . . 3.130 3.071 2.667 3.133 0.003 10 0 "[ . 1 . 2]" 1
954 1 40 ILE MG 1 51 ARG H . . 5.290 4.898 4.546 5.104 . 0 0 "[ . 1 . 2]" 1
955 1 41 THR H 1 41 THR HB . . 3.250 2.628 2.534 2.781 . 0 0 "[ . 1 . 2]" 1
956 1 41 THR H 1 41 THR MG . . 3.840 3.837 3.804 3.863 0.023 14 0 "[ . 1 . 2]" 1
957 1 41 THR H 1 42 ASP H . . 4.420 4.066 4.005 4.143 . 0 0 "[ . 1 . 2]" 1
958 1 41 THR H 1 49 THR HA . . 4.880 4.783 4.682 4.876 . 0 0 "[ . 1 . 2]" 1
959 1 41 THR H 1 49 THR HB . . 3.910 3.060 2.855 3.298 . 0 0 "[ . 1 . 2]" 1
960 1 41 THR H 1 49 THR MG . . 4.210 3.594 3.047 3.947 . 0 0 "[ . 1 . 2]" 1
961 1 41 THR H 1 50 VAL MG2 . . 4.730 4.712 4.516 4.733 0.003 17 0 "[ . 1 . 2]" 1
962 1 41 THR H 1 51 ARG H . . 5.030 4.665 4.484 4.865 . 0 0 "[ . 1 . 2]" 1
963 1 41 THR HA 1 41 THR MG . . 3.210 2.307 2.218 2.441 . 0 0 "[ . 1 . 2]" 1
964 1 41 THR HA 1 42 ASP H . . 2.820 2.222 2.207 2.235 . 0 0 "[ . 1 . 2]" 1
965 1 41 THR HA 1 42 ASP HA . . 4.480 4.487 4.476 4.495 0.015 14 0 "[ . 1 . 2]" 1
966 1 41 THR HA 1 42 ASP HB2 . . 4.970 4.459 4.407 4.631 . 0 0 "[ . 1 . 2]" 1
967 1 41 THR HA 1 42 ASP QB . . 4.270 4.130 4.115 4.156 . 0 0 "[ . 1 . 2]" 1
968 1 41 THR HA 1 42 ASP HB3 . . 4.970 4.887 4.700 4.958 . 0 0 "[ . 1 . 2]" 1
969 1 41 THR HB 1 42 ASP H . . 4.570 4.412 4.349 4.452 . 0 0 "[ . 1 . 2]" 1
970 1 41 THR HB 1 49 THR H . . 3.730 3.641 3.538 3.727 . 0 0 "[ . 1 . 2]" 1
971 1 41 THR HB 1 49 THR MG . . 3.430 3.203 2.847 3.398 . 0 0 "[ . 1 . 2]" 1
972 1 41 THR MG 1 42 ASP H . . 3.460 3.308 3.166 3.429 . 0 0 "[ . 1 . 2]" 1
973 1 41 THR MG 1 43 ASN HA . . 4.160 3.969 3.818 4.150 . 0 0 "[ . 1 . 2]" 1
974 1 42 ASP H 1 42 ASP HB2 . . 3.310 2.258 2.198 2.423 . 0 0 "[ . 1 . 2]" 1
975 1 42 ASP H 1 42 ASP QB . . 2.870 2.172 2.138 2.242 . 0 0 "[ . 1 . 2]" 1
976 1 42 ASP H 1 42 ASP HB3 . . 3.310 2.844 2.642 2.926 . 0 0 "[ . 1 . 2]" 1
977 1 42 ASP H 1 43 ASN H . . 4.710 4.474 4.451 4.513 . 0 0 "[ . 1 . 2]" 1
978 1 42 ASP HA 1 43 ASN H . . 2.880 2.140 2.139 2.142 . 0 0 "[ . 1 . 2]" 1
979 1 42 ASP HA 1 43 ASN HD21 . . 4.730 4.201 3.837 4.466 . 0 0 "[ . 1 . 2]" 1
980 1 42 ASP HA 1 43 ASN HD22 . . 4.800 4.630 4.380 4.774 . 0 0 "[ . 1 . 2]" 1
981 1 42 ASP HA 1 44 LYS H . . 3.730 3.556 3.479 3.647 . 0 0 "[ . 1 . 2]" 1
982 1 42 ASP HA 1 48 ILE HA . . 3.890 3.618 3.288 3.841 . 0 0 "[ . 1 . 2]" 1
983 1 42 ASP HA 1 48 ILE HB . . 4.370 4.129 3.811 4.362 . 0 0 "[ . 1 . 2]" 1
984 1 42 ASP HA 1 48 ILE MG . . 3.530 3.272 3.068 3.524 . 0 0 "[ . 1 . 2]" 1
985 1 42 ASP HA 1 49 THR H . . 4.290 4.127 3.898 4.288 . 0 0 "[ . 1 . 2]" 1
986 1 42 ASP QB 1 43 ASN H . . 4.150 3.799 3.735 3.840 . 0 0 "[ . 1 . 2]" 1
987 1 42 ASP QB 1 44 LYS H . . 4.440 4.103 3.824 4.297 . 0 0 "[ . 1 . 2]" 1
988 1 43 ASN H 1 43 ASN HB2 . . 3.430 2.619 2.580 2.660 . 0 0 "[ . 1 . 2]" 1
989 1 43 ASN H 1 43 ASN HB3 . . 3.700 3.661 3.647 3.685 . 0 0 "[ . 1 . 2]" 1
990 1 43 ASN H 1 43 ASN HD21 . . 4.080 2.627 2.342 2.902 . 0 0 "[ . 1 . 2]" 1
991 1 43 ASN H 1 43 ASN HD22 . . 4.200 3.539 3.377 3.703 . 0 0 "[ . 1 . 2]" 1
992 1 43 ASN H 1 44 LYS H . . 3.040 2.222 2.137 2.273 . 0 0 "[ . 1 . 2]" 1
993 1 43 ASN H 1 44 LYS HA . . 4.530 4.477 4.392 4.527 . 0 0 "[ . 1 . 2]" 1
994 1 43 ASN H 1 45 ASP H . . 4.170 4.049 3.947 4.140 . 0 0 "[ . 1 . 2]" 1
995 1 43 ASN H 1 46 GLY H . . 5.290 5.163 4.947 5.279 . 0 0 "[ . 1 . 2]" 1
996 1 43 ASN H 1 47 THR H . . 5.090 4.854 4.624 5.048 . 0 0 "[ . 1 . 2]" 1
997 1 43 ASN H 1 48 ILE HA . . 3.430 3.199 3.017 3.315 . 0 0 "[ . 1 . 2]" 1
998 1 43 ASN H 1 48 ILE HB . . 5.080 4.847 4.598 4.981 . 0 0 "[ . 1 . 2]" 1
999 1 43 ASN H 1 48 ILE MG . . 3.850 3.567 3.315 3.716 . 0 0 "[ . 1 . 2]" 1
1000 1 43 ASN H 1 49 THR H . . 4.440 4.227 4.110 4.332 . 0 0 "[ . 1 . 2]" 1
1001 1 43 ASN HA 1 45 ASP H . . 4.590 4.450 4.300 4.586 . 0 0 "[ . 1 . 2]" 1
1002 1 43 ASN HB2 1 43 ASN HD22 . . 3.740 3.447 3.436 3.467 . 0 0 "[ . 1 . 2]" 1
1003 1 43 ASN HB2 1 44 LYS H . . 4.020 3.021 2.861 3.157 . 0 0 "[ . 1 . 2]" 1
1004 1 43 ASN HB2 1 44 LYS HA . . 5.310 4.723 4.640 4.833 . 0 0 "[ . 1 . 2]" 1
1005 1 43 ASN HB2 1 45 ASP H . . 3.710 2.621 2.548 2.753 . 0 0 "[ . 1 . 2]" 1
1006 1 43 ASN HB2 1 46 GLY H . . 5.050 3.892 3.554 4.244 . 0 0 "[ . 1 . 2]" 1
1007 1 43 ASN HB2 1 47 THR H . . 4.410 3.296 3.123 3.444 . 0 0 "[ . 1 . 2]" 1
1008 1 43 ASN HB3 1 43 ASN HD22 . . 4.080 4.001 3.968 4.036 . 0 0 "[ . 1 . 2]" 1
1009 1 43 ASN HB3 1 44 LYS H . . 4.170 4.092 3.992 4.171 0.001 3 0 "[ . 1 . 2]" 1
1010 1 43 ASN HB3 1 45 ASP H . . 3.930 3.596 3.422 3.850 . 0 0 "[ . 1 . 2]" 1
1011 1 43 ASN HB3 1 47 THR H . . 5.000 4.746 4.547 4.948 . 0 0 "[ . 1 . 2]" 1
1012 1 43 ASN HD21 1 44 LYS H . . 5.000 4.102 3.915 4.318 . 0 0 "[ . 1 . 2]" 1
1013 1 43 ASN HD21 1 45 ASP H . . 4.430 4.362 4.282 4.431 0.001 9 0 "[ . 1 . 2]" 1
1014 1 43 ASN HD21 1 47 THR HB . . 4.500 4.172 3.906 4.460 . 0 0 "[ . 1 . 2]" 1
1015 1 43 ASN HD21 1 47 THR MG . . 4.860 4.734 4.545 4.857 . 0 0 "[ . 1 . 2]" 1
1016 1 43 ASN HD21 1 48 ILE HA . . 4.350 2.170 1.982 2.537 . 0 0 "[ . 1 . 2]" 1
1017 1 43 ASN HD21 1 48 ILE MG . . 4.800 3.678 3.437 4.024 . 0 0 "[ . 1 . 2]" 1
1018 1 43 ASN HD21 1 49 THR H . . 4.250 3.397 3.175 3.674 . 0 0 "[ . 1 . 2]" 1
1019 1 43 ASN HD21 1 49 THR HB . . 4.970 4.850 4.746 4.956 . 0 0 "[ . 1 . 2]" 1
1020 1 43 ASN HD21 1 49 THR HG1 . . 4.080 3.662 3.473 3.989 . 0 0 "[ . 1 . 2]" 1
1021 1 43 ASN HD22 1 47 THR HB . . 5.120 4.733 4.576 4.943 . 0 0 "[ . 1 . 2]" 1
1022 1 43 ASN HD22 1 48 ILE H . . 4.730 4.250 4.058 4.542 . 0 0 "[ . 1 . 2]" 1
1023 1 43 ASN HD22 1 48 ILE HA . . 4.260 2.537 2.333 2.877 . 0 0 "[ . 1 . 2]" 1
1024 1 43 ASN HD22 1 48 ILE MG . . 5.140 4.485 4.294 4.760 . 0 0 "[ . 1 . 2]" 1
1025 1 43 ASN HD22 1 49 THR H . . 4.060 2.419 2.148 2.789 . 0 0 "[ . 1 . 2]" 1
1026 1 43 ASN HD22 1 49 THR HB . . 4.320 3.231 3.101 3.349 . 0 0 "[ . 1 . 2]" 1
1027 1 43 ASN HD22 1 49 THR HG1 . . 3.810 2.024 1.900 2.279 . 0 0 "[ . 1 . 2]" 1
1028 1 43 ASN HD22 1 49 THR MG . . 5.440 4.386 4.286 4.551 . 0 0 "[ . 1 . 2]" 1
1029 1 44 LYS H 1 44 LYS HA . . 2.730 2.276 2.274 2.279 . 0 0 "[ . 1 . 2]" 1
1030 1 44 LYS H 1 44 LYS HB2 . . 4.050 3.569 3.405 3.648 . 0 0 "[ . 1 . 2]" 1
1031 1 44 LYS H 1 44 LYS HB3 . . 4.050 4.028 3.988 4.056 0.006 16 0 "[ . 1 . 2]" 1
1032 1 44 LYS H 1 44 LYS HD2 . . 4.740 3.758 2.548 4.686 . 0 0 "[ . 1 . 2]" 1
1033 1 44 LYS H 1 44 LYS QD . . 3.980 3.164 2.428 3.633 . 0 0 "[ . 1 . 2]" 1
1034 1 44 LYS H 1 44 LYS HD3 . . 4.740 3.685 2.468 4.374 . 0 0 "[ . 1 . 2]" 1
1035 1 44 LYS H 1 44 LYS QG . . 3.330 2.732 2.484 3.135 . 0 0 "[ . 1 . 2]" 1
1036 1 44 LYS H 1 45 ASP H . . 3.420 2.698 2.612 2.756 . 0 0 "[ . 1 . 2]" 1
1037 1 44 LYS H 1 46 GLY H . . 4.410 3.906 3.804 3.983 . 0 0 "[ . 1 . 2]" 1
1038 1 44 LYS H 1 47 THR H . . 4.690 4.508 4.277 4.685 . 0 0 "[ . 1 . 2]" 1
1039 1 44 LYS H 1 48 ILE HA . . 5.030 4.892 4.792 5.010 . 0 0 "[ . 1 . 2]" 1
1040 1 44 LYS H 1 48 ILE MG . . 4.520 4.245 4.051 4.443 . 0 0 "[ . 1 . 2]" 1
1041 1 44 LYS HA 1 44 LYS HD2 . . 4.440 3.081 2.294 4.206 . 0 0 "[ . 1 . 2]" 1
1042 1 44 LYS HA 1 44 LYS QD . . 3.750 2.748 2.273 3.444 . 0 0 "[ . 1 . 2]" 1
1043 1 44 LYS HA 1 44 LYS HD3 . . 4.440 3.528 2.544 4.202 . 0 0 "[ . 1 . 2]" 1
1044 1 44 LYS HA 1 44 LYS QE . . 4.810 4.270 3.700 4.754 . 0 0 "[ . 1 . 2]" 1
1045 1 44 LYS HA 1 44 LYS HG2 . . 4.020 3.125 2.834 3.626 . 0 0 "[ . 1 . 2]" 1
1046 1 44 LYS HA 1 44 LYS QG . . 3.300 2.645 2.273 2.857 . 0 0 "[ . 1 . 2]" 1
1047 1 44 LYS HA 1 44 LYS HG3 . . 4.020 3.331 2.302 3.879 . 0 0 "[ . 1 . 2]" 1
1048 1 44 LYS HA 1 45 ASP H . . 3.520 2.927 2.862 2.973 . 0 0 "[ . 1 . 2]" 1
1049 1 44 LYS HA 1 45 ASP HA . . 5.100 4.466 4.436 4.485 . 0 0 "[ . 1 . 2]" 1
1050 1 44 LYS HA 1 46 GLY H . . 4.150 3.587 3.432 3.872 . 0 0 "[ . 1 . 2]" 1
1051 1 44 LYS QB 1 44 LYS QD . . 3.120 2.264 2.047 2.443 . 0 0 "[ . 1 . 2]" 1
1052 1 44 LYS QB 1 45 ASP H . . 4.210 3.782 3.739 3.828 . 0 0 "[ . 1 . 2]" 1
1053 1 44 LYS HB2 1 45 ASP H . . 4.830 4.083 4.043 4.166 . 0 0 "[ . 1 . 2]" 1
1054 1 44 LYS HB3 1 45 ASP H . . 4.830 4.469 4.392 4.512 . 0 0 "[ . 1 . 2]" 1
1055 1 44 LYS QE 1 44 LYS HG2 . . 3.820 2.862 2.196 3.496 . 0 0 "[ . 1 . 2]" 1
1056 1 44 LYS QE 1 44 LYS QG . . 3.320 2.238 2.071 2.592 . 0 0 "[ . 1 . 2]" 1
1057 1 44 LYS QE 1 44 LYS HG3 . . 3.820 2.553 2.096 3.272 . 0 0 "[ . 1 . 2]" 1
1058 1 44 LYS QG 1 45 ASP H . . 4.760 4.571 4.433 4.747 . 0 0 "[ . 1 . 2]" 1
1059 1 45 ASP H 1 45 ASP HB2 . . 4.010 3.005 2.431 3.779 . 0 0 "[ . 1 . 2]" 1
1060 1 45 ASP H 1 45 ASP QB . . 3.440 2.537 2.396 3.010 . 0 0 "[ . 1 . 2]" 1
1061 1 45 ASP H 1 45 ASP HB3 . . 4.010 2.978 2.453 3.765 . 0 0 "[ . 1 . 2]" 1
1062 1 45 ASP H 1 46 GLY H . . 2.990 1.951 1.814 2.073 . 0 0 "[ . 1 . 2]" 1
1063 1 45 ASP H 1 46 GLY HA2 . . 4.840 4.432 4.313 4.524 . 0 0 "[ . 1 . 2]" 1
1064 1 45 ASP H 1 46 GLY QA . . 4.180 4.035 3.951 4.101 . 0 0 "[ . 1 . 2]" 1
1065 1 45 ASP H 1 46 GLY HA3 . . 4.840 4.644 4.586 4.694 . 0 0 "[ . 1 . 2]" 1
1066 1 45 ASP H 1 47 THR H . . 3.260 2.910 2.749 3.115 . 0 0 "[ . 1 . 2]" 1
1067 1 45 ASP H 1 47 THR MG . . 5.370 5.100 4.877 5.225 . 0 0 "[ . 1 . 2]" 1
1068 1 45 ASP QB 1 46 GLY H . . 4.430 3.372 3.023 3.829 . 0 0 "[ . 1 . 2]" 1
1069 1 45 ASP QB 1 47 THR H . . 4.680 3.491 3.198 4.298 . 0 0 "[ . 1 . 2]" 1
1070 1 45 ASP HB2 1 46 GLY H . . 5.260 4.072 3.143 4.473 . 0 0 "[ . 1 . 2]" 1
1071 1 45 ASP HB3 1 46 GLY H . . 5.260 3.726 3.113 4.430 . 0 0 "[ . 1 . 2]" 1
1072 1 46 GLY H 1 47 THR H . . 3.050 2.047 1.880 2.226 . 0 0 "[ . 1 . 2]" 1
1073 1 46 GLY QA 1 47 THR MG . . 4.080 3.169 3.045 3.274 . 0 0 "[ . 1 . 2]" 1
1074 1 46 GLY HA2 1 47 THR MG . . 4.720 4.200 4.046 4.307 . 0 0 "[ . 1 . 2]" 1
1075 1 46 GLY HA3 1 47 THR MG . . 4.720 3.279 3.149 3.393 . 0 0 "[ . 1 . 2]" 1
1076 1 47 THR H 1 47 THR MG . . 3.430 2.814 2.581 2.985 . 0 0 "[ . 1 . 2]" 1
1077 1 47 THR H 1 48 ILE H . . 4.540 4.433 4.412 4.466 . 0 0 "[ . 1 . 2]" 1
1078 1 47 THR HA 1 47 THR MG . . 3.290 2.433 2.347 2.520 . 0 0 "[ . 1 . 2]" 1
1079 1 47 THR HA 1 48 ILE H . . 2.960 2.469 2.400 2.541 . 0 0 "[ . 1 . 2]" 1
1080 1 47 THR HA 1 48 ILE MG . . 3.490 3.256 3.162 3.443 . 0 0 "[ . 1 . 2]" 1
1081 1 47 THR HB 1 48 ILE H . . 3.120 2.295 2.164 2.419 . 0 0 "[ . 1 . 2]" 1
1082 1 47 THR MG 1 48 ILE H . . 3.850 3.741 3.659 3.836 . 0 0 "[ . 1 . 2]" 1
1083 1 48 ILE H 1 48 ILE MD . . 4.160 4.027 3.961 4.102 . 0 0 "[ . 1 . 2]" 1
1084 1 48 ILE H 1 48 ILE HG12 . . 3.420 2.453 2.350 2.646 . 0 0 "[ . 1 . 2]" 1
1085 1 48 ILE H 1 48 ILE HG13 . . 3.680 3.064 2.822 3.219 . 0 0 "[ . 1 . 2]" 1
1086 1 48 ILE H 1 48 ILE MG . . 3.690 2.883 2.749 3.035 . 0 0 "[ . 1 . 2]" 1
1087 1 48 ILE H 1 49 THR H . . 4.650 4.360 4.303 4.402 . 0 0 "[ . 1 . 2]" 1
1088 1 48 ILE HA 1 48 ILE MD . . 4.220 4.166 4.141 4.176 . 0 0 "[ . 1 . 2]" 1
1089 1 48 ILE HA 1 48 ILE MG . . 3.210 2.408 2.282 2.462 . 0 0 "[ . 1 . 2]" 1
1090 1 48 ILE HA 1 49 THR H . . 2.870 2.208 2.176 2.254 . 0 0 "[ . 1 . 2]" 1
1091 1 48 ILE HA 1 49 THR HB . . 4.640 4.522 4.407 4.603 . 0 0 "[ . 1 . 2]" 1
1092 1 48 ILE HB 1 48 ILE MD . . 3.310 2.347 2.279 2.412 . 0 0 "[ . 1 . 2]" 1
1093 1 48 ILE HB 1 49 THR H . . 3.250 2.949 2.778 3.086 . 0 0 "[ . 1 . 2]" 1
1094 1 48 ILE HB 1 50 VAL MG2 . . 4.190 3.980 3.823 4.148 . 0 0 "[ . 1 . 2]" 1
1095 1 48 ILE MD 1 48 ILE MG . . 2.930 2.014 1.924 2.263 . 0 0 "[ . 1 . 2]" 1
1096 1 48 ILE MD 1 49 THR H . . 4.820 4.620 4.308 4.821 0.001 16 0 "[ . 1 . 2]" 1
1097 1 48 ILE MD 1 50 VAL MG2 . . 3.230 2.981 2.550 3.171 . 0 0 "[ . 1 . 2]" 1
1098 1 48 ILE MD 1 71 ILE HB . . 5.090 4.078 3.878 4.316 . 0 0 "[ . 1 . 2]" 1
1099 1 48 ILE MD 1 71 ILE MD . . 3.400 2.509 2.394 2.678 . 0 0 "[ . 1 . 2]" 1
1100 1 48 ILE MD 1 71 ILE MG . . 4.710 3.435 3.192 3.684 . 0 0 "[ . 1 . 2]" 1
1101 1 48 ILE HG12 1 48 ILE MG . . 3.410 2.361 2.129 2.429 . 0 0 "[ . 1 . 2]" 1
1102 1 48 ILE HG12 1 49 THR H . . 5.160 4.960 4.814 5.033 . 0 0 "[ . 1 . 2]" 1
1103 1 48 ILE HG13 1 48 ILE MG . . 3.600 3.196 3.164 3.202 . 0 0 "[ . 1 . 2]" 1
1104 1 48 ILE HG13 1 49 THR H . . 4.510 3.986 3.758 4.113 . 0 0 "[ . 1 . 2]" 1
1105 1 48 ILE HG13 1 50 VAL MG2 . . 3.810 3.115 2.976 3.384 . 0 0 "[ . 1 . 2]" 1
1106 1 48 ILE MG 1 49 THR H . . 4.780 3.921 3.850 3.977 . 0 0 "[ . 1 . 2]" 1
1107 1 49 THR H 1 49 THR HB . . 3.230 2.495 2.385 2.549 . 0 0 "[ . 1 . 2]" 1
1108 1 49 THR H 1 49 THR HG1 . . 4.410 2.923 2.639 3.166 . 0 0 "[ . 1 . 2]" 1
1109 1 49 THR H 1 49 THR MG . . 3.850 3.779 3.695 3.815 . 0 0 "[ . 1 . 2]" 1
1110 1 49 THR H 1 50 VAL H . . 4.760 4.436 4.356 4.513 . 0 0 "[ . 1 . 2]" 1
1111 1 49 THR H 1 50 VAL MG2 . . 4.650 4.451 4.340 4.551 . 0 0 "[ . 1 . 2]" 1
1112 1 49 THR HA 1 49 THR MG . . 3.270 2.469 2.418 2.528 . 0 0 "[ . 1 . 2]" 1
1113 1 49 THR HA 1 50 VAL H . . 3.060 2.160 2.143 2.195 . 0 0 "[ . 1 . 2]" 1
1114 1 49 THR HA 1 50 VAL HA . . 4.960 4.390 4.386 4.399 . 0 0 "[ . 1 . 2]" 1
1115 1 49 THR HA 1 50 VAL HB . . 4.900 4.665 4.615 4.717 . 0 0 "[ . 1 . 2]" 1
1116 1 49 THR HA 1 50 VAL MG2 . . 4.140 3.652 3.557 3.799 . 0 0 "[ . 1 . 2]" 1
1117 1 49 THR HB 1 50 VAL H . . 4.670 4.226 4.075 4.372 . 0 0 "[ . 1 . 2]" 1
1118 1 49 THR MG 1 50 VAL H . . 3.550 2.513 2.214 2.723 . 0 0 "[ . 1 . 2]" 1
1119 1 49 THR MG 1 50 VAL HA . . 3.740 3.646 3.446 3.740 . 0 0 "[ . 1 . 2]" 1
1120 1 49 THR MG 1 51 ARG H . . 4.500 4.161 3.698 4.442 . 0 0 "[ . 1 . 2]" 1
1121 1 49 THR MG 1 51 ARG QD . . 4.070 3.209 2.390 3.790 . 0 0 "[ . 1 . 2]" 1
1122 1 49 THR MG 1 51 ARG QG . . 3.410 2.601 2.438 2.749 . 0 0 "[ . 1 . 2]" 1
1123 1 50 VAL H 1 50 VAL HB . . 3.750 2.606 2.535 2.692 . 0 0 "[ . 1 . 2]" 1
1124 1 50 VAL H 1 50 VAL MG1 . . 4.410 3.834 3.805 3.874 . 0 0 "[ . 1 . 2]" 1
1125 1 50 VAL H 1 50 VAL MG2 . . 3.550 2.639 2.564 2.737 . 0 0 "[ . 1 . 2]" 1
1126 1 50 VAL H 1 51 ARG H . . 4.630 4.447 4.297 4.538 . 0 0 "[ . 1 . 2]" 1
1127 1 50 VAL HA 1 50 VAL MG1 . . 3.350 2.389 2.280 2.456 . 0 0 "[ . 1 . 2]" 1
1128 1 50 VAL HA 1 50 VAL MG2 . . 3.430 2.352 2.293 2.404 . 0 0 "[ . 1 . 2]" 1
1129 1 50 VAL HA 1 51 ARG H . . 2.760 2.167 2.141 2.222 . 0 0 "[ . 1 . 2]" 1
1130 1 50 VAL HA 1 51 ARG HA . . 4.670 4.409 4.394 4.440 . 0 0 "[ . 1 . 2]" 1
1131 1 50 VAL HB 1 51 ARG H . . 4.220 4.092 3.905 4.221 0.001 4 0 "[ . 1 . 2]" 1
1132 1 50 VAL MG1 1 51 ARG H . . 3.380 2.371 2.049 2.726 . 0 0 "[ . 1 . 2]" 1
1133 1 50 VAL MG1 1 51 ARG HA . . 4.340 3.547 3.413 3.769 . 0 0 "[ . 1 . 2]" 1
1134 1 50 VAL MG1 1 62 MET ME . . 3.100 2.058 1.831 2.276 . 0 0 "[ . 1 . 2]" 1
1135 1 50 VAL MG1 1 62 MET HG2 . . 4.500 4.360 4.215 4.462 . 0 0 "[ . 1 . 2]" 1
1136 1 50 VAL MG1 1 62 MET HG3 . . 4.660 4.084 3.929 4.343 . 0 0 "[ . 1 . 2]" 1
1137 1 50 VAL MG1 1 64 ILE MD . . 3.100 2.995 2.767 3.098 . 0 0 "[ . 1 . 2]" 1
1138 1 50 VAL MG2 1 51 ARG H . . 4.240 4.048 3.979 4.142 . 0 0 "[ . 1 . 2]" 1
1139 1 51 ARG H 1 51 ARG HB2 . . 3.620 2.559 2.465 2.684 . 0 0 "[ . 1 . 2]" 1
1140 1 51 ARG H 1 51 ARG HB3 . . 3.850 3.644 3.591 3.721 . 0 0 "[ . 1 . 2]" 1
1141 1 51 ARG H 1 51 ARG QD . . 4.630 4.418 4.123 4.634 0.004 9 0 "[ . 1 . 2]" 1
1142 1 51 ARG H 1 51 ARG QG . . 3.570 3.523 3.425 3.571 0.001 16 0 "[ . 1 . 2]" 1
1143 1 51 ARG HA 1 51 ARG QD . . 4.450 4.001 3.902 4.084 . 0 0 "[ . 1 . 2]" 1
1144 1 51 ARG HA 1 51 ARG QG . . 3.490 2.287 2.230 2.320 . 0 0 "[ . 1 . 2]" 1
1145 1 51 ARG HA 1 52 TYR H . . 2.830 2.143 2.140 2.152 . 0 0 "[ . 1 . 2]" 1
1146 1 51 ARG HA 1 52 TYR HA . . 4.610 4.399 4.390 4.409 . 0 0 "[ . 1 . 2]" 1
1147 1 51 ARG HA 1 52 TYR HB3 . . 4.640 4.407 4.356 4.464 . 0 0 "[ . 1 . 2]" 1
1148 1 51 ARG HB2 1 51 ARG QD . . 3.230 2.283 2.153 2.490 . 0 0 "[ . 1 . 2]" 1
1149 1 51 ARG HB2 1 52 TYR H . . 5.270 4.440 4.376 4.495 . 0 0 "[ . 1 . 2]" 1
1150 1 51 ARG HB3 1 51 ARG QD . . 2.870 2.594 2.289 2.847 . 0 0 "[ . 1 . 2]" 1
1151 1 51 ARG HB3 1 52 TYR H . . 3.820 3.484 3.358 3.610 . 0 0 "[ . 1 . 2]" 1
1152 1 51 ARG QG 1 52 TYR H . . 3.830 3.774 3.690 3.830 . 0 0 "[ . 1 . 2]" 1
1153 1 52 TYR H 1 52 TYR HB2 . . 3.830 3.434 3.387 3.486 . 0 0 "[ . 1 . 2]" 1
1154 1 52 TYR H 1 52 TYR HB3 . . 3.610 2.697 2.622 2.756 . 0 0 "[ . 1 . 2]" 1
1155 1 52 TYR H 1 52 TYR QD . . 4.590 4.271 4.221 4.313 . 0 0 "[ . 1 . 2]" 1
1156 1 52 TYR H 1 53 ALA H . . 4.410 4.361 4.265 4.415 0.005 8 0 "[ . 1 . 2]" 1
1157 1 52 TYR H 1 53 ALA HA . . 4.900 4.734 4.682 4.774 . 0 0 "[ . 1 . 2]" 1
1158 1 52 TYR HA 1 53 ALA H . . 2.990 2.235 2.163 2.303 . 0 0 "[ . 1 . 2]" 1
1159 1 52 TYR HA 1 53 ALA MB . . 3.960 3.841 3.795 3.918 . 0 0 "[ . 1 . 2]" 1
1160 1 52 TYR HB2 1 53 ALA H . . 4.340 3.874 3.754 4.014 . 0 0 "[ . 1 . 2]" 1
1161 1 52 TYR HB2 1 62 MET ME . . 3.960 2.752 2.550 3.150 . 0 0 "[ . 1 . 2]" 1
1162 1 52 TYR HB2 1 78 PHE QE . . 5.500 5.199 4.987 5.426 . 0 0 "[ . 1 . 2]" 1
1163 1 52 TYR HB2 1 78 PHE HZ . . 5.500 4.915 4.323 5.374 . 0 0 "[ . 1 . 2]" 1
1164 1 52 TYR HB3 1 53 ALA H . . 4.760 4.089 3.924 4.284 . 0 0 "[ . 1 . 2]" 1
1165 1 52 TYR HB3 1 62 MET ME . . 4.110 2.990 2.773 3.294 . 0 0 "[ . 1 . 2]" 1
1166 1 52 TYR HB3 1 78 PHE QE . . 4.880 4.202 3.966 4.406 . 0 0 "[ . 1 . 2]" 1
1167 1 52 TYR HB3 1 78 PHE HZ . . 5.260 4.370 3.585 4.958 . 0 0 "[ . 1 . 2]" 1
1168 1 52 TYR QD 1 53 ALA H . . 4.130 2.551 2.151 2.944 . 0 0 "[ . 1 . 2]" 1
1169 1 52 TYR QD 1 54 PRO HB3 . . 4.860 3.586 3.349 3.801 . 0 0 "[ . 1 . 2]" 1
1170 1 52 TYR QD 1 54 PRO HG3 . . 4.380 3.995 3.780 4.267 . 0 0 "[ . 1 . 2]" 1
1171 1 52 TYR QD 1 62 MET ME . . 4.020 3.589 3.281 3.869 . 0 0 "[ . 1 . 2]" 1
1172 1 52 TYR QD 1 78 PHE QE . . 4.750 2.353 2.052 2.601 . 0 0 "[ . 1 . 2]" 1
1173 1 52 TYR QD 1 78 PHE HZ . . 4.690 2.902 2.080 3.555 . 0 0 "[ . 1 . 2]" 1
1174 1 52 TYR QE 1 53 ALA H . . 4.790 3.719 3.459 4.001 . 0 0 "[ . 1 . 2]" 1
1175 1 52 TYR QE 1 54 PRO HA . . 3.530 2.719 2.243 3.024 . 0 0 "[ . 1 . 2]" 1
1176 1 52 TYR QE 1 54 PRO HB2 . . 4.340 3.718 3.610 3.968 . 0 0 "[ . 1 . 2]" 1
1177 1 52 TYR QE 1 54 PRO HB3 . . 3.760 2.061 1.995 2.317 . 0 0 "[ . 1 . 2]" 1
1178 1 52 TYR QE 1 54 PRO HG3 . . 4.290 3.828 3.538 4.052 . 0 0 "[ . 1 . 2]" 1
1179 1 52 TYR QE 1 55 THR H . . 4.580 4.290 4.061 4.543 . 0 0 "[ . 1 . 2]" 1
1180 1 52 TYR QE 1 60 HIS HD2 . . 4.030 3.650 3.259 4.030 . 12 0 "[ . 1 . 2]" 1
1181 1 52 TYR QE 1 78 PHE QE . . 4.220 2.686 2.004 3.316 . 0 0 "[ . 1 . 2]" 1
1182 1 52 TYR QE 1 78 PHE HZ . . 4.660 2.982 2.294 3.446 . 0 0 "[ . 1 . 2]" 1
1183 1 53 ALA H 1 53 ALA MB . . 3.050 2.348 2.211 2.488 . 0 0 "[ . 1 . 2]" 1
1184 1 53 ALA H 1 54 PRO HD3 . . 4.910 4.014 3.915 4.143 . 0 0 "[ . 1 . 2]" 1
1185 1 53 ALA HA 1 54 PRO HD2 . . 3.350 1.920 1.915 1.926 . 0 0 "[ . 1 . 2]" 1
1186 1 53 ALA HA 1 54 PRO HD3 . . 3.310 2.561 2.518 2.597 . 0 0 "[ . 1 . 2]" 1
1187 1 53 ALA HA 1 54 PRO HG2 . . 4.660 4.118 4.116 4.119 . 0 0 "[ . 1 . 2]" 1
1188 1 53 ALA HA 1 54 PRO HG3 . . 4.710 4.416 4.392 4.436 . 0 0 "[ . 1 . 2]" 1
1189 1 53 ALA MB 1 54 PRO HD2 . . 4.050 3.424 3.381 3.481 . 0 0 "[ . 1 . 2]" 1
1190 1 53 ALA MB 1 54 PRO HD3 . . 4.080 4.098 4.076 4.114 0.034 13 0 "[ . 1 . 2]" 1
1191 1 54 PRO HA 1 55 THR H . . 3.390 2.161 2.150 2.264 . 0 0 "[ . 1 . 2]" 1
1192 1 54 PRO HA 1 56 GLU H . . 3.900 3.743 3.530 3.901 0.001 2 0 "[ . 1 . 2]" 1
1193 1 54 PRO HB2 1 55 THR H . . 4.340 3.513 2.992 3.649 . 0 0 "[ . 1 . 2]" 1
1194 1 54 PRO HB2 1 56 GLU H . . 3.930 3.469 3.125 3.741 . 0 0 "[ . 1 . 2]" 1
1195 1 54 PRO HB2 1 60 HIS HE1 . . 4.920 4.015 3.751 4.242 . 0 0 "[ . 1 . 2]" 1
1196 1 54 PRO HB2 1 80 VAL HB . . 4.250 3.706 3.451 3.891 . 0 0 "[ . 1 . 2]" 1
1197 1 54 PRO HB2 1 80 VAL MG1 . . 3.360 2.172 2.034 2.445 . 0 0 "[ . 1 . 2]" 1
1198 1 54 PRO HB2 1 80 VAL MG2 . . 3.850 2.501 2.284 2.702 . 0 0 "[ . 1 . 2]" 1
1199 1 54 PRO HB3 1 55 THR H . . 4.190 3.988 3.660 4.080 . 0 0 "[ . 1 . 2]" 1
1200 1 54 PRO HB3 1 56 GLU H . . 4.810 4.520 4.288 4.748 . 0 0 "[ . 1 . 2]" 1
1201 1 54 PRO HB3 1 60 HIS HE1 . . 4.350 4.258 4.062 4.343 . 0 0 "[ . 1 . 2]" 1
1202 1 54 PRO HB3 1 80 VAL MG1 . . 3.340 3.133 2.953 3.308 . 0 0 "[ . 1 . 2]" 1
1203 1 54 PRO HB3 1 80 VAL MG2 . . 3.360 2.162 1.965 2.368 . 0 0 "[ . 1 . 2]" 1
1204 1 54 PRO HG2 1 55 THR HA . . 5.500 5.209 5.016 5.287 . 0 0 "[ . 1 . 2]" 1
1205 1 54 PRO HG2 1 80 VAL HA . . 5.500 5.394 5.208 5.501 0.001 2 0 "[ . 1 . 2]" 1
1206 1 54 PRO HG2 1 80 VAL MG1 . . 3.460 2.401 2.200 2.715 . 0 0 "[ . 1 . 2]" 1
1207 1 54 PRO HG2 1 80 VAL MG2 . . 3.780 3.255 3.040 3.471 . 0 0 "[ . 1 . 2]" 1
1208 1 54 PRO HG3 1 78 PHE QE . . 4.230 3.724 3.204 4.230 0.000 12 0 "[ . 1 . 2]" 1
1209 1 54 PRO HG3 1 80 VAL HA . . 5.070 4.548 4.293 4.700 . 0 0 "[ . 1 . 2]" 1
1210 1 54 PRO HG3 1 80 VAL MG1 . . 3.490 2.412 2.133 2.720 . 0 0 "[ . 1 . 2]" 1
1211 1 54 PRO HG3 1 80 VAL MG2 . . 3.640 2.178 1.989 2.508 . 0 0 "[ . 1 . 2]" 1
1212 1 55 THR H 1 55 THR MG . . 4.100 3.266 2.327 3.880 . 0 0 "[ . 1 . 2]" 1
1213 1 55 THR H 1 56 GLU H . . 3.070 2.289 1.967 2.429 . 0 0 "[ . 1 . 2]" 1
1214 1 55 THR HA 1 55 THR MG . . 2.900 2.343 2.249 2.442 . 0 0 "[ . 1 . 2]" 1
1215 1 55 THR HB 1 56 GLU H . . 4.630 3.283 2.650 3.974 . 0 0 "[ . 1 . 2]" 1
1216 1 55 THR MG 1 56 GLU H . . 4.480 3.845 3.483 4.111 . 0 0 "[ . 1 . 2]" 1
1217 1 56 GLU H 1 56 GLU HB2 . . 4.120 2.585 2.396 2.875 . 0 0 "[ . 1 . 2]" 1
1218 1 56 GLU H 1 56 GLU QB . . 3.530 2.487 2.361 2.599 . 0 0 "[ . 1 . 2]" 1
1219 1 56 GLU H 1 56 GLU HB3 . . 4.120 3.452 2.896 3.714 . 0 0 "[ . 1 . 2]" 1
1220 1 56 GLU H 1 56 GLU QG . . 4.900 3.767 3.337 4.270 . 0 0 "[ . 1 . 2]" 1
1221 1 56 GLU H 1 57 LYS H . . 4.680 4.457 4.403 4.499 . 0 0 "[ . 1 . 2]" 1
1222 1 56 GLU H 1 60 HIS HE1 . . 4.430 4.275 4.013 4.432 0.002 10 0 "[ . 1 . 2]" 1
1223 1 56 GLU HA 1 57 LYS H . . 2.790 2.402 2.269 2.558 . 0 0 "[ . 1 . 2]" 1
1224 1 56 GLU HA 1 57 LYS QB . . 4.960 4.320 4.178 4.643 . 0 0 "[ . 1 . 2]" 1
1225 1 56 GLU HA 1 57 LYS QG . . 5.000 4.081 3.431 4.368 . 0 0 "[ . 1 . 2]" 1
1226 1 56 GLU QB 1 57 LYS H . . 3.300 2.624 2.114 3.303 0.003 13 0 "[ . 1 . 2]" 1
1227 1 56 GLU QB 1 60 HIS HE1 . . 4.360 3.982 3.715 4.292 . 0 0 "[ . 1 . 2]" 1
1228 1 56 GLU HB2 1 57 LYS H . . 4.120 3.888 3.603 4.115 . 0 0 "[ . 1 . 2]" 1
1229 1 56 GLU HB3 1 57 LYS H . . 4.120 2.687 2.129 3.481 . 0 0 "[ . 1 . 2]" 1
1230 1 56 GLU QG 1 57 LYS H . . 3.800 3.184 1.969 3.803 0.003 11 0 "[ . 1 . 2]" 1
1231 1 57 LYS H 1 57 LYS QB . . 2.970 2.660 2.501 2.797 . 0 0 "[ . 1 . 2]" 1
1232 1 57 LYS H 1 57 LYS QD . . 3.680 3.538 3.144 3.720 0.040 13 0 "[ . 1 . 2]" 1
1233 1 57 LYS H 1 57 LYS QE . . 5.340 4.183 2.574 4.929 . 0 0 "[ . 1 . 2]" 1
1234 1 57 LYS H 1 57 LYS HG2 . . 3.780 2.186 1.894 3.709 . 0 0 "[ . 1 . 2]" 1
1235 1 57 LYS H 1 57 LYS QG . . 3.280 2.022 1.885 2.217 . 0 0 "[ . 1 . 2]" 1
1236 1 57 LYS H 1 57 LYS HG3 . . 3.780 3.305 2.117 3.646 . 0 0 "[ . 1 . 2]" 1
1237 1 57 LYS H 1 58 GLY H . . 4.620 4.564 4.492 4.621 0.001 10 0 "[ . 1 . 2]" 1
1238 1 57 LYS H 1 80 VAL MG1 . . 4.650 4.436 4.160 4.649 . 0 0 "[ . 1 . 2]" 1
1239 1 57 LYS HA 1 57 LYS HG2 . . 4.130 3.597 2.914 3.713 . 0 0 "[ . 1 . 2]" 1
1240 1 57 LYS HA 1 57 LYS QG . . 3.600 3.264 2.559 3.343 . 0 0 "[ . 1 . 2]" 1
1241 1 57 LYS HA 1 57 LYS HG3 . . 4.130 3.746 2.834 3.963 . 0 0 "[ . 1 . 2]" 1
1242 1 57 LYS HA 1 58 GLY H . . 3.110 2.304 2.160 2.522 . 0 0 "[ . 1 . 2]" 1
1243 1 57 LYS HA 1 58 GLY HA3 . . 4.830 4.389 4.360 4.460 . 0 0 "[ . 1 . 2]" 1
1244 1 57 LYS HA 1 60 HIS HE1 . . 4.500 3.191 2.963 3.502 . 0 0 "[ . 1 . 2]" 1
1245 1 57 LYS HA 1 80 VAL H . . 4.180 3.987 3.845 4.124 . 0 0 "[ . 1 . 2]" 1
1246 1 57 LYS HA 1 80 VAL HB . . 3.500 2.117 1.997 2.370 . 0 0 "[ . 1 . 2]" 1
1247 1 57 LYS HA 1 80 VAL MG1 . . 3.380 2.481 2.150 2.750 . 0 0 "[ . 1 . 2]" 1
1248 1 57 LYS HA 1 80 VAL MG2 . . 4.090 3.729 3.584 4.011 . 0 0 "[ . 1 . 2]" 1
1249 1 57 LYS QB 1 57 LYS HE2 . . 4.340 3.700 2.089 4.252 . 0 0 "[ . 1 . 2]" 1
1250 1 57 LYS QB 1 57 LYS QE . . 3.810 3.188 1.954 3.663 . 0 0 "[ . 1 . 2]" 1
1251 1 57 LYS QB 1 57 LYS HE3 . . 4.340 3.673 1.972 4.249 . 0 0 "[ . 1 . 2]" 1
1252 1 57 LYS QB 1 58 GLY H . . 3.350 2.701 2.199 3.167 . 0 0 "[ . 1 . 2]" 1
1253 1 57 LYS QB 1 80 VAL HB . . 4.330 3.640 3.428 3.878 . 0 0 "[ . 1 . 2]" 1
1254 1 57 LYS QB 1 80 VAL MG1 . . 3.740 3.229 2.886 3.707 . 0 0 "[ . 1 . 2]" 1
1255 1 57 LYS QB 1 82 ALA H . . 4.720 3.973 3.494 4.415 . 0 0 "[ . 1 . 2]" 1
1256 1 57 LYS QB 1 82 ALA HA . . 5.370 4.701 4.251 5.340 . 0 0 "[ . 1 . 2]" 1
1257 1 57 LYS QD 1 81 ASP HA . . 4.560 3.860 3.341 4.530 . 0 0 "[ . 1 . 2]" 1
1258 1 57 LYS QD 1 82 ALA H . . 4.360 3.911 3.309 4.335 . 0 0 "[ . 1 . 2]" 1
1259 1 57 LYS QE 1 57 LYS QG . . 3.170 2.265 2.046 2.656 . 0 0 "[ . 1 . 2]" 1
1260 1 57 LYS QG 1 58 GLY H . . 4.160 3.765 3.280 4.072 . 0 0 "[ . 1 . 2]" 1
1261 1 57 LYS HG2 1 58 GLY H . . 4.850 4.604 4.152 4.841 . 0 0 "[ . 1 . 2]" 1
1262 1 57 LYS HG3 1 58 GLY H . . 4.850 4.033 3.425 4.705 . 0 0 "[ . 1 . 2]" 1
1263 1 58 GLY H 1 59 LEU H . . 4.600 4.420 4.355 4.509 . 0 0 "[ . 1 . 2]" 1
1264 1 58 GLY H 1 60 HIS HE1 . . 4.560 3.318 2.663 3.709 . 0 0 "[ . 1 . 2]" 1
1265 1 58 GLY H 1 79 TYR QE . . 4.860 3.978 3.640 4.409 . 0 0 "[ . 1 . 2]" 1
1266 1 58 GLY H 1 80 VAL H . . 3.730 2.440 2.262 2.748 . 0 0 "[ . 1 . 2]" 1
1267 1 58 GLY H 1 80 VAL HA . . 4.930 4.426 4.250 4.746 . 0 0 "[ . 1 . 2]" 1
1268 1 58 GLY H 1 80 VAL HB . . 3.390 2.438 2.076 2.947 . 0 0 "[ . 1 . 2]" 1
1269 1 58 GLY H 1 80 VAL MG1 . . 4.020 3.748 3.497 4.011 . 0 0 "[ . 1 . 2]" 1
1270 1 58 GLY H 1 80 VAL MG2 . . 4.260 3.737 3.251 4.222 . 0 0 "[ . 1 . 2]" 1
1271 1 58 GLY HA2 1 59 LEU H . . 3.170 2.558 2.445 2.664 . 0 0 "[ . 1 . 2]" 1
1272 1 58 GLY HA2 1 59 LEU HB3 . . 5.380 5.270 5.184 5.338 . 0 0 "[ . 1 . 2]" 1
1273 1 58 GLY HA2 1 79 TYR QD . . 5.020 3.445 3.232 3.641 . 0 0 "[ . 1 . 2]" 1
1274 1 58 GLY HA2 1 79 TYR QE . . 4.380 2.240 2.029 2.403 . 0 0 "[ . 1 . 2]" 1
1275 1 58 GLY HA2 1 80 VAL H . . 4.810 3.834 3.647 4.034 . 0 0 "[ . 1 . 2]" 1
1276 1 58 GLY HA3 1 59 LEU H . . 3.340 2.570 2.467 2.688 . 0 0 "[ . 1 . 2]" 1
1277 1 58 GLY HA3 1 59 LEU HB2 . . 5.050 4.874 4.804 4.978 . 0 0 "[ . 1 . 2]" 1
1278 1 58 GLY HA3 1 79 TYR QD . . 4.970 4.631 4.482 4.828 . 0 0 "[ . 1 . 2]" 1
1279 1 58 GLY HA3 1 79 TYR QE . . 3.860 3.695 3.527 3.842 . 0 0 "[ . 1 . 2]" 1
1280 1 58 GLY HA3 1 80 VAL H . . 4.660 4.535 4.413 4.608 . 0 0 "[ . 1 . 2]" 1
1281 1 59 LEU H 1 59 LEU HB2 . . 3.340 2.338 2.246 2.482 . 0 0 "[ . 1 . 2]" 1
1282 1 59 LEU H 1 59 LEU HB3 . . 3.190 2.756 2.702 2.829 . 0 0 "[ . 1 . 2]" 1
1283 1 59 LEU H 1 59 LEU MD1 . . 3.920 3.811 3.643 3.893 . 0 0 "[ . 1 . 2]" 1
1284 1 59 LEU H 1 59 LEU MD2 . . 4.370 4.252 4.206 4.353 . 0 0 "[ . 1 . 2]" 1
1285 1 59 LEU H 1 59 LEU HG . . 4.630 4.559 4.523 4.593 . 0 0 "[ . 1 . 2]" 1
1286 1 59 LEU H 1 60 HIS H . . 4.660 4.512 4.441 4.580 . 0 0 "[ . 1 . 2]" 1
1287 1 59 LEU H 1 79 TYR HA . . 4.630 4.410 4.176 4.605 . 0 0 "[ . 1 . 2]" 1
1288 1 59 LEU H 1 79 TYR QD . . 4.410 3.101 2.868 3.335 . 0 0 "[ . 1 . 2]" 1
1289 1 59 LEU H 1 79 TYR QE . . 4.300 2.855 2.593 3.241 . 0 0 "[ . 1 . 2]" 1
1290 1 59 LEU HA 1 59 LEU MD1 . . 3.400 2.155 1.971 2.345 . 0 0 "[ . 1 . 2]" 1
1291 1 59 LEU HA 1 59 LEU MD2 . . 4.250 3.843 3.823 3.864 . 0 0 "[ . 1 . 2]" 1
1292 1 59 LEU HA 1 59 LEU HG . . 4.260 2.801 2.643 2.922 . 0 0 "[ . 1 . 2]" 1
1293 1 59 LEU HA 1 60 HIS H . . 3.010 2.152 2.139 2.182 . 0 0 "[ . 1 . 2]" 1
1294 1 59 LEU HA 1 60 HIS HD1 . . 4.990 3.322 3.051 3.684 . 0 0 "[ . 1 . 2]" 1
1295 1 59 LEU HA 1 78 PHE H . . 4.640 4.246 3.821 4.458 . 0 0 "[ . 1 . 2]" 1
1296 1 59 LEU HA 1 79 TYR HA . . 3.720 2.387 2.114 2.556 . 0 0 "[ . 1 . 2]" 1
1297 1 59 LEU HA 1 79 TYR QD . . 3.920 2.675 2.478 2.817 . 0 0 "[ . 1 . 2]" 1
1298 1 59 LEU HA 1 80 VAL H . . 3.960 3.815 3.541 3.958 . 0 0 "[ . 1 . 2]" 1
1299 1 59 LEU HB2 1 59 LEU MD1 . . 3.480 2.248 2.132 2.359 . 0 0 "[ . 1 . 2]" 1
1300 1 59 LEU HB2 1 59 LEU MD2 . . 3.350 2.449 2.314 2.569 . 0 0 "[ . 1 . 2]" 1
1301 1 59 LEU HB2 1 60 HIS H . . 4.760 4.383 4.283 4.480 . 0 0 "[ . 1 . 2]" 1
1302 1 59 LEU HB2 1 79 TYR QD . . 3.750 2.625 2.257 2.804 . 0 0 "[ . 1 . 2]" 1
1303 1 59 LEU HB2 1 79 TYR QE . . 4.060 3.498 3.292 3.644 . 0 0 "[ . 1 . 2]" 1
1304 1 59 LEU HB3 1 59 LEU MD1 . . 3.500 3.178 3.159 3.194 . 0 0 "[ . 1 . 2]" 1
1305 1 59 LEU HB3 1 59 LEU MD2 . . 3.230 2.204 2.060 2.382 . 0 0 "[ . 1 . 2]" 1
1306 1 59 LEU HB3 1 60 HIS H . . 4.080 3.996 3.861 4.081 0.001 3 0 "[ . 1 . 2]" 1
1307 1 59 LEU HB3 1 79 TYR QD . . 4.280 4.177 3.907 4.283 0.003 12 0 "[ . 1 . 2]" 1
1308 1 59 LEU HB3 1 79 TYR QE . . 5.020 4.895 4.611 5.020 0.000 9 0 "[ . 1 . 2]" 1
1309 1 59 LEU MD1 1 60 HIS H . . 3.390 3.166 2.710 3.373 . 0 0 "[ . 1 . 2]" 1
1310 1 59 LEU MD1 1 77 GLN HA . . 4.540 4.074 3.779 4.542 0.002 15 0 "[ . 1 . 2]" 1
1311 1 59 LEU MD1 1 77 GLN QB . . 3.340 2.586 2.329 2.907 . 0 0 "[ . 1 . 2]" 1
1312 1 59 LEU MD1 1 78 PHE H . . 3.720 3.159 2.824 3.513 . 0 0 "[ . 1 . 2]" 1
1313 1 59 LEU MD1 1 79 TYR H . . 4.260 3.397 2.812 3.878 . 0 0 "[ . 1 . 2]" 1
1314 1 59 LEU MD1 1 79 TYR HA . . 4.100 2.833 2.320 3.171 . 0 0 "[ . 1 . 2]" 1
1315 1 59 LEU MD1 1 79 TYR HB2 . . 4.450 2.581 2.164 2.856 . 0 0 "[ . 1 . 2]" 1
1316 1 59 LEU MD1 1 79 TYR QB . . 3.670 2.551 2.147 2.814 . 0 0 "[ . 1 . 2]" 1
1317 1 59 LEU MD1 1 79 TYR HB3 . . 4.450 4.006 3.588 4.297 . 0 0 "[ . 1 . 2]" 1
1318 1 59 LEU MD1 1 79 TYR QD . . 3.430 2.242 2.076 2.429 . 0 0 "[ . 1 . 2]" 1
1319 1 59 LEU MD1 1 79 TYR QE . . 4.350 4.114 3.896 4.235 . 0 0 "[ . 1 . 2]" 1
1320 1 59 LEU MD2 1 60 HIS H . . 4.750 4.510 4.300 4.731 . 0 0 "[ . 1 . 2]" 1
1321 1 59 LEU MD2 1 77 GLN HE21 . . 4.170 3.062 2.069 4.093 . 0 0 "[ . 1 . 2]" 1
1322 1 59 LEU MD2 1 77 GLN HE22 . . 4.170 3.071 1.983 3.725 . 0 0 "[ . 1 . 2]" 1
1323 1 59 LEU HG 1 60 HIS H . . 4.290 2.993 2.768 3.287 . 0 0 "[ . 1 . 2]" 1
1324 1 59 LEU HG 1 79 TYR HA . . 5.200 4.722 4.279 4.973 . 0 0 "[ . 1 . 2]" 1
1325 1 60 HIS H 1 60 HIS HB2 . . 4.200 2.519 2.439 2.611 . 0 0 "[ . 1 . 2]" 1
1326 1 60 HIS H 1 60 HIS QB . . 3.330 2.480 2.405 2.565 . 0 0 "[ . 1 . 2]" 1
1327 1 60 HIS H 1 60 HIS HB3 . . 4.200 3.704 3.658 3.761 . 0 0 "[ . 1 . 2]" 1
1328 1 60 HIS H 1 60 HIS HD1 . . 3.820 2.724 2.348 3.151 . 0 0 "[ . 1 . 2]" 1
1329 1 60 HIS H 1 61 GLN H . . 4.560 4.494 4.415 4.540 . 0 0 "[ . 1 . 2]" 1
1330 1 60 HIS H 1 77 GLN HA . . 5.500 4.516 4.316 4.810 . 0 0 "[ . 1 . 2]" 1
1331 1 60 HIS H 1 78 PHE H . . 3.780 3.010 2.710 3.191 . 0 0 "[ . 1 . 2]" 1
1332 1 60 HIS H 1 78 PHE QB . . 5.500 4.950 4.757 5.109 . 0 0 "[ . 1 . 2]" 1
1333 1 60 HIS H 1 78 PHE QD . . 4.860 4.225 4.008 4.415 . 0 0 "[ . 1 . 2]" 1
1334 1 60 HIS H 1 78 PHE QE . . 4.830 4.514 4.294 4.832 0.002 3 0 "[ . 1 . 2]" 1
1335 1 60 HIS H 1 79 TYR HA . . 3.660 3.463 3.269 3.666 0.006 15 0 "[ . 1 . 2]" 1
1336 1 60 HIS H 1 79 TYR QB . . 5.340 5.072 4.750 5.342 0.002 9 0 "[ . 1 . 2]" 1
1337 1 60 HIS H 1 79 TYR QD . . 4.900 4.716 4.503 4.883 . 0 0 "[ . 1 . 2]" 1
1338 1 60 HIS H 1 80 VAL H . . 4.780 4.695 4.498 4.780 . 0 0 "[ . 1 . 2]" 1
1339 1 60 HIS HA 1 60 HIS HD2 . . 4.940 3.720 3.496 3.911 . 0 0 "[ . 1 . 2]" 1
1340 1 60 HIS HA 1 61 GLN H . . 3.330 2.309 2.204 2.437 . 0 0 "[ . 1 . 2]" 1
1341 1 60 HIS QB 1 61 GLN H . . 3.830 2.647 2.331 2.962 . 0 0 "[ . 1 . 2]" 1
1342 1 60 HIS QB 1 78 PHE H . . 4.160 3.791 3.471 3.973 . 0 0 "[ . 1 . 2]" 1
1343 1 60 HIS QB 1 78 PHE QE . . 3.820 2.710 2.484 3.203 . 0 0 "[ . 1 . 2]" 1
1344 1 60 HIS QB 1 78 PHE HZ . . 4.210 2.575 2.237 3.198 . 0 0 "[ . 1 . 2]" 1
1345 1 60 HIS HB2 1 78 PHE HZ . . 4.940 2.910 2.655 3.373 . 0 0 "[ . 1 . 2]" 1
1346 1 60 HIS HB3 1 78 PHE HZ . . 4.940 2.938 2.374 4.024 . 0 0 "[ . 1 . 2]" 1
1347 1 60 HIS HD1 1 80 VAL H . . 4.290 3.405 3.142 3.708 . 0 0 "[ . 1 . 2]" 1
1348 1 60 HIS HD1 1 80 VAL HB . . 4.800 3.603 3.217 3.887 . 0 0 "[ . 1 . 2]" 1
1349 1 60 HIS HD1 1 80 VAL MG2 . . 4.040 2.436 2.047 2.767 . 0 0 "[ . 1 . 2]" 1
1350 1 60 HIS HD2 1 61 GLN H . . 4.690 4.413 4.102 4.681 . 0 0 "[ . 1 . 2]" 1
1351 1 60 HIS HE1 1 80 VAL H . . 4.730 4.095 3.731 4.699 . 0 0 "[ . 1 . 2]" 1
1352 1 60 HIS HE1 1 80 VAL HB . . 3.800 2.772 2.325 3.351 . 0 0 "[ . 1 . 2]" 1
1353 1 60 HIS HE1 1 80 VAL MG1 . . 4.450 3.843 3.532 4.191 . 0 0 "[ . 1 . 2]" 1
1354 1 60 HIS HE1 1 80 VAL MG2 . . 3.890 2.813 2.397 3.326 . 0 0 "[ . 1 . 2]" 1
1355 1 61 GLN H 1 61 GLN HB2 . . 3.990 2.737 2.553 2.891 . 0 0 "[ . 1 . 2]" 1
1356 1 61 GLN H 1 61 GLN HB3 . . 3.160 2.773 2.631 2.934 . 0 0 "[ . 1 . 2]" 1
1357 1 61 GLN H 1 61 GLN QG . . 4.610 4.097 4.022 4.179 . 0 0 "[ . 1 . 2]" 1
1358 1 61 GLN H 1 62 MET H . . 4.900 4.329 4.154 4.422 . 0 0 "[ . 1 . 2]" 1
1359 1 61 GLN H 1 62 MET HA . . 5.390 4.969 4.774 5.092 . 0 0 "[ . 1 . 2]" 1
1360 1 61 GLN HA 1 61 GLN QG . . 3.570 2.388 2.195 2.836 . 0 0 "[ . 1 . 2]" 1
1361 1 61 GLN HA 1 62 MET H . . 2.950 2.144 2.139 2.176 . 0 0 "[ . 1 . 2]" 1
1362 1 61 GLN HA 1 62 MET HB2 . . 4.790 4.709 4.595 4.782 . 0 0 "[ . 1 . 2]" 1
1363 1 61 GLN HA 1 62 MET HB3 . . 4.790 4.471 4.389 4.531 . 0 0 "[ . 1 . 2]" 1
1364 1 61 GLN HA 1 77 GLN HA . . 3.510 3.311 2.657 3.511 0.001 13 0 "[ . 1 . 2]" 1
1365 1 61 GLN HA 1 77 GLN QG . . 4.730 3.851 3.294 4.735 0.005 15 0 "[ . 1 . 2]" 1
1366 1 61 GLN HA 1 78 PHE H . . 4.530 4.442 4.272 4.533 0.003 14 0 "[ . 1 . 2]" 1
1367 1 61 GLN HB2 1 61 GLN QE . . 4.440 3.598 2.441 4.358 . 0 0 "[ . 1 . 2]" 1
1368 1 61 GLN HB2 1 62 MET H . . 4.530 4.424 4.307 4.518 . 0 0 "[ . 1 . 2]" 1
1369 1 61 GLN HB3 1 61 GLN QE . . 4.440 3.522 2.096 4.102 . 0 0 "[ . 1 . 2]" 1
1370 1 61 GLN HB3 1 62 MET H . . 4.470 4.118 3.888 4.207 . 0 0 "[ . 1 . 2]" 1
1371 1 61 GLN HB3 1 62 MET HA . . 4.780 4.623 4.486 4.734 . 0 0 "[ . 1 . 2]" 1
1372 1 61 GLN QE 1 61 GLN QG . . 3.090 2.172 2.067 2.455 . 0 0 "[ . 1 . 2]" 1
1373 1 61 GLN QG 1 62 MET H . . 3.570 2.992 2.792 3.206 . 0 0 "[ . 1 . 2]" 1
1374 1 61 GLN QG 1 62 MET HA . . 5.340 4.356 4.010 5.069 . 0 0 "[ . 1 . 2]" 1
1375 1 61 GLN QG 1 77 GLN HA . . 5.340 4.615 3.973 5.248 . 0 0 "[ . 1 . 2]" 1
1376 1 62 MET H 1 62 MET HB2 . . 3.560 3.136 3.047 3.235 . 0 0 "[ . 1 . 2]" 1
1377 1 62 MET H 1 62 MET QB . . 3.110 2.405 2.357 2.498 . 0 0 "[ . 1 . 2]" 1
1378 1 62 MET H 1 62 MET HB3 . . 3.560 2.499 2.440 2.599 . 0 0 "[ . 1 . 2]" 1
1379 1 62 MET H 1 62 MET HG2 . . 4.980 4.278 4.181 4.349 . 0 0 "[ . 1 . 2]" 1
1380 1 62 MET H 1 62 MET HG3 . . 4.990 4.670 4.615 4.728 . 0 0 "[ . 1 . 2]" 1
1381 1 62 MET H 1 63 GLY H . . 4.560 4.322 4.176 4.421 . 0 0 "[ . 1 . 2]" 1
1382 1 62 MET H 1 76 LEU H . . 3.820 2.941 2.596 3.245 . 0 0 "[ . 1 . 2]" 1
1383 1 62 MET H 1 76 LEU MD1 . . 4.360 3.345 2.871 3.702 . 0 0 "[ . 1 . 2]" 1
1384 1 62 MET H 1 78 PHE QE . . 4.250 3.361 2.894 4.230 . 0 0 "[ . 1 . 2]" 1
1385 1 62 MET HA 1 62 MET ME . . 4.560 3.782 3.611 3.999 . 0 0 "[ . 1 . 2]" 1
1386 1 62 MET HA 1 62 MET HG2 . . 4.140 3.263 3.167 3.383 . 0 0 "[ . 1 . 2]" 1
1387 1 62 MET HA 1 62 MET HG3 . . 3.830 2.665 2.579 2.747 . 0 0 "[ . 1 . 2]" 1
1388 1 62 MET HA 1 63 GLY H . . 2.860 2.150 2.144 2.191 . 0 0 "[ . 1 . 2]" 1
1389 1 62 MET HA 1 63 GLY HA3 . . 4.660 4.375 4.335 4.398 . 0 0 "[ . 1 . 2]" 1
1390 1 62 MET HA 1 76 LEU H . . 5.180 4.666 4.464 4.767 . 0 0 "[ . 1 . 2]" 1
1391 1 62 MET QB 1 76 LEU MD1 . . 2.900 2.056 1.927 2.265 . 0 0 "[ . 1 . 2]" 1
1392 1 62 MET QB 1 78 PHE QD . . 3.630 3.377 3.031 3.611 . 0 0 "[ . 1 . 2]" 1
1393 1 62 MET QB 1 78 PHE QE . . 3.380 2.243 2.015 2.374 . 0 0 "[ . 1 . 2]" 1
1394 1 62 MET HB2 1 62 MET ME . . 3.480 2.207 2.044 2.418 . 0 0 "[ . 1 . 2]" 1
1395 1 62 MET HB2 1 63 GLY H . . 4.550 4.212 4.077 4.305 . 0 0 "[ . 1 . 2]" 1
1396 1 62 MET HB2 1 78 PHE QD . . 4.150 3.977 3.488 4.154 0.004 16 0 "[ . 1 . 2]" 1
1397 1 62 MET HB2 1 78 PHE QE . . 3.980 2.310 2.056 2.452 . 0 0 "[ . 1 . 2]" 1
1398 1 62 MET HB3 1 62 MET ME . . 3.480 3.237 2.810 3.377 . 0 0 "[ . 1 . 2]" 1
1399 1 62 MET HB3 1 63 GLY H . . 4.550 4.344 4.140 4.440 . 0 0 "[ . 1 . 2]" 1
1400 1 62 MET HB3 1 78 PHE QD . . 4.150 3.657 3.330 3.982 . 0 0 "[ . 1 . 2]" 1
1401 1 62 MET HB3 1 78 PHE QE . . 3.980 3.055 2.723 3.247 . 0 0 "[ . 1 . 2]" 1
1402 1 62 MET ME 1 62 MET HG3 . . 3.670 2.363 2.226 2.518 . 0 0 "[ . 1 . 2]" 1
1403 1 62 MET ME 1 78 PHE QD . . 4.620 4.222 3.525 4.570 . 0 0 "[ . 1 . 2]" 1
1404 1 62 MET ME 1 78 PHE QE . . 3.450 3.127 2.468 3.451 0.001 16 0 "[ . 1 . 2]" 1
1405 1 62 MET ME 1 78 PHE HZ . . 3.750 3.276 2.652 3.689 . 0 0 "[ . 1 . 2]" 1
1406 1 62 MET HG2 1 63 GLY H . . 3.650 3.410 3.044 3.642 . 0 0 "[ . 1 . 2]" 1
1407 1 62 MET HG2 1 64 ILE MD . . 3.710 2.693 2.264 3.060 . 0 0 "[ . 1 . 2]" 1
1408 1 62 MET HG2 1 64 ILE HG12 . . 4.210 2.614 2.330 2.853 . 0 0 "[ . 1 . 2]" 1
1409 1 62 MET HG2 1 64 ILE HG13 . . 4.210 3.877 3.614 4.015 . 0 0 "[ . 1 . 2]" 1
1410 1 62 MET HG2 1 76 LEU MD1 . . 4.750 3.672 3.317 4.002 . 0 0 "[ . 1 . 2]" 1
1411 1 62 MET HG2 1 76 LEU MD2 . . 4.930 3.198 2.775 3.632 . 0 0 "[ . 1 . 2]" 1
1412 1 62 MET HG2 1 78 PHE QE . . 5.240 5.073 4.658 5.223 . 0 0 "[ . 1 . 2]" 1
1413 1 62 MET HG3 1 63 GLY H . . 3.660 3.196 2.729 3.427 . 0 0 "[ . 1 . 2]" 1
1414 1 62 MET HG3 1 64 ILE MD . . 4.070 2.677 2.440 2.970 . 0 0 "[ . 1 . 2]" 1
1415 1 62 MET HG3 1 64 ILE HG12 . . 4.880 3.788 3.326 4.159 . 0 0 "[ . 1 . 2]" 1
1416 1 62 MET HG3 1 64 ILE QG . . 4.110 3.645 3.246 3.935 . 0 0 "[ . 1 . 2]" 1
1417 1 62 MET HG3 1 64 ILE HG13 . . 4.880 4.760 4.532 4.857 . 0 0 "[ . 1 . 2]" 1
1418 1 62 MET HG3 1 76 LEU MD1 . . 4.780 4.278 3.994 4.634 . 0 0 "[ . 1 . 2]" 1
1419 1 62 MET HG3 1 76 LEU MD2 . . 5.160 4.363 3.982 4.885 . 0 0 "[ . 1 . 2]" 1
1420 1 62 MET HG3 1 76 LEU HG . . 4.550 4.377 4.076 4.506 . 0 0 "[ . 1 . 2]" 1
1421 1 62 MET HG3 1 78 PHE QE . . 4.800 4.675 4.397 4.796 . 0 0 "[ . 1 . 2]" 1
1422 1 63 GLY H 1 64 ILE H . . 4.580 4.174 4.016 4.295 . 0 0 "[ . 1 . 2]" 1
1423 1 63 GLY H 1 75 PRO HB2 . . 5.130 5.107 4.996 5.139 0.009 18 0 "[ . 1 . 2]" 1
1424 1 63 GLY H 1 75 PRO HB3 . . 4.390 4.264 4.123 4.368 . 0 0 "[ . 1 . 2]" 1
1425 1 63 GLY HA2 1 64 ILE H . . 3.450 2.154 2.142 2.176 . 0 0 "[ . 1 . 2]" 1
1426 1 63 GLY HA2 1 70 HIS HE1 . . 3.970 3.899 3.702 3.975 0.005 3 0 "[ . 1 . 2]" 1
1427 1 63 GLY HA2 1 74 SER HG . . 4.620 3.127 3.030 3.207 . 0 0 "[ . 1 . 2]" 1
1428 1 63 GLY HA2 1 75 PRO HA . . 3.820 2.235 2.122 2.426 . 0 0 "[ . 1 . 2]" 1
1429 1 63 GLY HA2 1 75 PRO HB2 . . 4.930 3.597 3.439 3.716 . 0 0 "[ . 1 . 2]" 1
1430 1 63 GLY HA2 1 75 PRO HB3 . . 4.260 2.279 2.212 2.399 . 0 0 "[ . 1 . 2]" 1
1431 1 63 GLY HA2 1 76 LEU H . . 4.180 3.781 3.580 3.959 . 0 0 "[ . 1 . 2]" 1
1432 1 63 GLY HA3 1 64 ILE HA . . 4.900 4.601 4.575 4.619 . 0 0 "[ . 1 . 2]" 1
1433 1 63 GLY HA3 1 70 HIS HE1 . . 3.670 3.561 3.427 3.674 0.004 9 0 "[ . 1 . 2]" 1
1434 1 63 GLY HA3 1 74 SER HG . . 4.630 4.275 4.150 4.393 . 0 0 "[ . 1 . 2]" 1
1435 1 63 GLY HA3 1 75 PRO HA . . 4.240 3.866 3.751 4.101 . 0 0 "[ . 1 . 2]" 1
1436 1 63 GLY HA3 1 75 PRO HB2 . . 4.700 4.416 4.294 4.578 . 0 0 "[ . 1 . 2]" 1
1437 1 63 GLY HA3 1 75 PRO HB3 . . 4.500 2.883 2.752 3.024 . 0 0 "[ . 1 . 2]" 1
1438 1 64 ILE H 1 64 ILE HB . . 3.990 2.610 2.554 2.676 . 0 0 "[ . 1 . 2]" 1
1439 1 64 ILE H 1 64 ILE MD . . 4.500 3.251 2.759 3.618 . 0 0 "[ . 1 . 2]" 1
1440 1 64 ILE H 1 64 ILE HG12 . . 4.540 2.388 2.249 2.497 . 0 0 "[ . 1 . 2]" 1
1441 1 64 ILE H 1 64 ILE HG13 . . 4.540 3.837 3.716 3.937 . 0 0 "[ . 1 . 2]" 1
1442 1 64 ILE H 1 64 ILE MG . . 4.560 3.823 3.805 3.840 . 0 0 "[ . 1 . 2]" 1
1443 1 64 ILE H 1 65 LYS H . . 4.710 4.557 4.520 4.573 . 0 0 "[ . 1 . 2]" 1
1444 1 64 ILE H 1 70 HIS HE1 . . 4.680 4.635 4.503 4.687 0.007 15 0 "[ . 1 . 2]" 1
1445 1 64 ILE H 1 71 ILE H . . 5.300 5.272 5.194 5.303 0.003 12 0 "[ . 1 . 2]" 1
1446 1 64 ILE H 1 71 ILE HG12 . . 4.600 3.764 3.657 3.883 . 0 0 "[ . 1 . 2]" 1
1447 1 64 ILE H 1 74 SER HB2 . . 4.290 2.445 1.928 2.741 . 0 0 "[ . 1 . 2]" 1
1448 1 64 ILE H 1 74 SER HB3 . . 4.120 3.095 2.995 3.308 . 0 0 "[ . 1 . 2]" 1
1449 1 64 ILE H 1 74 SER HG . . 3.450 2.386 2.046 2.540 . 0 0 "[ . 1 . 2]" 1
1450 1 64 ILE H 1 75 PRO HA . . 4.470 3.016 2.843 3.146 . 0 0 "[ . 1 . 2]" 1
1451 1 64 ILE HA 1 64 ILE MD . . 3.640 2.152 2.049 2.266 . 0 0 "[ . 1 . 2]" 1
1452 1 64 ILE HA 1 64 ILE MG . . 3.380 2.267 2.204 2.346 . 0 0 "[ . 1 . 2]" 1
1453 1 64 ILE HA 1 65 LYS H . . 2.770 2.323 2.174 2.424 . 0 0 "[ . 1 . 2]" 1
1454 1 64 ILE HB 1 64 ILE MD . . 3.260 3.221 3.192 3.230 . 0 0 "[ . 1 . 2]" 1
1455 1 64 ILE HB 1 65 LYS H . . 4.260 3.646 3.432 4.053 . 0 0 "[ . 1 . 2]" 1
1456 1 64 ILE HB 1 71 ILE H . . 4.950 4.144 4.052 4.354 . 0 0 "[ . 1 . 2]" 1
1457 1 64 ILE HB 1 71 ILE MD . . 3.270 1.959 1.895 2.072 . 0 0 "[ . 1 . 2]" 1
1458 1 64 ILE HB 1 71 ILE HG12 . . 3.650 2.015 1.996 2.105 . 0 0 "[ . 1 . 2]" 1
1459 1 64 ILE HB 1 71 ILE HG13 . . 4.100 3.281 3.076 3.401 . 0 0 "[ . 1 . 2]" 1
1460 1 64 ILE HB 1 71 ILE MG . . 4.640 3.103 2.942 3.430 . 0 0 "[ . 1 . 2]" 1
1461 1 64 ILE HB 1 74 SER HB2 . . 4.730 2.946 2.767 3.206 . 0 0 "[ . 1 . 2]" 1
1462 1 64 ILE HB 1 74 SER HB3 . . 4.330 2.752 2.448 3.016 . 0 0 "[ . 1 . 2]" 1
1463 1 64 ILE MD 1 64 ILE MG . . 2.780 2.045 1.931 2.353 . 0 0 "[ . 1 . 2]" 1
1464 1 64 ILE MD 1 65 LYS H . . 3.790 3.598 3.434 3.770 . 0 0 "[ . 1 . 2]" 1
1465 1 64 ILE QG 1 71 ILE MD . . 3.410 2.508 2.427 2.761 . 0 0 "[ . 1 . 2]" 1
1466 1 64 ILE HG12 1 64 ILE MG . . 3.440 3.188 3.141 3.200 . 0 0 "[ . 1 . 2]" 1
1467 1 64 ILE HG12 1 71 ILE MD . . 4.230 3.223 2.874 3.520 . 0 0 "[ . 1 . 2]" 1
1468 1 64 ILE HG13 1 64 ILE MG . . 3.440 2.268 2.090 2.426 . 0 0 "[ . 1 . 2]" 1
1469 1 64 ILE HG13 1 71 ILE MD . . 4.230 2.623 2.504 2.918 . 0 0 "[ . 1 . 2]" 1
1470 1 64 ILE MG 1 65 LYS H . . 3.290 1.933 1.757 2.478 . 0 0 "[ . 1 . 2]" 1
1471 1 64 ILE MG 1 65 LYS HA . . 4.500 3.536 3.399 3.740 . 0 0 "[ . 1 . 2]" 1
1472 1 64 ILE MG 1 71 ILE H . . 4.610 3.940 3.797 4.302 . 0 0 "[ . 1 . 2]" 1
1473 1 64 ILE MG 1 71 ILE HB . . 5.400 4.104 3.892 4.348 . 0 0 "[ . 1 . 2]" 1
1474 1 64 ILE MG 1 71 ILE MD . . 3.000 1.965 1.885 2.076 . 0 0 "[ . 1 . 2]" 1
1475 1 64 ILE MG 1 71 ILE HG12 . . 3.310 2.818 2.502 2.955 . 0 0 "[ . 1 . 2]" 1
1476 1 64 ILE MG 1 71 ILE HG13 . . 4.190 4.099 3.885 4.191 0.001 4 0 "[ . 1 . 2]" 1
1477 1 64 ILE MG 1 71 ILE MG . . 3.470 2.119 1.951 2.466 . 0 0 "[ . 1 . 2]" 1
1478 1 65 LYS H 1 65 LYS HB2 . . 3.450 2.658 2.452 2.753 . 0 0 "[ . 1 . 2]" 1
1479 1 65 LYS H 1 65 LYS HB3 . . 3.750 3.685 3.577 3.742 . 0 0 "[ . 1 . 2]" 1
1480 1 65 LYS H 1 65 LYS QD . . 5.340 4.742 4.677 4.770 . 0 0 "[ . 1 . 2]" 1
1481 1 65 LYS H 1 65 LYS HG2 . . 4.220 3.806 3.679 3.868 . 0 0 "[ . 1 . 2]" 1
1482 1 65 LYS H 1 65 LYS HG3 . . 4.610 4.477 4.274 4.570 . 0 0 "[ . 1 . 2]" 1
1483 1 65 LYS H 1 70 HIS HA . . 5.460 5.296 5.244 5.355 . 0 0 "[ . 1 . 2]" 1
1484 1 65 LYS H 1 71 ILE MG . . 4.450 3.455 3.145 3.933 . 0 0 "[ . 1 . 2]" 1
1485 1 65 LYS HA 1 65 LYS HD2 . . 4.070 3.776 3.741 3.831 . 0 0 "[ . 1 . 2]" 1
1486 1 65 LYS HA 1 65 LYS QD . . 3.470 2.476 2.465 2.494 . 0 0 "[ . 1 . 2]" 1
1487 1 65 LYS HA 1 65 LYS HD3 . . 4.070 2.510 2.499 2.528 . 0 0 "[ . 1 . 2]" 1
1488 1 65 LYS HA 1 65 LYS QE . . 3.820 3.737 3.633 3.805 . 0 0 "[ . 1 . 2]" 1
1489 1 65 LYS HA 1 65 LYS HG2 . . 3.930 2.377 2.362 2.394 . 0 0 "[ . 1 . 2]" 1
1490 1 65 LYS HA 1 65 LYS HG3 . . 4.070 3.609 3.602 3.617 . 0 0 "[ . 1 . 2]" 1
1491 1 65 LYS HA 1 66 TYR H . . 2.900 2.315 2.286 2.374 . 0 0 "[ . 1 . 2]" 1
1492 1 65 LYS HA 1 66 TYR HA . . 4.550 4.446 4.426 4.466 . 0 0 "[ . 1 . 2]" 1
1493 1 65 LYS HA 1 69 ASN H . . 3.920 3.741 3.620 3.807 . 0 0 "[ . 1 . 2]" 1
1494 1 65 LYS HA 1 70 HIS HA . . 3.470 2.714 2.646 2.792 . 0 0 "[ . 1 . 2]" 1
1495 1 65 LYS HA 1 71 ILE H . . 3.840 2.575 2.526 2.629 . 0 0 "[ . 1 . 2]" 1
1496 1 65 LYS HA 1 71 ILE MG . . 4.070 2.787 2.648 2.976 . 0 0 "[ . 1 . 2]" 1
1497 1 65 LYS HB2 1 65 LYS HD2 . . 4.000 3.538 3.516 3.570 . 0 0 "[ . 1 . 2]" 1
1498 1 65 LYS HB2 1 65 LYS HD3 . . 4.000 3.712 3.676 3.737 . 0 0 "[ . 1 . 2]" 1
1499 1 65 LYS HB2 1 66 TYR H . . 4.120 4.042 3.941 4.092 . 0 0 "[ . 1 . 2]" 1
1500 1 65 LYS HB2 1 68 GLY H . . 5.030 4.745 4.604 5.002 . 0 0 "[ . 1 . 2]" 1
1501 1 65 LYS HB2 1 69 ASN H . . 4.880 4.819 4.690 4.877 . 0 0 "[ . 1 . 2]" 1
1502 1 65 LYS HB3 1 66 TYR H . . 3.480 2.745 2.587 2.825 . 0 0 "[ . 1 . 2]" 1
1503 1 65 LYS HB3 1 68 GLY H . . 3.770 3.100 2.954 3.371 . 0 0 "[ . 1 . 2]" 1
1504 1 65 LYS HB3 1 69 ASN H . . 3.530 3.129 3.006 3.187 . 0 0 "[ . 1 . 2]" 1
1505 1 65 LYS QD 1 66 TYR H . . 3.750 2.688 2.621 2.746 . 0 0 "[ . 1 . 2]" 1
1506 1 65 LYS QD 1 68 GLY H . . 4.430 3.405 3.305 3.708 . 0 0 "[ . 1 . 2]" 1
1507 1 65 LYS QD 1 68 GLY HA2 . . 4.020 2.549 2.434 2.795 . 0 0 "[ . 1 . 2]" 1
1508 1 65 LYS QD 1 68 GLY HA3 . . 4.410 4.059 3.949 4.251 . 0 0 "[ . 1 . 2]" 1
1509 1 65 LYS QD 1 69 ASN H . . 3.800 2.267 2.154 2.391 . 0 0 "[ . 1 . 2]" 1
1510 1 65 LYS QD 1 70 HIS H . . 5.270 3.062 2.880 3.180 . 0 0 "[ . 1 . 2]" 1
1511 1 65 LYS QD 1 70 HIS HA . . 4.210 2.803 2.692 2.965 . 0 0 "[ . 1 . 2]" 1
1512 1 65 LYS HD2 1 68 GLY HA2 . . 4.750 2.596 2.472 2.867 . 0 0 "[ . 1 . 2]" 1
1513 1 65 LYS HD2 1 68 GLY HA3 . . 5.260 4.261 4.131 4.492 . 0 0 "[ . 1 . 2]" 1
1514 1 65 LYS HD2 1 70 HIS HA . . 4.990 4.458 4.379 4.557 . 0 0 "[ . 1 . 2]" 1
1515 1 65 LYS HD3 1 68 GLY HA2 . . 4.750 3.721 3.555 3.870 . 0 0 "[ . 1 . 2]" 1
1516 1 65 LYS HD3 1 68 GLY HA3 . . 5.260 5.109 4.958 5.251 . 0 0 "[ . 1 . 2]" 1
1517 1 65 LYS HD3 1 70 HIS HA . . 4.990 2.833 2.717 3.004 . 0 0 "[ . 1 . 2]" 1
1518 1 65 LYS QE 1 65 LYS HG2 . . 3.580 2.342 2.272 2.433 . 0 0 "[ . 1 . 2]" 1
1519 1 65 LYS QE 1 65 LYS HG3 . . 3.540 2.626 2.348 2.909 . 0 0 "[ . 1 . 2]" 1
1520 1 65 LYS QE 1 69 ASN H . . 4.410 4.007 3.717 4.280 . 0 0 "[ . 1 . 2]" 1
1521 1 65 LYS QE 1 70 HIS H . . 4.260 2.659 2.322 3.068 . 0 0 "[ . 1 . 2]" 1
1522 1 65 LYS QE 1 70 HIS HD2 . . 4.690 2.482 2.347 2.606 . 0 0 "[ . 1 . 2]" 1
1523 1 65 LYS QE 1 70 HIS HE1 . . 4.050 3.691 3.450 3.857 . 0 0 "[ . 1 . 2]" 1
1524 1 65 LYS HE2 1 65 LYS HG2 . . 4.120 3.102 2.513 3.623 . 0 0 "[ . 1 . 2]" 1
1525 1 65 LYS HE2 1 65 LYS HG3 . . 4.050 3.579 3.193 3.814 . 0 0 "[ . 1 . 2]" 1
1526 1 65 LYS HE3 1 65 LYS HG2 . . 4.120 2.539 2.302 2.934 . 0 0 "[ . 1 . 2]" 1
1527 1 65 LYS HE3 1 65 LYS HG3 . . 4.050 2.703 2.392 3.020 . 0 0 "[ . 1 . 2]" 1
1528 1 65 LYS HG2 1 66 TYR H . . 4.260 4.183 4.146 4.213 . 0 0 "[ . 1 . 2]" 1
1529 1 65 LYS HG2 1 69 ASN H . . 4.790 4.666 4.534 4.778 . 0 0 "[ . 1 . 2]" 1
1530 1 65 LYS HG2 1 70 HIS HA . . 4.030 3.069 2.987 3.110 . 0 0 "[ . 1 . 2]" 1
1531 1 65 LYS HG2 1 71 ILE H . . 4.250 4.251 4.222 4.257 0.007 15 0 "[ . 1 . 2]" 1
1532 1 65 LYS HG3 1 66 TYR H . . 4.930 4.817 4.709 4.874 . 0 0 "[ . 1 . 2]" 1
1533 1 65 LYS HG3 1 69 ASN H . . 4.980 4.826 4.698 4.926 . 0 0 "[ . 1 . 2]" 1
1534 1 65 LYS HG3 1 70 HIS HA . . 4.700 4.640 4.569 4.684 . 0 0 "[ . 1 . 2]" 1
1535 1 66 TYR H 1 66 TYR HB2 . . 3.670 3.257 3.202 3.312 . 0 0 "[ . 1 . 2]" 1
1536 1 66 TYR H 1 66 TYR HB3 . . 3.420 2.713 2.660 2.772 . 0 0 "[ . 1 . 2]" 1
1537 1 66 TYR H 1 66 TYR QD . . 4.410 4.298 4.207 4.374 . 0 0 "[ . 1 . 2]" 1
1538 1 66 TYR H 1 67 ASP H . . 4.480 3.938 3.821 4.183 . 0 0 "[ . 1 . 2]" 1
1539 1 66 TYR H 1 68 GLY H . . 4.410 3.306 3.089 3.444 . 0 0 "[ . 1 . 2]" 1
1540 1 66 TYR H 1 68 GLY HA2 . . 5.110 4.518 4.391 4.594 . 0 0 "[ . 1 . 2]" 1
1541 1 66 TYR H 1 69 ASN H . . 3.130 2.112 1.982 2.198 . 0 0 "[ . 1 . 2]" 1
1542 1 66 TYR H 1 69 ASN HA . . 4.740 4.334 4.239 4.414 . 0 0 "[ . 1 . 2]" 1
1543 1 66 TYR H 1 69 ASN QB . . 4.020 3.437 3.317 3.546 . 0 0 "[ . 1 . 2]" 1
1544 1 66 TYR H 1 70 HIS HA . . 4.110 3.985 3.877 4.069 . 0 0 "[ . 1 . 2]" 1
1545 1 66 TYR H 1 71 ILE H . . 4.140 3.538 3.417 3.680 . 0 0 "[ . 1 . 2]" 1
1546 1 66 TYR H 1 71 ILE MG . . 3.620 3.093 2.950 3.337 . 0 0 "[ . 1 . 2]" 1
1547 1 66 TYR HA 1 66 TYR QD . . 3.530 2.782 2.438 2.902 . 0 0 "[ . 1 . 2]" 1
1548 1 66 TYR HA 1 66 TYR QE . . 4.900 4.668 4.529 4.752 . 0 0 "[ . 1 . 2]" 1
1549 1 66 TYR HA 1 67 ASP H . . 3.010 2.175 2.138 2.207 . 0 0 "[ . 1 . 2]" 1
1550 1 66 TYR HA 1 67 ASP HA . . 4.580 4.391 4.358 4.408 . 0 0 "[ . 1 . 2]" 1
1551 1 66 TYR HA 1 67 ASP HB3 . . 5.030 4.939 4.910 4.988 . 0 0 "[ . 1 . 2]" 1
1552 1 66 TYR HA 1 68 GLY H . . 4.320 3.870 3.661 4.017 . 0 0 "[ . 1 . 2]" 1
1553 1 66 TYR HA 1 69 ASN H . . 4.550 4.350 4.212 4.432 . 0 0 "[ . 1 . 2]" 1
1554 1 66 TYR HA 1 71 ILE MG . . 4.830 3.655 3.490 3.797 . 0 0 "[ . 1 . 2]" 1
1555 1 66 TYR HB2 1 67 ASP H . . 4.600 4.434 4.272 4.492 . 0 0 "[ . 1 . 2]" 1
1556 1 66 TYR HB2 1 69 ASN H . . 5.260 5.054 4.895 5.136 . 0 0 "[ . 1 . 2]" 1
1557 1 66 TYR HB2 1 71 ILE MG . . 3.510 2.014 1.864 2.149 . 0 0 "[ . 1 . 2]" 1
1558 1 66 TYR HB3 1 69 ASN H . . 4.050 3.968 3.833 4.048 . 0 0 "[ . 1 . 2]" 1
1559 1 66 TYR HB3 1 71 ILE H . . 4.790 4.207 3.989 4.335 . 0 0 "[ . 1 . 2]" 1
1560 1 66 TYR HB3 1 71 ILE MG . . 3.550 2.492 2.208 2.749 . 0 0 "[ . 1 . 2]" 1
1561 1 66 TYR QD 1 67 ASP H . . 4.160 3.996 3.254 4.157 . 0 0 "[ . 1 . 2]" 1
1562 1 66 TYR QD 1 67 ASP HB2 . . 3.780 3.726 3.626 3.779 . 0 0 "[ . 1 . 2]" 1
1563 1 66 TYR QD 1 67 ASP HB3 . . 4.290 3.623 3.502 3.918 . 0 0 "[ . 1 . 2]" 1
1564 1 66 TYR QD 1 71 ILE MG . . 4.150 3.603 3.427 3.750 . 0 0 "[ . 1 . 2]" 1
1565 1 66 TYR QE 1 67 ASP HB2 . . 4.100 3.830 3.738 3.922 . 0 0 "[ . 1 . 2]" 1
1566 1 66 TYR QE 1 67 ASP HB3 . . 4.300 4.092 3.880 4.282 . 0 0 "[ . 1 . 2]" 1
1567 1 67 ASP H 1 67 ASP HB2 . . 3.910 2.970 2.845 3.039 . 0 0 "[ . 1 . 2]" 1
1568 1 67 ASP H 1 67 ASP HB3 . . 4.090 3.766 3.676 3.802 . 0 0 "[ . 1 . 2]" 1
1569 1 67 ASP H 1 68 GLY H . . 3.500 2.759 2.670 2.892 . 0 0 "[ . 1 . 2]" 1
1570 1 67 ASP H 1 69 ASN H . . 4.820 4.344 4.248 4.506 . 0 0 "[ . 1 . 2]" 1
1571 1 67 ASP HA 1 68 GLY H . . 3.090 2.915 2.847 2.981 . 0 0 "[ . 1 . 2]" 1
1572 1 67 ASP HA 1 69 ASN H . . 5.040 4.990 4.889 5.049 0.009 18 0 "[ . 1 . 2]" 1
1573 1 67 ASP HB2 1 68 GLY H . . 4.570 4.483 4.432 4.523 . 0 0 "[ . 1 . 2]" 1
1574 1 67 ASP HB3 1 68 GLY H . . 4.580 4.108 4.041 4.173 . 0 0 "[ . 1 . 2]" 1
1575 1 67 ASP HB3 1 68 GLY HA3 . . 5.500 4.779 4.697 4.824 . 0 0 "[ . 1 . 2]" 1
1576 1 67 ASP HB3 1 69 ASN H . . 4.940 4.882 4.771 4.936 . 0 0 "[ . 1 . 2]" 1
1577 1 68 GLY H 1 69 ASN H . . 3.250 2.403 2.296 2.480 . 0 0 "[ . 1 . 2]" 1
1578 1 68 GLY HA2 1 69 ASN HA . . 5.090 4.344 4.335 4.356 . 0 0 "[ . 1 . 2]" 1
1579 1 69 ASN H 1 69 ASN QB . . 2.880 2.775 2.710 2.838 . 0 0 "[ . 1 . 2]" 1
1580 1 69 ASN H 1 69 ASN QD . . 4.550 4.232 3.787 4.533 . 0 0 "[ . 1 . 2]" 1
1581 1 69 ASN H 1 70 HIS HA . . 4.870 4.561 4.481 4.629 . 0 0 "[ . 1 . 2]" 1
1582 1 69 ASN HA 1 69 ASN QD . . 4.350 3.236 1.965 4.117 . 0 0 "[ . 1 . 2]" 1
1583 1 69 ASN HA 1 69 ASN HD22 . . 4.950 4.157 3.336 4.901 . 0 0 "[ . 1 . 2]" 1
1584 1 69 ASN HA 1 70 HIS H . . 3.290 2.144 2.140 2.157 . 0 0 "[ . 1 . 2]" 1
1585 1 69 ASN QB 1 69 ASN QD . . 3.040 2.256 2.067 2.506 . 0 0 "[ . 1 . 2]" 1
1586 1 69 ASN QB 1 69 ASN HD22 . . 3.500 3.316 3.223 3.413 . 0 0 "[ . 1 . 2]" 1
1587 1 69 ASN QB 1 70 HIS H . . 3.970 3.700 3.372 3.855 . 0 0 "[ . 1 . 2]" 1
1588 1 70 HIS H 1 70 HIS HB2 . . 3.730 2.165 2.139 2.203 . 0 0 "[ . 1 . 2]" 1
1589 1 70 HIS H 1 70 HIS HB3 . . 4.070 3.478 3.455 3.507 . 0 0 "[ . 1 . 2]" 1
1590 1 70 HIS H 1 70 HIS HD2 . . 4.300 3.404 3.304 3.530 . 0 0 "[ . 1 . 2]" 1
1591 1 70 HIS HA 1 70 HIS HD2 . . 5.120 4.133 4.036 4.247 . 0 0 "[ . 1 . 2]" 1
1592 1 70 HIS HA 1 71 ILE H . . 3.010 2.187 2.160 2.214 . 0 0 "[ . 1 . 2]" 1
1593 1 70 HIS HA 1 71 ILE HG12 . . 4.680 4.036 3.926 4.149 . 0 0 "[ . 1 . 2]" 1
1594 1 70 HIS HA 1 71 ILE MG . . 4.540 3.814 3.705 3.950 . 0 0 "[ . 1 . 2]" 1
1595 1 70 HIS HA 1 74 SER HG . . 4.930 3.903 3.662 4.078 . 0 0 "[ . 1 . 2]" 1
1596 1 70 HIS HB2 1 70 HIS HD2 . . 3.940 2.715 2.697 2.736 . 0 0 "[ . 1 . 2]" 1
1597 1 70 HIS HB2 1 71 ILE H . . 4.710 4.605 4.579 4.620 . 0 0 "[ . 1 . 2]" 1
1598 1 70 HIS HB2 1 74 SER HG . . 5.500 5.465 5.404 5.500 . 0 0 "[ . 1 . 2]" 1
1599 1 70 HIS HB3 1 71 ILE H . . 4.080 3.919 3.818 3.992 . 0 0 "[ . 1 . 2]" 1
1600 1 70 HIS HB3 1 74 SER H . . 4.860 4.557 4.441 4.627 . 0 0 "[ . 1 . 2]" 1
1601 1 70 HIS HB3 1 74 SER HG . . 4.590 4.059 4.009 4.166 . 0 0 "[ . 1 . 2]" 1
1602 1 70 HIS HE1 1 74 SER HG . . 4.210 3.555 3.484 3.715 . 0 0 "[ . 1 . 2]" 1
1603 1 70 HIS HE1 1 75 PRO HA . . 4.740 4.757 4.722 4.772 0.032 17 0 "[ . 1 . 2]" 1
1604 1 70 HIS HE1 1 75 PRO HB2 . . 5.500 5.479 5.401 5.518 0.018 20 0 "[ . 1 . 2]" 1
1605 1 70 HIS HE1 1 75 PRO HB3 . . 3.960 3.826 3.771 3.852 . 0 0 "[ . 1 . 2]" 1
1606 1 70 HIS HE1 1 75 PRO QD . . 4.390 2.820 2.684 3.107 . 0 0 "[ . 1 . 2]" 1
1607 1 70 HIS HE1 1 75 PRO QG . . 4.530 3.938 3.789 4.117 . 0 0 "[ . 1 . 2]" 1
1608 1 71 ILE H 1 71 ILE HB . . 3.950 3.614 3.604 3.631 . 0 0 "[ . 1 . 2]" 1
1609 1 71 ILE H 1 71 ILE MD . . 4.160 3.925 3.864 4.050 . 0 0 "[ . 1 . 2]" 1
1610 1 71 ILE H 1 71 ILE HG12 . . 3.450 2.471 2.325 2.632 . 0 0 "[ . 1 . 2]" 1
1611 1 71 ILE H 1 71 ILE HG13 . . 3.730 3.313 2.968 3.491 . 0 0 "[ . 1 . 2]" 1
1612 1 71 ILE H 1 71 ILE MG . . 3.360 2.070 1.887 2.217 . 0 0 "[ . 1 . 2]" 1
1613 1 71 ILE H 1 74 SER HB3 . . 4.410 4.028 3.823 4.420 0.010 14 0 "[ . 1 . 2]" 1
1614 1 71 ILE H 1 74 SER HG . . 4.670 4.232 4.048 4.407 . 0 0 "[ . 1 . 2]" 1
1615 1 71 ILE HA 1 71 ILE MD . . 4.200 4.136 4.088 4.149 . 0 0 "[ . 1 . 2]" 1
1616 1 71 ILE HA 1 71 ILE MG . . 3.310 2.329 2.244 2.424 . 0 0 "[ . 1 . 2]" 1
1617 1 71 ILE HA 1 72 PRO HD2 . . 3.640 2.377 2.369 2.392 . 0 0 "[ . 1 . 2]" 1
1618 1 71 ILE HA 1 72 PRO HD3 . . 3.360 2.291 2.288 2.297 . 0 0 "[ . 1 . 2]" 1
1619 1 71 ILE HA 1 72 PRO HG2 . . 4.920 4.494 4.487 4.506 . 0 0 "[ . 1 . 2]" 1
1620 1 71 ILE HA 1 72 PRO HG3 . . 4.830 4.458 4.453 4.467 . 0 0 "[ . 1 . 2]" 1
1621 1 71 ILE HB 1 71 ILE MD . . 3.200 2.244 2.152 2.345 . 0 0 "[ . 1 . 2]" 1
1622 1 71 ILE HB 1 72 PRO HD2 . . 3.550 1.960 1.953 1.968 . 0 0 "[ . 1 . 2]" 1
1623 1 71 ILE HB 1 72 PRO HD3 . . 3.650 3.408 3.400 3.422 . 0 0 "[ . 1 . 2]" 1
1624 1 71 ILE HB 1 72 PRO HG2 . . 4.690 3.797 3.742 3.829 . 0 0 "[ . 1 . 2]" 1
1625 1 71 ILE MD 1 71 ILE MG . . 3.060 2.295 2.100 2.458 . 0 0 "[ . 1 . 2]" 1
1626 1 71 ILE MD 1 72 PRO HD2 . . 4.300 3.700 3.539 3.746 . 0 0 "[ . 1 . 2]" 1
1627 1 71 ILE MD 1 72 PRO HD3 . . 5.080 5.059 4.918 5.094 0.014 6 0 "[ . 1 . 2]" 1
1628 1 71 ILE MD 1 74 SER H . . 4.920 3.847 3.486 4.321 . 0 0 "[ . 1 . 2]" 1
1629 1 71 ILE MD 1 74 SER HB2 . . 4.610 2.859 2.680 3.301 . 0 0 "[ . 1 . 2]" 1
1630 1 71 ILE MD 1 74 SER HB3 . . 4.760 2.497 1.966 2.674 . 0 0 "[ . 1 . 2]" 1
1631 1 71 ILE HG12 1 71 ILE MG . . 3.440 2.184 2.090 2.330 . 0 0 "[ . 1 . 2]" 1
1632 1 71 ILE HG12 1 74 SER H . . 4.670 4.065 3.786 4.674 0.004 14 0 "[ . 1 . 2]" 1
1633 1 71 ILE HG12 1 74 SER HB2 . . 4.900 3.477 3.293 3.791 . 0 0 "[ . 1 . 2]" 1
1634 1 71 ILE HG12 1 74 SER HB3 . . 4.210 2.249 2.011 2.746 . 0 0 "[ . 1 . 2]" 1
1635 1 71 ILE HG13 1 71 ILE MG . . 3.690 3.173 3.140 3.188 . 0 0 "[ . 1 . 2]" 1
1636 1 71 ILE HG13 1 72 PRO HD2 . . 4.960 3.908 3.775 4.123 . 0 0 "[ . 1 . 2]" 1
1637 1 71 ILE HG13 1 74 SER H . . 4.210 2.726 2.432 3.242 . 0 0 "[ . 1 . 2]" 1
1638 1 71 ILE HG13 1 74 SER HB3 . . 4.450 2.033 1.993 2.144 . 0 0 "[ . 1 . 2]" 1
1639 1 71 ILE MG 1 72 PRO HD2 . . 4.280 3.238 3.018 3.341 . 0 0 "[ . 1 . 2]" 1
1640 1 71 ILE MG 1 72 PRO HD3 . . 4.220 3.956 3.735 4.036 . 0 0 "[ . 1 . 2]" 1
1641 1 72 PRO HA 1 73 GLY H . . 2.890 2.323 2.275 2.387 . 0 0 "[ . 1 . 2]" 1
1642 1 72 PRO HA 1 73 GLY QA . . 4.310 3.912 3.904 3.923 . 0 0 "[ . 1 . 2]" 1
1643 1 72 PRO HA 1 74 SER H . . 3.930 3.845 3.775 3.937 0.007 1 0 "[ . 1 . 2]" 1
1644 1 72 PRO QB 1 73 GLY H . . 3.930 3.834 3.782 3.891 . 0 0 "[ . 1 . 2]" 1
1645 1 72 PRO HB2 1 73 GLY H . . 4.630 4.169 4.107 4.236 . 0 0 "[ . 1 . 2]" 1
1646 1 72 PRO HB3 1 73 GLY H . . 4.630 4.476 4.424 4.534 . 0 0 "[ . 1 . 2]" 1
1647 1 73 GLY H 1 74 SER H . . 3.320 1.786 1.759 1.796 . 0 0 "[ . 1 . 2]" 1
1648 1 73 GLY H 1 74 SER HB2 . . 5.500 5.267 5.136 5.541 0.041 14 0 "[ . 1 . 2]" 1
1649 1 73 GLY H 1 74 SER HB3 . . 4.450 4.165 4.032 4.335 . 0 0 "[ . 1 . 2]" 1
1650 1 74 SER H 1 74 SER HB2 . . 4.050 3.572 3.462 3.883 . 0 0 "[ . 1 . 2]" 1
1651 1 74 SER H 1 74 SER HB3 . . 3.520 2.551 2.448 2.880 . 0 0 "[ . 1 . 2]" 1
1652 1 74 SER H 1 74 SER HG . . 4.310 3.844 3.762 4.040 . 0 0 "[ . 1 . 2]" 1
1653 1 74 SER H 1 75 PRO HA . . 4.940 4.774 4.763 4.778 . 0 0 "[ . 1 . 2]" 1
1654 1 74 SER HA 1 75 PRO HA . . 3.400 2.394 2.386 2.419 . 0 0 "[ . 1 . 2]" 1
1655 1 74 SER HA 1 75 PRO HB3 . . 5.010 4.497 4.490 4.518 . 0 0 "[ . 1 . 2]" 1
1656 1 74 SER HA 1 76 LEU H . . 3.800 3.525 3.223 3.656 . 0 0 "[ . 1 . 2]" 1
1657 1 74 SER HB2 1 75 PRO HA . . 4.770 2.598 1.956 2.767 . 0 0 "[ . 1 . 2]" 1
1658 1 74 SER HB3 1 75 PRO HA . . 4.840 3.693 3.573 3.726 . 0 0 "[ . 1 . 2]" 1
1659 1 74 SER HG 1 75 PRO HA . . 4.180 2.902 2.805 3.031 . 0 0 "[ . 1 . 2]" 1
1660 1 75 PRO HA 1 76 LEU H . . 3.110 2.485 2.339 2.561 . 0 0 "[ . 1 . 2]" 1
1661 1 75 PRO HA 1 76 LEU HA . . 4.590 4.499 4.438 4.557 . 0 0 "[ . 1 . 2]" 1
1662 1 75 PRO HA 1 76 LEU HB3 . . 4.590 4.361 4.283 4.445 . 0 0 "[ . 1 . 2]" 1
1663 1 75 PRO HA 1 76 LEU MD2 . . 4.480 4.296 4.136 4.449 . 0 0 "[ . 1 . 2]" 1
1664 1 75 PRO HA 1 76 LEU HG . . 4.090 3.847 3.680 4.030 . 0 0 "[ . 1 . 2]" 1
1665 1 75 PRO HB2 1 76 LEU H . . 3.550 2.413 2.237 2.779 . 0 0 "[ . 1 . 2]" 1
1666 1 75 PRO HB3 1 76 LEU H . . 3.740 3.358 3.277 3.541 . 0 0 "[ . 1 . 2]" 1
1667 1 75 PRO QG 1 76 LEU H . . 4.680 4.022 3.890 4.274 . 0 0 "[ . 1 . 2]" 1
1668 1 76 LEU H 1 76 LEU HB3 . . 3.760 3.279 3.182 3.404 . 0 0 "[ . 1 . 2]" 1
1669 1 76 LEU H 1 76 LEU MD1 . . 4.030 3.378 3.160 3.554 . 0 0 "[ . 1 . 2]" 1
1670 1 76 LEU H 1 76 LEU MD2 . . 4.500 3.689 3.504 3.819 . 0 0 "[ . 1 . 2]" 1
1671 1 76 LEU H 1 76 LEU HG . . 3.340 2.237 2.068 2.420 . 0 0 "[ . 1 . 2]" 1
1672 1 76 LEU H 1 77 GLN H . . 4.450 4.396 4.297 4.454 0.004 13 0 "[ . 1 . 2]" 1
1673 1 76 LEU H 1 77 GLN HA . . 5.500 4.753 4.644 4.855 . 0 0 "[ . 1 . 2]" 1
1674 1 76 LEU HA 1 76 LEU MD1 . . 4.120 3.628 3.521 3.694 . 0 0 "[ . 1 . 2]" 1
1675 1 76 LEU HA 1 76 LEU MD2 . . 4.590 4.049 4.025 4.086 . 0 0 "[ . 1 . 2]" 1
1676 1 76 LEU HA 1 77 GLN H . . 2.890 2.314 2.216 2.493 . 0 0 "[ . 1 . 2]" 1
1677 1 76 LEU HA 1 77 GLN QG . . 4.820 3.760 3.231 4.176 . 0 0 "[ . 1 . 2]" 1
1678 1 76 LEU HB2 1 76 LEU MD1 . . 3.630 2.142 2.019 2.223 . 0 0 "[ . 1 . 2]" 1
1679 1 76 LEU HB2 1 77 GLN H . . 3.270 2.667 2.245 2.942 . 0 0 "[ . 1 . 2]" 1
1680 1 76 LEU HB3 1 76 LEU MD2 . . 3.160 2.120 1.997 2.233 . 0 0 "[ . 1 . 2]" 1
1681 1 76 LEU HB3 1 77 GLN H . . 3.990 3.873 3.629 4.006 0.016 15 0 "[ . 1 . 2]" 1
1682 1 76 LEU MD1 1 77 GLN H . . 3.860 3.233 2.704 3.600 . 0 0 "[ . 1 . 2]" 1
1683 1 76 LEU MD1 1 77 GLN HA . . 4.430 3.279 2.999 3.604 . 0 0 "[ . 1 . 2]" 1
1684 1 76 LEU MD1 1 78 PHE H . . 4.770 3.714 3.357 4.190 . 0 0 "[ . 1 . 2]" 1
1685 1 76 LEU MD1 1 78 PHE QB . . 4.110 2.802 2.512 3.359 . 0 0 "[ . 1 . 2]" 1
1686 1 76 LEU MD1 1 78 PHE QD . . 3.400 2.127 1.900 2.592 . 0 0 "[ . 1 . 2]" 1
1687 1 77 GLN H 1 77 GLN QB . . 3.130 2.511 2.277 3.086 . 0 0 "[ . 1 . 2]" 1
1688 1 77 GLN H 1 77 GLN HG2 . . 4.330 3.671 1.900 4.245 . 0 0 "[ . 1 . 2]" 1
1689 1 77 GLN H 1 77 GLN QG . . 3.660 2.882 1.863 3.288 . 0 0 "[ . 1 . 2]" 1
1690 1 77 GLN H 1 77 GLN HG3 . . 4.330 3.237 2.669 4.305 . 0 0 "[ . 1 . 2]" 1
1691 1 77 GLN H 1 78 PHE H . . 4.730 4.432 4.272 4.570 . 0 0 "[ . 1 . 2]" 1
1692 1 77 GLN HA 1 77 GLN HG2 . . 4.100 2.679 2.345 3.610 . 0 0 "[ . 1 . 2]" 1
1693 1 77 GLN HA 1 77 GLN QG . . 3.530 2.533 2.244 3.316 . 0 0 "[ . 1 . 2]" 1
1694 1 77 GLN HA 1 77 GLN HG3 . . 4.100 3.172 2.759 3.871 . 0 0 "[ . 1 . 2]" 1
1695 1 77 GLN HA 1 78 PHE H . . 2.960 2.189 2.141 2.295 . 0 0 "[ . 1 . 2]" 1
1696 1 77 GLN HA 1 78 PHE QD . . 4.220 2.959 2.699 3.183 . 0 0 "[ . 1 . 2]" 1
1697 1 77 GLN QB 1 77 GLN QE . . 4.000 3.120 1.899 3.630 . 0 0 "[ . 1 . 2]" 1
1698 1 77 GLN QB 1 78 PHE H . . 3.560 3.048 2.674 3.317 . 0 0 "[ . 1 . 2]" 1
1699 1 77 GLN QG 1 78 PHE H . . 4.300 3.992 3.642 4.291 . 0 0 "[ . 1 . 2]" 1
1700 1 77 GLN HG2 1 78 PHE H . . 5.040 4.310 3.769 5.036 . 0 0 "[ . 1 . 2]" 1
1701 1 77 GLN HG3 1 78 PHE H . . 5.040 4.863 4.487 5.045 0.005 12 0 "[ . 1 . 2]" 1
1702 1 78 PHE H 1 78 PHE QD . . 3.730 2.346 2.069 2.751 . 0 0 "[ . 1 . 2]" 1
1703 1 78 PHE H 1 78 PHE QE . . 4.150 4.026 3.815 4.152 0.002 3 0 "[ . 1 . 2]" 1
1704 1 78 PHE HA 1 78 PHE QD . . 4.470 3.684 3.654 3.718 . 0 0 "[ . 1 . 2]" 1
1705 1 78 PHE HA 1 79 TYR H . . 3.420 2.177 2.139 2.359 . 0 0 "[ . 1 . 2]" 1
1706 1 78 PHE HA 1 79 TYR QB . . 4.790 4.037 3.980 4.076 . 0 0 "[ . 1 . 2]" 1
1707 1 78 PHE QD 1 79 TYR H . . 4.640 4.324 3.781 4.578 . 0 0 "[ . 1 . 2]" 1
1708 1 78 PHE QD 1 80 VAL MG2 . . 3.110 2.768 2.387 3.079 . 0 0 "[ . 1 . 2]" 1
1709 1 78 PHE QE 1 80 VAL MG2 . . 3.110 2.758 2.377 3.035 . 0 0 "[ . 1 . 2]" 1
1710 1 78 PHE HZ 1 80 VAL MG2 . . 4.800 4.345 4.012 4.554 . 0 0 "[ . 1 . 2]" 1
1711 1 79 TYR H 1 79 TYR HB2 . . 3.790 2.589 2.451 2.720 . 0 0 "[ . 1 . 2]" 1
1712 1 79 TYR H 1 79 TYR QB . . 3.250 2.340 2.283 2.426 . 0 0 "[ . 1 . 2]" 1
1713 1 79 TYR H 1 79 TYR HB3 . . 3.790 2.673 2.616 2.736 . 0 0 "[ . 1 . 2]" 1
1714 1 79 TYR H 1 79 TYR QD . . 4.760 4.242 4.167 4.305 . 0 0 "[ . 1 . 2]" 1
1715 1 79 TYR H 1 80 VAL H . . 5.420 4.547 4.458 4.595 . 0 0 "[ . 1 . 2]" 1
1716 1 79 TYR HA 1 79 TYR QD . . 3.790 2.658 2.383 2.929 . 0 0 "[ . 1 . 2]" 1
1717 1 79 TYR HA 1 79 TYR QE . . 5.080 4.482 4.353 4.613 . 0 0 "[ . 1 . 2]" 1
1718 1 79 TYR HA 1 80 VAL H . . 3.110 2.207 2.158 2.248 . 0 0 "[ . 1 . 2]" 1
1719 1 79 TYR HA 1 80 VAL MG2 . . 4.540 3.569 3.377 3.716 . 0 0 "[ . 1 . 2]" 1
1720 1 79 TYR QB 1 80 VAL H . . 3.940 3.569 3.488 3.690 . 0 0 "[ . 1 . 2]" 1
1721 1 79 TYR HB2 1 80 VAL H . . 4.610 4.196 4.097 4.313 . 0 0 "[ . 1 . 2]" 1
1722 1 79 TYR HB3 1 80 VAL H . . 4.610 3.864 3.768 4.009 . 0 0 "[ . 1 . 2]" 1
1723 1 79 TYR QD 1 80 VAL H . . 4.420 3.359 3.191 3.538 . 0 0 "[ . 1 . 2]" 1
1724 1 79 TYR QD 1 81 ASP H . . 4.990 4.573 4.212 4.964 . 0 0 "[ . 1 . 2]" 1
1725 1 79 TYR QE 1 81 ASP HB2 . . 4.770 4.162 3.017 4.769 . 0 0 "[ . 1 . 2]" 1
1726 1 79 TYR QE 1 81 ASP QB . . 4.000 3.261 2.762 3.993 . 0 0 "[ . 1 . 2]" 1
1727 1 79 TYR QE 1 81 ASP HB3 . . 4.770 3.722 2.831 4.772 0.002 11 0 "[ . 1 . 2]" 1
1728 1 80 VAL H 1 80 VAL HB . . 3.380 2.578 2.503 2.633 . 0 0 "[ . 1 . 2]" 1
1729 1 80 VAL H 1 80 VAL MG1 . . 4.280 3.823 3.781 3.851 . 0 0 "[ . 1 . 2]" 1
1730 1 80 VAL H 1 80 VAL MG2 . . 3.420 2.672 2.425 2.836 . 0 0 "[ . 1 . 2]" 1
1731 1 80 VAL H 1 81 ASP H . . 4.870 4.435 4.271 4.550 . 0 0 "[ . 1 . 2]" 1
1732 1 80 VAL HA 1 80 VAL MG1 . . 3.410 2.371 2.262 2.489 . 0 0 "[ . 1 . 2]" 1
1733 1 80 VAL HA 1 80 VAL MG2 . . 3.410 2.350 2.250 2.462 . 0 0 "[ . 1 . 2]" 1
1734 1 80 VAL HA 1 81 ASP H . . 2.910 2.178 2.140 2.275 . 0 0 "[ . 1 . 2]" 1
1735 1 80 VAL HB 1 81 ASP H . . 4.900 4.104 3.837 4.302 . 0 0 "[ . 1 . 2]" 1
1736 1 80 VAL MG1 1 81 ASP H . . 3.750 2.370 1.917 2.832 . 0 0 "[ . 1 . 2]" 1
1737 1 80 VAL MG2 1 81 ASP H . . 4.110 3.975 3.817 4.092 . 0 0 "[ . 1 . 2]" 1
1738 1 81 ASP H 1 81 ASP HB2 . . 3.950 3.591 2.590 3.862 . 0 0 "[ . 1 . 2]" 1
1739 1 81 ASP H 1 81 ASP HB3 . . 3.950 3.131 2.662 3.765 . 0 0 "[ . 1 . 2]" 1
1740 1 81 ASP HA 1 82 ALA H . . 3.240 2.398 2.201 2.549 . 0 0 "[ . 1 . 2]" 1
1741 1 81 ASP QB 1 82 ALA H . . 3.460 2.621 2.109 3.398 . 0 0 "[ . 1 . 2]" 1
1742 1 81 ASP HB2 1 82 ALA H . . 4.010 2.860 2.130 4.008 . 0 0 "[ . 1 . 2]" 1
1743 1 81 ASP HB3 1 82 ALA H . . 4.010 3.646 2.594 3.942 . 0 0 "[ . 1 . 2]" 1
1744 1 82 ALA H 1 82 ALA MB . . 3.120 2.207 2.110 2.258 . 0 0 "[ . 1 . 2]" 1
1745 1 82 ALA H 1 83 ILE H . . 4.650 4.612 4.521 4.649 . 0 0 "[ . 1 . 2]" 1
1746 1 82 ALA HA 1 83 ILE H . . 2.830 2.250 2.146 2.369 . 0 0 "[ . 1 . 2]" 1
1747 1 82 ALA HA 1 83 ILE HB . . 5.460 4.760 4.662 4.871 . 0 0 "[ . 1 . 2]" 1
1748 1 82 ALA MB 1 83 ILE H . . 3.390 2.766 2.442 3.151 . 0 0 "[ . 1 . 2]" 1
1749 1 83 ILE H 1 83 ILE HB . . 3.160 2.551 2.488 2.679 . 0 0 "[ . 1 . 2]" 1
1750 1 83 ILE H 1 83 ILE MD . . 3.700 3.503 3.161 3.690 . 0 0 "[ . 1 . 2]" 1
1751 1 83 ILE H 1 83 ILE HG12 . . 3.810 3.472 3.173 3.749 . 0 0 "[ . 1 . 2]" 1
1752 1 83 ILE H 1 83 ILE HG13 . . 3.510 2.134 1.923 2.397 . 0 0 "[ . 1 . 2]" 1
1753 1 83 ILE H 1 83 ILE MG . . 3.970 3.771 3.764 3.790 . 0 0 "[ . 1 . 2]" 1
1754 1 83 ILE H 1 84 ASN H . . 4.560 4.003 2.421 4.558 . 0 0 "[ . 1 . 2]" 1
1755 1 83 ILE HA 1 83 ILE MD . . 3.910 3.860 3.825 3.895 . 0 0 "[ . 1 . 2]" 1
1756 1 83 ILE HA 1 83 ILE HG12 . . 3.810 2.607 2.522 2.775 . 0 0 "[ . 1 . 2]" 1
1757 1 83 ILE HA 1 83 ILE HG13 . . 3.880 2.947 2.779 3.045 . 0 0 "[ . 1 . 2]" 1
1758 1 83 ILE HA 1 83 ILE MG . . 3.360 2.387 2.298 2.457 . 0 0 "[ . 1 . 2]" 1
1759 1 83 ILE HB 1 83 ILE MD . . 3.140 2.336 2.234 2.448 . 0 0 "[ . 1 . 2]" 1
1760 1 83 ILE HB 1 84 ASN H . . 4.960 3.949 2.223 4.467 . 0 0 "[ . 1 . 2]" 1
1761 1 83 ILE HG12 1 83 ILE MG . . 3.340 2.269 2.075 2.439 . 0 0 "[ . 1 . 2]" 1
1762 1 83 ILE HG13 1 83 ILE MG . . 3.510 3.188 3.145 3.202 . 0 0 "[ . 1 . 2]" 1
1763 1 83 ILE MG 1 84 ASN H . . 4.750 3.027 2.277 3.653 . 0 0 "[ . 1 . 2]" 1
1764 1 84 ASN HA 1 84 ASN HD21 . . 2.910 2.419 1.984 2.829 . 0 0 "[ . 1 . 2]" 1
1765 1 84 ASN HA 1 84 ASN HD22 . . 3.670 3.557 3.351 3.663 . 0 0 "[ . 1 . 2]" 1
1766 1 86 ARG HB2 1 86 ARG QD . . 3.730 2.710 2.134 3.498 . 0 0 "[ . 1 . 2]" 1
1767 1 86 ARG HB3 1 86 ARG QD . . 3.730 2.531 2.126 3.511 . 0 0 "[ . 1 . 2]" 1
1768 1 87 HIS HA 1 87 HIS HD2 . . 5.150 3.737 2.187 4.865 . 0 0 "[ . 1 . 2]" 1
1769 1 89 GLY QA 1 90 PRO QD . . 2.840 1.975 1.878 2.168 . 0 0 "[ . 1 . 2]" 1
1770 1 92 SER HA 1 93 GLY H . . 3.110 2.280 2.143 2.777 . 0 0 "[ . 1 . 2]" 1
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