NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
522255 |
2lbb   |
17553 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lbb
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 1896
_Distance_constraint_stats_list.Viol_count 1164
_Distance_constraint_stats_list.Viol_total 348.210
_Distance_constraint_stats_list.Viol_max 0.361
_Distance_constraint_stats_list.Viol_rms 0.0130
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0018
_Distance_constraint_stats_list.Viol_average_violations_only 0.0299
_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 9 MET 0.017 0.005 8 0 "[ . 1]"
1 10 SER 0.021 0.005 9 0 "[ . 1]"
1 11 ALA 0.103 0.025 9 0 "[ . 1]"
1 12 ASP 0.170 0.129 9 0 "[ . 1]"
1 13 ASP 0.142 0.031 9 0 "[ . 1]"
1 14 PHE 0.205 0.025 9 0 "[ . 1]"
1 15 ASP 0.162 0.031 9 0 "[ . 1]"
1 16 ALA 1.057 0.216 4 0 "[ . 1]"
1 17 ALA 0.481 0.049 10 0 "[ . 1]"
1 18 VAL 1.111 0.161 5 0 "[ . 1]"
1 19 LYS 2.016 0.361 4 0 "[ . 1]"
1 20 TYR 1.337 0.361 4 0 "[ . 1]"
1 21 VAL 2.574 0.233 5 0 "[ . 1]"
1 22 SER 0.894 0.136 7 0 "[ . 1]"
1 23 ASN 0.833 0.267 7 0 "[ . 1]"
1 24 THR 1.603 0.250 5 0 "[ . 1]"
1 25 THR 0.000 0.000 . 0 "[ . 1]"
1 26 THR 0.620 0.106 5 0 "[ . 1]"
1 27 MET 1.220 0.106 5 0 "[ . 1]"
1 28 MET 0.082 0.028 1 0 "[ . 1]"
1 29 ALA 0.431 0.047 10 0 "[ . 1]"
1 30 SER 0.005 0.005 1 0 "[ . 1]"
1 31 ASN 0.094 0.024 1 0 "[ . 1]"
1 32 ASP 0.009 0.006 3 0 "[ . 1]"
1 33 ASP 0.110 0.023 3 0 "[ . 1]"
1 34 LYS 0.826 0.070 8 0 "[ . 1]"
1 35 LEU 0.585 0.100 1 0 "[ . 1]"
1 36 CYS 0.379 0.046 1 0 "[ . 1]"
1 37 PHE 1.357 0.095 9 0 "[ . 1]"
1 38 TYR 1.087 0.095 9 0 "[ . 1]"
1 39 LYS 0.289 0.028 2 0 "[ . 1]"
1 40 TYR 0.394 0.046 1 0 "[ . 1]"
1 41 TYR 0.111 0.025 6 0 "[ . 1]"
1 42 LYS 0.333 0.025 10 0 "[ . 1]"
1 43 GLN 0.791 0.064 2 0 "[ . 1]"
1 44 ALA 0.584 0.117 2 0 "[ . 1]"
1 45 THR 0.229 0.024 8 0 "[ . 1]"
1 46 VAL 0.047 0.014 5 0 "[ . 1]"
1 47 GLY 0.091 0.024 8 0 "[ . 1]"
1 48 ASP 0.020 0.007 4 0 "[ . 1]"
1 49 CYS 0.161 0.020 10 0 "[ . 1]"
1 50 ASN 0.031 0.013 3 0 "[ . 1]"
1 51 LYS 0.246 0.047 6 0 "[ . 1]"
1 52 PRO 1.106 0.093 9 0 "[ . 1]"
1 53 LYS 1.330 0.093 9 0 "[ . 1]"
1 54 PRO 0.010 0.009 6 0 "[ . 1]"
1 55 GLY 0.714 0.090 10 0 "[ . 1]"
1 56 MET 0.035 0.011 9 0 "[ . 1]"
1 57 LEU 0.408 0.101 3 0 "[ . 1]"
1 58 GLN 2.465 0.224 9 0 "[ . 1]"
1 59 LEU 1.336 0.138 6 0 "[ . 1]"
1 60 GLN 0.849 0.080 1 0 "[ . 1]"
1 61 GLU 3.852 0.320 6 0 "[ . 1]"
1 62 LYS 3.364 0.320 6 0 "[ . 1]"
1 63 TYR 1.168 0.080 10 0 "[ . 1]"
1 64 LYS 0.781 0.219 6 0 "[ . 1]"
1 65 TRP 2.071 0.219 6 0 "[ . 1]"
1 66 GLU 0.674 0.053 6 0 "[ . 1]"
1 67 ALA 0.093 0.022 10 0 "[ . 1]"
1 68 TRP 0.459 0.051 10 0 "[ . 1]"
1 69 ASN 0.275 0.031 4 0 "[ . 1]"
1 70 ALA 0.042 0.016 8 0 "[ . 1]"
1 71 LEU 0.990 0.103 6 0 "[ . 1]"
1 72 ARG 0.192 0.023 5 0 "[ . 1]"
1 73 GLY 0.041 0.020 1 0 "[ . 1]"
1 74 MET 1.389 0.106 8 0 "[ . 1]"
1 75 SER 0.253 0.061 8 0 "[ . 1]"
1 76 THR 0.085 0.041 6 0 "[ . 1]"
1 77 GLU 0.081 0.041 6 0 "[ . 1]"
1 78 SER 0.055 0.012 6 0 "[ . 1]"
1 79 ALA 0.275 0.041 8 0 "[ . 1]"
1 80 LYS 0.133 0.028 8 0 "[ . 1]"
1 81 GLU 0.771 0.345 2 0 "[ . 1]"
1 82 ALA 1.389 0.345 2 0 "[ . 1]"
1 83 TYR 0.221 0.036 5 0 "[ . 1]"
1 84 VAL 0.668 0.054 10 0 "[ . 1]"
1 85 LYS 0.424 0.051 1 0 "[ . 1]"
1 86 LEU 0.321 0.052 5 0 "[ . 1]"
1 87 LEU 2.167 0.073 2 0 "[ . 1]"
1 88 ASP 1.044 0.141 5 0 "[ . 1]"
1 89 THR 0.155 0.057 7 0 "[ . 1]"
1 90 LEU 0.923 0.141 5 0 "[ . 1]"
1 91 ALA 2.341 0.135 1 0 "[ . 1]"
1 92 PRO 0.244 0.034 1 0 "[ . 1]"
1 93 SER 0.000 0.000 . 0 "[ . 1]"
1 94 TRP 5.839 0.157 5 0 "[ . 1]"
1 95 ARG 1.192 0.139 8 0 "[ . 1]"
1 96 ASN 0.179 0.037 10 0 "[ . 1]"
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 9 MET HA 1 10 SER H . . 2.930 2.317 2.232 2.495 . 0 0 "[ . 1]" 1
2 1 9 MET HA 1 11 ALA H . . 4.270 4.076 3.924 4.273 0.003 7 0 "[ . 1]" 1
3 1 9 MET QB 1 10 SER H . . 3.430 2.748 2.435 3.120 . 0 0 "[ . 1]" 1
4 1 9 MET QB 1 11 ALA H . . 3.330 2.490 2.394 2.696 . 0 0 "[ . 1]" 1
5 1 9 MET QB 1 11 ALA HA . . 4.940 4.874 4.729 4.937 . 0 0 "[ . 1]" 1
6 1 9 MET QB 1 11 ALA MB . . 3.290 2.895 2.560 3.058 . 0 0 "[ . 1]" 1
7 1 9 MET HB2 1 10 SER H . . 4.020 3.467 2.688 4.020 0.000 2 0 "[ . 1]" 1
8 1 9 MET HB2 1 11 ALA H . . 4.130 3.249 2.410 4.134 0.004 2 0 "[ . 1]" 1
9 1 9 MET HB3 1 10 SER H . . 4.020 3.225 2.473 3.805 . 0 0 "[ . 1]" 1
10 1 9 MET HB3 1 11 ALA H . . 4.130 3.213 2.410 4.135 0.005 8 0 "[ . 1]" 1
11 1 10 SER H 1 10 SER QB . . 3.290 2.564 2.068 2.928 . 0 0 "[ . 1]" 1
12 1 10 SER H 1 11 ALA H . . 3.970 2.637 2.418 2.818 . 0 0 "[ . 1]" 1
13 1 10 SER H 1 11 ALA MB . . 4.600 4.152 3.576 4.415 . 0 0 "[ . 1]" 1
14 1 10 SER H 1 84 VAL QG . . 5.440 4.306 4.093 4.539 . 0 0 "[ . 1]" 1
15 1 10 SER HA 1 11 ALA H . . 3.560 3.389 2.985 3.539 . 0 0 "[ . 1]" 1
16 1 10 SER HA 1 11 ALA MB . . 5.010 4.922 4.690 5.015 0.005 6 0 "[ . 1]" 1
17 1 10 SER HA 1 12 ASP H . . 3.930 3.858 3.663 3.935 0.005 9 0 "[ . 1]" 1
18 1 10 SER HA 1 13 ASP H . . 3.800 3.063 2.966 3.177 . 0 0 "[ . 1]" 1
19 1 10 SER HA 1 84 VAL QG . . 4.490 2.670 2.345 3.219 . 0 0 "[ . 1]" 1
20 1 10 SER QB 1 11 ALA H . . 4.040 3.166 2.568 3.809 . 0 0 "[ . 1]" 1
21 1 10 SER QB 1 11 ALA MB . . 5.020 4.217 3.839 4.572 . 0 0 "[ . 1]" 1
22 1 10 SER QB 1 13 ASP QB . . 4.630 3.814 3.303 4.335 . 0 0 "[ . 1]" 1
23 1 10 SER QB 1 81 GLU QB . . 4.440 4.131 3.923 4.336 . 0 0 "[ . 1]" 1
24 1 10 SER QB 1 84 VAL HB . . 4.120 2.469 2.203 3.315 . 0 0 "[ . 1]" 1
25 1 10 SER QB 1 84 VAL QG . . 3.460 1.998 1.784 2.638 . 0 0 "[ . 1]" 1
26 1 10 SER QB 1 85 LYS QG . . 5.180 4.206 3.859 4.573 . 0 0 "[ . 1]" 1
27 1 11 ALA H 1 11 ALA MB . . 2.710 2.145 2.042 2.281 . 0 0 "[ . 1]" 1
28 1 11 ALA H 1 12 ASP H . . 3.300 2.551 2.209 2.792 . 0 0 "[ . 1]" 1
29 1 11 ALA H 1 12 ASP QB . . 4.600 4.363 4.036 4.591 . 0 0 "[ . 1]" 1
30 1 11 ALA H 1 13 ASP H . . 4.520 3.871 3.551 4.067 . 0 0 "[ . 1]" 1
31 1 11 ALA H 1 13 ASP QB . . 5.230 4.846 4.653 5.055 . 0 0 "[ . 1]" 1
32 1 11 ALA H 1 14 PHE H . . 5.300 5.077 4.892 5.193 . 0 0 "[ . 1]" 1
33 1 11 ALA H 1 14 PHE HB3 . . 5.500 5.505 5.495 5.525 0.025 9 0 "[ . 1]" 1
34 1 11 ALA HA 1 12 ASP H . . 3.510 3.476 3.429 3.526 0.016 9 0 "[ . 1]" 1
35 1 11 ALA HA 1 13 ASP H . . 4.360 4.308 4.129 4.360 . 0 0 "[ . 1]" 1
36 1 11 ALA HA 1 80 LYS HB2 . . 4.520 2.498 2.301 2.724 . 0 0 "[ . 1]" 1
37 1 11 ALA HA 1 80 LYS HB3 . . 3.360 2.179 2.069 2.341 . 0 0 "[ . 1]" 1
38 1 11 ALA HA 1 80 LYS QD . . 4.470 3.141 2.859 3.545 . 0 0 "[ . 1]" 1
39 1 11 ALA HA 1 80 LYS QE . . 5.070 4.584 3.924 4.863 . 0 0 "[ . 1]" 1
40 1 11 ALA HA 1 80 LYS QG . . 4.990 3.997 3.910 4.076 . 0 0 "[ . 1]" 1
41 1 11 ALA MB 1 12 ASP H . . 3.160 2.864 2.746 2.963 . 0 0 "[ . 1]" 1
42 1 11 ALA MB 1 12 ASP HA . . 4.220 3.889 3.758 3.971 . 0 0 "[ . 1]" 1
43 1 11 ALA MB 1 12 ASP QB . . 4.570 3.695 3.583 3.816 . 0 0 "[ . 1]" 1
44 1 11 ALA MB 1 13 ASP H . . 4.620 4.487 4.372 4.575 . 0 0 "[ . 1]" 1
45 1 11 ALA MB 1 77 GLU H . . 4.990 4.784 4.625 4.966 . 0 0 "[ . 1]" 1
46 1 11 ALA MB 1 77 GLU HA . . 3.520 2.461 2.307 2.633 . 0 0 "[ . 1]" 1
47 1 11 ALA MB 1 77 GLU HB2 . . 5.010 4.197 4.001 4.429 . 0 0 "[ . 1]" 1
48 1 11 ALA MB 1 77 GLU HG2 . . 4.780 3.003 2.522 3.595 . 0 0 "[ . 1]" 1
49 1 11 ALA MB 1 77 GLU QG . . 3.960 2.917 2.496 3.420 . 0 0 "[ . 1]" 1
50 1 11 ALA MB 1 77 GLU HG3 . . 4.780 4.138 3.584 4.372 . 0 0 "[ . 1]" 1
51 1 11 ALA MB 1 80 LYS HB2 . . 3.420 2.642 2.280 2.915 . 0 0 "[ . 1]" 1
52 1 11 ALA MB 1 80 LYS QG . . 4.550 4.119 3.882 4.287 . 0 0 "[ . 1]" 1
53 1 12 ASP H 1 12 ASP HB2 . . 3.320 2.661 2.301 3.449 0.129 9 0 "[ . 1]" 1
54 1 12 ASP H 1 12 ASP QB . . 2.650 2.298 2.127 2.348 . 0 0 "[ . 1]" 1
55 1 12 ASP H 1 12 ASP HB3 . . 3.320 2.673 2.147 3.061 . 0 0 "[ . 1]" 1
56 1 12 ASP H 1 13 ASP HA . . 5.090 4.895 4.865 5.100 0.010 9 0 "[ . 1]" 1
57 1 12 ASP H 1 13 ASP QB . . 4.450 4.122 3.977 4.416 . 0 0 "[ . 1]" 1
58 1 12 ASP H 1 14 PHE HB3 . . 5.300 4.973 4.910 5.032 . 0 0 "[ . 1]" 1
59 1 12 ASP HA 1 14 PHE H . . 3.980 3.568 3.535 3.599 . 0 0 "[ . 1]" 1
60 1 12 ASP HA 1 15 ASP H . . 4.690 4.563 4.503 4.691 0.001 9 0 "[ . 1]" 1
61 1 12 ASP QB 1 13 ASP H . . 3.730 2.982 2.868 3.417 . 0 0 "[ . 1]" 1
62 1 13 ASP H 1 13 ASP QB . . 2.590 2.272 2.161 2.360 . 0 0 "[ . 1]" 1
63 1 13 ASP H 1 14 PHE H . . 2.900 2.480 2.456 2.508 . 0 0 "[ . 1]" 1
64 1 13 ASP H 1 14 PHE HB3 . . 4.460 4.430 4.397 4.461 0.001 5 0 "[ . 1]" 1
65 1 13 ASP H 1 14 PHE QD . . 3.990 3.686 3.648 3.878 . 0 0 "[ . 1]" 1
66 1 13 ASP H 1 15 ASP H . . 4.600 4.608 4.596 4.631 0.031 9 0 "[ . 1]" 1
67 1 13 ASP H 1 84 VAL QG . . 3.920 3.869 3.744 3.927 0.007 5 0 "[ . 1]" 1
68 1 13 ASP HA 1 15 ASP H . . 4.190 3.476 3.391 3.511 . 0 0 "[ . 1]" 1
69 1 13 ASP HA 1 16 ALA H . . 3.720 3.540 3.425 3.584 . 0 0 "[ . 1]" 1
70 1 13 ASP HA 1 16 ALA MB . . 3.740 3.711 3.556 3.747 0.007 1 0 "[ . 1]" 1
71 1 13 ASP HA 1 17 ALA H . . 5.340 5.194 5.131 5.325 . 0 0 "[ . 1]" 1
72 1 13 ASP HA 1 84 VAL QG . . 4.780 4.705 4.519 4.784 0.004 3 0 "[ . 1]" 1
73 1 13 ASP QB 1 16 ALA H . . 4.900 4.293 4.055 4.710 . 0 0 "[ . 1]" 1
74 1 13 ASP QB 1 84 VAL QG . . 2.770 2.693 2.579 2.779 0.009 6 0 "[ . 1]" 1
75 1 13 ASP HB2 1 14 PHE H . . 5.200 3.578 3.451 4.159 . 0 0 "[ . 1]" 1
76 1 13 ASP HB3 1 14 PHE H . . 5.200 4.038 3.470 4.181 . 0 0 "[ . 1]" 1
77 1 14 PHE H 1 14 PHE HB2 . . 3.740 3.554 3.541 3.557 . 0 0 "[ . 1]" 1
78 1 14 PHE H 1 14 PHE HB3 . . 2.860 2.301 2.268 2.307 . 0 0 "[ . 1]" 1
79 1 14 PHE H 1 14 PHE QD . . 3.430 1.957 1.943 2.055 . 0 0 "[ . 1]" 1
80 1 14 PHE H 1 15 ASP H . . 3.130 2.760 2.748 2.768 . 0 0 "[ . 1]" 1
81 1 14 PHE H 1 15 ASP HB2 . . 4.730 4.634 4.588 4.649 . 0 0 "[ . 1]" 1
82 1 14 PHE H 1 16 ALA H . . 4.790 4.721 4.504 4.798 0.008 1 0 "[ . 1]" 1
83 1 14 PHE H 1 17 ALA H . . 5.090 5.016 4.980 5.052 . 0 0 "[ . 1]" 1
84 1 14 PHE H 1 17 ALA MB . . 4.700 4.537 4.430 4.647 . 0 0 "[ . 1]" 1
85 1 14 PHE H 1 18 VAL QG . . 5.440 5.400 5.246 5.445 0.005 3 0 "[ . 1]" 1
86 1 14 PHE H 1 80 LYS HB3 . . 4.100 4.021 3.872 4.109 0.009 7 0 "[ . 1]" 1
87 1 14 PHE H 1 80 LYS QG . . 4.960 4.942 4.856 4.973 0.013 2 0 "[ . 1]" 1
88 1 14 PHE H 1 84 VAL QG . . 3.630 3.541 3.361 3.633 0.003 6 0 "[ . 1]" 1
89 1 14 PHE HA 1 14 PHE QD . . 3.770 3.679 3.675 3.685 . 0 0 "[ . 1]" 1
90 1 14 PHE HA 1 17 ALA H . . 3.680 3.292 3.153 3.372 . 0 0 "[ . 1]" 1
91 1 14 PHE HA 1 17 ALA HA . . 5.500 5.011 4.932 5.172 . 0 0 "[ . 1]" 1
92 1 14 PHE HA 1 17 ALA MB . . 3.420 2.331 2.240 2.447 . 0 0 "[ . 1]" 1
93 1 14 PHE HA 1 84 VAL HA . . 4.930 4.797 4.612 4.915 . 0 0 "[ . 1]" 1
94 1 14 PHE HA 1 84 VAL QG . . 2.910 2.658 2.475 2.794 . 0 0 "[ . 1]" 1
95 1 14 PHE HA 1 87 LEU MD2 . . 5.500 5.184 5.093 5.278 . 0 0 "[ . 1]" 1
96 1 14 PHE HB2 1 15 ASP H . . 4.410 4.056 4.034 4.113 . 0 0 "[ . 1]" 1
97 1 14 PHE HB2 1 18 VAL QG . . 4.480 3.238 3.162 3.309 . 0 0 "[ . 1]" 1
98 1 14 PHE HB2 1 80 LYS HA . . 4.100 3.310 3.082 3.422 . 0 0 "[ . 1]" 1
99 1 14 PHE HB2 1 80 LYS HB2 . . 4.880 4.837 4.672 4.890 0.010 7 0 "[ . 1]" 1
100 1 14 PHE HB2 1 80 LYS HB3 . . 4.070 3.196 2.975 3.284 . 0 0 "[ . 1]" 1
101 1 14 PHE HB2 1 80 LYS HG2 . . 5.000 3.108 2.960 3.240 . 0 0 "[ . 1]" 1
102 1 14 PHE HB2 1 80 LYS QG . . 4.360 3.060 2.924 3.185 . 0 0 "[ . 1]" 1
103 1 14 PHE HB2 1 80 LYS HG3 . . 5.000 4.595 4.514 4.698 . 0 0 "[ . 1]" 1
104 1 14 PHE HB2 1 84 VAL QG . . 3.970 3.886 3.719 3.991 0.021 2 0 "[ . 1]" 1
105 1 14 PHE HB3 1 15 ASP H . . 3.930 3.875 3.867 3.882 . 0 0 "[ . 1]" 1
106 1 14 PHE HB3 1 80 LYS HA . . 4.760 3.542 3.329 3.651 . 0 0 "[ . 1]" 1
107 1 14 PHE HB3 1 80 LYS HB2 . . 4.750 3.896 3.713 3.990 . 0 0 "[ . 1]" 1
108 1 14 PHE HB3 1 80 LYS HB3 . . 4.260 2.152 1.992 2.244 . 0 0 "[ . 1]" 1
109 1 14 PHE HB3 1 84 VAL QG . . 3.960 3.486 3.331 3.609 . 0 0 "[ . 1]" 1
110 1 14 PHE QD 1 15 ASP H . . 3.340 2.375 2.329 2.430 . 0 0 "[ . 1]" 1
111 1 14 PHE QD 1 15 ASP HA . . 4.280 4.003 3.982 4.017 . 0 0 "[ . 1]" 1
112 1 14 PHE QD 1 16 ALA H . . 5.440 4.990 4.857 5.079 . 0 0 "[ . 1]" 1
113 1 14 PHE QD 1 18 VAL H . . 5.130 4.847 4.699 5.094 . 0 0 "[ . 1]" 1
114 1 14 PHE QD 1 18 VAL MG1 . . 5.050 4.840 4.644 4.953 . 0 0 "[ . 1]" 1
115 1 14 PHE QD 1 18 VAL QG . . 3.780 2.711 2.577 2.793 . 0 0 "[ . 1]" 1
116 1 14 PHE QD 1 18 VAL MG2 . . 5.050 2.725 2.590 2.808 . 0 0 "[ . 1]" 1
117 1 14 PHE QD 1 44 ALA MB . . 4.360 3.887 3.630 4.058 . 0 0 "[ . 1]" 1
118 1 14 PHE QD 1 80 LYS HA . . 4.440 4.173 4.046 4.277 . 0 0 "[ . 1]" 1
119 1 14 PHE QD 1 80 LYS HB3 . . 4.770 3.781 3.658 3.933 . 0 0 "[ . 1]" 1
120 1 14 PHE QD 1 80 LYS QE . . 4.010 3.066 3.020 3.100 . 0 0 "[ . 1]" 1
121 1 14 PHE QD 1 80 LYS HG2 . . 4.970 2.781 2.667 2.872 . 0 0 "[ . 1]" 1
122 1 14 PHE QD 1 80 LYS QG . . 4.190 2.745 2.635 2.834 . 0 0 "[ . 1]" 1
123 1 14 PHE QD 1 80 LYS HG3 . . 4.970 4.235 4.105 4.345 . 0 0 "[ . 1]" 1
124 1 15 ASP H 1 15 ASP HB2 . . 2.760 2.162 2.119 2.178 . 0 0 "[ . 1]" 1
125 1 15 ASP H 1 15 ASP HB3 . . 3.490 3.475 3.429 3.489 . 0 0 "[ . 1]" 1
126 1 15 ASP H 1 16 ALA H . . 3.000 2.884 2.762 2.943 . 0 0 "[ . 1]" 1
127 1 15 ASP H 1 16 ALA MB . . 4.670 4.457 4.405 4.505 . 0 0 "[ . 1]" 1
128 1 15 ASP H 1 18 VAL QG . . 4.340 4.299 4.141 4.363 0.023 7 0 "[ . 1]" 1
129 1 15 ASP H 1 80 LYS QE . . 5.340 5.255 5.143 5.341 0.001 9 0 "[ . 1]" 1
130 1 15 ASP HA 1 16 ALA MB . . 5.140 5.032 5.018 5.046 . 0 0 "[ . 1]" 1
131 1 15 ASP HA 1 18 VAL H . . 4.280 3.571 3.466 3.686 . 0 0 "[ . 1]" 1
132 1 15 ASP HA 1 18 VAL HB . . 4.170 3.428 3.228 3.600 . 0 0 "[ . 1]" 1
133 1 15 ASP HA 1 18 VAL MG1 . . 4.920 4.762 4.569 4.946 0.026 5 0 "[ . 1]" 1
134 1 15 ASP HA 1 18 VAL QG . . 3.460 2.972 2.766 3.127 . 0 0 "[ . 1]" 1
135 1 15 ASP HA 1 18 VAL MG2 . . 4.920 3.003 2.788 3.162 . 0 0 "[ . 1]" 1
136 1 15 ASP HA 1 19 LYS H . . 4.510 4.322 4.094 4.529 0.019 4 0 "[ . 1]" 1
137 1 15 ASP HB2 1 16 ALA H . . 3.120 2.703 2.625 2.909 . 0 0 "[ . 1]" 1
138 1 15 ASP HB2 1 16 ALA MB . . 4.390 4.197 4.101 4.306 . 0 0 "[ . 1]" 1
139 1 15 ASP HB2 1 17 ALA H . . 4.940 4.736 4.666 4.899 . 0 0 "[ . 1]" 1
140 1 15 ASP HB3 1 16 ALA H . . 3.240 2.929 2.804 3.173 . 0 0 "[ . 1]" 1
141 1 15 ASP HB3 1 16 ALA HA . . 4.400 3.921 3.877 4.017 . 0 0 "[ . 1]" 1
142 1 15 ASP HB3 1 16 ALA MB . . 4.350 4.118 4.040 4.197 . 0 0 "[ . 1]" 1
143 1 15 ASP HB3 1 17 ALA H . . 4.870 4.792 4.717 4.876 0.006 2 0 "[ . 1]" 1
144 1 15 ASP HB3 1 18 VAL QG . . 5.350 5.144 4.970 5.287 . 0 0 "[ . 1]" 1
145 1 15 ASP HB3 1 19 LYS QG . . 4.860 4.171 3.884 4.639 . 0 0 "[ . 1]" 1
146 1 16 ALA H 1 16 ALA MB . . 2.520 2.099 2.027 2.215 . 0 0 "[ . 1]" 1
147 1 16 ALA H 1 17 ALA H . . 2.820 2.611 2.516 2.679 . 0 0 "[ . 1]" 1
148 1 16 ALA H 1 17 ALA MB . . 4.330 4.201 4.076 4.282 . 0 0 "[ . 1]" 1
149 1 16 ALA H 1 18 VAL QG . . 5.160 5.037 4.915 5.140 . 0 0 "[ . 1]" 1
150 1 16 ALA H 1 19 LYS H . . 5.180 4.972 4.825 5.097 . 0 0 "[ . 1]" 1
151 1 16 ALA H 1 19 LYS QG . . 5.340 4.902 4.210 5.163 . 0 0 "[ . 1]" 1
152 1 16 ALA H 1 94 TRP HE3 . . 5.500 5.442 5.298 5.529 0.029 5 0 "[ . 1]" 1
153 1 16 ALA HA 1 17 ALA MB . . 5.050 4.939 4.896 4.961 . 0 0 "[ . 1]" 1
154 1 16 ALA HA 1 18 VAL QG . . 5.440 5.460 5.363 5.515 0.075 7 0 "[ . 1]" 1
155 1 16 ALA HA 1 19 LYS H . . 4.070 3.649 3.579 3.696 . 0 0 "[ . 1]" 1
156 1 16 ALA HA 1 19 LYS QB . . 3.460 2.812 2.360 3.676 0.216 4 0 "[ . 1]" 1
157 1 16 ALA HA 1 20 TYR HB2 . . 5.220 4.914 4.632 5.244 0.024 7 0 "[ . 1]" 1
158 1 16 ALA HA 1 94 TRP HE3 . . 4.570 4.587 4.577 4.597 0.027 6 0 "[ . 1]" 1
159 1 16 ALA MB 1 17 ALA H . . 3.190 3.075 2.949 3.186 . 0 0 "[ . 1]" 1
160 1 16 ALA MB 1 17 ALA HA . . 4.560 3.921 3.836 4.009 . 0 0 "[ . 1]" 1
161 1 16 ALA MB 1 19 LYS H . . 5.220 4.787 4.745 4.840 . 0 0 "[ . 1]" 1
162 1 16 ALA MB 1 20 TYR HB2 . . 4.740 4.503 4.204 4.769 0.029 4 0 "[ . 1]" 1
163 1 16 ALA MB 1 87 LEU MD2 . . 4.900 4.760 4.613 4.839 . 0 0 "[ . 1]" 1
164 1 16 ALA MB 1 94 TRP HE3 . . 3.380 2.614 2.446 2.827 . 0 0 "[ . 1]" 1
165 1 17 ALA H 1 17 ALA MB . . 2.660 2.200 2.155 2.269 . 0 0 "[ . 1]" 1
166 1 17 ALA H 1 18 VAL H . . 2.960 2.470 2.228 2.557 . 0 0 "[ . 1]" 1
167 1 17 ALA H 1 18 VAL HA . . 5.150 5.107 4.922 5.169 0.019 7 0 "[ . 1]" 1
168 1 17 ALA H 1 18 VAL HB . . 5.050 4.769 4.511 4.938 . 0 0 "[ . 1]" 1
169 1 17 ALA H 1 18 VAL QG . . 3.830 3.795 3.693 3.834 0.004 7 0 "[ . 1]" 1
170 1 17 ALA H 1 19 LYS H . . 3.880 3.700 3.627 3.753 . 0 0 "[ . 1]" 1
171 1 17 ALA H 1 19 LYS QG . . 5.340 4.989 3.659 5.362 0.022 7 0 "[ . 1]" 1
172 1 17 ALA H 1 87 LEU MD2 . . 4.500 4.294 4.210 4.352 . 0 0 "[ . 1]" 1
173 1 17 ALA HA 1 18 VAL HA . . 4.940 4.767 4.720 4.790 . 0 0 "[ . 1]" 1
174 1 17 ALA HA 1 20 TYR H . . 3.910 3.570 3.402 3.949 0.039 7 0 "[ . 1]" 1
175 1 17 ALA HA 1 21 VAL MG2 . . 4.580 4.000 3.876 4.074 . 0 0 "[ . 1]" 1
176 1 17 ALA HA 1 83 TYR QE . . 4.900 3.960 3.783 4.334 . 0 0 "[ . 1]" 1
177 1 17 ALA HA 1 87 LEU HB3 . . 5.150 4.889 4.725 4.993 . 0 0 "[ . 1]" 1
178 1 17 ALA HA 1 87 LEU MD1 . . 4.830 4.387 4.292 4.473 . 0 0 "[ . 1]" 1
179 1 17 ALA HA 1 87 LEU MD2 . . 3.400 2.134 2.063 2.193 . 0 0 "[ . 1]" 1
180 1 17 ALA HA 1 94 TRP HB2 . . 4.980 4.573 4.428 4.795 . 0 0 "[ . 1]" 1
181 1 17 ALA HA 1 94 TRP HE3 . . 4.210 2.985 2.830 3.191 . 0 0 "[ . 1]" 1
182 1 17 ALA MB 1 18 VAL H . . 3.060 2.457 2.323 2.786 . 0 0 "[ . 1]" 1
183 1 17 ALA MB 1 18 VAL HA . . 4.510 3.709 3.674 3.808 . 0 0 "[ . 1]" 1
184 1 17 ALA MB 1 18 VAL QG . . 3.890 2.903 2.740 3.059 . 0 0 "[ . 1]" 1
185 1 17 ALA MB 1 19 LYS H . . 4.450 4.311 4.184 4.458 0.008 10 0 "[ . 1]" 1
186 1 17 ALA MB 1 20 TYR HB2 . . 5.500 4.986 4.719 5.511 0.011 7 0 "[ . 1]" 1
187 1 17 ALA MB 1 21 VAL H . . 5.250 4.935 4.854 5.122 . 0 0 "[ . 1]" 1
188 1 17 ALA MB 1 21 VAL MG1 . . 5.500 5.529 5.491 5.549 0.049 10 0 "[ . 1]" 1
189 1 17 ALA MB 1 21 VAL MG2 . . 4.120 3.703 3.641 3.772 . 0 0 "[ . 1]" 1
190 1 17 ALA MB 1 83 TYR HB3 . . 4.220 3.076 2.658 3.251 . 0 0 "[ . 1]" 1
191 1 17 ALA MB 1 83 TYR QE . . 3.390 2.788 2.598 3.191 . 0 0 "[ . 1]" 1
192 1 17 ALA MB 1 84 VAL HA . . 3.880 3.083 2.872 3.275 . 0 0 "[ . 1]" 1
193 1 17 ALA MB 1 87 LEU HB3 . . 3.680 3.398 3.283 3.481 . 0 0 "[ . 1]" 1
194 1 17 ALA MB 1 87 LEU MD1 . . 4.340 4.062 3.985 4.155 . 0 0 "[ . 1]" 1
195 1 17 ALA MB 1 87 LEU MD2 . . 3.100 1.871 1.848 1.922 . 0 0 "[ . 1]" 1
196 1 17 ALA MB 1 87 LEU HG . . 4.310 4.168 4.113 4.284 . 0 0 "[ . 1]" 1
197 1 17 ALA MB 1 94 TRP HE3 . . 4.140 3.967 3.816 4.166 0.026 2 0 "[ . 1]" 1
198 1 18 VAL H 1 18 VAL HB . . 2.830 2.653 2.540 2.718 . 0 0 "[ . 1]" 1
199 1 18 VAL H 1 18 VAL MG1 . . 3.980 3.761 3.756 3.778 . 0 0 "[ . 1]" 1
200 1 18 VAL H 1 18 VAL QG . . 2.690 2.119 2.028 2.332 . 0 0 "[ . 1]" 1
201 1 18 VAL H 1 18 VAL MG2 . . 3.980 2.131 2.036 2.354 . 0 0 "[ . 1]" 1
202 1 18 VAL H 1 19 LYS H . . 3.060 2.590 2.421 2.644 . 0 0 "[ . 1]" 1
203 1 18 VAL H 1 19 LYS QB . . 4.880 4.514 4.247 4.784 . 0 0 "[ . 1]" 1
204 1 18 VAL H 1 21 VAL MG2 . . 5.500 4.898 4.720 4.990 . 0 0 "[ . 1]" 1
205 1 18 VAL H 1 87 LEU MD2 . . 4.490 4.336 4.270 4.376 . 0 0 "[ . 1]" 1
206 1 18 VAL HA 1 18 VAL MG1 . . 3.360 2.318 2.199 2.374 . 0 0 "[ . 1]" 1
207 1 18 VAL HA 1 18 VAL QG . . 2.940 2.093 2.031 2.128 . 0 0 "[ . 1]" 1
208 1 18 VAL HA 1 18 VAL MG2 . . 3.360 2.386 2.305 2.457 . 0 0 "[ . 1]" 1
209 1 18 VAL HA 1 21 VAL H . . 3.590 3.461 3.365 3.623 0.033 7 0 "[ . 1]" 1
210 1 18 VAL HA 1 21 VAL HB . . 3.800 2.760 2.542 2.878 . 0 0 "[ . 1]" 1
211 1 18 VAL HA 1 21 VAL MG1 . . 4.160 4.066 3.748 4.178 0.018 8 0 "[ . 1]" 1
212 1 18 VAL HA 1 21 VAL MG2 . . 4.020 3.510 3.280 3.639 . 0 0 "[ . 1]" 1
213 1 18 VAL HA 1 41 TYR QD . . 5.500 4.704 4.351 4.957 . 0 0 "[ . 1]" 1
214 1 18 VAL HA 1 83 TYR QE . . 4.200 2.723 2.591 2.848 . 0 0 "[ . 1]" 1
215 1 18 VAL HA 1 87 LEU MD1 . . 5.500 5.463 5.307 5.518 0.018 1 0 "[ . 1]" 1
216 1 18 VAL HB 1 19 LYS H . . 2.980 2.872 2.812 2.972 . 0 0 "[ . 1]" 1
217 1 18 VAL HB 1 21 VAL H . . 5.500 5.492 5.429 5.661 0.161 5 0 "[ . 1]" 1
218 1 18 VAL QG 1 19 LYS H . . 3.530 3.384 3.358 3.424 . 0 0 "[ . 1]" 1
219 1 18 VAL QG 1 19 LYS QB . . 5.210 4.496 4.297 4.556 . 0 0 "[ . 1]" 1
220 1 18 VAL QG 1 20 TYR H . . 5.440 4.696 4.506 5.142 . 0 0 "[ . 1]" 1
221 1 18 VAL QG 1 21 VAL H . . 4.570 4.280 4.214 4.374 . 0 0 "[ . 1]" 1
222 1 18 VAL QG 1 21 VAL HB . . 4.010 3.658 3.482 3.815 . 0 0 "[ . 1]" 1
223 1 18 VAL QG 1 22 SER H . . 4.040 3.696 3.584 3.755 . 0 0 "[ . 1]" 1
224 1 18 VAL QG 1 22 SER HA . . 5.440 4.506 4.405 4.617 . 0 0 "[ . 1]" 1
225 1 18 VAL QG 1 22 SER QB . . 3.860 2.715 2.466 3.304 . 0 0 "[ . 1]" 1
226 1 18 VAL QG 1 37 PHE QB . . 5.280 4.601 4.187 4.817 . 0 0 "[ . 1]" 1
227 1 18 VAL QG 1 41 TYR HA . . 5.250 4.032 3.758 4.312 . 0 0 "[ . 1]" 1
228 1 18 VAL QG 1 41 TYR QB . . 4.380 3.434 3.061 3.824 . 0 0 "[ . 1]" 1
229 1 18 VAL QG 1 41 TYR QD . . 2.850 2.124 1.883 2.423 . 0 0 "[ . 1]" 1
230 1 18 VAL QG 1 41 TYR QE . . 3.330 2.108 1.947 2.408 . 0 0 "[ . 1]" 1
231 1 18 VAL QG 1 87 LEU MD2 . . 4.920 4.465 4.309 4.530 . 0 0 "[ . 1]" 1
232 1 18 VAL MG1 1 19 LYS H . . 4.090 3.803 3.735 3.909 . 0 0 "[ . 1]" 1
233 1 18 VAL MG1 1 21 VAL HB . . 5.500 3.834 3.619 4.018 . 0 0 "[ . 1]" 1
234 1 18 VAL MG1 1 22 SER H . . 5.500 3.754 3.631 3.821 . 0 0 "[ . 1]" 1
235 1 18 VAL MG1 1 41 TYR QD . . 3.390 2.263 1.978 2.654 . 0 0 "[ . 1]" 1
236 1 18 VAL MG1 1 41 TYR QE . . 4.120 2.135 1.963 2.452 . 0 0 "[ . 1]" 1
237 1 18 VAL MG2 1 19 LYS H . . 4.090 3.797 3.698 3.918 . 0 0 "[ . 1]" 1
238 1 18 VAL MG2 1 21 VAL HB . . 5.500 4.632 4.528 4.752 . 0 0 "[ . 1]" 1
239 1 18 VAL MG2 1 22 SER H . . 5.500 5.529 5.509 5.636 0.136 7 0 "[ . 1]" 1
240 1 18 VAL MG2 1 41 TYR QD . . 3.390 2.617 2.344 3.252 . 0 0 "[ . 1]" 1
241 1 18 VAL MG2 1 41 TYR QE . . 4.120 3.322 2.960 3.702 . 0 0 "[ . 1]" 1
242 1 19 LYS H 1 19 LYS QB . . 2.650 2.288 2.095 2.646 . 0 0 "[ . 1]" 1
243 1 19 LYS H 1 19 LYS QD . . 4.900 4.149 3.677 4.495 . 0 0 "[ . 1]" 1
244 1 19 LYS H 1 19 LYS HG2 . . 4.020 2.944 2.712 3.312 . 0 0 "[ . 1]" 1
245 1 19 LYS H 1 19 LYS QG . . 3.280 2.632 1.871 3.107 . 0 0 "[ . 1]" 1
246 1 19 LYS H 1 19 LYS HG3 . . 4.020 3.365 1.890 4.026 0.006 5 0 "[ . 1]" 1
247 1 19 LYS H 1 20 TYR H . . 2.980 2.563 2.471 2.875 . 0 0 "[ . 1]" 1
248 1 19 LYS H 1 20 TYR HB2 . . 5.080 4.650 4.518 4.959 . 0 0 "[ . 1]" 1
249 1 19 LYS H 1 20 TYR HB3 . . 5.320 5.108 5.068 5.167 . 0 0 "[ . 1]" 1
250 1 19 LYS H 1 21 VAL H . . 3.990 3.898 3.769 4.139 0.149 5 0 "[ . 1]" 1
251 1 19 LYS H 1 21 VAL MG2 . . 5.500 5.226 4.905 5.368 . 0 0 "[ . 1]" 1
252 1 19 LYS H 1 22 SER H . . 4.810 4.492 4.395 4.555 . 0 0 "[ . 1]" 1
253 1 19 LYS H 1 87 LEU MD2 . . 5.120 5.019 4.793 5.117 . 0 0 "[ . 1]" 1
254 1 19 LYS HA 1 19 LYS HG2 . . 3.990 2.851 2.235 4.155 0.165 4 0 "[ . 1]" 1
255 1 19 LYS HA 1 19 LYS QG . . 3.490 2.660 2.212 3.376 . 0 0 "[ . 1]" 1
256 1 19 LYS HA 1 19 LYS HG3 . . 3.990 3.635 3.539 3.705 . 0 0 "[ . 1]" 1
257 1 19 LYS HA 1 23 ASN H . . 4.420 3.682 3.367 4.436 0.016 5 0 "[ . 1]" 1
258 1 19 LYS HA 1 23 ASN HD21 . . 4.000 3.707 3.461 3.891 . 0 0 "[ . 1]" 1
259 1 19 LYS HA 1 23 ASN QD . . 3.500 3.181 2.968 3.512 0.012 7 0 "[ . 1]" 1
260 1 19 LYS HA 1 23 ASN HD22 . . 4.000 3.511 3.146 4.162 0.162 7 0 "[ . 1]" 1
261 1 19 LYS QB 1 19 LYS QE . . 3.640 3.267 2.216 3.641 0.001 6 0 "[ . 1]" 1
262 1 19 LYS QB 1 20 TYR H . . 2.880 2.845 2.292 3.241 0.361 4 0 "[ . 1]" 1
263 1 19 LYS QB 1 20 TYR HA . . 5.180 3.942 3.650 4.175 . 0 0 "[ . 1]" 1
264 1 19 LYS QB 1 20 TYR HB2 . . 4.770 4.176 3.860 4.733 . 0 0 "[ . 1]" 1
265 1 19 LYS QB 1 23 ASN QD . . 4.190 2.532 2.211 3.122 . 0 0 "[ . 1]" 1
266 1 19 LYS QD 1 19 LYS QE . . 2.360 2.050 2.011 2.090 . 0 0 "[ . 1]" 1
267 1 19 LYS QD 1 22 SER H . . 5.340 5.281 5.128 5.348 0.008 1 0 "[ . 1]" 1
268 1 19 LYS QD 1 23 ASN QB . . 4.560 4.291 3.742 4.455 . 0 0 "[ . 1]" 1
269 1 19 LYS QD 1 23 ASN QD . . 4.120 2.243 1.899 2.815 . 0 0 "[ . 1]" 1
270 1 19 LYS QE 1 19 LYS QG . . 3.120 2.097 1.987 2.222 . 0 0 "[ . 1]" 1
271 1 19 LYS QE 1 23 ASN QD . . 4.200 3.510 2.063 4.081 . 0 0 "[ . 1]" 1
272 1 19 LYS QG 1 20 TYR H . . 4.440 3.849 1.877 4.404 . 0 0 "[ . 1]" 1
273 1 19 LYS QG 1 23 ASN QD . . 4.050 3.887 3.596 4.087 0.037 5 0 "[ . 1]" 1
274 1 19 LYS HG2 1 20 TYR H . . 5.190 4.479 3.513 4.820 . 0 0 "[ . 1]" 1
275 1 19 LYS HG2 1 23 ASN HD21 . . 5.250 5.155 4.719 5.255 0.005 8 0 "[ . 1]" 1
276 1 19 LYS HG2 1 23 ASN HD22 . . 5.250 4.774 4.317 5.265 0.015 7 0 "[ . 1]" 1
277 1 19 LYS HG3 1 20 TYR H . . 5.190 4.440 1.885 5.192 0.002 1 0 "[ . 1]" 1
278 1 19 LYS HG3 1 23 ASN HD21 . . 5.250 5.059 4.883 5.176 . 0 0 "[ . 1]" 1
279 1 19 LYS HG3 1 23 ASN HD22 . . 5.250 4.812 4.213 5.271 0.021 7 0 "[ . 1]" 1
280 1 20 TYR H 1 20 TYR HB2 . . 2.720 2.329 2.249 2.408 . 0 0 "[ . 1]" 1
281 1 20 TYR H 1 20 TYR HB3 . . 2.810 2.805 2.674 2.852 0.042 4 0 "[ . 1]" 1
282 1 20 TYR H 1 20 TYR QD . . 4.310 4.129 4.042 4.175 . 0 0 "[ . 1]" 1
283 1 20 TYR H 1 21 VAL H . . 3.030 2.504 2.362 2.768 . 0 0 "[ . 1]" 1
284 1 20 TYR H 1 21 VAL HA . . 5.350 5.158 5.046 5.366 0.016 7 0 "[ . 1]" 1
285 1 20 TYR H 1 21 VAL MG2 . . 4.700 4.255 4.139 4.473 . 0 0 "[ . 1]" 1
286 1 20 TYR H 1 23 ASN H . . 4.850 4.673 4.576 4.754 . 0 0 "[ . 1]" 1
287 1 20 TYR H 1 87 LEU MD2 . . 4.330 3.960 3.854 4.230 . 0 0 "[ . 1]" 1
288 1 20 TYR H 1 94 TRP HE3 . . 5.330 4.877 4.651 5.078 . 0 0 "[ . 1]" 1
289 1 20 TYR HA 1 20 TYR QD . . 3.480 3.061 3.008 3.081 . 0 0 "[ . 1]" 1
290 1 20 TYR HA 1 21 VAL HA . . 5.120 4.654 4.633 4.771 . 0 0 "[ . 1]" 1
291 1 20 TYR HA 1 21 VAL MG2 . . 5.360 4.909 4.865 5.088 . 0 0 "[ . 1]" 1
292 1 20 TYR HA 1 23 ASN H . . 4.030 3.814 3.460 3.962 . 0 0 "[ . 1]" 1
293 1 20 TYR HA 1 23 ASN QB . . 3.900 3.422 2.909 4.167 0.267 7 0 "[ . 1]" 1
294 1 20 TYR HA 1 23 ASN QD . . 4.530 3.639 1.933 4.060 . 0 0 "[ . 1]" 1
295 1 20 TYR HA 1 24 THR H . . 4.750 3.545 3.254 4.677 . 0 0 "[ . 1]" 1
296 1 20 TYR HA 1 87 LEU MD2 . . 5.500 4.989 4.835 5.429 . 0 0 "[ . 1]" 1
297 1 20 TYR HB2 1 21 VAL H . . 4.160 3.827 3.716 3.873 . 0 0 "[ . 1]" 1
298 1 20 TYR HB2 1 87 LEU MD2 . . 4.340 3.477 3.266 4.040 . 0 0 "[ . 1]" 1
299 1 20 TYR HB2 1 91 ALA MB . . 5.500 5.121 4.949 5.418 . 0 0 "[ . 1]" 1
300 1 20 TYR HB2 1 94 TRP HB2 . . 4.690 3.437 3.248 3.595 . 0 0 "[ . 1]" 1
301 1 20 TYR HB3 1 21 VAL H . . 3.290 2.960 2.510 3.047 . 0 0 "[ . 1]" 1
302 1 20 TYR HB3 1 21 VAL HB . . 4.850 4.789 4.725 4.862 0.012 7 0 "[ . 1]" 1
303 1 20 TYR HB3 1 22 SER H . . 5.410 5.099 4.875 5.185 . 0 0 "[ . 1]" 1
304 1 20 TYR HB3 1 87 LEU MD2 . . 4.340 2.355 2.158 2.860 . 0 0 "[ . 1]" 1
305 1 20 TYR HB3 1 91 ALA MB . . 5.140 4.129 3.986 4.443 . 0 0 "[ . 1]" 1
306 1 20 TYR HB3 1 94 TRP HB2 . . 4.850 4.057 3.896 4.185 . 0 0 "[ . 1]" 1
307 1 20 TYR QD 1 21 VAL H . . 4.390 4.180 3.633 4.265 . 0 0 "[ . 1]" 1
308 1 20 TYR QD 1 21 VAL HA . . 3.750 3.660 3.241 3.736 . 0 0 "[ . 1]" 1
309 1 20 TYR QD 1 21 VAL MG1 . . 5.500 5.320 4.972 5.388 . 0 0 "[ . 1]" 1
310 1 20 TYR QD 1 21 VAL MG2 . . 3.700 3.524 3.208 3.609 . 0 0 "[ . 1]" 1
311 1 20 TYR QD 1 24 THR H . . 5.080 4.579 4.428 5.010 . 0 0 "[ . 1]" 1
312 1 20 TYR QD 1 24 THR MG . . 4.160 2.830 2.662 3.421 . 0 0 "[ . 1]" 1
313 1 20 TYR QD 1 27 MET HB3 . . 5.140 5.015 4.781 5.170 0.030 5 0 "[ . 1]" 1
314 1 20 TYR QD 1 27 MET ME . . 4.470 4.086 3.863 4.489 0.019 5 0 "[ . 1]" 1
315 1 20 TYR QD 1 87 LEU MD1 . . 3.530 3.294 3.168 3.364 . 0 0 "[ . 1]" 1
316 1 20 TYR QD 1 87 LEU MD2 . . 3.790 3.713 3.635 3.791 0.001 4 0 "[ . 1]" 1
317 1 20 TYR QD 1 87 LEU HG . . 5.380 4.996 4.876 5.241 . 0 0 "[ . 1]" 1
318 1 20 TYR QD 1 91 ALA MB . . 4.650 2.741 2.541 3.018 . 0 0 "[ . 1]" 1
319 1 21 VAL H 1 21 VAL HB . . 2.820 2.418 2.392 2.431 . 0 0 "[ . 1]" 1
320 1 21 VAL H 1 21 VAL MG1 . . 3.770 3.748 3.739 3.758 . 0 0 "[ . 1]" 1
321 1 21 VAL H 1 21 VAL MG2 . . 3.140 2.682 2.428 2.761 . 0 0 "[ . 1]" 1
322 1 21 VAL H 1 22 SER H . . 3.060 2.268 2.205 2.601 . 0 0 "[ . 1]" 1
323 1 21 VAL H 1 23 ASN H . . 4.430 3.788 3.716 3.896 . 0 0 "[ . 1]" 1
324 1 21 VAL H 1 24 THR H . . 5.120 4.387 4.198 4.881 . 0 0 "[ . 1]" 1
325 1 21 VAL H 1 24 THR MG . . 5.430 5.452 5.393 5.663 0.233 5 0 "[ . 1]" 1
326 1 21 VAL H 1 83 TYR QE . . 4.560 3.989 3.778 4.143 . 0 0 "[ . 1]" 1
327 1 21 VAL H 1 87 LEU MD1 . . 4.750 4.206 4.028 4.276 . 0 0 "[ . 1]" 1
328 1 21 VAL H 1 87 LEU MD2 . . 4.050 3.673 3.397 3.751 . 0 0 "[ . 1]" 1
329 1 21 VAL HA 1 21 VAL MG1 . . 3.250 2.409 2.394 2.422 . 0 0 "[ . 1]" 1
330 1 21 VAL HA 1 21 VAL MG2 . . 3.020 2.188 2.172 2.200 . 0 0 "[ . 1]" 1
331 1 21 VAL HA 1 22 SER HA . . 5.500 4.718 4.694 4.734 . 0 0 "[ . 1]" 1
332 1 21 VAL HA 1 23 ASN H . . 4.630 4.349 3.933 4.490 . 0 0 "[ . 1]" 1
333 1 21 VAL HA 1 24 THR H . . 3.850 3.704 3.356 3.854 0.004 10 0 "[ . 1]" 1
334 1 21 VAL HA 1 24 THR HB . . 4.570 4.175 2.471 4.418 . 0 0 "[ . 1]" 1
335 1 21 VAL HA 1 24 THR MG . . 3.810 3.765 3.662 3.818 0.008 1 0 "[ . 1]" 1
336 1 21 VAL HA 1 27 MET ME . . 3.440 2.962 2.808 3.198 . 0 0 "[ . 1]" 1
337 1 21 VAL HA 1 83 TYR QE . . 5.250 5.174 4.962 5.286 0.036 5 0 "[ . 1]" 1
338 1 21 VAL HA 1 87 LEU MD1 . . 4.030 3.759 3.709 3.816 . 0 0 "[ . 1]" 1
339 1 21 VAL HA 1 87 LEU MD2 . . 4.800 4.547 4.470 4.616 . 0 0 "[ . 1]" 1
340 1 21 VAL HB 1 22 SER H . . 3.120 2.853 2.746 2.923 . 0 0 "[ . 1]" 1
341 1 21 VAL HB 1 22 SER QB . . 4.600 4.219 4.096 4.579 . 0 0 "[ . 1]" 1
342 1 21 VAL HB 1 23 ASN H . . 5.160 5.093 4.861 5.165 0.005 8 0 "[ . 1]" 1
343 1 21 VAL HB 1 37 PHE QB . . 5.120 4.259 4.130 4.448 . 0 0 "[ . 1]" 1
344 1 21 VAL MG1 1 22 SER H . . 3.500 3.488 3.421 3.525 0.025 1 0 "[ . 1]" 1
345 1 21 VAL MG1 1 22 SER HA . . 4.280 3.450 3.385 3.485 . 0 0 "[ . 1]" 1
346 1 21 VAL MG1 1 23 ASN H . . 5.020 4.963 4.677 5.032 0.012 6 0 "[ . 1]" 1
347 1 21 VAL MG1 1 24 THR H . . 5.200 5.014 4.334 5.224 0.024 4 0 "[ . 1]" 1
348 1 21 VAL MG1 1 24 THR MG . . 5.500 4.997 4.596 5.109 . 0 0 "[ . 1]" 1
349 1 21 VAL MG1 1 27 MET ME . . 3.140 2.836 2.490 3.129 . 0 0 "[ . 1]" 1
350 1 21 VAL MG1 1 37 PHE HA . . 5.200 4.998 4.869 5.080 . 0 0 "[ . 1]" 1
351 1 21 VAL MG1 1 37 PHE QB . . 3.580 2.845 2.699 2.951 . 0 0 "[ . 1]" 1
352 1 21 VAL MG1 1 37 PHE QD . . 4.500 2.610 2.535 2.687 . 0 0 "[ . 1]" 1
353 1 21 VAL MG1 1 83 TYR QE . . 4.350 3.599 3.364 3.734 . 0 0 "[ . 1]" 1
354 1 21 VAL MG1 1 87 LEU HB2 . . 5.500 5.374 5.248 5.489 . 0 0 "[ . 1]" 1
355 1 21 VAL MG1 1 87 LEU MD1 . . 4.110 3.682 3.610 3.727 . 0 0 "[ . 1]" 1
356 1 21 VAL MG1 1 87 LEU MD2 . . 4.630 4.506 4.379 4.575 . 0 0 "[ . 1]" 1
357 1 21 VAL MG2 1 22 SER H . . 4.230 4.017 3.965 4.042 . 0 0 "[ . 1]" 1
358 1 21 VAL MG2 1 23 ASN H . . 5.500 5.425 5.160 5.502 0.002 10 0 "[ . 1]" 1
359 1 21 VAL MG2 1 24 THR H . . 5.320 5.217 5.001 5.288 . 0 0 "[ . 1]" 1
360 1 21 VAL MG2 1 24 THR HB . . 5.500 5.247 4.004 5.462 . 0 0 "[ . 1]" 1
361 1 21 VAL MG2 1 24 THR MG . . 4.390 4.462 4.413 4.474 0.084 8 0 "[ . 1]" 1
362 1 21 VAL MG2 1 27 MET ME . . 2.970 2.491 2.332 2.569 . 0 0 "[ . 1]" 1
363 1 21 VAL MG2 1 37 PHE H . . 5.500 5.544 5.523 5.576 0.076 7 0 "[ . 1]" 1
364 1 21 VAL MG2 1 37 PHE QD . . 4.330 3.808 3.693 4.000 . 0 0 "[ . 1]" 1
365 1 21 VAL MG2 1 83 TYR QE . . 3.620 2.042 1.947 2.152 . 0 0 "[ . 1]" 1
366 1 21 VAL MG2 1 87 LEU HA . . 4.320 3.847 3.787 3.909 . 0 0 "[ . 1]" 1
367 1 21 VAL MG2 1 87 LEU HB2 . . 4.550 3.344 3.268 3.435 . 0 0 "[ . 1]" 1
368 1 21 VAL MG2 1 87 LEU HB3 . . 4.810 4.484 4.437 4.548 . 0 0 "[ . 1]" 1
369 1 21 VAL MG2 1 87 LEU MD1 . . 3.010 1.819 1.793 1.866 . 0 0 "[ . 1]" 1
370 1 21 VAL MG2 1 87 LEU MD2 . . 3.120 2.238 2.080 2.311 . 0 0 "[ . 1]" 1
371 1 21 VAL MG2 1 91 ALA MB . . 4.610 3.926 3.747 4.084 . 0 0 "[ . 1]" 1
372 1 22 SER H 1 22 SER QB . . 2.710 2.284 2.265 2.306 . 0 0 "[ . 1]" 1
373 1 22 SER H 1 23 ASN H . . 3.060 2.452 2.373 2.508 . 0 0 "[ . 1]" 1
374 1 22 SER H 1 23 ASN QB . . 4.720 4.586 4.453 4.774 0.054 7 0 "[ . 1]" 1
375 1 22 SER H 1 87 LEU MD2 . . 5.500 5.546 5.533 5.563 0.063 10 0 "[ . 1]" 1
376 1 22 SER HA 1 23 ASN H . . 3.520 3.502 3.418 3.526 0.006 2 0 "[ . 1]" 1
377 1 22 SER HA 1 23 ASN HA . . 4.770 4.631 4.544 4.662 . 0 0 "[ . 1]" 1
378 1 22 SER HA 1 24 THR H . . 5.240 4.721 3.858 5.016 . 0 0 "[ . 1]" 1
379 1 22 SER QB 1 23 ASN HA . . 4.470 4.232 3.958 4.365 . 0 0 "[ . 1]" 1
380 1 22 SER QB 1 24 THR H . . 5.340 4.754 4.535 4.849 . 0 0 "[ . 1]" 1
381 1 22 SER HB2 1 23 ASN H . . 4.100 3.766 2.738 4.087 . 0 0 "[ . 1]" 1
382 1 22 SER HB3 1 23 ASN H . . 4.100 2.958 2.691 3.917 . 0 0 "[ . 1]" 1
383 1 23 ASN H 1 23 ASN QB . . 2.740 2.487 2.348 2.803 0.063 7 0 "[ . 1]" 1
384 1 23 ASN H 1 23 ASN HD21 . . 4.560 3.624 3.338 3.974 . 0 0 "[ . 1]" 1
385 1 23 ASN H 1 23 ASN QD . . 3.830 3.412 3.160 3.698 . 0 0 "[ . 1]" 1
386 1 23 ASN H 1 23 ASN HD22 . . 4.560 4.186 3.684 4.547 . 0 0 "[ . 1]" 1
387 1 23 ASN H 1 24 THR HA . . 5.190 4.970 4.753 5.030 . 0 0 "[ . 1]" 1
388 1 23 ASN H 1 24 THR HB . . 4.650 4.468 4.062 4.563 . 0 0 "[ . 1]" 1
389 1 23 ASN H 1 24 THR MG . . 5.410 5.387 5.261 5.438 0.028 9 0 "[ . 1]" 1
390 1 23 ASN QB 1 23 ASN QD . . 3.030 2.100 2.063 2.152 . 0 0 "[ . 1]" 1
391 1 23 ASN QB 1 24 THR H . . 3.830 2.726 2.416 3.665 . 0 0 "[ . 1]" 1
392 1 23 ASN QD 1 24 THR H . . 5.200 4.431 4.032 5.207 0.007 5 0 "[ . 1]" 1
393 1 24 THR H 1 24 THR HB . . 3.010 2.428 2.328 2.721 . 0 0 "[ . 1]" 1
394 1 24 THR H 1 24 THR MG . . 3.580 3.578 3.517 3.830 0.250 5 0 "[ . 1]" 1
395 1 24 THR H 1 25 THR HA . . 5.500 5.050 4.724 5.182 . 0 0 "[ . 1]" 1
396 1 24 THR H 1 25 THR MG . . 4.760 4.081 3.555 4.564 . 0 0 "[ . 1]" 1
397 1 24 THR HA 1 24 THR MG . . 3.340 2.650 2.402 2.693 . 0 0 "[ . 1]" 1
398 1 24 THR HB 1 27 MET HB3 . . 5.500 5.456 5.011 5.525 0.025 8 0 "[ . 1]" 1
399 1 24 THR MG 1 25 THR H . . 4.030 2.781 2.439 2.914 . 0 0 "[ . 1]" 1
400 1 24 THR MG 1 26 THR H . . 3.720 2.398 1.812 2.595 . 0 0 "[ . 1]" 1
401 1 24 THR MG 1 27 MET H . . 3.240 2.645 2.141 2.736 . 0 0 "[ . 1]" 1
402 1 24 THR MG 1 27 MET HB3 . . 3.150 2.784 2.761 2.812 . 0 0 "[ . 1]" 1
403 1 24 THR MG 1 27 MET ME . . 3.820 3.431 3.273 3.658 . 0 0 "[ . 1]" 1
404 1 25 THR H 1 25 THR MG . . 4.340 3.292 2.773 3.627 . 0 0 "[ . 1]" 1
405 1 25 THR H 1 26 THR H . . 4.270 2.017 1.893 2.862 . 0 0 "[ . 1]" 1
406 1 25 THR HA 1 25 THR MG . . 2.570 2.131 1.962 2.454 . 0 0 "[ . 1]" 1
407 1 25 THR HA 1 27 MET H . . 4.700 3.465 3.345 3.933 . 0 0 "[ . 1]" 1
408 1 25 THR HA 1 29 ALA MB . . 5.500 4.877 4.612 5.442 . 0 0 "[ . 1]" 1
409 1 26 THR H 1 26 THR MG . . 3.940 2.902 2.227 3.916 . 0 0 "[ . 1]" 1
410 1 26 THR H 1 27 MET H . . 3.160 2.296 1.778 2.445 . 0 0 "[ . 1]" 1
411 1 26 THR H 1 27 MET HB3 . . 4.750 4.358 3.989 4.542 . 0 0 "[ . 1]" 1
412 1 26 THR HA 1 26 THR MG . . 3.130 2.495 2.068 3.188 0.058 8 0 "[ . 1]" 1
413 1 26 THR HA 1 27 MET H . . 3.330 3.375 3.330 3.436 0.106 5 0 "[ . 1]" 1
414 1 26 THR MG 1 27 MET H . . 4.450 3.641 2.345 4.372 . 0 0 "[ . 1]" 1
415 1 27 MET H 1 27 MET HB3 . . 2.720 2.404 2.361 2.463 . 0 0 "[ . 1]" 1
416 1 27 MET H 1 27 MET ME . . 4.720 3.929 3.767 4.029 . 0 0 "[ . 1]" 1
417 1 27 MET H 1 27 MET HG2 . . 4.020 2.730 2.662 2.773 . 0 0 "[ . 1]" 1
418 1 27 MET H 1 27 MET HG3 . . 4.260 3.972 3.913 4.021 . 0 0 "[ . 1]" 1
419 1 27 MET H 1 28 MET H . . 4.860 4.643 4.638 4.649 . 0 0 "[ . 1]" 1
420 1 27 MET H 1 29 ALA MB . . 5.330 4.927 4.819 5.191 . 0 0 "[ . 1]" 1
421 1 27 MET HA 1 27 MET HG2 . . 3.800 3.563 3.559 3.569 . 0 0 "[ . 1]" 1
422 1 27 MET HA 1 28 MET H . . 2.920 2.376 2.303 2.402 . 0 0 "[ . 1]" 1
423 1 27 MET HA 1 91 ALA MB . . 5.020 4.724 4.461 4.954 . 0 0 "[ . 1]" 1
424 1 27 MET HB3 1 27 MET HG3 . . 2.980 2.832 2.787 2.869 . 0 0 "[ . 1]" 1
425 1 27 MET HB3 1 91 ALA MB . . 4.180 2.772 2.380 3.003 . 0 0 "[ . 1]" 1
426 1 27 MET ME 1 27 MET HG3 . . 3.250 2.529 2.415 2.604 . 0 0 "[ . 1]" 1
427 1 27 MET ME 1 29 ALA H . . 5.340 5.144 5.012 5.288 . 0 0 "[ . 1]" 1
428 1 27 MET ME 1 29 ALA MB . . 2.920 2.660 2.505 2.927 0.007 5 0 "[ . 1]" 1
429 1 27 MET ME 1 34 LYS HA . . 4.990 4.718 3.940 5.013 0.023 1 0 "[ . 1]" 1
430 1 27 MET ME 1 37 PHE QB . . 5.240 4.698 4.175 5.010 . 0 0 "[ . 1]" 1
431 1 27 MET ME 1 37 PHE QD . . 4.940 4.636 4.116 4.906 . 0 0 "[ . 1]" 1
432 1 27 MET ME 1 87 LEU HA . . 5.310 4.490 4.171 4.658 . 0 0 "[ . 1]" 1
433 1 27 MET ME 1 87 LEU MD1 . . 2.800 2.683 2.624 2.732 . 0 0 "[ . 1]" 1
434 1 27 MET ME 1 87 LEU MD2 . . 4.490 4.501 4.490 4.514 0.024 10 0 "[ . 1]" 1
435 1 27 MET ME 1 90 LEU H . . 5.500 4.790 4.738 4.844 . 0 0 "[ . 1]" 1
436 1 27 MET ME 1 90 LEU HA . . 4.230 3.927 3.846 3.971 . 0 0 "[ . 1]" 1
437 1 27 MET ME 1 90 LEU QB . . 4.340 1.909 1.877 1.948 . 0 0 "[ . 1]" 1
438 1 27 MET ME 1 90 LEU QD . . 3.040 1.980 1.894 2.095 . 0 0 "[ . 1]" 1
439 1 27 MET ME 1 91 ALA H . . 4.090 4.088 4.023 4.113 0.023 1 0 "[ . 1]" 1
440 1 27 MET ME 1 91 ALA MB . . 3.640 3.344 3.269 3.528 . 0 0 "[ . 1]" 1
441 1 27 MET HG2 1 28 MET H . . 4.100 3.929 3.845 4.046 . 0 0 "[ . 1]" 1
442 1 27 MET HG2 1 29 ALA H . . 4.160 4.186 4.162 4.207 0.047 10 0 "[ . 1]" 1
443 1 27 MET HG2 1 87 LEU MD1 . . 5.480 5.370 5.149 5.454 . 0 0 "[ . 1]" 1
444 1 27 MET HG2 1 90 LEU QD . . 4.810 3.624 3.225 3.962 . 0 0 "[ . 1]" 1
445 1 27 MET HG2 1 91 ALA MB . . 4.110 4.081 4.008 4.122 0.012 8 0 "[ . 1]" 1
446 1 27 MET HG3 1 28 MET H . . 4.000 3.843 3.650 4.020 0.020 5 0 "[ . 1]" 1
447 1 27 MET HG3 1 29 ALA H . . 5.000 4.944 4.801 5.026 0.026 8 0 "[ . 1]" 1
448 1 27 MET HG3 1 29 ALA MB . . 3.990 3.260 2.995 3.455 . 0 0 "[ . 1]" 1
449 1 27 MET HG3 1 87 LEU MD1 . . 5.100 4.449 4.163 4.634 . 0 0 "[ . 1]" 1
450 1 27 MET HG3 1 90 LEU HA . . 4.660 3.161 2.850 3.344 . 0 0 "[ . 1]" 1
451 1 27 MET HG3 1 91 ALA MB . . 4.280 3.001 2.863 3.110 . 0 0 "[ . 1]" 1
452 1 28 MET H 1 28 MET QB . . 3.520 2.330 2.143 2.691 . 0 0 "[ . 1]" 1
453 1 28 MET H 1 29 ALA H . . 4.390 4.256 4.238 4.263 . 0 0 "[ . 1]" 1
454 1 28 MET H 1 29 ALA MB . . 4.890 4.836 4.711 4.918 0.028 1 0 "[ . 1]" 1
455 1 28 MET HA 1 29 ALA H . . 2.510 2.198 2.196 2.200 . 0 0 "[ . 1]" 1
456 1 28 MET QB 1 29 ALA H . . 4.020 3.770 3.645 3.985 . 0 0 "[ . 1]" 1
457 1 29 ALA H 1 29 ALA MB . . 2.810 2.515 2.469 2.556 . 0 0 "[ . 1]" 1
458 1 29 ALA H 1 30 SER H . . 4.590 4.461 4.433 4.488 . 0 0 "[ . 1]" 1
459 1 29 ALA H 1 34 LYS QD . . 4.610 4.488 3.921 4.618 0.008 6 0 "[ . 1]" 1
460 1 29 ALA H 1 90 LEU QD . . 4.880 4.448 4.267 4.662 . 0 0 "[ . 1]" 1
461 1 29 ALA MB 1 30 SER H . . 3.360 2.593 2.514 2.723 . 0 0 "[ . 1]" 1
462 1 29 ALA MB 1 30 SER HA . . 4.400 4.196 4.121 4.306 . 0 0 "[ . 1]" 1
463 1 29 ALA MB 1 31 ASN HA . . 5.500 5.234 5.179 5.321 . 0 0 "[ . 1]" 1
464 1 29 ALA MB 1 33 ASP QB . . 3.380 2.850 2.245 3.215 . 0 0 "[ . 1]" 1
465 1 29 ALA MB 1 34 LYS H . . 4.030 3.601 3.143 3.927 . 0 0 "[ . 1]" 1
466 1 29 ALA MB 1 34 LYS HA . . 4.100 3.739 3.495 4.107 0.007 1 0 "[ . 1]" 1
467 1 29 ALA MB 1 34 LYS QD . . 3.910 2.163 1.995 2.806 . 0 0 "[ . 1]" 1
468 1 29 ALA MB 1 34 LYS HG3 . . 3.600 2.743 2.453 3.283 . 0 0 "[ . 1]" 1
469 1 29 ALA MB 1 37 PHE QD . . 5.500 5.172 4.823 5.354 . 0 0 "[ . 1]" 1
470 1 29 ALA MB 1 90 LEU QD . . 3.200 1.785 1.704 1.846 . 0 0 "[ . 1]" 1
471 1 30 SER H 1 30 SER HB2 . . 3.790 2.628 2.179 2.884 . 0 0 "[ . 1]" 1
472 1 30 SER H 1 30 SER QB . . 3.260 2.426 2.156 2.783 . 0 0 "[ . 1]" 1
473 1 30 SER H 1 30 SER HB3 . . 3.790 2.998 2.525 3.736 . 0 0 "[ . 1]" 1
474 1 30 SER H 1 33 ASP H . . 4.260 3.527 3.312 3.890 . 0 0 "[ . 1]" 1
475 1 30 SER H 1 33 ASP HB2 . . 3.980 2.297 1.946 2.587 . 0 0 "[ . 1]" 1
476 1 30 SER H 1 33 ASP QB . . 3.380 2.135 1.933 2.512 . 0 0 "[ . 1]" 1
477 1 30 SER H 1 33 ASP HB3 . . 3.980 3.074 2.072 3.945 . 0 0 "[ . 1]" 1
478 1 30 SER H 1 34 LYS H . . 4.450 3.744 3.364 4.328 . 0 0 "[ . 1]" 1
479 1 30 SER H 1 34 LYS HG3 . . 5.140 3.941 3.475 4.820 . 0 0 "[ . 1]" 1
480 1 30 SER H 1 90 LEU QD . . 3.850 3.177 2.889 3.606 . 0 0 "[ . 1]" 1
481 1 30 SER HA 1 32 ASP H . . 4.750 4.062 3.943 4.427 . 0 0 "[ . 1]" 1
482 1 30 SER HA 1 34 LYS H . . 5.500 4.996 4.831 5.505 0.005 1 0 "[ . 1]" 1
483 1 30 SER QB 1 32 ASP H . . 4.900 2.595 2.223 2.844 . 0 0 "[ . 1]" 1
484 1 31 ASN HA 1 31 ASN HD21 . . 4.680 3.248 1.972 4.337 . 0 0 "[ . 1]" 1
485 1 31 ASN HA 1 31 ASN QD . . 4.080 3.070 1.959 3.942 . 0 0 "[ . 1]" 1
486 1 31 ASN HA 1 31 ASN HD22 . . 4.680 4.001 3.344 4.528 . 0 0 "[ . 1]" 1
487 1 31 ASN HA 1 34 LYS H . . 3.880 3.852 3.748 3.896 0.016 3 0 "[ . 1]" 1
488 1 31 ASN HA 1 34 LYS HB2 . . 3.950 3.253 2.917 3.714 . 0 0 "[ . 1]" 1
489 1 31 ASN HA 1 34 LYS QD . . 5.110 4.894 4.364 5.134 0.024 1 0 "[ . 1]" 1
490 1 31 ASN HA 1 34 LYS HG3 . . 3.550 3.292 3.116 3.551 0.001 4 0 "[ . 1]" 1
491 1 31 ASN QB 1 31 ASN QD . . 3.010 2.226 2.065 2.510 . 0 0 "[ . 1]" 1
492 1 31 ASN QB 1 32 ASP H . . 3.420 2.913 2.810 3.013 . 0 0 "[ . 1]" 1
493 1 31 ASN QB 1 33 ASP H . . 5.340 4.839 4.680 5.043 . 0 0 "[ . 1]" 1
494 1 31 ASN QB 1 34 LYS HG3 . . 5.340 5.183 5.008 5.269 . 0 0 "[ . 1]" 1
495 1 31 ASN QD 1 32 ASP H . . 5.300 5.028 4.197 5.303 0.003 4 0 "[ . 1]" 1
496 1 32 ASP H 1 32 ASP QB . . 3.170 2.208 2.168 2.258 . 0 0 "[ . 1]" 1
497 1 32 ASP H 1 33 ASP H . . 3.270 2.305 2.172 2.556 . 0 0 "[ . 1]" 1
498 1 32 ASP HA 1 34 LYS H . . 4.530 4.415 4.264 4.530 . 0 0 "[ . 1]" 1
499 1 32 ASP HA 1 35 LEU H . . 3.830 3.615 3.471 3.700 . 0 0 "[ . 1]" 1
500 1 32 ASP HA 1 35 LEU HB3 . . 3.470 3.103 2.787 3.315 . 0 0 "[ . 1]" 1
501 1 32 ASP HA 1 35 LEU QD . . 4.060 3.571 3.398 3.689 . 0 0 "[ . 1]" 1
502 1 32 ASP QB 1 33 ASP H . . 3.010 2.757 2.385 3.006 . 0 0 "[ . 1]" 1
503 1 32 ASP QB 1 33 ASP HA . . 4.790 3.865 3.765 3.922 . 0 0 "[ . 1]" 1
504 1 32 ASP QB 1 35 LEU HB3 . . 5.340 4.726 4.416 4.913 . 0 0 "[ . 1]" 1
505 1 32 ASP HB2 1 33 ASP H . . 3.560 3.323 3.036 3.566 0.006 3 0 "[ . 1]" 1
506 1 32 ASP HB3 1 33 ASP H . . 3.560 3.088 2.430 3.559 . 0 0 "[ . 1]" 1
507 1 33 ASP H 1 33 ASP HB2 . . 4.180 2.376 2.116 2.765 . 0 0 "[ . 1]" 1
508 1 33 ASP H 1 33 ASP QB . . 3.420 2.327 2.081 2.676 . 0 0 "[ . 1]" 1
509 1 33 ASP H 1 33 ASP HB3 . . 4.180 3.360 2.937 3.614 . 0 0 "[ . 1]" 1
510 1 33 ASP H 1 34 LYS H . . 2.980 2.573 2.452 2.725 . 0 0 "[ . 1]" 1
511 1 33 ASP HA 1 35 LEU H . . 4.180 3.703 3.639 3.980 . 0 0 "[ . 1]" 1
512 1 33 ASP HA 1 36 CYS HB2 . . 3.650 3.344 3.241 3.472 . 0 0 "[ . 1]" 1
513 1 33 ASP HA 1 36 CYS HB3 . . 4.580 4.564 4.458 4.603 0.023 3 0 "[ . 1]" 1
514 1 33 ASP HA 1 86 LEU QD . . 3.640 3.100 2.786 3.325 . 0 0 "[ . 1]" 1
515 1 33 ASP HA 1 90 LEU MD1 . . 5.040 4.804 4.663 5.041 0.001 7 0 "[ . 1]" 1
516 1 33 ASP HA 1 90 LEU QD . . 4.270 3.899 3.381 4.118 . 0 0 "[ . 1]" 1
517 1 33 ASP HA 1 90 LEU MD2 . . 5.040 4.156 3.452 4.447 . 0 0 "[ . 1]" 1
518 1 33 ASP QB 1 34 LYS H . . 3.240 2.620 2.489 2.725 . 0 0 "[ . 1]" 1
519 1 33 ASP QB 1 34 LYS HA . . 4.490 3.851 3.792 3.900 . 0 0 "[ . 1]" 1
520 1 33 ASP QB 1 34 LYS HG2 . . 4.180 3.461 3.180 3.622 . 0 0 "[ . 1]" 1
521 1 33 ASP QB 1 34 LYS HG3 . . 4.610 4.020 3.757 4.449 . 0 0 "[ . 1]" 1
522 1 33 ASP QB 1 86 LEU QD . . 3.830 3.185 2.687 3.706 . 0 0 "[ . 1]" 1
523 1 33 ASP QB 1 90 LEU QD . . 3.230 2.150 1.835 2.302 . 0 0 "[ . 1]" 1
524 1 33 ASP HB2 1 34 LYS H . . 3.830 2.984 2.529 3.496 . 0 0 "[ . 1]" 1
525 1 33 ASP HB2 1 86 LEU MD1 . . 6.190 4.647 4.201 5.018 . 0 0 "[ . 1]" 1
526 1 33 ASP HB2 1 86 LEU MD2 . . 6.190 4.881 4.583 5.144 . 0 0 "[ . 1]" 1
527 1 33 ASP HB3 1 34 LYS H . . 3.830 3.330 2.647 3.837 0.007 5 0 "[ . 1]" 1
528 1 33 ASP HB3 1 86 LEU MD1 . . 6.190 3.561 3.036 4.344 . 0 0 "[ . 1]" 1
529 1 33 ASP HB3 1 86 LEU MD2 . . 6.190 4.050 3.102 4.941 . 0 0 "[ . 1]" 1
530 1 34 LYS H 1 34 LYS HB2 . . 2.920 2.512 2.455 2.598 . 0 0 "[ . 1]" 1
531 1 34 LYS H 1 34 LYS HD2 . . 4.890 4.714 4.369 4.837 . 0 0 "[ . 1]" 1
532 1 34 LYS H 1 34 LYS QD . . 4.300 4.235 3.981 4.318 0.018 8 0 "[ . 1]" 1
533 1 34 LYS H 1 34 LYS HD3 . . 4.890 4.799 4.587 4.908 0.018 5 0 "[ . 1]" 1
534 1 34 LYS H 1 34 LYS HG2 . . 3.220 2.699 2.222 2.929 . 0 0 "[ . 1]" 1
535 1 34 LYS H 1 34 LYS HG3 . . 2.960 2.665 2.441 2.993 0.033 8 0 "[ . 1]" 1
536 1 34 LYS H 1 35 LEU H . . 3.070 2.604 2.590 2.633 . 0 0 "[ . 1]" 1
537 1 34 LYS H 1 35 LEU HB3 . . 4.970 4.906 4.759 4.993 0.023 8 0 "[ . 1]" 1
538 1 34 LYS H 1 90 LEU QD . . 3.890 3.600 3.437 3.787 . 0 0 "[ . 1]" 1
539 1 34 LYS HA 1 34 LYS QD . . 3.600 3.413 2.854 3.670 0.070 8 0 "[ . 1]" 1
540 1 34 LYS HA 1 34 LYS HG2 . . 3.740 2.448 2.371 2.646 . 0 0 "[ . 1]" 1
541 1 34 LYS HA 1 34 LYS HG3 . . 3.760 3.590 3.460 3.795 0.035 1 0 "[ . 1]" 1
542 1 34 LYS HA 1 37 PHE QB . . 4.170 4.184 4.171 4.204 0.034 2 0 "[ . 1]" 1
543 1 34 LYS HA 1 37 PHE QD . . 3.590 2.278 2.003 2.587 . 0 0 "[ . 1]" 1
544 1 34 LYS HA 1 90 LEU QD . . 3.760 2.845 2.711 2.940 . 0 0 "[ . 1]" 1
545 1 34 LYS HA 1 90 LEU HG . . 5.500 5.528 5.512 5.541 0.041 5 0 "[ . 1]" 1
546 1 34 LYS HB2 1 35 LEU H . . 3.340 3.212 2.981 3.261 . 0 0 "[ . 1]" 1
547 1 34 LYS HB2 1 90 LEU QD . . 5.040 4.696 4.562 4.830 . 0 0 "[ . 1]" 1
548 1 34 LYS HG2 1 37 PHE QD . . 5.500 4.492 4.173 4.763 . 0 0 "[ . 1]" 1
549 1 34 LYS HG2 1 90 LEU QD . . 3.920 2.749 2.644 2.938 . 0 0 "[ . 1]" 1
550 1 35 LEU H 1 35 LEU HB3 . . 2.600 2.526 2.435 2.597 . 0 0 "[ . 1]" 1
551 1 35 LEU H 1 35 LEU QD . . 4.820 3.733 3.644 3.792 . 0 0 "[ . 1]" 1
552 1 35 LEU H 1 35 LEU HG . . 4.950 4.501 4.466 4.526 . 0 0 "[ . 1]" 1
553 1 35 LEU H 1 36 CYS H . . 2.930 2.295 2.232 2.463 . 0 0 "[ . 1]" 1
554 1 35 LEU H 1 36 CYS HA . . 5.020 4.833 4.765 4.990 . 0 0 "[ . 1]" 1
555 1 35 LEU H 1 37 PHE QD . . 4.680 4.552 4.467 4.704 0.024 10 0 "[ . 1]" 1
556 1 35 LEU HA 1 35 LEU MD1 . . 3.730 3.191 2.971 3.445 . 0 0 "[ . 1]" 1
557 1 35 LEU HA 1 35 LEU QD . . 3.230 2.986 2.861 3.115 . 0 0 "[ . 1]" 1
558 1 35 LEU HA 1 35 LEU MD2 . . 3.730 3.647 3.549 3.733 0.003 10 0 "[ . 1]" 1
559 1 35 LEU HA 1 35 LEU HG . . 4.030 2.489 2.460 2.541 . 0 0 "[ . 1]" 1
560 1 35 LEU HA 1 36 CYS H . . 3.540 3.343 3.341 3.345 . 0 0 "[ . 1]" 1
561 1 35 LEU HA 1 38 TYR HB3 . . 3.450 2.381 2.265 2.492 . 0 0 "[ . 1]" 1
562 1 35 LEU HA 1 38 TYR QD . . 4.170 3.332 3.104 3.698 . 0 0 "[ . 1]" 1
563 1 35 LEU HA 1 39 LYS HG2 . . 5.500 5.042 4.892 5.313 . 0 0 "[ . 1]" 1
564 1 35 LEU HB3 1 35 LEU MD1 . . 3.090 2.859 2.703 2.972 . 0 0 "[ . 1]" 1
565 1 35 LEU HB3 1 35 LEU QD . . 2.670 2.003 1.915 2.079 . 0 0 "[ . 1]" 1
566 1 35 LEU HB3 1 35 LEU MD2 . . 3.090 2.046 1.952 2.124 . 0 0 "[ . 1]" 1
567 1 35 LEU HB3 1 36 CYS H . . 3.380 3.333 3.328 3.338 . 0 0 "[ . 1]" 1
568 1 35 LEU HB3 1 63 TYR HB2 . . 5.500 5.451 5.269 5.509 0.009 4 0 "[ . 1]" 1
569 1 35 LEU HB3 1 64 LYS HA . . 5.500 5.516 5.312 5.600 0.100 1 0 "[ . 1]" 1
570 1 35 LEU QD 1 36 CYS HA . . 4.150 3.578 3.231 3.861 . 0 0 "[ . 1]" 1
571 1 35 LEU QD 1 38 TYR H . . 5.370 4.779 4.479 5.051 . 0 0 "[ . 1]" 1
572 1 35 LEU QD 1 38 TYR QD . . 3.870 3.063 2.692 3.399 . 0 0 "[ . 1]" 1
573 1 35 LEU QD 1 39 LYS QE . . 4.460 4.193 3.825 4.411 . 0 0 "[ . 1]" 1
574 1 35 LEU QD 1 63 TYR HA . . 4.190 3.482 3.310 3.593 . 0 0 "[ . 1]" 1
575 1 35 LEU QD 1 63 TYR HB2 . . 3.770 2.316 2.142 2.467 . 0 0 "[ . 1]" 1
576 1 35 LEU QD 1 63 TYR HB3 . . 3.040 2.402 1.960 2.545 . 0 0 "[ . 1]" 1
577 1 35 LEU QD 1 63 TYR QD . . 3.800 3.481 3.346 3.565 . 0 0 "[ . 1]" 1
578 1 35 LEU QD 1 63 TYR QE . . 5.440 5.132 5.000 5.227 . 0 0 "[ . 1]" 1
579 1 35 LEU QD 1 64 LYS H . . 4.160 2.878 2.689 3.019 . 0 0 "[ . 1]" 1
580 1 35 LEU QD 1 64 LYS HA . . 2.990 1.996 1.903 2.148 . 0 0 "[ . 1]" 1
581 1 35 LEU QD 1 66 GLU H . . 5.210 4.419 4.187 4.582 . 0 0 "[ . 1]" 1
582 1 35 LEU QD 1 67 ALA H . . 3.750 3.377 3.170 3.612 . 0 0 "[ . 1]" 1
583 1 35 LEU QD 1 68 TRP H . . 4.650 4.099 3.895 4.263 . 0 0 "[ . 1]" 1
584 1 35 LEU MD1 1 63 TYR HB3 . . 3.490 2.608 1.975 3.039 . 0 0 "[ . 1]" 1
585 1 35 LEU MD1 1 63 TYR QD . . 4.940 3.598 3.455 3.733 . 0 0 "[ . 1]" 1
586 1 35 LEU MD1 1 64 LYS H . . 4.980 2.922 2.753 3.075 . 0 0 "[ . 1]" 1
587 1 35 LEU MD1 1 64 LYS HA . . 3.570 2.042 1.959 2.263 . 0 0 "[ . 1]" 1
588 1 35 LEU MD1 1 67 ALA H . . 5.260 4.432 4.198 4.708 . 0 0 "[ . 1]" 1
589 1 35 LEU MD2 1 63 TYR HB3 . . 3.490 2.991 2.651 3.278 . 0 0 "[ . 1]" 1
590 1 35 LEU MD2 1 63 TYR QD . . 4.940 4.679 4.378 4.955 0.015 1 0 "[ . 1]" 1
591 1 35 LEU MD2 1 64 LYS H . . 4.980 4.361 3.772 4.818 . 0 0 "[ . 1]" 1
592 1 35 LEU MD2 1 64 LYS HA . . 3.570 2.925 2.571 3.346 . 0 0 "[ . 1]" 1
593 1 35 LEU MD2 1 67 ALA H . . 5.260 3.519 3.230 3.859 . 0 0 "[ . 1]" 1
594 1 35 LEU HG 1 36 CYS H . . 4.780 4.712 4.681 4.746 . 0 0 "[ . 1]" 1
595 1 35 LEU HG 1 36 CYS HA . . 4.810 4.804 4.739 4.837 0.027 3 0 "[ . 1]" 1
596 1 35 LEU HG 1 38 TYR H . . 5.400 4.762 4.581 4.995 . 0 0 "[ . 1]" 1
597 1 35 LEU HG 1 38 TYR HB3 . . 4.480 3.491 3.181 3.827 . 0 0 "[ . 1]" 1
598 1 35 LEU HG 1 38 TYR QD . . 3.840 2.425 2.304 2.605 . 0 0 "[ . 1]" 1
599 1 36 CYS H 1 36 CYS HB2 . . 3.000 2.445 2.396 2.497 . 0 0 "[ . 1]" 1
600 1 36 CYS H 1 36 CYS HB3 . . 3.770 3.605 3.590 3.618 . 0 0 "[ . 1]" 1
601 1 36 CYS H 1 37 PHE H . . 3.010 2.531 2.491 2.557 . 0 0 "[ . 1]" 1
602 1 36 CYS H 1 37 PHE QB . . 4.570 4.481 4.441 4.575 0.005 10 0 "[ . 1]" 1
603 1 36 CYS H 1 37 PHE QD . . 4.690 3.829 3.709 3.938 . 0 0 "[ . 1]" 1
604 1 36 CYS H 1 40 TYR QE . . 5.500 5.492 5.400 5.546 0.046 1 0 "[ . 1]" 1
605 1 36 CYS H 1 86 LEU QD . . 3.850 3.722 3.580 3.858 0.008 8 0 "[ . 1]" 1
606 1 36 CYS HA 1 38 TYR H . . 4.680 3.798 3.734 3.882 . 0 0 "[ . 1]" 1
607 1 36 CYS HA 1 39 LYS H . . 4.220 3.525 3.397 3.671 . 0 0 "[ . 1]" 1
608 1 36 CYS HA 1 39 LYS HE2 . . 3.840 2.203 2.088 2.373 . 0 0 "[ . 1]" 1
609 1 36 CYS HA 1 39 LYS QE . . 3.360 2.188 2.076 2.351 . 0 0 "[ . 1]" 1
610 1 36 CYS HA 1 39 LYS HE3 . . 3.840 3.761 3.659 3.848 0.008 2 0 "[ . 1]" 1
611 1 36 CYS HA 1 39 LYS HG2 . . 4.480 2.222 2.068 2.406 . 0 0 "[ . 1]" 1
612 1 36 CYS HA 1 39 LYS HG3 . . 3.670 3.329 3.197 3.499 . 0 0 "[ . 1]" 1
613 1 36 CYS HA 1 40 TYR QE . . 4.670 4.222 4.146 4.276 . 0 0 "[ . 1]" 1
614 1 36 CYS HA 1 71 LEU QD . . 5.280 4.572 4.445 4.676 . 0 0 "[ . 1]" 1
615 1 36 CYS HA 1 86 LEU QD . . 4.650 4.328 4.300 4.365 . 0 0 "[ . 1]" 1
616 1 36 CYS HB2 1 37 PHE H . . 4.110 2.456 2.384 2.544 . 0 0 "[ . 1]" 1
617 1 36 CYS HB2 1 39 LYS QE . . 5.340 4.297 4.141 4.439 . 0 0 "[ . 1]" 1
618 1 36 CYS HB2 1 40 TYR QD . . 4.610 4.529 4.292 4.607 . 0 0 "[ . 1]" 1
619 1 36 CYS HB2 1 40 TYR QE . . 3.930 3.436 3.296 3.540 . 0 0 "[ . 1]" 1
620 1 36 CYS HB2 1 86 LEU HB2 . . 5.500 4.767 4.626 5.055 . 0 0 "[ . 1]" 1
621 1 36 CYS HB2 1 86 LEU MD1 . . 4.250 1.985 1.965 2.017 . 0 0 "[ . 1]" 1
622 1 36 CYS HB2 1 86 LEU QD . . 3.300 1.966 1.945 1.992 . 0 0 "[ . 1]" 1
623 1 36 CYS HB2 1 86 LEU MD2 . . 4.250 3.192 3.079 3.423 . 0 0 "[ . 1]" 1
624 1 36 CYS HB3 1 37 PHE H . . 3.750 3.496 3.419 3.573 . 0 0 "[ . 1]" 1
625 1 36 CYS HB3 1 40 TYR QD . . 4.540 3.918 3.633 4.128 . 0 0 "[ . 1]" 1
626 1 36 CYS HB3 1 40 TYR QE . . 4.130 2.399 2.238 2.537 . 0 0 "[ . 1]" 1
627 1 36 CYS HB3 1 82 ALA MB . . 5.220 4.940 4.804 5.066 . 0 0 "[ . 1]" 1
628 1 36 CYS HB3 1 86 LEU QD . . 3.510 2.775 2.689 2.872 . 0 0 "[ . 1]" 1
629 1 37 PHE H 1 37 PHE HB2 . . 3.570 3.535 3.511 3.575 0.005 10 0 "[ . 1]" 1
630 1 37 PHE H 1 37 PHE QB . . 2.930 2.231 2.188 2.319 . 0 0 "[ . 1]" 1
631 1 37 PHE H 1 37 PHE HB3 . . 3.570 2.256 2.210 2.349 . 0 0 "[ . 1]" 1
632 1 37 PHE H 1 37 PHE QD . . 3.380 2.517 2.431 2.605 . 0 0 "[ . 1]" 1
633 1 37 PHE H 1 38 TYR H . . 3.300 2.572 2.520 2.601 . 0 0 "[ . 1]" 1
634 1 37 PHE H 1 38 TYR QD . . 5.500 5.575 5.550 5.595 0.095 9 0 "[ . 1]" 1
635 1 37 PHE H 1 40 TYR H . . 5.020 4.909 4.871 4.947 . 0 0 "[ . 1]" 1
636 1 37 PHE H 1 40 TYR QD . . 4.420 4.118 3.981 4.196 . 0 0 "[ . 1]" 1
637 1 37 PHE H 1 40 TYR QE . . 4.450 4.400 4.337 4.450 0.000 5 0 "[ . 1]" 1
638 1 37 PHE H 1 86 LEU QD . . 3.330 3.062 2.766 3.247 . 0 0 "[ . 1]" 1
639 1 37 PHE HA 1 37 PHE QD . . 3.730 3.629 3.604 3.661 . 0 0 "[ . 1]" 1
640 1 37 PHE HA 1 39 LYS HG2 . . 5.500 4.845 4.732 4.901 . 0 0 "[ . 1]" 1
641 1 37 PHE HA 1 40 TYR H . . 4.260 3.339 3.190 3.449 . 0 0 "[ . 1]" 1
642 1 37 PHE HA 1 40 TYR QB . . 3.970 2.523 2.440 2.612 . 0 0 "[ . 1]" 1
643 1 37 PHE HA 1 40 TYR QD . . 3.970 2.002 1.986 2.033 . 0 0 "[ . 1]" 1
644 1 37 PHE HA 1 86 LEU HB3 . . 5.190 4.846 4.689 5.048 . 0 0 "[ . 1]" 1
645 1 37 PHE QB 1 38 TYR H . . 3.960 3.683 3.665 3.712 . 0 0 "[ . 1]" 1
646 1 37 PHE QB 1 40 TYR QE . . 5.340 4.507 4.326 4.691 . 0 0 "[ . 1]" 1
647 1 37 PHE QB 1 83 TYR QE . . 3.850 2.730 2.551 3.060 . 0 0 "[ . 1]" 1
648 1 37 PHE QD 1 38 TYR H . . 4.330 3.481 3.426 3.572 . 0 0 "[ . 1]" 1
649 1 37 PHE QD 1 86 LEU QD . . 4.600 4.010 3.596 4.384 . 0 0 "[ . 1]" 1
650 1 38 TYR H 1 38 TYR HB3 . . 2.740 2.137 2.126 2.148 . 0 0 "[ . 1]" 1
651 1 38 TYR H 1 38 TYR QD . . 3.750 3.526 3.508 3.554 . 0 0 "[ . 1]" 1
652 1 38 TYR H 1 39 LYS H . . 3.330 2.375 2.318 2.414 . 0 0 "[ . 1]" 1
653 1 38 TYR H 1 39 LYS HA . . 5.220 5.056 5.008 5.087 . 0 0 "[ . 1]" 1
654 1 38 TYR HA 1 38 TYR QD . . 3.720 3.263 3.255 3.270 . 0 0 "[ . 1]" 1
655 1 38 TYR HA 1 39 LYS HG2 . . 5.500 5.394 5.348 5.425 . 0 0 "[ . 1]" 1
656 1 38 TYR HA 1 41 TYR H . . 3.960 3.811 3.719 3.958 . 0 0 "[ . 1]" 1
657 1 38 TYR HB3 1 39 LYS H . . 3.260 3.091 3.010 3.246 . 0 0 "[ . 1]" 1
658 1 38 TYR HB3 1 39 LYS HG2 . . 4.770 4.392 4.353 4.408 . 0 0 "[ . 1]" 1
659 1 38 TYR QD 1 39 LYS H . . 3.490 2.657 2.528 2.949 . 0 0 "[ . 1]" 1
660 1 38 TYR QD 1 39 LYS HA . . 3.890 3.553 3.476 3.683 . 0 0 "[ . 1]" 1
661 1 38 TYR QD 1 39 LYS HB2 . . 4.900 4.435 4.394 4.543 . 0 0 "[ . 1]" 1
662 1 38 TYR QD 1 39 LYS QB . . 4.290 2.777 2.746 2.867 . 0 0 "[ . 1]" 1
663 1 38 TYR QD 1 39 LYS HB3 . . 4.900 2.806 2.774 2.899 . 0 0 "[ . 1]" 1
664 1 38 TYR QD 1 67 ALA MB . . 4.420 3.564 3.350 3.710 . 0 0 "[ . 1]" 1
665 1 38 TYR QD 1 68 TRP HB2 . . 4.830 4.716 4.342 4.837 0.007 9 0 "[ . 1]" 1
666 1 38 TYR QD 1 71 LEU QD . . 5.440 5.472 5.456 5.491 0.051 1 0 "[ . 1]" 1
667 1 39 LYS H 1 39 LYS HB2 . . 3.700 3.609 3.596 3.627 . 0 0 "[ . 1]" 1
668 1 39 LYS H 1 39 LYS QB . . 3.140 2.724 2.675 2.805 . 0 0 "[ . 1]" 1
669 1 39 LYS H 1 39 LYS HB3 . . 3.700 2.819 2.759 2.920 . 0 0 "[ . 1]" 1
670 1 39 LYS H 1 39 LYS HG2 . . 3.740 1.929 1.917 1.941 . 0 0 "[ . 1]" 1
671 1 39 LYS H 1 39 LYS HG3 . . 3.370 2.878 2.815 2.911 . 0 0 "[ . 1]" 1
672 1 39 LYS H 1 40 TYR H . . 3.270 2.336 2.220 2.425 . 0 0 "[ . 1]" 1
673 1 39 LYS H 1 42 LYS HB2 . . 5.500 5.457 5.363 5.523 0.023 8 0 "[ . 1]" 1
674 1 39 LYS H 1 67 ALA MB . . 4.600 4.541 4.389 4.622 0.022 10 0 "[ . 1]" 1
675 1 39 LYS H 1 71 LEU QD . . 5.090 4.609 4.476 4.720 . 0 0 "[ . 1]" 1
676 1 39 LYS HA 1 42 LYS H . . 3.590 3.478 3.418 3.546 . 0 0 "[ . 1]" 1
677 1 39 LYS HA 1 42 LYS HB2 . . 4.270 2.822 2.712 2.891 . 0 0 "[ . 1]" 1
678 1 39 LYS HA 1 42 LYS HB3 . . 4.840 4.442 4.320 4.548 . 0 0 "[ . 1]" 1
679 1 39 LYS HA 1 42 LYS HG2 . . 4.190 3.449 3.214 3.654 . 0 0 "[ . 1]" 1
680 1 39 LYS HA 1 42 LYS HG3 . . 4.800 3.693 3.505 3.938 . 0 0 "[ . 1]" 1
681 1 39 LYS HA 1 43 GLN H . . 4.130 4.134 4.047 4.158 0.028 2 0 "[ . 1]" 1
682 1 39 LYS HA 1 67 ALA MB . . 4.950 4.582 4.266 4.727 . 0 0 "[ . 1]" 1
683 1 39 LYS HA 1 68 TRP HB2 . . 3.940 3.767 3.522 3.934 . 0 0 "[ . 1]" 1
684 1 39 LYS HA 1 68 TRP HD1 . . 5.160 3.820 3.701 4.087 . 0 0 "[ . 1]" 1
685 1 39 LYS HA 1 68 TRP HE1 . . 5.500 5.170 5.034 5.357 . 0 0 "[ . 1]" 1
686 1 39 LYS HA 1 71 LEU QD . . 4.480 4.165 4.047 4.431 . 0 0 "[ . 1]" 1
687 1 39 LYS QB 1 68 TRP H . . 4.620 3.532 3.382 3.704 . 0 0 "[ . 1]" 1
688 1 39 LYS QB 1 71 LEU QD . . 3.390 2.149 1.956 2.518 . 0 0 "[ . 1]" 1
689 1 39 LYS HB2 1 40 TYR H . . 4.270 3.942 3.891 4.038 . 0 0 "[ . 1]" 1
690 1 39 LYS HB3 1 40 TYR H . . 4.270 4.190 4.147 4.276 0.006 6 0 "[ . 1]" 1
691 1 39 LYS QE 1 39 LYS HG3 . . 3.670 2.240 2.191 2.338 . 0 0 "[ . 1]" 1
692 1 39 LYS QE 1 40 TYR H . . 5.290 4.320 4.211 4.522 . 0 0 "[ . 1]" 1
693 1 39 LYS QE 1 40 TYR QE . . 3.560 2.266 2.103 2.644 . 0 0 "[ . 1]" 1
694 1 39 LYS QE 1 71 LEU QD . . 3.590 1.915 1.840 2.024 . 0 0 "[ . 1]" 1
695 1 39 LYS HE2 1 39 LYS HG3 . . 4.220 2.727 2.600 2.860 . 0 0 "[ . 1]" 1
696 1 39 LYS HE3 1 39 LYS HG3 . . 4.220 2.391 2.293 2.650 . 0 0 "[ . 1]" 1
697 1 39 LYS HG2 1 40 TYR H . . 3.700 3.117 3.047 3.284 . 0 0 "[ . 1]" 1
698 1 39 LYS HG2 1 40 TYR HA . . 5.500 5.076 5.035 5.148 . 0 0 "[ . 1]" 1
699 1 39 LYS HG2 1 71 LEU QD . . 4.120 3.614 3.510 3.682 . 0 0 "[ . 1]" 1
700 1 39 LYS HG3 1 40 TYR H . . 3.400 2.623 2.505 2.846 . 0 0 "[ . 1]" 1
701 1 39 LYS HG3 1 41 TYR H . . 5.290 5.079 5.009 5.236 . 0 0 "[ . 1]" 1
702 1 39 LYS HG3 1 67 ALA MB . . 4.330 4.288 4.082 4.347 0.017 2 0 "[ . 1]" 1
703 1 40 TYR H 1 40 TYR HB2 . . 3.650 2.418 2.372 2.452 . 0 0 "[ . 1]" 1
704 1 40 TYR H 1 40 TYR QB . . 3.060 2.382 2.340 2.413 . 0 0 "[ . 1]" 1
705 1 40 TYR H 1 40 TYR HB3 . . 3.650 3.592 3.580 3.596 . 0 0 "[ . 1]" 1
706 1 40 TYR H 1 40 TYR QD . . 3.730 3.284 3.224 3.372 . 0 0 "[ . 1]" 1
707 1 40 TYR H 1 40 TYR QE . . 4.850 4.699 4.621 4.819 . 0 0 "[ . 1]" 1
708 1 40 TYR H 1 41 TYR H . . 3.080 2.543 2.464 2.590 . 0 0 "[ . 1]" 1
709 1 40 TYR H 1 83 TYR QD . . 4.740 4.447 4.295 4.650 . 0 0 "[ . 1]" 1
710 1 40 TYR HA 1 40 TYR QD . . 3.390 1.922 1.910 1.936 . 0 0 "[ . 1]" 1
711 1 40 TYR HA 1 40 TYR QE . . 4.470 4.263 4.234 4.289 . 0 0 "[ . 1]" 1
712 1 40 TYR HA 1 43 GLN H . . 3.810 3.317 3.238 3.416 . 0 0 "[ . 1]" 1
713 1 40 TYR HA 1 43 GLN HB2 . . 4.700 2.798 2.459 3.023 . 0 0 "[ . 1]" 1
714 1 40 TYR HA 1 43 GLN HB3 . . 4.700 3.939 3.752 4.208 . 0 0 "[ . 1]" 1
715 1 40 TYR HA 1 44 ALA H . . 4.360 3.771 3.700 3.881 . 0 0 "[ . 1]" 1
716 1 40 TYR HA 1 71 LEU QD . . 4.640 3.453 3.284 3.614 . 0 0 "[ . 1]" 1
717 1 40 TYR HA 1 74 MET ME . . 4.750 3.796 3.275 4.724 . 0 0 "[ . 1]" 1
718 1 40 TYR HA 1 79 ALA MB . . 3.870 2.591 2.470 2.723 . 0 0 "[ . 1]" 1
719 1 40 TYR HA 1 82 ALA MB . . 4.850 4.504 4.408 4.649 . 0 0 "[ . 1]" 1
720 1 40 TYR QB 1 41 TYR H . . 3.510 2.552 2.481 2.601 . 0 0 "[ . 1]" 1
721 1 40 TYR QB 1 79 ALA MB . . 3.860 2.965 2.850 3.178 . 0 0 "[ . 1]" 1
722 1 40 TYR QB 1 82 ALA MB . . 4.680 3.640 3.574 3.852 . 0 0 "[ . 1]" 1
723 1 40 TYR QB 1 83 TYR QD . . 3.540 1.921 1.887 1.992 . 0 0 "[ . 1]" 1
724 1 40 TYR HB2 1 83 TYR QD . . 4.130 2.113 1.999 2.311 . 0 0 "[ . 1]" 1
725 1 40 TYR HB3 1 83 TYR QD . . 4.130 2.251 2.025 2.442 . 0 0 "[ . 1]" 1
726 1 40 TYR QD 1 41 TYR H . . 4.800 4.423 4.383 4.466 . 0 0 "[ . 1]" 1
727 1 40 TYR QD 1 71 LEU QD . . 3.910 2.723 2.520 2.973 . 0 0 "[ . 1]" 1
728 1 40 TYR QD 1 74 MET ME . . 3.670 2.856 2.418 3.591 . 0 0 "[ . 1]" 1
729 1 40 TYR QD 1 79 ALA HA . . 4.110 3.219 2.895 3.547 . 0 0 "[ . 1]" 1
730 1 40 TYR QD 1 79 ALA MB . . 3.930 3.085 2.796 3.269 . 0 0 "[ . 1]" 1
731 1 40 TYR QD 1 82 ALA H . . 5.260 5.016 4.897 5.145 . 0 0 "[ . 1]" 1
732 1 40 TYR QD 1 82 ALA MB . . 3.870 3.052 2.986 3.147 . 0 0 "[ . 1]" 1
733 1 40 TYR QD 1 83 TYR H . . 4.420 4.286 4.164 4.410 . 0 0 "[ . 1]" 1
734 1 40 TYR QD 1 83 TYR HA . . 3.750 2.710 2.575 2.903 . 0 0 "[ . 1]" 1
735 1 40 TYR QD 1 86 LEU HB2 . . 4.850 4.406 4.298 4.540 . 0 0 "[ . 1]" 1
736 1 40 TYR QD 1 86 LEU HB3 . . 4.820 3.623 3.473 3.724 . 0 0 "[ . 1]" 1
737 1 40 TYR QD 1 86 LEU QD . . 3.870 3.698 3.653 3.767 . 0 0 "[ . 1]" 1
738 1 40 TYR QE 1 71 LEU QD . . 3.730 2.381 2.055 2.704 . 0 0 "[ . 1]" 1
739 1 40 TYR QE 1 74 MET ME . . 3.820 2.698 2.193 3.155 . 0 0 "[ . 1]" 1
740 1 40 TYR QE 1 79 ALA MB . . 5.420 4.675 4.368 4.822 . 0 0 "[ . 1]" 1
741 1 40 TYR QE 1 82 ALA H . . 5.500 5.231 5.032 5.387 . 0 0 "[ . 1]" 1
742 1 40 TYR QE 1 82 ALA MB . . 3.640 2.637 2.501 2.785 . 0 0 "[ . 1]" 1
743 1 40 TYR QE 1 86 LEU H . . 4.570 4.294 4.225 4.361 . 0 0 "[ . 1]" 1
744 1 40 TYR QE 1 86 LEU HB2 . . 4.640 2.417 2.345 2.539 . 0 0 "[ . 1]" 1
745 1 40 TYR QE 1 86 LEU HB3 . . 5.010 2.416 2.377 2.491 . 0 0 "[ . 1]" 1
746 1 40 TYR QE 1 86 LEU MD1 . . 4.160 2.991 2.871 3.045 . 0 0 "[ . 1]" 1
747 1 40 TYR QE 1 86 LEU QD . . 3.580 2.842 2.764 2.880 . 0 0 "[ . 1]" 1
748 1 40 TYR QE 1 86 LEU MD2 . . 4.160 3.557 3.519 3.604 . 0 0 "[ . 1]" 1
749 1 40 TYR QE 1 87 LEU H . . 4.740 4.763 4.750 4.785 0.045 2 0 "[ . 1]" 1
750 1 41 TYR H 1 41 TYR HB2 . . 3.130 2.471 2.407 2.575 . 0 0 "[ . 1]" 1
751 1 41 TYR H 1 41 TYR QB . . 2.710 2.251 2.239 2.258 . 0 0 "[ . 1]" 1
752 1 41 TYR H 1 41 TYR HB3 . . 3.130 2.598 2.499 2.664 . 0 0 "[ . 1]" 1
753 1 41 TYR H 1 41 TYR QD . . 4.420 4.193 4.180 4.202 . 0 0 "[ . 1]" 1
754 1 41 TYR H 1 42 LYS H . . 3.110 2.583 2.553 2.623 . 0 0 "[ . 1]" 1
755 1 41 TYR H 1 42 LYS HB2 . . 4.810 4.789 4.720 4.835 0.025 6 0 "[ . 1]" 1
756 1 41 TYR H 1 42 LYS HG2 . . 4.480 4.280 4.144 4.354 . 0 0 "[ . 1]" 1
757 1 41 TYR H 1 43 GLN QB . . 5.340 5.158 5.009 5.279 . 0 0 "[ . 1]" 1
758 1 41 TYR H 1 44 ALA H . . 4.920 4.686 4.648 4.730 . 0 0 "[ . 1]" 1
759 1 41 TYR H 1 44 ALA MB . . 4.750 4.562 4.444 4.724 . 0 0 "[ . 1]" 1
760 1 41 TYR H 1 79 ALA MB . . 5.370 4.913 4.768 5.082 . 0 0 "[ . 1]" 1
761 1 41 TYR H 1 83 TYR QD . . 4.050 3.679 3.539 3.886 . 0 0 "[ . 1]" 1
762 1 41 TYR HA 1 41 TYR QD . . 3.340 3.059 3.013 3.099 . 0 0 "[ . 1]" 1
763 1 41 TYR HA 1 42 LYS H . . 3.510 3.451 3.432 3.471 . 0 0 "[ . 1]" 1
764 1 41 TYR HA 1 43 GLN H . . 4.760 4.589 4.473 4.733 . 0 0 "[ . 1]" 1
765 1 41 TYR HA 1 44 ALA MB . . 3.560 2.832 2.650 3.086 . 0 0 "[ . 1]" 1
766 1 41 TYR QB 1 42 LYS H . . 4.340 2.934 2.857 2.997 . 0 0 "[ . 1]" 1
767 1 41 TYR QB 1 83 TYR QE . . 4.210 2.661 2.061 2.924 . 0 0 "[ . 1]" 1
768 1 41 TYR QD 1 42 LYS H . . 3.930 3.920 3.806 3.939 0.009 5 0 "[ . 1]" 1
769 1 41 TYR QD 1 42 LYS HA . . 4.590 3.351 3.286 3.417 . 0 0 "[ . 1]" 1
770 1 41 TYR QD 1 42 LYS HD2 . . 4.380 2.616 2.318 2.851 . 0 0 "[ . 1]" 1
771 1 41 TYR QD 1 42 LYS HD3 . . 4.420 3.654 3.209 3.983 . 0 0 "[ . 1]" 1
772 1 41 TYR QD 1 42 LYS QE . . 4.870 4.410 3.956 4.681 . 0 0 "[ . 1]" 1
773 1 41 TYR QD 1 42 LYS HG2 . . 4.790 3.720 3.454 3.915 . 0 0 "[ . 1]" 1
774 1 41 TYR QD 1 45 THR HB . . 5.140 4.159 3.985 4.234 . 0 0 "[ . 1]" 1
775 1 41 TYR QD 1 45 THR MG . . 4.410 4.406 4.351 4.422 0.012 2 0 "[ . 1]" 1
776 1 41 TYR QD 1 83 TYR QD . . 5.040 4.870 4.745 4.997 . 0 0 "[ . 1]" 1
777 1 41 TYR QE 1 45 THR HB . . 5.500 4.567 4.345 4.694 . 0 0 "[ . 1]" 1
778 1 41 TYR QE 1 45 THR MG . . 3.820 3.661 3.537 3.747 . 0 0 "[ . 1]" 1
779 1 42 LYS H 1 42 LYS HB2 . . 3.240 2.428 2.385 2.480 . 0 0 "[ . 1]" 1
780 1 42 LYS H 1 42 LYS HB3 . . 3.780 3.619 3.599 3.639 . 0 0 "[ . 1]" 1
781 1 42 LYS H 1 42 LYS HD2 . . 4.310 3.683 3.532 3.805 . 0 0 "[ . 1]" 1
782 1 42 LYS H 1 42 LYS QE . . 4.920 4.569 4.540 4.605 . 0 0 "[ . 1]" 1
783 1 42 LYS H 1 42 LYS HG2 . . 3.200 2.546 2.471 2.608 . 0 0 "[ . 1]" 1
784 1 42 LYS H 1 42 LYS HG3 . . 4.040 3.886 3.858 3.915 . 0 0 "[ . 1]" 1
785 1 42 LYS H 1 45 THR H . . 4.950 4.762 4.617 4.842 . 0 0 "[ . 1]" 1
786 1 42 LYS HA 1 42 LYS HD2 . . 3.750 1.987 1.981 1.993 . 0 0 "[ . 1]" 1
787 1 42 LYS HA 1 42 LYS HD3 . . 3.770 3.598 3.588 3.606 . 0 0 "[ . 1]" 1
788 1 42 LYS HA 1 42 LYS QE . . 3.680 2.486 2.440 2.573 . 0 0 "[ . 1]" 1
789 1 42 LYS HA 1 42 LYS HG2 . . 4.180 3.096 3.030 3.184 . 0 0 "[ . 1]" 1
790 1 42 LYS HA 1 44 ALA H . . 4.490 4.266 4.136 4.385 . 0 0 "[ . 1]" 1
791 1 42 LYS HA 1 45 THR H . . 3.890 3.655 3.573 3.764 . 0 0 "[ . 1]" 1
792 1 42 LYS HA 1 45 THR HB . . 4.100 2.840 2.738 2.953 . 0 0 "[ . 1]" 1
793 1 42 LYS HA 1 45 THR MG . . 4.470 4.198 4.099 4.303 . 0 0 "[ . 1]" 1
794 1 42 LYS HA 1 46 VAL H . . 3.840 3.453 3.297 3.602 . 0 0 "[ . 1]" 1
795 1 42 LYS HA 1 46 VAL QG . . 3.780 3.267 2.833 3.542 . 0 0 "[ . 1]" 1
796 1 42 LYS HA 1 47 GLY H . . 5.500 5.058 4.873 5.154 . 0 0 "[ . 1]" 1
797 1 42 LYS HA 1 68 TRP HE1 . . 4.770 4.410 4.282 4.716 . 0 0 "[ . 1]" 1
798 1 42 LYS HB2 1 42 LYS QE . . 4.130 3.439 3.391 3.517 . 0 0 "[ . 1]" 1
799 1 42 LYS HB2 1 43 GLN H . . 3.370 2.654 2.521 2.789 . 0 0 "[ . 1]" 1
800 1 42 LYS HB2 1 68 TRP HE1 . . 4.540 3.036 2.811 3.337 . 0 0 "[ . 1]" 1
801 1 42 LYS HB2 1 68 TRP HZ2 . . 5.410 4.589 4.254 4.922 . 0 0 "[ . 1]" 1
802 1 42 LYS HB3 1 42 LYS QE . . 3.880 2.077 1.987 2.141 . 0 0 "[ . 1]" 1
803 1 42 LYS HB3 1 43 GLN H . . 3.870 3.647 3.492 3.778 . 0 0 "[ . 1]" 1
804 1 42 LYS HB3 1 44 ALA H . . 5.500 5.461 5.277 5.517 0.017 7 0 "[ . 1]" 1
805 1 42 LYS HB3 1 46 VAL H . . 5.060 4.560 4.460 4.639 . 0 0 "[ . 1]" 1
806 1 42 LYS HB3 1 68 TRP HE1 . . 4.450 2.430 2.271 2.829 . 0 0 "[ . 1]" 1
807 1 42 LYS HD2 1 43 GLN H . . 5.470 5.096 4.999 5.153 . 0 0 "[ . 1]" 1
808 1 42 LYS HD3 1 68 TRP HZ2 . . 5.500 5.462 5.257 5.525 0.025 10 0 "[ . 1]" 1
809 1 42 LYS QE 1 42 LYS HG2 . . 3.560 3.355 3.303 3.481 . 0 0 "[ . 1]" 1
810 1 42 LYS QE 1 42 LYS HG3 . . 3.530 2.511 2.333 2.930 . 0 0 "[ . 1]" 1
811 1 42 LYS QE 1 45 THR H . . 5.340 5.341 5.268 5.358 0.018 2 0 "[ . 1]" 1
812 1 42 LYS QE 1 45 THR MG . . 4.780 4.441 4.189 4.615 . 0 0 "[ . 1]" 1
813 1 42 LYS QE 1 46 VAL QG . . 3.300 2.301 2.118 2.607 . 0 0 "[ . 1]" 1
814 1 42 LYS QE 1 68 TRP HE1 . . 4.480 3.788 3.519 4.145 . 0 0 "[ . 1]" 1
815 1 42 LYS QE 1 68 TRP HZ2 . . 3.470 2.678 2.552 2.806 . 0 0 "[ . 1]" 1
816 1 42 LYS HG2 1 43 GLN H . . 4.500 4.338 4.269 4.396 . 0 0 "[ . 1]" 1
817 1 42 LYS HG3 1 43 GLN H . . 5.210 5.002 4.888 5.108 . 0 0 "[ . 1]" 1
818 1 43 GLN H 1 43 GLN HB2 . . 3.800 2.147 2.082 2.293 . 0 0 "[ . 1]" 1
819 1 43 GLN H 1 43 GLN QB . . 2.960 2.124 2.061 2.267 . 0 0 "[ . 1]" 1
820 1 43 GLN H 1 43 GLN HB3 . . 3.800 3.380 3.287 3.559 . 0 0 "[ . 1]" 1
821 1 43 GLN H 1 43 GLN HG2 . . 4.450 3.968 2.744 4.514 0.064 2 0 "[ . 1]" 1
822 1 43 GLN H 1 43 GLN QG . . 3.820 3.483 2.678 3.844 0.024 10 0 "[ . 1]" 1
823 1 43 GLN H 1 43 GLN HG3 . . 4.450 4.057 3.737 4.183 . 0 0 "[ . 1]" 1
824 1 43 GLN H 1 45 THR H . . 4.450 3.853 3.778 3.954 . 0 0 "[ . 1]" 1
825 1 43 GLN H 1 68 TRP HE1 . . 4.170 3.934 3.661 4.170 0.000 8 0 "[ . 1]" 1
826 1 43 GLN H 1 79 ALA MB . . 4.090 3.760 3.675 3.901 . 0 0 "[ . 1]" 1
827 1 43 GLN HA 1 43 GLN HG2 . . 4.210 3.289 2.684 3.511 . 0 0 "[ . 1]" 1
828 1 43 GLN HA 1 43 GLN HG3 . . 4.210 2.609 2.108 3.697 . 0 0 "[ . 1]" 1
829 1 43 GLN HA 1 45 THR H . . 4.430 3.662 3.569 3.769 . 0 0 "[ . 1]" 1
830 1 43 GLN HA 1 46 VAL H . . 3.970 3.732 3.510 3.862 . 0 0 "[ . 1]" 1
831 1 43 GLN HA 1 47 GLY H . . 3.110 2.462 2.349 2.558 . 0 0 "[ . 1]" 1
832 1 43 GLN HA 1 47 GLY HA2 . . 3.890 3.350 3.190 3.528 . 0 0 "[ . 1]" 1
833 1 43 GLN HA 1 68 TRP HD1 . . 4.650 4.480 4.278 4.648 . 0 0 "[ . 1]" 1
834 1 43 GLN HA 1 68 TRP HE1 . . 3.340 3.296 2.854 3.391 0.051 10 0 "[ . 1]" 1
835 1 43 GLN QB 1 44 ALA H . . 3.360 2.900 2.829 3.001 . 0 0 "[ . 1]" 1
836 1 43 GLN QB 1 45 THR H . . 5.170 4.424 4.366 4.464 . 0 0 "[ . 1]" 1
837 1 43 GLN QB 1 47 GLY H . . 4.710 4.567 4.316 4.718 0.008 10 0 "[ . 1]" 1
838 1 43 GLN QB 1 68 TRP HD1 . . 4.500 4.159 4.057 4.448 . 0 0 "[ . 1]" 1
839 1 43 GLN QB 1 68 TRP HE1 . . 4.830 4.447 4.205 4.652 . 0 0 "[ . 1]" 1
840 1 43 GLN QB 1 71 LEU QD . . 4.180 2.877 2.690 3.077 . 0 0 "[ . 1]" 1
841 1 43 GLN QB 1 74 MET HB3 . . 4.420 2.875 2.464 3.041 . 0 0 "[ . 1]" 1
842 1 43 GLN QB 1 75 SER H . . 5.340 5.356 5.334 5.372 0.032 10 0 "[ . 1]" 1
843 1 43 GLN QB 1 79 ALA MB . . 3.020 1.985 1.910 2.191 . 0 0 "[ . 1]" 1
844 1 43 GLN HB2 1 44 ALA H . . 3.880 3.184 2.939 3.357 . 0 0 "[ . 1]" 1
845 1 43 GLN HB2 1 47 GLY H . . 5.440 5.356 5.263 5.451 0.011 7 0 "[ . 1]" 1
846 1 43 GLN HB2 1 79 ALA MB . . 3.780 2.680 2.209 2.916 . 0 0 "[ . 1]" 1
847 1 43 GLN HB3 1 44 ALA H . . 3.880 3.403 3.193 3.730 . 0 0 "[ . 1]" 1
848 1 43 GLN HB3 1 47 GLY H . . 5.440 4.961 4.582 5.194 . 0 0 "[ . 1]" 1
849 1 43 GLN HB3 1 79 ALA MB . . 3.780 2.085 1.949 2.427 . 0 0 "[ . 1]" 1
850 1 43 GLN QG 1 68 TRP HD1 . . 4.530 3.475 1.978 4.070 . 0 0 "[ . 1]" 1
851 1 43 GLN QG 1 68 TRP HE1 . . 4.880 3.698 2.574 4.132 . 0 0 "[ . 1]" 1
852 1 43 GLN QG 1 71 LEU QD . . 4.050 2.623 1.928 3.029 . 0 0 "[ . 1]" 1
853 1 43 GLN QG 1 79 ALA MB . . 4.200 3.483 3.361 3.726 . 0 0 "[ . 1]" 1
854 1 44 ALA H 1 44 ALA MB . . 2.600 2.229 2.168 2.283 . 0 0 "[ . 1]" 1
855 1 44 ALA H 1 45 THR H . . 3.150 2.456 2.407 2.526 . 0 0 "[ . 1]" 1
856 1 44 ALA H 1 46 VAL H . . 4.390 4.274 4.034 4.395 0.005 1 0 "[ . 1]" 1
857 1 44 ALA H 1 47 GLY H . . 5.060 5.001 4.807 5.069 0.009 4 0 "[ . 1]" 1
858 1 44 ALA H 1 79 ALA MB . . 3.080 2.783 2.645 2.866 . 0 0 "[ . 1]" 1
859 1 44 ALA HA 1 76 THR MG . . 3.370 2.645 2.487 2.907 . 0 0 "[ . 1]" 1
860 1 44 ALA MB 1 45 THR H . . 3.530 3.275 3.164 3.314 . 0 0 "[ . 1]" 1
861 1 44 ALA MB 1 76 THR HA . . 4.090 3.384 3.178 3.542 . 0 0 "[ . 1]" 1
862 1 44 ALA MB 1 79 ALA H . . 4.170 3.903 3.681 4.196 0.026 8 0 "[ . 1]" 1
863 1 44 ALA MB 1 79 ALA MB . . 3.080 1.872 1.837 1.898 . 0 0 "[ . 1]" 1
864 1 44 ALA MB 1 80 LYS H . . 3.340 2.734 2.491 3.138 . 0 0 "[ . 1]" 1
865 1 44 ALA MB 1 80 LYS HA . . 3.670 3.335 3.029 3.420 . 0 0 "[ . 1]" 1
866 1 44 ALA MB 1 80 LYS HB2 . . 5.040 4.099 3.954 4.227 . 0 0 "[ . 1]" 1
867 1 44 ALA MB 1 80 LYS HB3 . . 4.830 4.333 4.068 4.504 . 0 0 "[ . 1]" 1
868 1 44 ALA MB 1 80 LYS QE . . 3.990 3.090 2.524 3.797 . 0 0 "[ . 1]" 1
869 1 44 ALA MB 1 80 LYS HG2 . . 3.420 2.793 2.473 2.942 . 0 0 "[ . 1]" 1
870 1 44 ALA MB 1 80 LYS QG . . 2.820 1.955 1.827 2.039 . 0 0 "[ . 1]" 1
871 1 44 ALA MB 1 80 LYS HG3 . . 3.420 1.998 1.882 2.089 . 0 0 "[ . 1]" 1
872 1 44 ALA MB 1 82 ALA H . . 5.500 5.545 5.522 5.617 0.117 2 0 "[ . 1]" 1
873 1 44 ALA MB 1 83 TYR H . . 5.500 5.457 5.349 5.512 0.012 6 0 "[ . 1]" 1
874 1 45 THR H 1 45 THR HB . . 3.010 2.607 2.567 2.634 . 0 0 "[ . 1]" 1
875 1 45 THR H 1 45 THR MG . . 3.830 3.835 3.820 3.848 0.018 4 0 "[ . 1]" 1
876 1 45 THR H 1 46 VAL H . . 2.910 2.160 1.983 2.241 . 0 0 "[ . 1]" 1
877 1 45 THR H 1 46 VAL HB . . 4.630 4.446 4.360 4.509 . 0 0 "[ . 1]" 1
878 1 45 THR H 1 46 VAL QG . . 5.440 4.019 3.828 4.097 . 0 0 "[ . 1]" 1
879 1 45 THR H 1 47 GLY H . . 3.900 3.795 3.706 3.909 0.009 2 0 "[ . 1]" 1
880 1 45 THR H 1 76 THR MG . . 5.240 4.749 4.641 4.985 . 0 0 "[ . 1]" 1
881 1 45 THR H 1 79 ALA MB . . 4.600 4.476 4.335 4.565 . 0 0 "[ . 1]" 1
882 1 45 THR HA 1 45 THR MG . . 3.280 2.404 2.361 2.422 . 0 0 "[ . 1]" 1
883 1 45 THR HB 1 46 VAL H . . 3.240 2.411 2.350 2.717 . 0 0 "[ . 1]" 1
884 1 45 THR HB 1 46 VAL QG . . 4.520 2.913 2.760 3.024 . 0 0 "[ . 1]" 1
885 1 45 THR MG 1 46 VAL H . . 3.480 3.214 3.135 3.469 . 0 0 "[ . 1]" 1
886 1 45 THR MG 1 47 GLY H . . 5.390 5.317 5.244 5.414 0.024 8 0 "[ . 1]" 1
887 1 46 VAL H 1 46 VAL HB . . 2.940 2.518 2.491 2.609 . 0 0 "[ . 1]" 1
888 1 46 VAL H 1 46 VAL MG1 . . 3.990 3.792 3.777 3.833 . 0 0 "[ . 1]" 1
889 1 46 VAL H 1 46 VAL QG . . 2.880 2.410 2.269 2.518 . 0 0 "[ . 1]" 1
890 1 46 VAL H 1 46 VAL MG2 . . 3.990 2.438 2.287 2.553 . 0 0 "[ . 1]" 1
891 1 46 VAL H 1 47 GLY H . . 2.760 2.621 2.441 2.714 . 0 0 "[ . 1]" 1
892 1 46 VAL HA 1 46 VAL MG1 . . 3.040 2.333 2.283 2.355 . 0 0 "[ . 1]" 1
893 1 46 VAL HA 1 46 VAL MG2 . . 3.040 2.376 2.279 2.431 . 0 0 "[ . 1]" 1
894 1 46 VAL HB 1 47 GLY H . . 2.980 2.087 2.051 2.143 . 0 0 "[ . 1]" 1
895 1 46 VAL HB 1 68 TRP HE1 . . 4.200 3.562 3.376 3.690 . 0 0 "[ . 1]" 1
896 1 46 VAL HB 1 68 TRP HZ2 . . 3.420 3.028 2.642 3.170 . 0 0 "[ . 1]" 1
897 1 46 VAL QG 1 48 ASP H . . 4.210 2.299 2.091 2.460 . 0 0 "[ . 1]" 1
898 1 46 VAL QG 1 49 CYS H . . 5.440 5.132 4.985 5.276 . 0 0 "[ . 1]" 1
899 1 46 VAL QG 1 49 CYS HA . . 4.750 4.236 3.956 4.340 . 0 0 "[ . 1]" 1
900 1 46 VAL QG 1 50 ASN H . . 5.070 4.676 4.190 4.909 . 0 0 "[ . 1]" 1
901 1 46 VAL QG 1 50 ASN QB . . 5.280 4.544 4.179 4.823 . 0 0 "[ . 1]" 1
902 1 46 VAL QG 1 50 ASN QD . . 3.310 2.574 2.220 2.874 . 0 0 "[ . 1]" 1
903 1 46 VAL QG 1 68 TRP HZ2 . . 2.710 2.550 2.410 2.630 . 0 0 "[ . 1]" 1
904 1 46 VAL MG1 1 47 GLY H . . 3.880 3.018 2.950 3.177 . 0 0 "[ . 1]" 1
905 1 46 VAL MG1 1 50 ASN HD21 . . 5.480 3.225 2.839 3.400 . 0 0 "[ . 1]" 1
906 1 46 VAL MG1 1 50 ASN HD22 . . 5.480 2.798 2.263 3.198 . 0 0 "[ . 1]" 1
907 1 46 VAL MG1 1 68 TRP HE1 . . 4.360 4.317 4.198 4.374 0.014 5 0 "[ . 1]" 1
908 1 46 VAL MG1 1 68 TRP HZ2 . . 3.320 3.145 2.890 3.325 0.005 1 0 "[ . 1]" 1
909 1 46 VAL MG2 1 47 GLY H . . 3.880 3.635 3.583 3.664 . 0 0 "[ . 1]" 1
910 1 46 VAL MG2 1 50 ASN HD21 . . 5.480 5.167 4.682 5.483 0.003 3 0 "[ . 1]" 1
911 1 46 VAL MG2 1 50 ASN HD22 . . 5.480 4.726 3.938 5.479 . 0 0 "[ . 1]" 1
912 1 46 VAL MG2 1 68 TRP HE1 . . 4.360 4.225 4.011 4.374 0.014 2 0 "[ . 1]" 1
913 1 46 VAL MG2 1 68 TRP HZ2 . . 3.320 2.701 2.577 2.838 . 0 0 "[ . 1]" 1
914 1 47 GLY H 1 47 GLY HA2 . . 2.940 2.578 2.476 2.621 . 0 0 "[ . 1]" 1
915 1 47 GLY H 1 48 ASP H . . 3.650 2.669 2.341 2.867 . 0 0 "[ . 1]" 1
916 1 47 GLY H 1 68 TRP HE1 . . 4.240 3.892 3.789 4.031 . 0 0 "[ . 1]" 1
917 1 47 GLY HA3 1 48 ASP H . . 3.100 2.781 2.651 3.039 . 0 0 "[ . 1]" 1
918 1 48 ASP H 1 48 ASP HB3 . . 3.700 3.357 3.185 3.657 . 0 0 "[ . 1]" 1
919 1 48 ASP H 1 49 CYS H . . 4.470 4.376 4.350 4.395 . 0 0 "[ . 1]" 1
920 1 48 ASP H 1 49 CYS HA . . 5.450 4.772 4.622 4.855 . 0 0 "[ . 1]" 1
921 1 48 ASP H 1 68 TRP HE1 . . 4.810 4.296 3.819 4.633 . 0 0 "[ . 1]" 1
922 1 48 ASP H 1 73 GLY H . . 5.500 4.970 4.351 5.330 . 0 0 "[ . 1]" 1
923 1 48 ASP HA 1 49 CYS H . . 3.030 2.374 2.304 2.433 . 0 0 "[ . 1]" 1
924 1 48 ASP HA 1 49 CYS HB2 . . 4.840 4.570 4.437 4.651 . 0 0 "[ . 1]" 1
925 1 48 ASP HA 1 49 CYS HB3 . . 4.880 4.744 4.691 4.839 . 0 0 "[ . 1]" 1
926 1 48 ASP HA 1 68 TRP HE1 . . 4.540 3.997 3.844 4.211 . 0 0 "[ . 1]" 1
927 1 48 ASP HA 1 72 ARG HA . . 4.070 2.663 2.184 3.112 . 0 0 "[ . 1]" 1
928 1 48 ASP HA 1 72 ARG QG . . 5.340 4.086 3.419 5.343 0.003 7 0 "[ . 1]" 1
929 1 48 ASP HA 1 73 GLY H . . 3.300 3.016 2.225 3.307 0.007 4 0 "[ . 1]" 1
930 1 48 ASP HB2 1 49 CYS H . . 3.790 2.551 2.362 2.709 . 0 0 "[ . 1]" 1
931 1 48 ASP HB2 1 49 CYS HA . . 4.990 4.845 4.568 4.994 0.004 9 0 "[ . 1]" 1
932 1 48 ASP HB2 1 72 ARG HA . . 4.330 2.612 2.156 3.086 . 0 0 "[ . 1]" 1
933 1 48 ASP HB2 1 72 ARG QB . . 4.280 3.190 2.081 3.674 . 0 0 "[ . 1]" 1
934 1 48 ASP HB2 1 72 ARG QG . . 4.930 2.972 1.986 4.864 . 0 0 "[ . 1]" 1
935 1 48 ASP HB3 1 49 CYS H . . 4.030 3.841 3.482 3.994 . 0 0 "[ . 1]" 1
936 1 48 ASP HB3 1 72 ARG HA . . 4.330 3.208 2.488 3.622 . 0 0 "[ . 1]" 1
937 1 48 ASP HB3 1 72 ARG QG . . 5.340 4.203 3.015 5.341 0.001 8 0 "[ . 1]" 1
938 1 48 ASP HB3 1 73 GLY H . . 4.150 2.135 1.944 2.560 . 0 0 "[ . 1]" 1
939 1 48 ASP HB3 1 74 MET H . . 5.150 4.427 4.247 4.783 . 0 0 "[ . 1]" 1
940 1 49 CYS H 1 49 CYS HB2 . . 3.440 2.730 2.597 2.841 . 0 0 "[ . 1]" 1
941 1 49 CYS H 1 49 CYS HB3 . . 3.720 2.428 2.391 2.500 . 0 0 "[ . 1]" 1
942 1 49 CYS H 1 50 ASN H . . 4.670 4.570 4.441 4.615 . 0 0 "[ . 1]" 1
943 1 49 CYS H 1 68 TRP HE1 . . 4.370 4.365 4.324 4.387 0.017 6 0 "[ . 1]" 1
944 1 49 CYS H 1 69 ASN HA . . 4.230 3.488 3.152 3.629 . 0 0 "[ . 1]" 1
945 1 49 CYS H 1 69 ASN HB2 . . 5.500 5.432 5.066 5.518 0.018 7 0 "[ . 1]" 1
946 1 49 CYS H 1 72 ARG H . . 5.140 4.665 4.460 5.026 . 0 0 "[ . 1]" 1
947 1 49 CYS H 1 72 ARG HA . . 3.980 2.923 2.480 3.194 . 0 0 "[ . 1]" 1
948 1 49 CYS H 1 72 ARG QB . . 4.780 3.788 2.700 4.426 . 0 0 "[ . 1]" 1
949 1 49 CYS H 1 72 ARG HG2 . . 5.500 3.303 2.230 5.376 . 0 0 "[ . 1]" 1
950 1 49 CYS H 1 72 ARG QG . . 4.800 3.061 2.156 4.817 0.017 8 0 "[ . 1]" 1
951 1 49 CYS H 1 72 ARG HG3 . . 5.500 3.695 2.559 5.516 0.016 1 0 "[ . 1]" 1
952 1 49 CYS HA 1 50 ASN H . . 3.110 2.200 2.145 2.243 . 0 0 "[ . 1]" 1
953 1 49 CYS HA 1 68 TRP HE1 . . 3.710 3.662 3.498 3.730 0.020 10 0 "[ . 1]" 1
954 1 49 CYS HA 1 68 TRP HZ2 . . 4.290 3.318 3.236 3.435 . 0 0 "[ . 1]" 1
955 1 49 CYS HA 1 69 ASN HA . . 5.220 4.834 4.631 4.926 . 0 0 "[ . 1]" 1
956 1 49 CYS HB2 1 50 ASN H . . 4.280 4.060 3.993 4.255 . 0 0 "[ . 1]" 1
957 1 49 CYS HB2 1 68 TRP HE1 . . 4.390 4.076 3.592 4.359 . 0 0 "[ . 1]" 1
958 1 49 CYS HB2 1 69 ASN H . . 4.590 3.823 3.516 4.043 . 0 0 "[ . 1]" 1
959 1 49 CYS HB2 1 69 ASN HA . . 3.880 2.810 2.396 2.929 . 0 0 "[ . 1]" 1
960 1 49 CYS HB2 1 69 ASN HB2 . . 5.210 3.891 3.602 4.117 . 0 0 "[ . 1]" 1
961 1 49 CYS HB3 1 69 ASN HA . . 3.420 2.031 1.991 2.101 . 0 0 "[ . 1]" 1
962 1 50 ASN H 1 50 ASN QB . . 3.590 3.152 2.925 3.377 . 0 0 "[ . 1]" 1
963 1 50 ASN H 1 50 ASN HD21 . . 4.650 3.383 2.682 4.351 . 0 0 "[ . 1]" 1
964 1 50 ASN H 1 50 ASN QD . . 4.040 3.198 2.634 3.903 . 0 0 "[ . 1]" 1
965 1 50 ASN H 1 50 ASN HD22 . . 4.650 4.044 3.566 4.414 . 0 0 "[ . 1]" 1
966 1 50 ASN H 1 51 LYS QE . . 4.780 4.219 3.614 4.793 0.013 3 0 "[ . 1]" 1
967 1 50 ASN H 1 51 LYS HG2 . . 4.770 3.194 2.927 4.780 0.010 3 0 "[ . 1]" 1
968 1 50 ASN H 1 51 LYS HG3 . . 4.770 4.262 3.221 4.593 . 0 0 "[ . 1]" 1
969 1 50 ASN QB 1 50 ASN QD . . 3.020 2.140 2.067 2.262 . 0 0 "[ . 1]" 1
970 1 50 ASN HB2 1 51 LYS H . . 4.670 4.367 4.225 4.497 . 0 0 "[ . 1]" 1
971 1 50 ASN HB3 1 51 LYS H . . 4.670 4.575 4.410 4.656 . 0 0 "[ . 1]" 1
972 1 51 LYS H 1 51 LYS HB2 . . 2.860 2.555 2.435 2.742 . 0 0 "[ . 1]" 1
973 1 51 LYS H 1 51 LYS HB3 . . 3.800 3.706 3.620 3.794 . 0 0 "[ . 1]" 1
974 1 51 LYS H 1 51 LYS QE . . 5.040 4.425 3.721 5.047 0.007 2 0 "[ . 1]" 1
975 1 51 LYS H 1 51 LYS QG . . 3.920 3.102 2.747 3.654 . 0 0 "[ . 1]" 1
976 1 51 LYS H 1 52 PRO HA . . 5.500 5.247 5.126 5.389 . 0 0 "[ . 1]" 1
977 1 51 LYS H 1 52 PRO HD2 . . 4.960 4.801 4.791 4.814 . 0 0 "[ . 1]" 1
978 1 51 LYS H 1 52 PRO HD3 . . 5.100 5.009 4.969 5.051 . 0 0 "[ . 1]" 1
979 1 51 LYS H 1 65 TRP HE1 . . 4.050 3.691 3.581 3.786 . 0 0 "[ . 1]" 1
980 1 51 LYS HB2 1 51 LYS QE . . 4.680 3.921 2.407 4.247 . 0 0 "[ . 1]" 1
981 1 51 LYS HB2 1 52 PRO HD2 . . 4.130 3.580 3.421 3.638 . 0 0 "[ . 1]" 1
982 1 51 LYS HB2 1 65 TRP HD1 . . 4.110 3.850 3.490 4.063 . 0 0 "[ . 1]" 1
983 1 51 LYS HB2 1 65 TRP HE1 . . 3.290 3.136 2.890 3.294 0.004 3 0 "[ . 1]" 1
984 1 51 LYS HB3 1 51 LYS QE . . 4.070 3.629 2.412 4.003 . 0 0 "[ . 1]" 1
985 1 51 LYS HB3 1 52 PRO HD2 . . 3.460 1.991 1.962 2.118 . 0 0 "[ . 1]" 1
986 1 51 LYS HB3 1 52 PRO HD3 . . 3.810 3.439 3.393 3.543 . 0 0 "[ . 1]" 1
987 1 51 LYS HB3 1 65 TRP HD1 . . 4.780 4.517 3.996 4.781 0.001 7 0 "[ . 1]" 1
988 1 51 LYS HB3 1 65 TRP HE1 . . 4.200 3.670 3.071 4.088 . 0 0 "[ . 1]" 1
989 1 51 LYS QD 1 51 LYS QG . . 2.370 2.046 2.005 2.091 . 0 0 "[ . 1]" 1
990 1 51 LYS QD 1 52 PRO HD2 . . 3.430 2.231 1.956 3.114 . 0 0 "[ . 1]" 1
991 1 51 LYS QE 1 51 LYS QG . . 3.170 2.116 1.967 2.480 . 0 0 "[ . 1]" 1
992 1 51 LYS QE 1 52 PRO HD2 . . 4.410 3.852 3.121 4.382 . 0 0 "[ . 1]" 1
993 1 51 LYS QG 1 52 PRO HD2 . . 4.320 3.546 2.613 3.869 . 0 0 "[ . 1]" 1
994 1 51 LYS QG 1 52 PRO HD3 . . 5.250 4.372 3.259 4.565 . 0 0 "[ . 1]" 1
995 1 51 LYS HG2 1 52 PRO HD2 . . 5.060 4.034 2.652 4.279 . 0 0 "[ . 1]" 1
996 1 51 LYS HG2 1 65 TRP HE1 . . 5.500 5.520 5.494 5.547 0.047 6 0 "[ . 1]" 1
997 1 51 LYS HG3 1 52 PRO HD2 . . 5.060 4.038 3.836 4.726 . 0 0 "[ . 1]" 1
998 1 51 LYS HG3 1 65 TRP HE1 . . 5.500 5.376 4.888 5.494 . 0 0 "[ . 1]" 1
999 1 52 PRO HA 1 53 LYS H . . 2.470 2.261 2.212 2.292 . 0 0 "[ . 1]" 1
1000 1 52 PRO HA 1 53 LYS HB2 . . 4.870 4.547 4.462 4.584 . 0 0 "[ . 1]" 1
1001 1 52 PRO HA 1 53 LYS HB3 . . 4.970 4.810 4.770 4.843 . 0 0 "[ . 1]" 1
1002 1 52 PRO HA 1 65 TRP HE1 . . 4.180 4.018 3.940 4.130 . 0 0 "[ . 1]" 1
1003 1 52 PRO HA 1 65 TRP HZ2 . . 4.130 3.648 3.451 3.878 . 0 0 "[ . 1]" 1
1004 1 52 PRO QB 1 53 LYS H . . 3.200 2.878 2.792 3.023 . 0 0 "[ . 1]" 1
1005 1 52 PRO HD2 1 65 TRP HE1 . . 4.820 4.737 4.462 4.806 . 0 0 "[ . 1]" 1
1006 1 52 PRO HD3 1 53 LYS H . . 5.500 5.587 5.579 5.593 0.093 9 0 "[ . 1]" 1
1007 1 52 PRO HD3 1 65 TRP HE1 . . 5.500 5.506 5.319 5.555 0.055 6 0 "[ . 1]" 1
1008 1 52 PRO QG 1 53 LYS H . . 4.620 4.411 4.352 4.505 . 0 0 "[ . 1]" 1
1009 1 53 LYS H 1 53 LYS HB2 . . 2.810 2.481 2.391 2.509 . 0 0 "[ . 1]" 1
1010 1 53 LYS H 1 53 LYS HB3 . . 2.860 2.563 2.534 2.657 . 0 0 "[ . 1]" 1
1011 1 53 LYS H 1 53 LYS QD . . 4.700 4.183 4.063 4.250 . 0 0 "[ . 1]" 1
1012 1 53 LYS H 1 53 LYS HG3 . . 4.670 4.429 4.409 4.461 . 0 0 "[ . 1]" 1
1013 1 53 LYS H 1 54 PRO HD2 . . 4.840 4.786 4.774 4.798 . 0 0 "[ . 1]" 1
1014 1 53 LYS H 1 54 PRO HD3 . . 4.890 4.844 4.781 4.863 . 0 0 "[ . 1]" 1
1015 1 53 LYS H 1 65 TRP HE1 . . 4.220 4.248 4.222 4.264 0.044 3 0 "[ . 1]" 1
1016 1 53 LYS H 1 65 TRP HZ2 . . 4.170 3.604 3.442 3.959 . 0 0 "[ . 1]" 1
1017 1 53 LYS HA 1 53 LYS QD . . 4.660 2.495 2.290 2.918 . 0 0 "[ . 1]" 1
1018 1 53 LYS HA 1 53 LYS HG3 . . 4.120 2.733 2.566 2.759 . 0 0 "[ . 1]" 1
1019 1 53 LYS HA 1 54 PRO HD2 . . 3.310 2.135 2.068 2.150 . 0 0 "[ . 1]" 1
1020 1 53 LYS HA 1 54 PRO HD3 . . 3.220 2.257 2.254 2.271 . 0 0 "[ . 1]" 1
1021 1 53 LYS HA 1 54 PRO HG2 . . 4.530 4.300 4.248 4.313 . 0 0 "[ . 1]" 1
1022 1 53 LYS HA 1 54 PRO HG3 . . 4.680 4.344 4.326 4.350 . 0 0 "[ . 1]" 1
1023 1 53 LYS HA 1 65 TRP HD1 . . 4.980 4.046 3.818 4.187 . 0 0 "[ . 1]" 1
1024 1 53 LYS HA 1 65 TRP HE1 . . 3.530 3.239 3.169 3.317 . 0 0 "[ . 1]" 1
1025 1 53 LYS HA 1 65 TRP HE3 . . 5.140 4.847 4.743 5.117 . 0 0 "[ . 1]" 1
1026 1 53 LYS HA 1 65 TRP HZ2 . . 5.410 3.662 3.536 4.011 . 0 0 "[ . 1]" 1
1027 1 53 LYS HB2 1 53 LYS QD . . 3.090 2.218 2.050 2.368 . 0 0 "[ . 1]" 1
1028 1 53 LYS HB2 1 53 LYS QE . . 4.490 3.640 2.385 4.025 . 0 0 "[ . 1]" 1
1029 1 53 LYS HB2 1 54 PRO HD2 . . 5.070 3.707 3.659 3.802 . 0 0 "[ . 1]" 1
1030 1 53 LYS HB2 1 54 PRO HD3 . . 5.270 4.609 4.574 4.676 . 0 0 "[ . 1]" 1
1031 1 53 LYS HB2 1 65 TRP HE1 . . 5.190 4.990 4.851 5.120 . 0 0 "[ . 1]" 1
1032 1 53 LYS HB2 1 65 TRP HE3 . . 5.500 5.374 5.196 5.503 0.003 7 0 "[ . 1]" 1
1033 1 53 LYS HB3 1 53 LYS QD . . 3.410 3.239 3.087 3.392 . 0 0 "[ . 1]" 1
1034 1 53 LYS HB3 1 53 LYS QE . . 4.390 4.147 3.322 4.393 0.003 7 0 "[ . 1]" 1
1035 1 53 LYS HB3 1 54 PRO HD2 . . 4.580 4.016 3.970 4.146 . 0 0 "[ . 1]" 1
1036 1 53 LYS HB3 1 54 PRO HD3 . . 5.100 4.917 4.886 4.982 . 0 0 "[ . 1]" 1
1037 1 53 LYS HB3 1 65 TRP HZ2 . . 5.500 5.242 5.103 5.508 0.008 6 0 "[ . 1]" 1
1038 1 53 LYS QD 1 54 PRO HD2 . . 3.960 2.147 1.986 2.652 . 0 0 "[ . 1]" 1
1039 1 53 LYS QD 1 54 PRO HD3 . . 4.530 3.443 3.304 4.067 . 0 0 "[ . 1]" 1
1040 1 53 LYS QD 1 65 TRP HE1 . . 5.340 4.723 4.318 4.985 . 0 0 "[ . 1]" 1
1041 1 53 LYS QD 1 65 TRP HZ2 . . 4.630 4.152 3.858 4.485 . 0 0 "[ . 1]" 1
1042 1 53 LYS QE 1 53 LYS HG2 . . 3.320 2.467 2.322 2.728 . 0 0 "[ . 1]" 1
1043 1 53 LYS QE 1 53 LYS HG3 . . 3.460 2.829 2.267 3.461 0.001 9 0 "[ . 1]" 1
1044 1 53 LYS HG2 1 54 PRO HD2 . . 4.030 3.580 3.544 3.724 . 0 0 "[ . 1]" 1
1045 1 53 LYS HG2 1 54 PRO HD3 . . 5.460 5.121 5.095 5.186 . 0 0 "[ . 1]" 1
1046 1 53 LYS HG3 1 54 PRO HD2 . . 3.960 1.987 1.964 1.995 . 0 0 "[ . 1]" 1
1047 1 53 LYS HG3 1 54 PRO HD3 . . 4.530 3.504 3.475 3.546 . 0 0 "[ . 1]" 1
1048 1 53 LYS HG3 1 54 PRO HG2 . . 4.970 3.198 3.159 3.298 . 0 0 "[ . 1]" 1
1049 1 53 LYS HG3 1 65 TRP HE3 . . 5.500 5.517 5.502 5.554 0.054 10 0 "[ . 1]" 1
1050 1 54 PRO HA 1 55 GLY H . . 2.720 2.713 2.704 2.721 0.001 9 0 "[ . 1]" 1
1051 1 54 PRO HA 1 55 GLY HA2 . . 4.370 4.337 4.333 4.344 . 0 0 "[ . 1]" 1
1052 1 54 PRO HA 1 55 GLY HA3 . . 4.780 4.748 4.721 4.778 . 0 0 "[ . 1]" 1
1053 1 54 PRO HA 1 61 GLU QB . . 4.850 4.590 4.428 4.682 . 0 0 "[ . 1]" 1
1054 1 54 PRO HB2 1 55 GLY H . . 3.380 1.932 1.917 1.950 . 0 0 "[ . 1]" 1
1055 1 54 PRO HB2 1 58 GLN HB2 . . 4.730 4.361 4.002 4.588 . 0 0 "[ . 1]" 1
1056 1 54 PRO HB2 1 58 GLN HE21 . . 4.650 3.846 3.195 4.378 . 0 0 "[ . 1]" 1
1057 1 54 PRO HB3 1 55 GLY H . . 3.210 3.159 3.154 3.166 . 0 0 "[ . 1]" 1
1058 1 54 PRO HD2 1 55 GLY H . . 5.500 5.288 5.279 5.300 . 0 0 "[ . 1]" 1
1059 1 54 PRO HD2 1 62 LYS HA . . 4.940 4.662 4.575 4.853 . 0 0 "[ . 1]" 1
1060 1 54 PRO HD2 1 65 TRP HB2 . . 4.370 3.595 3.315 3.720 . 0 0 "[ . 1]" 1
1061 1 54 PRO HD2 1 65 TRP HB3 . . 4.320 3.859 3.757 3.923 . 0 0 "[ . 1]" 1
1062 1 54 PRO HD2 1 65 TRP HD1 . . 4.580 4.234 3.752 4.435 . 0 0 "[ . 1]" 1
1063 1 54 PRO HD2 1 65 TRP HE1 . . 4.930 4.646 4.453 4.729 . 0 0 "[ . 1]" 1
1064 1 54 PRO HD3 1 55 GLY H . . 5.500 5.333 5.326 5.341 . 0 0 "[ . 1]" 1
1065 1 54 PRO HD3 1 65 TRP HD1 . . 4.360 2.730 2.452 2.842 . 0 0 "[ . 1]" 1
1066 1 54 PRO HD3 1 65 TRP HE1 . . 3.830 3.550 3.478 3.592 . 0 0 "[ . 1]" 1
1067 1 54 PRO HG2 1 61 GLU QB . . 3.680 2.647 1.966 3.008 . 0 0 "[ . 1]" 1
1068 1 54 PRO HG2 1 61 GLU QG . . 4.400 2.484 1.985 3.833 . 0 0 "[ . 1]" 1
1069 1 54 PRO HG2 1 62 LYS HA . . 4.450 4.058 3.843 4.274 . 0 0 "[ . 1]" 1
1070 1 54 PRO HG2 1 65 TRP HB2 . . 5.330 3.830 3.607 3.880 . 0 0 "[ . 1]" 1
1071 1 54 PRO HG2 1 65 TRP HB3 . . 5.220 4.484 4.416 4.562 . 0 0 "[ . 1]" 1
1072 1 54 PRO HG3 1 55 GLY H . . 4.590 4.538 4.524 4.555 . 0 0 "[ . 1]" 1
1073 1 54 PRO HG3 1 61 GLU HA . . 4.700 3.643 3.081 3.906 . 0 0 "[ . 1]" 1
1074 1 54 PRO HG3 1 61 GLU QG . . 4.920 3.204 2.670 4.809 . 0 0 "[ . 1]" 1
1075 1 54 PRO HG3 1 62 LYS HA . . 4.780 4.061 3.725 4.789 0.009 6 0 "[ . 1]" 1
1076 1 54 PRO HG3 1 65 TRP HB2 . . 4.860 2.479 2.343 2.620 . 0 0 "[ . 1]" 1
1077 1 54 PRO HG3 1 65 TRP HB3 . . 4.860 3.704 3.478 4.042 . 0 0 "[ . 1]" 1
1078 1 54 PRO HG3 1 65 TRP HD1 . . 4.440 3.884 3.525 3.991 . 0 0 "[ . 1]" 1
1079 1 55 GLY H 1 55 GLY HA3 . . 2.840 2.295 2.294 2.300 . 0 0 "[ . 1]" 1
1080 1 55 GLY H 1 57 LEU MD1 . . 4.970 4.706 4.451 4.924 . 0 0 "[ . 1]" 1
1081 1 55 GLY H 1 58 GLN H . . 5.500 5.264 5.214 5.354 . 0 0 "[ . 1]" 1
1082 1 55 GLY H 1 58 GLN HB2 . . 4.370 4.278 4.106 4.392 0.022 6 0 "[ . 1]" 1
1083 1 55 GLY H 1 58 GLN HB3 . . 5.500 5.501 5.336 5.590 0.090 10 0 "[ . 1]" 1
1084 1 55 GLY H 1 58 GLN HE21 . . 4.930 3.930 3.389 4.974 0.044 9 0 "[ . 1]" 1
1085 1 55 GLY H 1 58 GLN HE22 . . 5.420 4.671 2.393 5.431 0.011 1 0 "[ . 1]" 1
1086 1 55 GLY HA2 1 56 MET H . . 3.110 2.662 2.415 2.920 . 0 0 "[ . 1]" 1
1087 1 55 GLY HA2 1 58 GLN HB2 . . 5.500 5.469 5.223 5.581 0.081 10 0 "[ . 1]" 1
1088 1 55 GLY HA3 1 56 MET H . . 3.260 2.480 2.266 2.724 . 0 0 "[ . 1]" 1
1089 1 55 GLY HA3 1 58 GLN HB2 . . 4.440 3.847 3.561 4.027 . 0 0 "[ . 1]" 1
1090 1 55 GLY HA3 1 58 GLN HG3 . . 4.860 4.857 4.760 4.924 0.064 1 0 "[ . 1]" 1
1091 1 56 MET H 1 56 MET HB2 . . 2.960 2.637 2.424 2.968 0.008 3 0 "[ . 1]" 1
1092 1 56 MET H 1 56 MET HB3 . . 3.530 3.200 2.959 3.353 . 0 0 "[ . 1]" 1
1093 1 56 MET HA 1 56 MET HB2 . . 2.970 2.774 2.616 2.860 . 0 0 "[ . 1]" 1
1094 1 56 MET HA 1 57 LEU H . . 3.510 3.219 3.074 3.521 0.011 9 0 "[ . 1]" 1
1095 1 56 MET HA 1 58 GLN H . . 3.850 3.693 3.519 3.789 . 0 0 "[ . 1]" 1
1096 1 56 MET HB2 1 57 LEU H . . 4.170 3.990 3.661 4.174 0.004 10 0 "[ . 1]" 1
1097 1 56 MET HB3 1 57 LEU H . . 4.870 3.636 2.723 4.057 . 0 0 "[ . 1]" 1
1098 1 56 MET HB3 1 57 LEU HB3 . . 4.700 4.461 4.097 4.667 . 0 0 "[ . 1]" 1
1099 1 56 MET HB3 1 57 LEU MD1 . . 4.130 3.571 3.107 4.050 . 0 0 "[ . 1]" 1
1100 1 57 LEU H 1 57 LEU HB2 . . 3.940 3.665 3.571 3.732 . 0 0 "[ . 1]" 1
1101 1 57 LEU H 1 57 LEU HB3 . . 3.350 3.051 2.374 3.373 0.023 10 0 "[ . 1]" 1
1102 1 57 LEU H 1 57 LEU MD1 . . 3.470 1.971 1.810 2.095 . 0 0 "[ . 1]" 1
1103 1 57 LEU H 1 57 LEU MD2 . . 4.240 2.416 1.846 3.722 . 0 0 "[ . 1]" 1
1104 1 57 LEU H 1 57 LEU HG . . 3.890 3.771 3.670 3.865 . 0 0 "[ . 1]" 1
1105 1 57 LEU H 1 58 GLN H . . 3.040 2.120 1.879 2.619 . 0 0 "[ . 1]" 1
1106 1 57 LEU H 1 58 GLN HB2 . . 4.460 3.869 3.555 4.466 0.006 3 0 "[ . 1]" 1
1107 1 57 LEU H 1 58 GLN HG3 . . 4.820 4.619 3.955 4.921 0.101 3 0 "[ . 1]" 1
1108 1 57 LEU HA 1 57 LEU MD1 . . 3.420 3.345 3.314 3.414 . 0 0 "[ . 1]" 1
1109 1 57 LEU HA 1 57 LEU MD2 . . 3.440 3.419 3.399 3.430 . 0 0 "[ . 1]" 1
1110 1 57 LEU HA 1 57 LEU HG . . 4.270 4.270 4.268 4.272 0.002 3 0 "[ . 1]" 1
1111 1 57 LEU HA 1 58 GLN H . . 3.370 3.282 3.124 3.336 . 0 0 "[ . 1]" 1
1112 1 57 LEU HB2 1 58 GLN HA . . 5.260 4.637 4.481 4.922 . 0 0 "[ . 1]" 1
1113 1 57 LEU HB3 1 57 LEU MD1 . . 3.120 2.238 2.145 2.452 . 0 0 "[ . 1]" 1
1114 1 57 LEU MD1 1 58 GLN HE21 . . 5.500 5.049 3.880 5.547 0.047 10 0 "[ . 1]" 1
1115 1 57 LEU MD2 1 58 GLN H . . 4.330 2.465 2.159 3.044 . 0 0 "[ . 1]" 1
1116 1 57 LEU MD2 1 58 GLN HB2 . . 3.780 2.947 2.594 3.579 . 0 0 "[ . 1]" 1
1117 1 58 GLN H 1 58 GLN HB2 . . 2.880 2.284 2.195 2.462 . 0 0 "[ . 1]" 1
1118 1 58 GLN H 1 58 GLN HG3 . . 3.620 3.534 3.269 3.683 0.063 2 0 "[ . 1]" 1
1119 1 58 GLN HA 1 58 GLN HE21 . . 4.950 4.547 4.294 4.654 . 0 0 "[ . 1]" 1
1120 1 58 GLN HA 1 58 GLN HG2 . . 3.560 2.315 2.154 3.046 . 0 0 "[ . 1]" 1
1121 1 58 GLN HA 1 59 LEU H . . 2.920 2.237 2.194 2.367 . 0 0 "[ . 1]" 1
1122 1 58 GLN HA 1 59 LEU HB2 . . 5.500 4.691 4.601 4.860 . 0 0 "[ . 1]" 1
1123 1 58 GLN HA 1 60 GLN H . . 5.000 4.471 4.337 4.735 . 0 0 "[ . 1]" 1
1124 1 58 GLN HA 1 61 GLU QG . . 4.750 4.315 3.652 4.736 . 0 0 "[ . 1]" 1
1125 1 58 GLN HB3 1 58 GLN HE22 . . 4.490 3.632 3.511 4.135 . 0 0 "[ . 1]" 1
1126 1 58 GLN HB3 1 59 LEU H . . 4.710 3.039 2.761 3.141 . 0 0 "[ . 1]" 1
1127 1 58 GLN HB3 1 60 GLN HE21 . . 5.500 4.222 3.134 5.535 0.035 1 0 "[ . 1]" 1
1128 1 58 GLN HE21 1 61 GLU HA . . 5.080 4.389 3.595 4.908 . 0 0 "[ . 1]" 1
1129 1 58 GLN HE21 1 61 GLU QG . . 4.550 3.893 3.619 3.971 . 0 0 "[ . 1]" 1
1130 1 58 GLN HE22 1 61 GLU QG . . 4.840 4.936 4.769 5.064 0.224 9 0 "[ . 1]" 1
1131 1 58 GLN HG2 1 59 LEU H . . 4.240 3.461 2.894 4.262 0.022 10 0 "[ . 1]" 1
1132 1 59 LEU H 1 59 LEU HB2 . . 3.070 2.522 2.463 2.593 . 0 0 "[ . 1]" 1
1133 1 59 LEU H 1 59 LEU QD . . 3.630 2.703 1.928 3.102 . 0 0 "[ . 1]" 1
1134 1 59 LEU H 1 59 LEU HG . . 3.890 2.858 2.555 3.958 0.068 6 0 "[ . 1]" 1
1135 1 59 LEU H 1 60 GLN H . . 3.650 2.457 2.358 2.499 . 0 0 "[ . 1]" 1
1136 1 59 LEU H 1 60 GLN QG . . 5.340 4.610 3.511 5.341 0.001 7 0 "[ . 1]" 1
1137 1 59 LEU HA 1 59 LEU MD1 . . 3.900 3.638 2.073 3.922 0.022 10 0 "[ . 1]" 1
1138 1 59 LEU HA 1 59 LEU QD . . 3.160 2.717 2.056 3.083 . 0 0 "[ . 1]" 1
1139 1 59 LEU HA 1 59 LEU MD2 . . 3.900 2.970 2.697 3.591 . 0 0 "[ . 1]" 1
1140 1 59 LEU HA 1 60 GLN HA . . 4.920 4.825 4.761 4.865 . 0 0 "[ . 1]" 1
1141 1 59 LEU HA 1 62 LYS H . . 4.000 3.705 3.575 3.892 . 0 0 "[ . 1]" 1
1142 1 59 LEU HA 1 62 LYS HB2 . . 4.140 3.734 3.492 4.163 0.023 6 0 "[ . 1]" 1
1143 1 59 LEU HA 1 62 LYS HD3 . . 3.800 2.579 2.085 2.940 . 0 0 "[ . 1]" 1
1144 1 59 LEU HA 1 62 LYS QE . . 4.330 2.052 1.954 2.603 . 0 0 "[ . 1]" 1
1145 1 59 LEU HA 1 63 TYR H . . 5.430 5.078 4.991 5.163 . 0 0 "[ . 1]" 1
1146 1 59 LEU HB2 1 59 LEU MD1 . . 3.290 2.109 1.954 3.167 . 0 0 "[ . 1]" 1
1147 1 59 LEU HB2 1 59 LEU QD . . 2.730 1.969 1.919 2.048 . 0 0 "[ . 1]" 1
1148 1 59 LEU HB2 1 59 LEU MD2 . . 3.290 2.894 2.074 3.091 . 0 0 "[ . 1]" 1
1149 1 59 LEU HB2 1 60 GLN H . . 3.370 2.235 2.136 2.381 . 0 0 "[ . 1]" 1
1150 1 59 LEU HB2 1 60 GLN QB . . 4.420 4.234 3.987 4.406 . 0 0 "[ . 1]" 1
1151 1 59 LEU HB2 1 60 GLN HE22 . . 4.070 3.142 2.470 3.826 . 0 0 "[ . 1]" 1
1152 1 59 LEU HB2 1 60 GLN QG . . 4.430 4.351 4.171 4.471 0.041 1 0 "[ . 1]" 1
1153 1 59 LEU HB2 1 61 GLU H . . 5.060 4.671 4.384 4.921 . 0 0 "[ . 1]" 1
1154 1 59 LEU HB2 1 62 LYS H . . 5.500 5.549 5.519 5.638 0.138 6 0 "[ . 1]" 1
1155 1 59 LEU HB3 1 60 GLN H . . 3.450 3.406 3.310 3.483 0.033 1 0 "[ . 1]" 1
1156 1 59 LEU HB3 1 60 GLN HA . . 5.270 4.377 4.287 4.444 . 0 0 "[ . 1]" 1
1157 1 59 LEU HB3 1 60 GLN QB . . 5.340 5.204 4.983 5.355 0.015 3 0 "[ . 1]" 1
1158 1 59 LEU HB3 1 60 GLN HE22 . . 5.500 4.849 4.184 5.505 0.005 2 0 "[ . 1]" 1
1159 1 59 LEU HB3 1 60 GLN QG . . 5.340 5.284 5.108 5.408 0.068 6 0 "[ . 1]" 1
1160 1 59 LEU HB3 1 63 TYR QD . . 4.710 4.705 4.395 4.751 0.041 4 0 "[ . 1]" 1
1161 1 59 LEU HB3 1 63 TYR QE . . 3.830 3.194 2.678 3.325 . 0 0 "[ . 1]" 1
1162 1 59 LEU QD 1 60 GLN H . . 4.140 3.444 3.103 3.613 . 0 0 "[ . 1]" 1
1163 1 59 LEU QD 1 60 GLN QB . . 4.830 4.789 4.602 4.865 0.035 8 0 "[ . 1]" 1
1164 1 59 LEU QD 1 60 GLN HE21 . . 4.650 3.662 2.944 3.895 . 0 0 "[ . 1]" 1
1165 1 59 LEU QD 1 60 GLN HE22 . . 4.140 3.045 2.447 3.746 . 0 0 "[ . 1]" 1
1166 1 59 LEU QD 1 60 GLN QG . . 5.140 4.797 4.187 4.939 . 0 0 "[ . 1]" 1
1167 1 59 LEU QD 1 62 LYS QE . . 4.250 2.960 2.636 3.350 . 0 0 "[ . 1]" 1
1168 1 59 LEU QD 1 63 TYR QE . . 4.170 3.900 3.787 4.195 0.025 6 0 "[ . 1]" 1
1169 1 59 LEU HG 1 60 GLN HE21 . . 5.450 5.160 4.468 5.459 0.009 7 0 "[ . 1]" 1
1170 1 60 GLN H 1 60 GLN QB . . 2.730 2.426 2.174 2.628 . 0 0 "[ . 1]" 1
1171 1 60 GLN H 1 60 GLN QG . . 3.240 2.861 2.194 3.292 0.052 9 0 "[ . 1]" 1
1172 1 60 GLN H 1 61 GLU H . . 3.200 2.778 2.656 2.859 . 0 0 "[ . 1]" 1
1173 1 60 GLN H 1 63 TYR QD . . 4.910 4.442 4.243 4.699 . 0 0 "[ . 1]" 1
1174 1 60 GLN HA 1 60 GLN QG . . 3.460 2.737 2.062 3.380 . 0 0 "[ . 1]" 1
1175 1 60 GLN HA 1 62 LYS HD3 . . 5.500 5.430 5.327 5.503 0.003 4 0 "[ . 1]" 1
1176 1 60 GLN HA 1 62 LYS QE . . 5.340 5.302 5.218 5.376 0.036 1 0 "[ . 1]" 1
1177 1 60 GLN HA 1 63 TYR H . . 3.500 3.170 3.076 3.285 . 0 0 "[ . 1]" 1
1178 1 60 GLN HA 1 63 TYR HB2 . . 4.150 2.896 2.730 3.042 . 0 0 "[ . 1]" 1
1179 1 60 GLN HA 1 63 TYR HB3 . . 4.680 4.437 4.326 4.637 . 0 0 "[ . 1]" 1
1180 1 60 GLN HA 1 63 TYR QD . . 3.400 2.129 2.037 2.395 . 0 0 "[ . 1]" 1
1181 1 60 GLN HA 1 63 TYR QE . . 4.410 3.468 3.344 3.717 . 0 0 "[ . 1]" 1
1182 1 60 GLN HA 1 64 LYS H . . 4.330 4.003 3.247 4.325 . 0 0 "[ . 1]" 1
1183 1 60 GLN QB 1 60 GLN HE22 . . 4.430 3.636 3.355 3.973 . 0 0 "[ . 1]" 1
1184 1 60 GLN QB 1 60 GLN QG . . 2.360 2.010 1.995 2.023 . 0 0 "[ . 1]" 1
1185 1 60 GLN QB 1 61 GLU H . . 3.720 3.029 2.630 3.663 . 0 0 "[ . 1]" 1
1186 1 60 GLN QB 1 64 LYS QD . . 4.750 2.222 1.942 3.053 . 0 0 "[ . 1]" 1
1187 1 60 GLN HE21 1 64 LYS QD . . 5.340 5.238 4.897 5.420 0.080 1 0 "[ . 1]" 1
1188 1 60 GLN HE22 1 60 GLN QG . . 3.480 3.348 3.238 3.434 . 0 0 "[ . 1]" 1
1189 1 60 GLN QG 1 63 TYR QD . . 5.330 3.687 2.617 5.336 0.006 10 0 "[ . 1]" 1
1190 1 60 GLN QG 1 64 LYS QD . . 4.500 3.298 2.542 4.022 . 0 0 "[ . 1]" 1
1191 1 61 GLU H 1 61 GLU QG . . 3.620 2.497 2.063 2.725 . 0 0 "[ . 1]" 1
1192 1 61 GLU H 1 62 LYS H . . 3.110 2.812 2.663 2.887 . 0 0 "[ . 1]" 1
1193 1 61 GLU H 1 62 LYS HD3 . . 4.800 3.991 3.711 4.132 . 0 0 "[ . 1]" 1
1194 1 61 GLU H 1 64 LYS QD . . 4.650 3.626 3.268 4.147 . 0 0 "[ . 1]" 1
1195 1 61 GLU HA 1 61 GLU QG . . 3.540 3.323 3.275 3.411 . 0 0 "[ . 1]" 1
1196 1 61 GLU HA 1 62 LYS HD3 . . 5.500 5.335 5.245 5.560 0.060 1 0 "[ . 1]" 1
1197 1 61 GLU HA 1 64 LYS H . . 4.280 3.588 3.372 4.184 . 0 0 "[ . 1]" 1
1198 1 61 GLU HA 1 64 LYS QB . . 3.860 2.810 2.574 3.907 0.047 6 0 "[ . 1]" 1
1199 1 61 GLU HA 1 64 LYS HD2 . . 4.420 3.669 2.643 4.422 0.002 10 0 "[ . 1]" 1
1200 1 61 GLU HA 1 64 LYS HD3 . . 4.420 2.501 1.994 3.670 . 0 0 "[ . 1]" 1
1201 1 61 GLU HA 1 65 TRP H . . 4.470 4.178 3.957 4.334 . 0 0 "[ . 1]" 1
1202 1 61 GLU QB 1 62 LYS H . . 3.130 3.396 3.300 3.450 0.320 6 0 "[ . 1]" 1
1203 1 61 GLU QB 1 62 LYS HD3 . . 4.690 4.218 4.119 4.497 . 0 0 "[ . 1]" 1
1204 1 61 GLU QG 1 62 LYS H . . 4.790 2.024 1.925 2.064 . 0 0 "[ . 1]" 1
1205 1 61 GLU QG 1 62 LYS QG . . 5.180 2.737 2.558 3.122 . 0 0 "[ . 1]" 1
1206 1 61 GLU HG2 1 62 LYS HD3 . . 4.130 2.337 2.019 3.228 . 0 0 "[ . 1]" 1
1207 1 61 GLU HG3 1 62 LYS HD3 . . 4.130 2.779 1.986 3.380 . 0 0 "[ . 1]" 1
1208 1 62 LYS H 1 62 LYS HB2 . . 2.830 2.332 2.276 2.389 . 0 0 "[ . 1]" 1
1209 1 62 LYS H 1 62 LYS HB3 . . 3.670 3.565 3.544 3.589 . 0 0 "[ . 1]" 1
1210 1 62 LYS H 1 62 LYS HD3 . . 3.930 2.164 2.083 2.252 . 0 0 "[ . 1]" 1
1211 1 62 LYS H 1 62 LYS QE . . 4.530 3.496 3.437 3.654 . 0 0 "[ . 1]" 1
1212 1 62 LYS H 1 62 LYS QG . . 3.820 3.040 2.811 3.184 . 0 0 "[ . 1]" 1
1213 1 62 LYS H 1 63 TYR H . . 2.970 2.614 2.496 2.705 . 0 0 "[ . 1]" 1
1214 1 62 LYS H 1 63 TYR HA . . 5.430 5.236 5.134 5.311 . 0 0 "[ . 1]" 1
1215 1 62 LYS H 1 64 LYS H . . 4.380 3.964 3.843 4.225 . 0 0 "[ . 1]" 1
1216 1 62 LYS H 1 65 TRP HB2 . . 5.500 5.237 5.143 5.329 . 0 0 "[ . 1]" 1
1217 1 62 LYS H 1 65 TRP HB3 . . 5.410 5.319 5.217 5.415 0.005 3 0 "[ . 1]" 1
1218 1 62 LYS HA 1 62 LYS HD3 . . 4.060 3.747 3.605 3.920 . 0 0 "[ . 1]" 1
1219 1 62 LYS HA 1 62 LYS QE . . 5.270 4.566 4.503 4.622 . 0 0 "[ . 1]" 1
1220 1 62 LYS HA 1 62 LYS HG2 . . 3.880 3.359 3.290 3.391 . 0 0 "[ . 1]" 1
1221 1 62 LYS HA 1 62 LYS QG . . 3.280 2.225 2.177 2.277 . 0 0 "[ . 1]" 1
1222 1 62 LYS HA 1 62 LYS HG3 . . 3.880 2.258 2.204 2.317 . 0 0 "[ . 1]" 1
1223 1 62 LYS HA 1 65 TRP H . . 3.810 3.424 3.299 3.737 . 0 0 "[ . 1]" 1
1224 1 62 LYS HA 1 65 TRP HB2 . . 3.850 3.591 3.466 3.859 0.009 10 0 "[ . 1]" 1
1225 1 62 LYS HA 1 65 TRP HB3 . . 4.070 2.900 2.816 3.031 . 0 0 "[ . 1]" 1
1226 1 62 LYS HB2 1 63 TYR H . . 3.190 2.630 2.547 2.717 . 0 0 "[ . 1]" 1
1227 1 62 LYS HB2 1 63 TYR QD . . 4.180 3.718 3.590 3.927 . 0 0 "[ . 1]" 1
1228 1 62 LYS HB2 1 63 TYR QE . . 4.200 3.932 3.786 4.161 . 0 0 "[ . 1]" 1
1229 1 62 LYS HB3 1 62 LYS HD3 . . 3.740 3.635 3.606 3.677 . 0 0 "[ . 1]" 1
1230 1 62 LYS HB3 1 62 LYS QE . . 4.170 3.120 2.976 3.218 . 0 0 "[ . 1]" 1
1231 1 62 LYS HB3 1 63 TYR H . . 3.790 3.452 3.341 3.555 . 0 0 "[ . 1]" 1
1232 1 62 LYS HB3 1 66 GLU H . . 5.460 4.960 4.832 5.194 . 0 0 "[ . 1]" 1
1233 1 62 LYS HB3 1 66 GLU HG3 . . 4.640 3.189 3.056 3.301 . 0 0 "[ . 1]" 1
1234 1 62 LYS HD3 1 63 TYR H . . 4.640 4.257 4.167 4.341 . 0 0 "[ . 1]" 1
1235 1 62 LYS QE 1 62 LYS QG . . 3.240 2.656 2.154 2.819 . 0 0 "[ . 1]" 1
1236 1 62 LYS QE 1 63 TYR H . . 4.390 4.268 4.003 4.387 . 0 0 "[ . 1]" 1
1237 1 62 LYS QE 1 63 TYR QD . . 4.990 4.602 4.317 4.837 . 0 0 "[ . 1]" 1
1238 1 62 LYS QE 1 63 TYR QE . . 4.190 3.819 3.456 4.179 . 0 0 "[ . 1]" 1
1239 1 63 TYR H 1 63 TYR HB2 . . 2.920 2.658 2.598 2.725 . 0 0 "[ . 1]" 1
1240 1 63 TYR H 1 63 TYR HB3 . . 3.600 3.590 3.577 3.597 . 0 0 "[ . 1]" 1
1241 1 63 TYR H 1 63 TYR QD . . 3.370 2.963 2.910 3.062 . 0 0 "[ . 1]" 1
1242 1 63 TYR H 1 63 TYR QE . . 4.360 4.233 4.126 4.349 . 0 0 "[ . 1]" 1
1243 1 63 TYR H 1 64 LYS H . . 3.050 2.581 2.506 2.783 . 0 0 "[ . 1]" 1
1244 1 63 TYR H 1 66 GLU H . . 5.040 4.581 4.445 4.666 . 0 0 "[ . 1]" 1
1245 1 63 TYR H 1 66 GLU HG3 . . 4.970 4.947 4.773 4.990 0.020 10 0 "[ . 1]" 1
1246 1 63 TYR HA 1 63 TYR QD . . 3.260 2.159 2.095 2.243 . 0 0 "[ . 1]" 1
1247 1 63 TYR HA 1 65 TRP H . . 5.050 4.114 4.032 4.191 . 0 0 "[ . 1]" 1
1248 1 63 TYR HA 1 66 GLU H . . 3.880 3.399 3.162 3.520 . 0 0 "[ . 1]" 1
1249 1 63 TYR HA 1 66 GLU HB2 . . 3.590 2.644 2.182 2.833 . 0 0 "[ . 1]" 1
1250 1 63 TYR HA 1 66 GLU HB3 . . 4.520 4.275 3.726 4.519 . 0 0 "[ . 1]" 1
1251 1 63 TYR HA 1 66 GLU HG2 . . 4.830 4.598 4.394 4.796 . 0 0 "[ . 1]" 1
1252 1 63 TYR HA 1 66 GLU HG3 . . 4.660 3.639 3.344 3.759 . 0 0 "[ . 1]" 1
1253 1 63 TYR HA 1 67 ALA H . . 4.090 3.789 3.739 3.883 . 0 0 "[ . 1]" 1
1254 1 63 TYR HA 1 67 ALA MB . . 4.710 4.256 4.179 4.458 . 0 0 "[ . 1]" 1
1255 1 63 TYR HB2 1 64 LYS H . . 3.430 2.757 2.227 2.955 . 0 0 "[ . 1]" 1
1256 1 63 TYR HB2 1 64 LYS HA . . 4.360 4.204 3.986 4.285 . 0 0 "[ . 1]" 1
1257 1 63 TYR HB2 1 65 TRP H . . 5.070 4.893 4.654 5.014 . 0 0 "[ . 1]" 1
1258 1 63 TYR HB3 1 64 LYS H . . 4.070 3.921 3.563 4.060 . 0 0 "[ . 1]" 1
1259 1 63 TYR HB3 1 66 GLU H . . 5.500 5.368 4.977 5.536 0.036 9 0 "[ . 1]" 1
1260 1 63 TYR HB3 1 67 ALA H . . 5.500 5.049 4.910 5.172 . 0 0 "[ . 1]" 1
1261 1 63 TYR QD 1 64 LYS H . . 4.430 4.307 3.937 4.415 . 0 0 "[ . 1]" 1
1262 1 63 TYR QD 1 65 TRP H . . 5.500 5.561 5.543 5.580 0.080 10 0 "[ . 1]" 1
1263 1 63 TYR QD 1 66 GLU H . . 5.360 5.150 5.109 5.194 . 0 0 "[ . 1]" 1
1264 1 63 TYR QD 1 66 GLU HB2 . . 4.940 4.014 3.844 4.140 . 0 0 "[ . 1]" 1
1265 1 63 TYR QD 1 66 GLU HB3 . . 5.500 5.268 4.964 5.440 . 0 0 "[ . 1]" 1
1266 1 63 TYR QD 1 66 GLU HG2 . . 5.500 5.475 5.406 5.526 0.026 10 0 "[ . 1]" 1
1267 1 63 TYR QD 1 66 GLU HG3 . . 4.300 4.031 3.902 4.111 . 0 0 "[ . 1]" 1
1268 1 64 LYS H 1 64 LYS QB . . 2.850 2.409 2.231 2.488 . 0 0 "[ . 1]" 1
1269 1 64 LYS H 1 64 LYS QD . . 4.090 3.333 2.959 3.732 . 0 0 "[ . 1]" 1
1270 1 64 LYS H 1 65 TRP H . . 3.190 2.419 2.280 2.756 . 0 0 "[ . 1]" 1
1271 1 64 LYS H 1 65 TRP HB2 . . 4.960 4.597 4.457 4.997 0.037 6 0 "[ . 1]" 1
1272 1 64 LYS H 1 65 TRP HB3 . . 5.500 4.930 4.790 5.299 . 0 0 "[ . 1]" 1
1273 1 64 LYS H 1 66 GLU H . . 4.510 3.854 3.726 3.962 . 0 0 "[ . 1]" 1
1274 1 64 LYS H 1 67 ALA MB . . 4.990 4.715 4.632 4.876 . 0 0 "[ . 1]" 1
1275 1 64 LYS HA 1 64 LYS QD . . 4.890 4.158 4.020 4.274 . 0 0 "[ . 1]" 1
1276 1 64 LYS HA 1 67 ALA H . . 3.930 3.722 3.648 3.822 . 0 0 "[ . 1]" 1
1277 1 64 LYS HA 1 67 ALA MB . . 3.370 2.872 2.747 3.018 . 0 0 "[ . 1]" 1
1278 1 64 LYS QB 1 64 LYS QD . . 3.300 2.148 1.918 2.257 . 0 0 "[ . 1]" 1
1279 1 64 LYS QB 1 65 TRP H . . 3.260 2.987 2.858 3.479 0.219 6 0 "[ . 1]" 1
1280 1 64 LYS QB 1 65 TRP HB2 . . 5.340 4.049 3.918 4.842 . 0 0 "[ . 1]" 1
1281 1 64 LYS QD 1 65 TRP H . . 5.340 4.636 4.117 5.006 . 0 0 "[ . 1]" 1
1282 1 65 TRP H 1 65 TRP HB2 . . 2.970 2.547 2.492 2.585 . 0 0 "[ . 1]" 1
1283 1 65 TRP H 1 65 TRP HB3 . . 2.980 2.699 2.665 2.721 . 0 0 "[ . 1]" 1
1284 1 65 TRP H 1 65 TRP HD1 . . 5.500 4.860 4.829 4.912 . 0 0 "[ . 1]" 1
1285 1 65 TRP H 1 65 TRP HE3 . . 5.160 4.952 4.893 4.992 . 0 0 "[ . 1]" 1
1286 1 65 TRP H 1 66 GLU H . . 3.320 2.242 2.224 2.313 . 0 0 "[ . 1]" 1
1287 1 65 TRP H 1 66 GLU HB2 . . 4.620 4.322 4.237 4.421 . 0 0 "[ . 1]" 1
1288 1 65 TRP H 1 67 ALA H . . 4.020 3.857 3.789 3.959 . 0 0 "[ . 1]" 1
1289 1 65 TRP HA 1 65 TRP HD1 . . 4.060 2.860 2.781 3.010 . 0 0 "[ . 1]" 1
1290 1 65 TRP HA 1 67 ALA H . . 4.700 4.443 4.292 4.590 . 0 0 "[ . 1]" 1
1291 1 65 TRP HA 1 67 ALA MB . . 5.200 5.076 4.980 5.180 . 0 0 "[ . 1]" 1
1292 1 65 TRP HA 1 68 TRP H . . 4.390 3.976 3.828 4.075 . 0 0 "[ . 1]" 1
1293 1 65 TRP HA 1 68 TRP HB2 . . 4.720 4.270 4.020 4.512 . 0 0 "[ . 1]" 1
1294 1 65 TRP HA 1 68 TRP HB3 . . 4.290 3.478 3.339 3.749 . 0 0 "[ . 1]" 1
1295 1 65 TRP HA 1 69 ASN H . . 4.470 4.356 4.179 4.483 0.013 3 0 "[ . 1]" 1
1296 1 65 TRP HB2 1 66 GLU H . . 4.170 3.914 3.842 4.017 . 0 0 "[ . 1]" 1
1297 1 65 TRP HB3 1 66 GLU H . . 3.330 2.979 2.872 3.115 . 0 0 "[ . 1]" 1
1298 1 65 TRP HB3 1 66 GLU HG2 . . 4.530 3.394 3.186 3.770 . 0 0 "[ . 1]" 1
1299 1 65 TRP HB3 1 66 GLU HG3 . . 4.960 4.659 4.501 4.830 . 0 0 "[ . 1]" 1
1300 1 65 TRP HE3 1 66 GLU H . . 4.350 4.231 4.185 4.332 . 0 0 "[ . 1]" 1
1301 1 65 TRP HE3 1 66 GLU HA . . 3.750 3.684 3.464 3.772 0.022 10 0 "[ . 1]" 1
1302 1 65 TRP HE3 1 66 GLU HB2 . . 5.340 5.312 5.182 5.351 0.011 1 0 "[ . 1]" 1
1303 1 65 TRP HE3 1 66 GLU HB3 . . 5.500 5.483 5.325 5.553 0.053 6 0 "[ . 1]" 1
1304 1 65 TRP HE3 1 66 GLU HG2 . . 3.700 2.899 2.814 3.012 . 0 0 "[ . 1]" 1
1305 1 65 TRP HE3 1 66 GLU HG3 . . 4.620 4.545 4.440 4.643 0.023 9 0 "[ . 1]" 1
1306 1 65 TRP HE3 1 69 ASN HB3 . . 5.120 4.907 4.367 5.092 . 0 0 "[ . 1]" 1
1307 1 66 GLU H 1 66 GLU HB2 . . 3.080 2.343 2.231 2.430 . 0 0 "[ . 1]" 1
1308 1 66 GLU H 1 66 GLU HB3 . . 3.810 3.581 3.520 3.614 . 0 0 "[ . 1]" 1
1309 1 66 GLU H 1 66 GLU HG2 . . 3.170 2.847 2.665 3.188 0.018 6 0 "[ . 1]" 1
1310 1 66 GLU H 1 66 GLU HG3 . . 3.830 3.459 3.306 3.656 . 0 0 "[ . 1]" 1
1311 1 66 GLU H 1 67 ALA H . . 2.980 2.373 2.267 2.440 . 0 0 "[ . 1]" 1
1312 1 66 GLU H 1 67 ALA MB . . 4.120 3.995 3.902 4.080 . 0 0 "[ . 1]" 1
1313 1 66 GLU H 1 68 TRP H . . 4.390 4.268 4.062 4.395 0.005 7 0 "[ . 1]" 1
1314 1 66 GLU H 1 69 ASN H . . 4.790 4.686 4.644 4.773 . 0 0 "[ . 1]" 1
1315 1 66 GLU H 1 69 ASN HB3 . . 5.500 5.034 4.835 5.145 . 0 0 "[ . 1]" 1
1316 1 66 GLU HA 1 66 GLU HG2 . . 3.860 2.487 2.325 2.561 . 0 0 "[ . 1]" 1
1317 1 66 GLU HA 1 66 GLU HG3 . . 3.810 3.687 3.596 3.736 . 0 0 "[ . 1]" 1
1318 1 66 GLU HA 1 69 ASN H . . 3.770 3.589 3.534 3.665 . 0 0 "[ . 1]" 1
1319 1 66 GLU HA 1 69 ASN HA . . 5.500 5.502 5.427 5.531 0.031 4 0 "[ . 1]" 1
1320 1 66 GLU HA 1 69 ASN HB2 . . 4.230 3.890 3.693 4.000 . 0 0 "[ . 1]" 1
1321 1 66 GLU HA 1 69 ASN HB3 . . 3.980 2.651 2.593 2.724 . 0 0 "[ . 1]" 1
1322 1 66 GLU HA 1 69 ASN HD21 . . 4.880 3.959 3.492 4.237 . 0 0 "[ . 1]" 1
1323 1 66 GLU HA 1 69 ASN HD22 . . 5.500 5.375 5.034 5.515 0.015 4 0 "[ . 1]" 1
1324 1 66 GLU HA 1 70 ALA H . . 4.490 4.192 4.070 4.360 . 0 0 "[ . 1]" 1
1325 1 66 GLU HB2 1 67 ALA H . . 3.100 2.783 2.640 2.948 . 0 0 "[ . 1]" 1
1326 1 66 GLU HB2 1 67 ALA MB . . 4.330 4.156 4.068 4.251 . 0 0 "[ . 1]" 1
1327 1 66 GLU HB2 1 68 TRP H . . 5.500 5.419 5.251 5.515 0.015 6 0 "[ . 1]" 1
1328 1 66 GLU HB3 1 67 ALA H . . 3.810 3.620 3.455 3.755 . 0 0 "[ . 1]" 1
1329 1 66 GLU HB3 1 70 ALA H . . 5.500 5.052 4.909 5.271 . 0 0 "[ . 1]" 1
1330 1 66 GLU HG2 1 67 ALA H . . 4.970 4.597 4.489 4.784 . 0 0 "[ . 1]" 1
1331 1 66 GLU HG3 1 67 ALA H . . 5.190 4.860 4.754 5.056 . 0 0 "[ . 1]" 1
1332 1 67 ALA H 1 67 ALA MB . . 2.600 2.108 2.040 2.178 . 0 0 "[ . 1]" 1
1333 1 67 ALA H 1 68 TRP H . . 2.980 2.766 2.630 2.854 . 0 0 "[ . 1]" 1
1334 1 67 ALA H 1 68 TRP HB2 . . 5.500 5.028 4.912 5.106 . 0 0 "[ . 1]" 1
1335 1 67 ALA H 1 69 ASN H . . 4.380 3.851 3.773 3.962 . 0 0 "[ . 1]" 1
1336 1 67 ALA HA 1 69 ASN H . . 4.610 4.125 3.981 4.326 . 0 0 "[ . 1]" 1
1337 1 67 ALA HA 1 70 ALA MB . . 2.900 2.387 2.155 2.592 . 0 0 "[ . 1]" 1
1338 1 67 ALA MB 1 68 TRP H . . 3.020 2.429 2.342 2.580 . 0 0 "[ . 1]" 1
1339 1 67 ALA MB 1 68 TRP HB2 . . 4.140 3.941 3.867 4.022 . 0 0 "[ . 1]" 1
1340 1 67 ALA MB 1 68 TRP HB3 . . 5.420 4.648 4.561 4.744 . 0 0 "[ . 1]" 1
1341 1 67 ALA MB 1 69 ASN H . . 4.500 4.226 4.156 4.283 . 0 0 "[ . 1]" 1
1342 1 67 ALA MB 1 70 ALA H . . 4.550 4.346 4.284 4.442 . 0 0 "[ . 1]" 1
1343 1 68 TRP H 1 68 TRP HB2 . . 3.030 2.389 2.345 2.430 . 0 0 "[ . 1]" 1
1344 1 68 TRP H 1 68 TRP HB3 . . 2.990 2.679 2.635 2.732 . 0 0 "[ . 1]" 1
1345 1 68 TRP H 1 68 TRP HD1 . . 4.870 4.687 4.646 4.727 . 0 0 "[ . 1]" 1
1346 1 68 TRP H 1 69 ASN H . . 3.190 2.677 2.596 2.731 . 0 0 "[ . 1]" 1
1347 1 68 TRP H 1 69 ASN HB2 . . 5.220 5.161 5.058 5.224 0.004 7 0 "[ . 1]" 1
1348 1 68 TRP H 1 69 ASN HB3 . . 5.150 4.920 4.698 5.006 . 0 0 "[ . 1]" 1
1349 1 68 TRP H 1 70 ALA H . . 4.300 4.005 3.884 4.131 . 0 0 "[ . 1]" 1
1350 1 68 TRP HA 1 68 TRP HD1 . . 3.700 2.120 2.052 2.181 . 0 0 "[ . 1]" 1
1351 1 68 TRP HB2 1 69 ASN H . . 4.190 3.944 3.861 3.995 . 0 0 "[ . 1]" 1
1352 1 68 TRP HB3 1 69 ASN H . . 4.630 2.887 2.738 2.970 . 0 0 "[ . 1]" 1
1353 1 68 TRP HD1 1 69 ASN H . . 5.130 4.979 4.757 5.087 . 0 0 "[ . 1]" 1
1354 1 68 TRP HD1 1 69 ASN HA . . 5.330 5.118 4.731 5.338 0.008 5 0 "[ . 1]" 1
1355 1 68 TRP HD1 1 71 LEU QB . . 5.190 3.681 3.508 4.235 . 0 0 "[ . 1]" 1
1356 1 68 TRP HD1 1 71 LEU QD . . 4.170 3.918 3.614 4.178 0.008 7 0 "[ . 1]" 1
1357 1 69 ASN H 1 69 ASN HB2 . . 2.990 2.750 2.629 2.890 . 0 0 "[ . 1]" 1
1358 1 69 ASN H 1 69 ASN HB3 . . 3.060 2.451 2.336 2.524 . 0 0 "[ . 1]" 1
1359 1 69 ASN H 1 69 ASN HD21 . . 4.730 4.348 4.112 4.517 . 0 0 "[ . 1]" 1
1360 1 69 ASN H 1 70 ALA H . . 3.280 2.327 2.278 2.432 . 0 0 "[ . 1]" 1
1361 1 69 ASN H 1 70 ALA MB . . 4.080 3.973 3.878 4.089 0.009 3 0 "[ . 1]" 1
1362 1 69 ASN H 1 71 LEU H . . 4.600 3.999 3.849 4.191 . 0 0 "[ . 1]" 1
1363 1 69 ASN HA 1 71 LEU H . . 4.240 3.905 3.809 4.162 . 0 0 "[ . 1]" 1
1364 1 69 ASN HA 1 72 ARG H . . 4.350 3.762 3.464 4.117 . 0 0 "[ . 1]" 1
1365 1 69 ASN HA 1 72 ARG QB . . 5.040 3.576 2.573 4.233 . 0 0 "[ . 1]" 1
1366 1 69 ASN HA 1 72 ARG HE . . 5.150 4.626 3.487 5.159 0.009 5 0 "[ . 1]" 1
1367 1 69 ASN HA 1 72 ARG QG . . 5.330 2.710 1.986 4.291 . 0 0 "[ . 1]" 1
1368 1 69 ASN HB2 1 70 ALA H . . 4.440 4.134 4.050 4.238 . 0 0 "[ . 1]" 1
1369 1 69 ASN HB2 1 70 ALA MB . . 5.500 5.466 5.418 5.502 0.002 8 0 "[ . 1]" 1
1370 1 69 ASN HB3 1 69 ASN HD22 . . 3.670 3.489 3.446 3.519 . 0 0 "[ . 1]" 1
1371 1 69 ASN HB3 1 70 ALA H . . 3.460 3.041 2.828 3.339 . 0 0 "[ . 1]" 1
1372 1 69 ASN HB3 1 70 ALA HA . . 5.040 4.389 4.326 4.490 . 0 0 "[ . 1]" 1
1373 1 69 ASN HB3 1 70 ALA MB . . 4.700 4.215 4.144 4.348 . 0 0 "[ . 1]" 1
1374 1 69 ASN HD21 1 70 ALA H . . 4.780 3.740 3.240 4.334 . 0 0 "[ . 1]" 1
1375 1 69 ASN HD21 1 70 ALA HA . . 4.570 3.368 2.985 4.004 . 0 0 "[ . 1]" 1
1376 1 69 ASN HD21 1 72 ARG HD2 . . 5.500 4.685 3.782 5.518 0.018 6 0 "[ . 1]" 1
1377 1 69 ASN HD21 1 72 ARG HD3 . . 5.500 4.508 3.815 5.202 . 0 0 "[ . 1]" 1
1378 1 69 ASN HD21 1 72 ARG QG . . 5.340 4.641 4.239 5.147 . 0 0 "[ . 1]" 1
1379 1 70 ALA H 1 70 ALA MB . . 2.540 2.154 2.055 2.251 . 0 0 "[ . 1]" 1
1380 1 70 ALA H 1 71 LEU H . . 3.020 2.505 2.379 2.583 . 0 0 "[ . 1]" 1
1381 1 70 ALA H 1 71 LEU HA . . 5.300 5.160 5.066 5.215 . 0 0 "[ . 1]" 1
1382 1 70 ALA H 1 71 LEU QD . . 3.960 3.759 3.506 3.976 0.016 8 0 "[ . 1]" 1
1383 1 70 ALA H 1 72 ARG H . . 4.250 4.127 3.984 4.251 0.001 3 0 "[ . 1]" 1
1384 1 70 ALA HA 1 72 ARG H . . 4.000 3.619 3.537 3.732 . 0 0 "[ . 1]" 1
1385 1 70 ALA MB 1 71 LEU H . . 3.240 2.901 2.637 2.998 . 0 0 "[ . 1]" 1
1386 1 70 ALA MB 1 71 LEU HA . . 4.030 3.953 3.907 4.004 . 0 0 "[ . 1]" 1
1387 1 70 ALA MB 1 71 LEU QD . . 4.110 2.337 2.208 2.465 . 0 0 "[ . 1]" 1
1388 1 71 LEU H 1 71 LEU QB . . 2.980 2.447 2.232 2.811 . 0 0 "[ . 1]" 1
1389 1 71 LEU H 1 71 LEU QD . . 3.170 2.621 2.418 2.862 . 0 0 "[ . 1]" 1
1390 1 71 LEU H 1 72 ARG H . . 2.950 2.610 2.460 2.850 . 0 0 "[ . 1]" 1
1391 1 71 LEU H 1 72 ARG HA . . 4.610 4.592 4.475 4.628 0.018 4 0 "[ . 1]" 1
1392 1 71 LEU H 1 72 ARG QB . . 4.720 4.482 4.307 4.719 . 0 0 "[ . 1]" 1
1393 1 71 LEU H 1 74 MET HB2 . . 5.500 5.560 5.506 5.603 0.103 6 0 "[ . 1]" 1
1394 1 71 LEU HA 1 71 LEU QD . . 3.970 2.372 2.202 2.665 . 0 0 "[ . 1]" 1
1395 1 71 LEU HA 1 72 ARG H . . 3.500 3.056 2.917 3.173 . 0 0 "[ . 1]" 1
1396 1 71 LEU HA 1 74 MET HB2 . . 4.030 3.486 3.373 3.748 . 0 0 "[ . 1]" 1
1397 1 71 LEU HA 1 74 MET ME . . 4.470 4.141 3.644 4.470 0.000 10 0 "[ . 1]" 1
1398 1 71 LEU QB 1 71 LEU QD . . 2.640 1.929 1.878 1.969 . 0 0 "[ . 1]" 1
1399 1 71 LEU QB 1 74 MET H . . 4.840 3.873 3.720 4.034 . 0 0 "[ . 1]" 1
1400 1 71 LEU QB 1 74 MET HB3 . . 3.940 3.227 3.124 3.502 . 0 0 "[ . 1]" 1
1401 1 71 LEU QD 1 72 ARG H . . 4.770 4.145 4.053 4.302 . 0 0 "[ . 1]" 1
1402 1 71 LEU QD 1 72 ARG HA . . 5.440 5.381 5.353 5.434 . 0 0 "[ . 1]" 1
1403 1 71 LEU QD 1 74 MET ME . . 3.090 1.834 1.767 2.090 . 0 0 "[ . 1]" 1
1404 1 72 ARG H 1 72 ARG QB . . 2.720 2.275 2.147 2.499 . 0 0 "[ . 1]" 1
1405 1 72 ARG H 1 72 ARG HD2 . . 5.480 4.566 3.755 5.022 . 0 0 "[ . 1]" 1
1406 1 72 ARG H 1 72 ARG QD . . 4.690 3.975 3.532 4.449 . 0 0 "[ . 1]" 1
1407 1 72 ARG H 1 72 ARG HD3 . . 5.480 4.484 3.941 5.053 . 0 0 "[ . 1]" 1
1408 1 72 ARG H 1 72 ARG HG2 . . 4.000 3.369 2.063 3.977 . 0 0 "[ . 1]" 1
1409 1 72 ARG H 1 72 ARG QG . . 3.160 2.559 2.047 2.876 . 0 0 "[ . 1]" 1
1410 1 72 ARG H 1 72 ARG HG3 . . 4.000 3.010 2.710 3.546 . 0 0 "[ . 1]" 1
1411 1 72 ARG H 1 73 GLY H . . 4.650 4.522 4.466 4.590 . 0 0 "[ . 1]" 1
1412 1 72 ARG H 1 74 MET H . . 4.990 4.571 4.476 4.663 . 0 0 "[ . 1]" 1
1413 1 72 ARG HA 1 72 ARG QD . . 4.580 4.167 3.971 4.537 . 0 0 "[ . 1]" 1
1414 1 72 ARG HA 1 72 ARG HG2 . . 4.100 2.799 2.251 3.709 . 0 0 "[ . 1]" 1
1415 1 72 ARG HA 1 72 ARG QG . . 3.540 2.592 2.183 3.344 . 0 0 "[ . 1]" 1
1416 1 72 ARG HA 1 72 ARG HG3 . . 4.100 3.094 2.655 3.827 . 0 0 "[ . 1]" 1
1417 1 72 ARG HA 1 73 GLY H . . 2.730 2.154 2.144 2.181 . 0 0 "[ . 1]" 1
1418 1 72 ARG HA 1 73 GLY QA . . 4.550 3.923 3.907 3.950 . 0 0 "[ . 1]" 1
1419 1 72 ARG HA 1 74 MET H . . 3.680 3.491 3.399 3.567 . 0 0 "[ . 1]" 1
1420 1 72 ARG HA 1 74 MET HB2 . . 5.130 4.929 4.785 5.070 . 0 0 "[ . 1]" 1
1421 1 72 ARG QB 1 72 ARG QD . . 3.010 2.275 2.169 2.434 . 0 0 "[ . 1]" 1
1422 1 72 ARG QB 1 73 GLY H . . 3.710 3.305 3.107 3.493 . 0 0 "[ . 1]" 1
1423 1 72 ARG HB2 1 72 ARG HD2 . . 4.140 3.302 3.048 3.595 . 0 0 "[ . 1]" 1
1424 1 72 ARG HB2 1 72 ARG HD3 . . 4.140 3.195 2.337 3.802 . 0 0 "[ . 1]" 1
1425 1 72 ARG HB2 1 72 ARG HE . . 4.230 3.057 2.026 4.166 . 0 0 "[ . 1]" 1
1426 1 72 ARG HB3 1 72 ARG HD2 . . 4.140 2.971 2.327 3.787 . 0 0 "[ . 1]" 1
1427 1 72 ARG HB3 1 72 ARG HD3 . . 4.140 3.299 2.462 3.757 . 0 0 "[ . 1]" 1
1428 1 72 ARG HB3 1 72 ARG HE . . 4.230 3.111 2.339 4.072 . 0 0 "[ . 1]" 1
1429 1 72 ARG QG 1 73 GLY H . . 4.230 3.869 3.568 4.250 0.020 1 0 "[ . 1]" 1
1430 1 72 ARG QG 1 73 GLY QA . . 5.180 4.603 3.780 4.987 . 0 0 "[ . 1]" 1
1431 1 72 ARG QG 1 74 MET H . . 5.340 5.158 4.734 5.363 0.023 5 0 "[ . 1]" 1
1432 1 73 GLY H 1 74 MET H . . 3.050 2.560 2.411 2.716 . 0 0 "[ . 1]" 1
1433 1 73 GLY H 1 74 MET HB2 . . 4.900 4.637 4.427 4.829 . 0 0 "[ . 1]" 1
1434 1 73 GLY QA 1 74 MET H . . 3.090 2.878 2.864 2.890 . 0 0 "[ . 1]" 1
1435 1 74 MET H 1 74 MET HB2 . . 2.880 2.252 2.215 2.402 . 0 0 "[ . 1]" 1
1436 1 74 MET H 1 74 MET HB3 . . 2.860 2.838 2.655 2.882 0.022 10 0 "[ . 1]" 1
1437 1 74 MET H 1 74 MET ME . . 4.910 4.880 4.699 4.973 0.063 10 0 "[ . 1]" 1
1438 1 74 MET H 1 74 MET HG2 . . 4.640 4.631 4.491 4.662 0.022 2 0 "[ . 1]" 1
1439 1 74 MET H 1 74 MET QG . . 4.060 3.940 3.913 4.021 . 0 0 "[ . 1]" 1
1440 1 74 MET H 1 74 MET HG3 . . 4.640 4.269 4.211 4.402 . 0 0 "[ . 1]" 1
1441 1 74 MET H 1 75 SER H . . 4.670 4.644 4.641 4.647 . 0 0 "[ . 1]" 1
1442 1 74 MET HA 1 74 MET HG2 . . 4.050 3.329 2.940 3.663 . 0 0 "[ . 1]" 1
1443 1 74 MET HA 1 74 MET QG . . 3.460 2.213 2.131 2.443 . 0 0 "[ . 1]" 1
1444 1 74 MET HA 1 74 MET HG3 . . 4.050 2.256 2.159 2.612 . 0 0 "[ . 1]" 1
1445 1 74 MET HA 1 75 SER H . . 2.700 2.308 2.282 2.316 . 0 0 "[ . 1]" 1
1446 1 74 MET HB2 1 75 SER H . . 4.200 4.074 4.010 4.096 . 0 0 "[ . 1]" 1
1447 1 74 MET HB3 1 74 MET ME . . 3.430 3.022 2.740 3.536 0.106 8 0 "[ . 1]" 1
1448 1 74 MET HB3 1 75 SER H . . 3.720 3.542 3.457 3.781 0.061 8 0 "[ . 1]" 1
1449 1 74 MET HB3 1 79 ALA H . . 5.250 4.893 4.452 5.230 . 0 0 "[ . 1]" 1
1450 1 74 MET HB3 1 79 ALA MB . . 3.820 3.776 3.563 3.832 0.012 6 0 "[ . 1]" 1
1451 1 74 MET ME 1 74 MET HG2 . . 3.540 2.349 2.093 3.296 . 0 0 "[ . 1]" 1
1452 1 74 MET ME 1 74 MET QG . . 2.960 2.207 2.068 2.257 . 0 0 "[ . 1]" 1
1453 1 74 MET ME 1 74 MET HG3 . . 3.540 3.187 2.236 3.341 . 0 0 "[ . 1]" 1
1454 1 74 MET ME 1 75 SER H . . 4.820 4.661 4.542 4.838 0.018 7 0 "[ . 1]" 1
1455 1 74 MET ME 1 79 ALA H . . 4.090 3.600 3.204 4.131 0.041 8 0 "[ . 1]" 1
1456 1 74 MET ME 1 79 ALA HA . . 3.100 2.238 1.951 3.136 0.036 8 0 "[ . 1]" 1
1457 1 74 MET ME 1 82 ALA H . . 5.110 4.809 4.664 5.116 0.006 8 0 "[ . 1]" 1
1458 1 74 MET ME 1 82 ALA MB . . 3.420 3.235 3.157 3.339 . 0 0 "[ . 1]" 1
1459 1 74 MET QG 1 75 SER H . . 3.170 2.176 1.929 2.296 . 0 0 "[ . 1]" 1
1460 1 74 MET QG 1 78 SER H . . 4.210 4.106 3.908 4.222 0.012 6 0 "[ . 1]" 1
1461 1 74 MET QG 1 78 SER HA . . 4.770 4.336 4.158 4.468 . 0 0 "[ . 1]" 1
1462 1 74 MET QG 1 79 ALA H . . 3.740 3.089 2.821 3.447 . 0 0 "[ . 1]" 1
1463 1 74 MET QG 1 79 ALA MB . . 4.370 3.009 2.784 3.241 . 0 0 "[ . 1]" 1
1464 1 74 MET HG2 1 75 SER H . . 3.630 2.838 2.191 3.541 . 0 0 "[ . 1]" 1
1465 1 74 MET HG2 1 78 SER H . . 4.960 4.491 4.089 4.954 . 0 0 "[ . 1]" 1
1466 1 74 MET HG2 1 79 ALA H . . 4.480 3.173 2.898 3.582 . 0 0 "[ . 1]" 1
1467 1 74 MET HG3 1 75 SER H . . 3.630 2.338 1.938 2.844 . 0 0 "[ . 1]" 1
1468 1 74 MET HG3 1 78 SER H . . 4.960 4.833 4.238 4.970 0.010 5 0 "[ . 1]" 1
1469 1 74 MET HG3 1 79 ALA H . . 4.480 4.320 3.398 4.491 0.011 6 0 "[ . 1]" 1
1470 1 75 SER H 1 75 SER QB . . 3.070 2.579 2.348 2.720 . 0 0 "[ . 1]" 1
1471 1 75 SER H 1 76 THR H . . 4.650 4.501 4.452 4.578 . 0 0 "[ . 1]" 1
1472 1 75 SER H 1 78 SER H . . 4.200 3.818 3.694 3.899 . 0 0 "[ . 1]" 1
1473 1 75 SER H 1 79 ALA H . . 4.790 4.300 4.175 4.521 . 0 0 "[ . 1]" 1
1474 1 75 SER H 1 79 ALA MB . . 5.160 4.892 4.807 4.991 . 0 0 "[ . 1]" 1
1475 1 75 SER HA 1 76 THR H . . 2.740 2.559 2.428 2.658 . 0 0 "[ . 1]" 1
1476 1 75 SER HA 1 76 THR HA . . 4.410 4.312 4.300 4.332 . 0 0 "[ . 1]" 1
1477 1 75 SER HA 1 79 ALA H . . 5.460 5.369 5.247 5.464 0.004 2 0 "[ . 1]" 1
1478 1 75 SER QB 1 76 THR H . . 3.430 2.207 1.944 2.358 . 0 0 "[ . 1]" 1
1479 1 75 SER QB 1 77 GLU H . . 3.410 2.952 2.699 3.235 . 0 0 "[ . 1]" 1
1480 1 75 SER HB2 1 76 THR H . . 4.070 3.045 2.192 3.655 . 0 0 "[ . 1]" 1
1481 1 75 SER HB2 1 78 SER H . . 4.360 2.625 2.349 4.031 . 0 0 "[ . 1]" 1
1482 1 75 SER HB3 1 76 THR H . . 4.070 2.404 1.961 3.652 . 0 0 "[ . 1]" 1
1483 1 75 SER HB3 1 78 SER H . . 4.360 3.778 3.234 4.097 . 0 0 "[ . 1]" 1
1484 1 76 THR H 1 76 THR HB . . 2.900 2.543 2.464 2.659 . 0 0 "[ . 1]" 1
1485 1 76 THR H 1 76 THR MG . . 3.900 3.770 3.766 3.779 . 0 0 "[ . 1]" 1
1486 1 76 THR H 1 77 GLU H . . 3.070 2.625 2.415 2.764 . 0 0 "[ . 1]" 1
1487 1 76 THR H 1 77 GLU QG . . 5.040 4.337 4.125 4.560 . 0 0 "[ . 1]" 1
1488 1 76 THR H 1 78 SER H . . 3.970 3.859 3.670 3.979 0.009 7 0 "[ . 1]" 1
1489 1 76 THR H 1 79 ALA MB . . 5.370 5.132 4.976 5.248 . 0 0 "[ . 1]" 1
1490 1 76 THR HA 1 76 THR MG . . 3.050 2.295 2.190 2.365 . 0 0 "[ . 1]" 1
1491 1 76 THR HA 1 78 SER H . . 4.780 4.280 4.150 4.532 . 0 0 "[ . 1]" 1
1492 1 76 THR HA 1 79 ALA H . . 4.420 3.720 3.567 3.884 . 0 0 "[ . 1]" 1
1493 1 76 THR HA 1 79 ALA MB . . 3.450 3.148 2.921 3.336 . 0 0 "[ . 1]" 1
1494 1 76 THR HB 1 77 GLU H . . 3.040 2.493 2.228 2.732 . 0 0 "[ . 1]" 1
1495 1 76 THR HB 1 77 GLU HB2 . . 5.250 4.775 4.666 4.860 . 0 0 "[ . 1]" 1
1496 1 76 THR HB 1 77 GLU HG2 . . 4.570 4.023 3.263 4.611 0.041 6 0 "[ . 1]" 1
1497 1 76 THR HB 1 77 GLU QG . . 3.980 3.219 2.844 3.590 . 0 0 "[ . 1]" 1
1498 1 76 THR HB 1 77 GLU HG3 . . 4.570 3.594 2.871 4.439 . 0 0 "[ . 1]" 1
1499 1 76 THR MG 1 77 GLU H . . 3.490 3.422 3.290 3.500 0.010 10 0 "[ . 1]" 1
1500 1 76 THR MG 1 77 GLU HA . . 3.680 3.551 3.463 3.676 . 0 0 "[ . 1]" 1
1501 1 76 THR MG 1 77 GLU HG2 . . 4.800 3.871 3.305 4.809 0.009 6 0 "[ . 1]" 1
1502 1 76 THR MG 1 77 GLU HG3 . . 4.800 4.158 3.410 4.799 . 0 0 "[ . 1]" 1
1503 1 76 THR MG 1 78 SER H . . 5.130 4.927 4.802 5.109 . 0 0 "[ . 1]" 1
1504 1 76 THR MG 1 79 ALA H . . 5.330 4.792 4.535 5.083 . 0 0 "[ . 1]" 1
1505 1 76 THR MG 1 80 LYS QE . . 3.630 2.530 2.042 3.084 . 0 0 "[ . 1]" 1
1506 1 76 THR MG 1 80 LYS QG . . 4.170 2.954 2.637 3.319 . 0 0 "[ . 1]" 1
1507 1 77 GLU H 1 77 GLU HB2 . . 2.730 2.485 2.312 2.678 . 0 0 "[ . 1]" 1
1508 1 77 GLU H 1 77 GLU HB3 . . 3.700 3.589 3.562 3.602 . 0 0 "[ . 1]" 1
1509 1 77 GLU H 1 77 GLU HG2 . . 3.930 3.140 2.433 3.634 . 0 0 "[ . 1]" 1
1510 1 77 GLU H 1 77 GLU QG . . 3.150 2.319 2.070 2.631 . 0 0 "[ . 1]" 1
1511 1 77 GLU H 1 77 GLU HG3 . . 3.930 2.524 2.085 3.179 . 0 0 "[ . 1]" 1
1512 1 77 GLU H 1 78 SER H . . 3.080 2.560 2.504 2.623 . 0 0 "[ . 1]" 1
1513 1 77 GLU H 1 79 ALA H . . 4.480 4.317 4.103 4.481 0.001 7 0 "[ . 1]" 1
1514 1 77 GLU H 1 79 ALA MB . . 5.210 5.120 5.054 5.214 0.004 1 0 "[ . 1]" 1
1515 1 77 GLU HA 1 77 GLU HG2 . . 3.760 2.558 2.281 3.317 . 0 0 "[ . 1]" 1
1516 1 77 GLU HA 1 77 GLU HG3 . . 3.760 3.283 2.637 3.735 . 0 0 "[ . 1]" 1
1517 1 77 GLU HA 1 80 LYS H . . 3.840 3.562 3.441 3.705 . 0 0 "[ . 1]" 1
1518 1 77 GLU HA 1 80 LYS HB2 . . 4.070 2.645 2.551 2.742 . 0 0 "[ . 1]" 1
1519 1 77 GLU HA 1 80 LYS HB3 . . 4.500 4.289 4.133 4.392 . 0 0 "[ . 1]" 1
1520 1 77 GLU HA 1 80 LYS HD2 . . 4.360 2.883 2.547 3.414 . 0 0 "[ . 1]" 1
1521 1 77 GLU HA 1 80 LYS QD . . 3.810 2.597 2.310 2.834 . 0 0 "[ . 1]" 1
1522 1 77 GLU HA 1 80 LYS HD3 . . 4.360 3.117 2.349 3.488 . 0 0 "[ . 1]" 1
1523 1 77 GLU HA 1 80 LYS HG2 . . 5.030 4.951 4.837 5.032 0.002 3 0 "[ . 1]" 1
1524 1 77 GLU HA 1 80 LYS QG . . 4.330 3.846 3.704 3.958 . 0 0 "[ . 1]" 1
1525 1 77 GLU HA 1 80 LYS HG3 . . 5.030 4.009 3.840 4.178 . 0 0 "[ . 1]" 1
1526 1 77 GLU HB2 1 77 GLU QG . . 2.620 2.269 2.131 2.524 . 0 0 "[ . 1]" 1
1527 1 77 GLU HB2 1 78 SER H . . 3.040 2.845 2.688 2.974 . 0 0 "[ . 1]" 1
1528 1 77 GLU HB3 1 78 SER H . . 4.070 3.824 3.488 4.072 0.002 6 0 "[ . 1]" 1
1529 1 77 GLU QG 1 78 SER H . . 4.450 4.115 3.988 4.202 . 0 0 "[ . 1]" 1
1530 1 78 SER H 1 79 ALA MB . . 4.590 4.321 4.157 4.469 . 0 0 "[ . 1]" 1
1531 1 79 ALA H 1 79 ALA MB . . 2.680 2.170 2.062 2.218 . 0 0 "[ . 1]" 1
1532 1 79 ALA H 1 80 LYS HA . . 5.320 5.254 5.036 5.348 0.028 8 0 "[ . 1]" 1
1533 1 79 ALA H 1 80 LYS HB2 . . 5.070 4.730 4.469 4.846 . 0 0 "[ . 1]" 1
1534 1 79 ALA H 1 80 LYS QG . . 5.340 4.380 4.013 4.550 . 0 0 "[ . 1]" 1
1535 1 79 ALA H 1 82 ALA MB . . 5.420 4.939 4.751 5.125 . 0 0 "[ . 1]" 1
1536 1 79 ALA HA 1 82 ALA H . . 3.790 3.465 3.383 3.578 . 0 0 "[ . 1]" 1
1537 1 79 ALA HA 1 82 ALA MB . . 3.370 2.879 2.742 3.030 . 0 0 "[ . 1]" 1
1538 1 79 ALA MB 1 80 LYS H . . 2.820 2.455 2.379 2.615 . 0 0 "[ . 1]" 1
1539 1 79 ALA MB 1 80 LYS HA . . 4.560 3.757 3.679 3.794 . 0 0 "[ . 1]" 1
1540 1 79 ALA MB 1 80 LYS QG . . 4.950 3.215 3.123 3.375 . 0 0 "[ . 1]" 1
1541 1 79 ALA MB 1 82 ALA H . . 4.690 4.411 4.346 4.563 . 0 0 "[ . 1]" 1
1542 1 79 ALA MB 1 82 ALA MB . . 4.050 3.934 3.850 4.060 0.010 2 0 "[ . 1]" 1
1543 1 79 ALA MB 1 83 TYR H . . 5.070 4.825 4.741 4.971 . 0 0 "[ . 1]" 1
1544 1 80 LYS H 1 80 LYS HB2 . . 3.750 2.491 2.411 2.576 . 0 0 "[ . 1]" 1
1545 1 80 LYS H 1 80 LYS HD2 . . 4.660 3.540 3.418 3.696 . 0 0 "[ . 1]" 1
1546 1 80 LYS H 1 80 LYS QD . . 3.870 3.340 3.111 3.519 . 0 0 "[ . 1]" 1
1547 1 80 LYS H 1 80 LYS HD3 . . 4.660 4.124 3.481 4.419 . 0 0 "[ . 1]" 1
1548 1 80 LYS H 1 80 LYS QG . . 2.860 2.184 2.028 2.322 . 0 0 "[ . 1]" 1
1549 1 80 LYS HA 1 80 LYS QD . . 4.890 4.088 4.068 4.108 . 0 0 "[ . 1]" 1
1550 1 80 LYS HA 1 80 LYS QE . . 5.080 4.636 4.533 4.824 . 0 0 "[ . 1]" 1
1551 1 80 LYS HA 1 80 LYS HG2 . . 3.750 2.765 2.658 2.925 . 0 0 "[ . 1]" 1
1552 1 80 LYS HA 1 80 LYS QG . . 3.250 2.467 2.428 2.502 . 0 0 "[ . 1]" 1
1553 1 80 LYS HA 1 80 LYS HG3 . . 3.750 2.783 2.653 2.850 . 0 0 "[ . 1]" 1
1554 1 80 LYS HA 1 83 TYR H . . 3.720 3.231 3.149 3.321 . 0 0 "[ . 1]" 1
1555 1 80 LYS HA 1 83 TYR HB2 . . 4.320 2.785 2.465 2.930 . 0 0 "[ . 1]" 1
1556 1 80 LYS HA 1 84 VAL QG . . 4.620 4.332 4.158 4.565 . 0 0 "[ . 1]" 1
1557 1 80 LYS HB2 1 81 GLU H . . 4.250 2.727 2.502 2.998 . 0 0 "[ . 1]" 1
1558 1 80 LYS HB3 1 80 LYS QE . . 4.920 3.508 3.046 3.698 . 0 0 "[ . 1]" 1
1559 1 80 LYS HB3 1 81 GLU H . . 5.000 3.701 3.423 3.931 . 0 0 "[ . 1]" 1
1560 1 80 LYS QE 1 80 LYS QG . . 3.210 2.144 1.995 2.259 . 0 0 "[ . 1]" 1
1561 1 81 GLU H 1 81 GLU HA . . 2.920 2.827 2.768 2.870 . 0 0 "[ . 1]" 1
1562 1 81 GLU H 1 81 GLU HB2 . . 3.580 2.291 2.073 3.592 0.012 2 0 "[ . 1]" 1
1563 1 81 GLU H 1 81 GLU QB . . 3.110 2.160 2.047 2.485 . 0 0 "[ . 1]" 1
1564 1 81 GLU H 1 81 GLU HB3 . . 3.580 3.312 2.534 3.484 . 0 0 "[ . 1]" 1
1565 1 81 GLU H 1 82 ALA H . . 2.880 2.579 2.432 2.812 . 0 0 "[ . 1]" 1
1566 1 81 GLU HA 1 85 LYS H . . 4.840 4.703 4.586 4.778 . 0 0 "[ . 1]" 1
1567 1 81 GLU HA 1 85 LYS QG . . 5.060 4.533 4.197 4.821 . 0 0 "[ . 1]" 1
1568 1 81 GLU QB 1 82 ALA HA . . 4.120 4.006 3.916 4.273 0.153 2 0 "[ . 1]" 1
1569 1 81 GLU QB 1 82 ALA MB . . 4.300 3.914 3.828 4.394 0.094 2 0 "[ . 1]" 1
1570 1 81 GLU QB 1 85 LYS QG . . 4.370 4.168 3.918 4.324 . 0 0 "[ . 1]" 1
1571 1 81 GLU HB2 1 82 ALA H . . 3.720 3.371 3.212 3.704 . 0 0 "[ . 1]" 1
1572 1 81 GLU HB2 1 82 ALA MB . . 4.900 4.431 4.251 4.824 . 0 0 "[ . 1]" 1
1573 1 81 GLU HB3 1 82 ALA H . . 3.720 3.625 3.237 3.887 0.167 2 0 "[ . 1]" 1
1574 1 81 GLU HB3 1 82 ALA MB . . 4.900 4.411 4.036 5.245 0.345 2 0 "[ . 1]" 1
1575 1 82 ALA H 1 82 ALA MB . . 2.510 2.259 2.104 2.319 . 0 0 "[ . 1]" 1
1576 1 82 ALA H 1 83 TYR HB2 . . 4.410 4.247 4.094 4.434 0.024 2 0 "[ . 1]" 1
1577 1 82 ALA H 1 85 LYS H . . 4.980 4.833 4.752 4.929 . 0 0 "[ . 1]" 1
1578 1 82 ALA H 1 85 LYS HB2 . . 5.440 5.325 5.259 5.436 . 0 0 "[ . 1]" 1
1579 1 82 ALA HA 1 85 LYS H . . 3.450 3.221 3.174 3.294 . 0 0 "[ . 1]" 1
1580 1 82 ALA HA 1 85 LYS HB2 . . 3.280 2.689 2.636 2.743 . 0 0 "[ . 1]" 1
1581 1 82 ALA HA 1 85 LYS QG . . 4.460 3.666 3.359 3.889 . 0 0 "[ . 1]" 1
1582 1 82 ALA HA 1 86 LEU H . . 3.880 3.537 3.343 3.688 . 0 0 "[ . 1]" 1
1583 1 82 ALA HA 1 86 LEU HB3 . . 5.000 4.973 4.849 5.052 0.052 5 0 "[ . 1]" 1
1584 1 82 ALA MB 1 83 TYR H . . 3.030 2.890 2.835 3.033 0.003 2 0 "[ . 1]" 1
1585 1 82 ALA MB 1 83 TYR QD . . 5.290 4.909 4.760 5.060 . 0 0 "[ . 1]" 1
1586 1 82 ALA MB 1 84 VAL H . . 4.880 4.439 4.371 4.562 . 0 0 "[ . 1]" 1
1587 1 82 ALA MB 1 85 LYS H . . 4.740 4.492 4.467 4.558 . 0 0 "[ . 1]" 1
1588 1 82 ALA MB 1 85 LYS HB2 . . 4.200 4.093 4.025 4.155 . 0 0 "[ . 1]" 1
1589 1 82 ALA MB 1 86 LEU H . . 4.240 4.107 3.975 4.193 . 0 0 "[ . 1]" 1
1590 1 83 TYR H 1 83 TYR HB2 . . 2.980 2.268 2.193 2.309 . 0 0 "[ . 1]" 1
1591 1 83 TYR H 1 83 TYR HB3 . . 3.030 2.867 2.812 2.978 . 0 0 "[ . 1]" 1
1592 1 83 TYR H 1 83 TYR QD . . 4.240 4.084 3.995 4.131 . 0 0 "[ . 1]" 1
1593 1 83 TYR H 1 84 VAL H . . 3.030 2.500 2.425 2.529 . 0 0 "[ . 1]" 1
1594 1 83 TYR H 1 84 VAL QG . . 4.350 3.827 3.603 3.978 . 0 0 "[ . 1]" 1
1595 1 83 TYR H 1 85 LYS H . . 4.190 4.045 3.886 4.142 . 0 0 "[ . 1]" 1
1596 1 83 TYR H 1 85 LYS HB2 . . 5.350 5.330 5.229 5.374 0.024 9 0 "[ . 1]" 1
1597 1 83 TYR HA 1 83 TYR QD . . 4.160 3.040 2.955 3.072 . 0 0 "[ . 1]" 1
1598 1 83 TYR HA 1 85 LYS H . . 4.610 4.409 4.257 4.536 . 0 0 "[ . 1]" 1
1599 1 83 TYR HA 1 86 LEU H . . 4.150 3.737 3.642 3.920 . 0 0 "[ . 1]" 1
1600 1 83 TYR HA 1 86 LEU HB2 . . 5.050 4.111 3.972 4.296 . 0 0 "[ . 1]" 1
1601 1 83 TYR HA 1 86 LEU HB3 . . 4.820 2.972 2.879 3.138 . 0 0 "[ . 1]" 1
1602 1 83 TYR HA 1 87 LEU H . . 4.200 3.447 3.418 3.468 . 0 0 "[ . 1]" 1
1603 1 83 TYR HA 1 87 LEU HB3 . . 5.500 4.847 4.736 4.934 . 0 0 "[ . 1]" 1
1604 1 83 TYR HB2 1 84 VAL H . . 4.090 3.818 3.746 3.889 . 0 0 "[ . 1]" 1
1605 1 83 TYR HB3 1 84 VAL H . . 3.290 3.080 2.868 3.209 . 0 0 "[ . 1]" 1
1606 1 83 TYR HB3 1 84 VAL HA . . 4.270 4.141 4.092 4.184 . 0 0 "[ . 1]" 1
1607 1 83 TYR HB3 1 87 LEU MD2 . . 5.330 4.831 4.659 4.943 . 0 0 "[ . 1]" 1
1608 1 83 TYR QD 1 84 VAL HA . . 4.210 3.828 3.581 4.150 . 0 0 "[ . 1]" 1
1609 1 83 TYR QE 1 87 LEU HB2 . . 4.660 3.511 3.292 3.779 . 0 0 "[ . 1]" 1
1610 1 83 TYR QE 1 87 LEU MD1 . . 3.600 3.562 3.457 3.616 0.016 2 0 "[ . 1]" 1
1611 1 83 TYR QE 1 87 LEU MD2 . . 4.400 2.501 2.321 2.907 . 0 0 "[ . 1]" 1
1612 1 84 VAL H 1 84 VAL HB . . 2.800 2.539 2.452 2.630 . 0 0 "[ . 1]" 1
1613 1 84 VAL H 1 84 VAL QG . . 2.720 2.363 2.191 2.497 . 0 0 "[ . 1]" 1
1614 1 84 VAL H 1 85 LYS H . . 3.060 2.302 2.229 2.438 . 0 0 "[ . 1]" 1
1615 1 84 VAL HA 1 84 VAL QG . . 2.810 2.103 2.062 2.136 . 0 0 "[ . 1]" 1
1616 1 84 VAL HA 1 86 LEU H . . 4.950 4.605 4.347 4.844 . 0 0 "[ . 1]" 1
1617 1 84 VAL HA 1 87 LEU H . . 4.220 3.959 3.829 4.073 . 0 0 "[ . 1]" 1
1618 1 84 VAL HA 1 87 LEU HB2 . . 4.290 4.020 3.950 4.065 . 0 0 "[ . 1]" 1
1619 1 84 VAL HA 1 87 LEU HB3 . . 3.830 3.049 2.995 3.098 . 0 0 "[ . 1]" 1
1620 1 84 VAL HA 1 87 LEU MD1 . . 5.500 5.538 5.516 5.554 0.054 10 0 "[ . 1]" 1
1621 1 84 VAL HA 1 87 LEU MD2 . . 4.480 3.755 3.716 3.813 . 0 0 "[ . 1]" 1
1622 1 84 VAL HA 1 88 ASP H . . 4.720 4.695 4.589 4.759 0.039 7 0 "[ . 1]" 1
1623 1 84 VAL HA 1 88 ASP HB2 . . 5.500 5.376 5.246 5.478 . 0 0 "[ . 1]" 1
1624 1 84 VAL HA 1 94 TRP HE1 . . 5.080 4.340 4.117 4.594 . 0 0 "[ . 1]" 1
1625 1 84 VAL HA 1 94 TRP HZ2 . . 4.680 2.108 1.987 2.331 . 0 0 "[ . 1]" 1
1626 1 84 VAL HA 1 95 ARG HE . . 5.500 5.503 5.484 5.522 0.022 7 0 "[ . 1]" 1
1627 1 84 VAL HB 1 85 LYS H . . 3.010 2.802 2.702 2.992 . 0 0 "[ . 1]" 1
1628 1 84 VAL QG 1 87 LEU MD2 . . 4.560 4.023 3.976 4.062 . 0 0 "[ . 1]" 1
1629 1 84 VAL QG 1 94 TRP HZ2 . . 3.590 1.898 1.877 1.944 . 0 0 "[ . 1]" 1
1630 1 85 LYS H 1 85 LYS HB2 . . 2.620 2.348 2.258 2.459 . 0 0 "[ . 1]" 1
1631 1 85 LYS H 1 85 LYS QD . . 5.180 4.260 3.829 4.561 . 0 0 "[ . 1]" 1
1632 1 85 LYS H 1 85 LYS HG2 . . 3.780 3.016 2.395 3.517 . 0 0 "[ . 1]" 1
1633 1 85 LYS H 1 85 LYS QG . . 2.960 2.682 2.350 2.892 . 0 0 "[ . 1]" 1
1634 1 85 LYS H 1 85 LYS HG3 . . 3.780 3.326 2.820 3.756 . 0 0 "[ . 1]" 1
1635 1 85 LYS H 1 86 LEU H . . 3.030 2.382 2.328 2.502 . 0 0 "[ . 1]" 1
1636 1 85 LYS H 1 86 LEU HB2 . . 5.050 4.677 4.635 4.779 . 0 0 "[ . 1]" 1
1637 1 85 LYS H 1 86 LEU HB3 . . 4.990 4.662 4.582 4.758 . 0 0 "[ . 1]" 1
1638 1 85 LYS H 1 87 LEU H . . 4.120 4.006 3.848 4.125 0.005 3 0 "[ . 1]" 1
1639 1 85 LYS H 1 88 ASP H . . 4.960 4.859 4.785 4.940 . 0 0 "[ . 1]" 1
1640 1 85 LYS H 1 88 ASP HB2 . . 5.500 5.472 5.331 5.516 0.016 1 0 "[ . 1]" 1
1641 1 85 LYS H 1 94 TRP HZ2 . . 5.160 5.072 4.897 5.188 0.028 5 0 "[ . 1]" 1
1642 1 85 LYS HA 1 85 LYS QD . . 3.740 2.868 2.055 3.664 . 0 0 "[ . 1]" 1
1643 1 85 LYS HA 1 85 LYS HG2 . . 3.990 2.505 2.225 2.909 . 0 0 "[ . 1]" 1
1644 1 85 LYS HA 1 85 LYS QG . . 3.480 2.456 2.191 2.818 . 0 0 "[ . 1]" 1
1645 1 85 LYS HA 1 85 LYS HG3 . . 3.990 3.564 3.281 3.791 . 0 0 "[ . 1]" 1
1646 1 85 LYS HA 1 88 ASP H . . 3.950 3.789 3.711 3.871 . 0 0 "[ . 1]" 1
1647 1 85 LYS HA 1 88 ASP HB2 . . 3.740 3.245 3.081 3.317 . 0 0 "[ . 1]" 1
1648 1 85 LYS HA 1 88 ASP HB3 . . 3.850 3.737 3.573 3.827 . 0 0 "[ . 1]" 1
1649 1 85 LYS HA 1 94 TRP HE1 . . 5.500 5.518 5.424 5.551 0.051 1 0 "[ . 1]" 1
1650 1 85 LYS HB2 1 86 LEU H . . 2.910 2.729 2.534 2.915 0.005 6 0 "[ . 1]" 1
1651 1 85 LYS HG2 1 86 LEU H . . 4.930 4.656 4.325 4.940 0.010 6 0 "[ . 1]" 1
1652 1 85 LYS HG3 1 86 LEU H . . 4.930 4.762 4.544 4.939 0.009 9 0 "[ . 1]" 1
1653 1 86 LEU H 1 86 LEU HB2 . . 3.080 2.489 2.425 2.567 . 0 0 "[ . 1]" 1
1654 1 86 LEU H 1 86 LEU HB3 . . 2.870 2.558 2.517 2.592 . 0 0 "[ . 1]" 1
1655 1 86 LEU H 1 86 LEU MD1 . . 4.210 4.118 4.046 4.167 . 0 0 "[ . 1]" 1
1656 1 86 LEU H 1 86 LEU MD2 . . 4.210 4.031 3.990 4.076 . 0 0 "[ . 1]" 1
1657 1 86 LEU H 1 87 LEU H . . 2.960 2.596 2.491 2.721 . 0 0 "[ . 1]" 1
1658 1 86 LEU H 1 87 LEU HB2 . . 5.100 4.946 4.828 5.096 . 0 0 "[ . 1]" 1
1659 1 86 LEU H 1 88 ASP H . . 4.100 3.893 3.790 3.979 . 0 0 "[ . 1]" 1
1660 1 86 LEU HA 1 86 LEU MD1 . . 4.060 3.184 3.137 3.278 . 0 0 "[ . 1]" 1
1661 1 86 LEU HA 1 86 LEU QD . . 2.730 1.934 1.914 1.970 . 0 0 "[ . 1]" 1
1662 1 86 LEU HA 1 86 LEU MD2 . . 4.060 1.951 1.931 1.986 . 0 0 "[ . 1]" 1
1663 1 86 LEU HA 1 89 THR HB . . 3.870 3.787 3.644 3.897 0.027 5 0 "[ . 1]" 1
1664 1 86 LEU HA 1 90 LEU QD . . 5.270 4.549 4.485 4.620 . 0 0 "[ . 1]" 1
1665 1 86 LEU HB2 1 86 LEU MD1 . . 3.670 3.151 3.140 3.157 . 0 0 "[ . 1]" 1
1666 1 86 LEU HB2 1 86 LEU QD . . 3.120 2.413 2.407 2.424 . 0 0 "[ . 1]" 1
1667 1 86 LEU HB2 1 86 LEU MD2 . . 3.670 2.505 2.497 2.522 . 0 0 "[ . 1]" 1
1668 1 86 LEU HB3 1 86 LEU MD1 . . 3.410 2.113 2.072 2.142 . 0 0 "[ . 1]" 1
1669 1 86 LEU HB3 1 86 LEU QD . . 2.980 2.084 2.046 2.110 . 0 0 "[ . 1]" 1
1670 1 86 LEU HB3 1 86 LEU MD2 . . 3.410 3.180 3.175 3.181 . 0 0 "[ . 1]" 1
1671 1 86 LEU HB3 1 87 LEU H . . 3.300 2.438 2.359 2.480 . 0 0 "[ . 1]" 1
1672 1 86 LEU HB3 1 90 LEU QD . . 4.040 3.875 3.725 3.980 . 0 0 "[ . 1]" 1
1673 1 86 LEU QD 1 87 LEU H . . 3.560 2.988 2.869 3.044 . 0 0 "[ . 1]" 1
1674 1 86 LEU QD 1 88 ASP H . . 4.800 4.053 4.022 4.088 . 0 0 "[ . 1]" 1
1675 1 86 LEU QD 1 89 THR H . . 3.740 3.365 3.336 3.416 . 0 0 "[ . 1]" 1
1676 1 86 LEU QD 1 89 THR HB . . 3.670 3.066 2.922 3.286 . 0 0 "[ . 1]" 1
1677 1 86 LEU QD 1 90 LEU H . . 4.100 3.676 3.600 3.731 . 0 0 "[ . 1]" 1
1678 1 86 LEU QD 1 90 LEU QD . . 3.130 1.817 1.785 1.838 . 0 0 "[ . 1]" 1
1679 1 86 LEU QD 1 90 LEU HG . . 4.910 2.818 2.261 2.986 . 0 0 "[ . 1]" 1
1680 1 86 LEU MD1 1 87 LEU H . . 4.280 3.050 2.918 3.113 . 0 0 "[ . 1]" 1
1681 1 86 LEU MD1 1 90 LEU H . . 4.840 3.842 3.751 3.923 . 0 0 "[ . 1]" 1
1682 1 86 LEU MD2 1 87 LEU H . . 4.280 4.284 4.227 4.308 0.028 10 0 "[ . 1]" 1
1683 1 86 LEU MD2 1 90 LEU H . . 4.840 4.693 4.500 4.810 . 0 0 "[ . 1]" 1
1684 1 87 LEU H 1 87 LEU HB2 . . 2.990 2.494 2.472 2.521 . 0 0 "[ . 1]" 1
1685 1 87 LEU H 1 87 LEU HB3 . . 3.510 2.515 2.487 2.538 . 0 0 "[ . 1]" 1
1686 1 87 LEU H 1 87 LEU MD1 . . 4.140 4.017 4.005 4.041 . 0 0 "[ . 1]" 1
1687 1 87 LEU H 1 87 LEU MD2 . . 4.430 4.203 4.185 4.215 . 0 0 "[ . 1]" 1
1688 1 87 LEU H 1 87 LEU HG . . 4.660 4.506 4.487 4.522 . 0 0 "[ . 1]" 1
1689 1 87 LEU H 1 88 ASP H . . 2.980 2.735 2.727 2.748 . 0 0 "[ . 1]" 1
1690 1 87 LEU H 1 89 THR H . . 4.500 4.305 4.264 4.352 . 0 0 "[ . 1]" 1
1691 1 87 LEU H 1 90 LEU QD . . 3.770 3.716 3.625 3.766 . 0 0 "[ . 1]" 1
1692 1 87 LEU H 1 94 TRP HE1 . . 5.500 5.465 5.347 5.565 0.065 7 0 "[ . 1]" 1
1693 1 87 LEU H 1 94 TRP HZ2 . . 5.500 5.204 5.070 5.448 . 0 0 "[ . 1]" 1
1694 1 87 LEU HA 1 87 LEU MD1 . . 3.050 2.097 2.060 2.138 . 0 0 "[ . 1]" 1
1695 1 87 LEU HA 1 87 LEU MD2 . . 4.390 3.794 3.770 3.811 . 0 0 "[ . 1]" 1
1696 1 87 LEU HA 1 87 LEU HG . . 3.810 3.342 3.326 3.361 . 0 0 "[ . 1]" 1
1697 1 87 LEU HA 1 89 THR H . . 4.590 3.695 3.515 3.811 . 0 0 "[ . 1]" 1
1698 1 87 LEU HA 1 90 LEU H . . 3.240 3.091 3.010 3.149 . 0 0 "[ . 1]" 1
1699 1 87 LEU HA 1 90 LEU HB2 . . 4.610 2.900 2.803 2.988 . 0 0 "[ . 1]" 1
1700 1 87 LEU HA 1 90 LEU QB . . 3.980 2.866 2.775 2.952 . 0 0 "[ . 1]" 1
1701 1 87 LEU HA 1 90 LEU HB3 . . 4.610 4.485 4.301 4.587 . 0 0 "[ . 1]" 1
1702 1 87 LEU HA 1 90 LEU QD . . 3.540 1.888 1.874 1.917 . 0 0 "[ . 1]" 1
1703 1 87 LEU HA 1 91 ALA H . . 3.800 3.729 3.627 3.788 . 0 0 "[ . 1]" 1
1704 1 87 LEU HB2 1 88 ASP H . . 4.290 4.098 4.073 4.120 . 0 0 "[ . 1]" 1
1705 1 87 LEU HB2 1 94 TRP HE1 . . 5.450 5.180 5.053 5.303 . 0 0 "[ . 1]" 1
1706 1 87 LEU HB3 1 87 LEU MD2 . . 3.650 2.492 2.463 2.515 . 0 0 "[ . 1]" 1
1707 1 87 LEU HB3 1 88 ASP H . . 3.180 2.980 2.946 3.006 . 0 0 "[ . 1]" 1
1708 1 87 LEU HB3 1 88 ASP HB3 . . 5.500 5.490 5.455 5.510 0.010 1 0 "[ . 1]" 1
1709 1 87 LEU HB3 1 94 TRP HE1 . . 3.950 3.502 3.374 3.642 . 0 0 "[ . 1]" 1
1710 1 87 LEU HB3 1 94 TRP HZ2 . . 4.600 3.448 3.348 3.632 . 0 0 "[ . 1]" 1
1711 1 87 LEU MD1 1 88 ASP H . . 5.130 4.400 4.368 4.428 . 0 0 "[ . 1]" 1
1712 1 87 LEU MD1 1 88 ASP HA . . 4.730 4.527 4.496 4.568 . 0 0 "[ . 1]" 1
1713 1 87 LEU MD1 1 89 THR H . . 4.960 4.641 4.500 4.794 . 0 0 "[ . 1]" 1
1714 1 87 LEU MD1 1 90 LEU H . . 3.590 3.365 3.309 3.458 . 0 0 "[ . 1]" 1
1715 1 87 LEU MD1 1 90 LEU HA . . 4.860 4.523 4.473 4.616 . 0 0 "[ . 1]" 1
1716 1 87 LEU MD1 1 90 LEU QB . . 3.210 1.961 1.928 2.023 . 0 0 "[ . 1]" 1
1717 1 87 LEU MD1 1 90 LEU HG . . 5.310 3.956 3.440 4.190 . 0 0 "[ . 1]" 1
1718 1 87 LEU MD1 1 91 ALA H . . 3.490 2.220 2.105 2.352 . 0 0 "[ . 1]" 1
1719 1 87 LEU MD1 1 91 ALA HA . . 4.890 4.452 4.322 4.600 . 0 0 "[ . 1]" 1
1720 1 87 LEU MD1 1 91 ALA MB . . 3.040 2.554 2.396 2.647 . 0 0 "[ . 1]" 1
1721 1 87 LEU MD1 1 92 PRO HD3 . . 5.500 5.195 5.106 5.296 . 0 0 "[ . 1]" 1
1722 1 87 LEU MD1 1 94 TRP HB3 . . 4.520 4.426 4.331 4.524 0.004 6 0 "[ . 1]" 1
1723 1 87 LEU MD1 1 94 TRP HE1 . . 4.870 4.852 4.736 4.887 0.017 10 0 "[ . 1]" 1
1724 1 87 LEU MD2 1 88 ASP H . . 5.000 4.856 4.832 4.895 . 0 0 "[ . 1]" 1
1725 1 87 LEU MD2 1 91 ALA H . . 4.750 4.665 4.604 4.750 . 0 0 "[ . 1]" 1
1726 1 87 LEU MD2 1 91 ALA MB . . 4.080 3.842 3.737 3.987 . 0 0 "[ . 1]" 1
1727 1 87 LEU MD2 1 94 TRP H . . 5.450 5.228 5.152 5.345 . 0 0 "[ . 1]" 1
1728 1 87 LEU MD2 1 94 TRP HB2 . . 4.850 3.888 3.759 4.019 . 0 0 "[ . 1]" 1
1729 1 87 LEU MD2 1 94 TRP HB3 . . 4.860 3.760 3.650 3.897 . 0 0 "[ . 1]" 1
1730 1 87 LEU MD2 1 94 TRP HD1 . . 4.270 4.159 3.912 4.258 . 0 0 "[ . 1]" 1
1731 1 87 LEU MD2 1 94 TRP HE1 . . 3.800 3.750 3.539 3.831 0.031 10 0 "[ . 1]" 1
1732 1 87 LEU MD2 1 94 TRP HZ2 . . 4.860 3.565 3.385 3.677 . 0 0 "[ . 1]" 1
1733 1 87 LEU HG 1 88 ASP H . . 4.370 4.125 4.090 4.165 . 0 0 "[ . 1]" 1
1734 1 87 LEU HG 1 89 THR H . . 5.390 5.365 5.166 5.447 0.057 7 0 "[ . 1]" 1
1735 1 87 LEU HG 1 90 LEU QD . . 4.600 4.208 4.129 4.260 . 0 0 "[ . 1]" 1
1736 1 87 LEU HG 1 91 ALA H . . 4.410 3.452 3.410 3.544 . 0 0 "[ . 1]" 1
1737 1 87 LEU HG 1 91 ALA MB . . 4.080 3.599 3.505 3.726 . 0 0 "[ . 1]" 1
1738 1 87 LEU HG 1 94 TRP H . . 5.010 5.044 5.025 5.083 0.073 2 0 "[ . 1]" 1
1739 1 87 LEU HG 1 94 TRP HB3 . . 5.040 4.152 4.096 4.192 . 0 0 "[ . 1]" 1
1740 1 87 LEU HG 1 94 TRP HD1 . . 3.790 3.563 3.329 3.645 . 0 0 "[ . 1]" 1
1741 1 87 LEU HG 1 94 TRP HE1 . . 3.740 3.396 3.234 3.444 . 0 0 "[ . 1]" 1
1742 1 88 ASP H 1 88 ASP HB2 . . 3.140 2.436 2.411 2.485 . 0 0 "[ . 1]" 1
1743 1 88 ASP H 1 88 ASP HB3 . . 2.950 2.630 2.577 2.656 . 0 0 "[ . 1]" 1
1744 1 88 ASP H 1 89 THR H . . 3.030 2.637 2.618 2.655 . 0 0 "[ . 1]" 1
1745 1 88 ASP H 1 90 LEU H . . 4.240 4.075 3.979 4.145 . 0 0 "[ . 1]" 1
1746 1 88 ASP H 1 90 LEU QD . . 4.470 4.488 4.405 4.611 0.141 5 0 "[ . 1]" 1
1747 1 88 ASP H 1 92 PRO HA . . 5.500 5.160 4.997 5.387 . 0 0 "[ . 1]" 1
1748 1 88 ASP H 1 94 TRP HE1 . . 3.940 3.934 3.898 3.955 0.015 5 0 "[ . 1]" 1
1749 1 88 ASP H 1 94 TRP HZ2 . . 5.500 4.919 4.698 5.161 . 0 0 "[ . 1]" 1
1750 1 88 ASP H 1 95 ARG HE . . 5.500 4.773 4.070 5.019 . 0 0 "[ . 1]" 1
1751 1 88 ASP HA 1 91 ALA H . . 4.340 3.942 3.862 4.047 . 0 0 "[ . 1]" 1
1752 1 88 ASP HA 1 94 TRP HD1 . . 3.550 3.593 3.576 3.612 0.062 10 0 "[ . 1]" 1
1753 1 88 ASP HA 1 94 TRP HE1 . . 3.200 3.062 2.892 3.206 0.006 6 0 "[ . 1]" 1
1754 1 88 ASP HA 1 95 ARG HE . . 4.930 3.662 2.929 3.966 . 0 0 "[ . 1]" 1
1755 1 88 ASP HB2 1 89 THR H . . 4.190 4.027 3.976 4.114 . 0 0 "[ . 1]" 1
1756 1 88 ASP HB2 1 94 TRP HE1 . . 4.280 3.459 3.354 3.629 . 0 0 "[ . 1]" 1
1757 1 88 ASP HB3 1 89 THR H . . 3.270 2.998 2.891 3.152 . 0 0 "[ . 1]" 1
1758 1 88 ASP HB3 1 90 LEU H . . 5.500 5.062 4.948 5.196 . 0 0 "[ . 1]" 1
1759 1 88 ASP HB3 1 94 TRP HE1 . . 5.220 5.012 4.899 5.162 . 0 0 "[ . 1]" 1
1760 1 89 THR H 1 89 THR HB . . 2.800 2.481 2.437 2.546 . 0 0 "[ . 1]" 1
1761 1 89 THR H 1 89 THR MG . . 3.120 2.400 2.349 2.449 . 0 0 "[ . 1]" 1
1762 1 89 THR H 1 90 LEU H . . 2.850 2.341 2.242 2.382 . 0 0 "[ . 1]" 1
1763 1 89 THR H 1 90 LEU QD . . 4.400 3.839 3.660 4.070 . 0 0 "[ . 1]" 1
1764 1 89 THR H 1 91 ALA H . . 4.440 4.309 4.184 4.398 . 0 0 "[ . 1]" 1
1765 1 89 THR HA 1 89 THR MG . . 3.260 3.175 3.171 3.179 . 0 0 "[ . 1]" 1
1766 1 89 THR HB 1 90 LEU H . . 3.970 3.923 3.881 3.981 0.011 5 0 "[ . 1]" 1
1767 1 89 THR MG 1 90 LEU H . . 3.490 2.151 2.089 2.225 . 0 0 "[ . 1]" 1
1768 1 89 THR MG 1 90 LEU MD1 . . 3.630 2.751 2.515 3.368 . 0 0 "[ . 1]" 1
1769 1 89 THR MG 1 90 LEU QD . . 2.860 2.448 2.260 2.558 . 0 0 "[ . 1]" 1
1770 1 89 THR MG 1 90 LEU MD2 . . 3.630 3.048 2.297 3.332 . 0 0 "[ . 1]" 1
1771 1 89 THR MG 1 90 LEU HG . . 4.630 2.012 1.935 2.113 . 0 0 "[ . 1]" 1
1772 1 90 LEU H 1 90 LEU HB2 . . 3.770 2.532 2.460 2.692 . 0 0 "[ . 1]" 1
1773 1 90 LEU H 1 90 LEU HB3 . . 3.770 3.636 3.620 3.648 . 0 0 "[ . 1]" 1
1774 1 90 LEU H 1 90 LEU MD1 . . 4.080 3.017 2.814 3.462 . 0 0 "[ . 1]" 1
1775 1 90 LEU H 1 90 LEU QD . . 3.000 2.883 2.766 3.039 0.039 7 0 "[ . 1]" 1
1776 1 90 LEU H 1 90 LEU MD2 . . 4.080 3.917 3.363 4.084 0.004 8 0 "[ . 1]" 1
1777 1 90 LEU H 1 90 LEU HG . . 2.680 2.549 2.099 2.711 0.031 8 0 "[ . 1]" 1
1778 1 90 LEU H 1 91 ALA H . . 2.790 2.512 2.471 2.544 . 0 0 "[ . 1]" 1
1779 1 90 LEU H 1 91 ALA HA . . 5.410 4.903 4.874 4.949 . 0 0 "[ . 1]" 1
1780 1 90 LEU H 1 91 ALA MB . . 4.920 4.663 4.633 4.697 . 0 0 "[ . 1]" 1
1781 1 90 LEU H 1 92 PRO HD3 . . 4.650 4.009 3.906 4.104 . 0 0 "[ . 1]" 1
1782 1 90 LEU HA 1 90 LEU QD . . 3.970 2.692 2.353 2.835 . 0 0 "[ . 1]" 1
1783 1 90 LEU HA 1 90 LEU HG . . 3.740 2.788 2.628 3.197 . 0 0 "[ . 1]" 1
1784 1 90 LEU HA 1 91 ALA MB . . 5.360 4.532 4.508 4.566 . 0 0 "[ . 1]" 1
1785 1 90 LEU QB 1 90 LEU QD . . 2.740 1.779 1.733 1.861 . 0 0 "[ . 1]" 1
1786 1 90 LEU QB 1 91 ALA H . . 2.830 2.181 2.121 2.230 . 0 0 "[ . 1]" 1
1787 1 90 LEU QB 1 91 ALA MB . . 3.400 3.162 3.069 3.189 . 0 0 "[ . 1]" 1
1788 1 90 LEU HB2 1 91 ALA H . . 3.430 2.209 2.138 2.261 . 0 0 "[ . 1]" 1
1789 1 90 LEU HB3 1 91 ALA H . . 3.430 3.394 3.310 3.513 0.083 7 0 "[ . 1]" 1
1790 1 90 LEU QD 1 91 ALA H . . 3.750 3.597 3.560 3.643 . 0 0 "[ . 1]" 1
1791 1 90 LEU HG 1 91 ALA H . . 4.720 4.251 3.819 4.420 . 0 0 "[ . 1]" 1
1792 1 91 ALA H 1 91 ALA MB . . 2.860 2.600 2.542 2.640 . 0 0 "[ . 1]" 1
1793 1 91 ALA H 1 92 PRO HA . . 4.550 4.439 4.405 4.477 . 0 0 "[ . 1]" 1
1794 1 91 ALA H 1 92 PRO HB3 . . 5.410 5.247 5.187 5.324 . 0 0 "[ . 1]" 1
1795 1 91 ALA H 1 92 PRO HD2 . . 4.260 4.081 4.030 4.147 . 0 0 "[ . 1]" 1
1796 1 91 ALA H 1 92 PRO HD3 . . 3.480 3.333 3.259 3.428 . 0 0 "[ . 1]" 1
1797 1 91 ALA H 1 94 TRP HB3 . . 5.500 5.578 5.549 5.593 0.093 4 0 "[ . 1]" 1
1798 1 91 ALA H 1 94 TRP HD1 . . 4.860 4.817 4.706 4.859 . 0 0 "[ . 1]" 1
1799 1 91 ALA H 1 94 TRP HE1 . . 5.500 5.601 5.565 5.635 0.135 1 0 "[ . 1]" 1
1800 1 91 ALA HA 1 92 PRO HB2 . . 5.500 5.524 5.512 5.534 0.034 1 0 "[ . 1]" 1
1801 1 91 ALA HA 1 92 PRO HB3 . . 5.200 5.156 5.133 5.175 . 0 0 "[ . 1]" 1
1802 1 91 ALA HA 1 92 PRO HD2 . . 3.130 1.988 1.970 2.002 . 0 0 "[ . 1]" 1
1803 1 91 ALA HA 1 92 PRO HD3 . . 3.260 2.759 2.723 2.787 . 0 0 "[ . 1]" 1
1804 1 91 ALA HA 1 93 SER H . . 3.770 3.151 3.136 3.169 . 0 0 "[ . 1]" 1
1805 1 91 ALA HA 1 94 TRP H . . 5.280 4.846 4.810 4.876 . 0 0 "[ . 1]" 1
1806 1 91 ALA MB 1 92 PRO HD2 . . 4.100 3.639 3.604 3.666 . 0 0 "[ . 1]" 1
1807 1 91 ALA MB 1 92 PRO HD3 . . 4.280 4.155 4.150 4.158 . 0 0 "[ . 1]" 1
1808 1 91 ALA MB 1 93 SER H . . 3.790 3.162 3.117 3.217 . 0 0 "[ . 1]" 1
1809 1 91 ALA MB 1 93 SER QB . . 4.170 3.434 3.338 3.601 . 0 0 "[ . 1]" 1
1810 1 91 ALA MB 1 94 TRP H . . 3.890 3.590 3.497 3.647 . 0 0 "[ . 1]" 1
1811 1 91 ALA MB 1 94 TRP HB2 . . 4.880 4.719 4.672 4.807 . 0 0 "[ . 1]" 1
1812 1 91 ALA MB 1 94 TRP HB3 . . 3.370 3.291 3.242 3.379 0.009 4 0 "[ . 1]" 1
1813 1 91 ALA MB 1 94 TRP HD1 . . 4.250 4.098 4.067 4.132 . 0 0 "[ . 1]" 1
1814 1 92 PRO HA 1 94 TRP H . . 3.840 3.338 3.320 3.358 . 0 0 "[ . 1]" 1
1815 1 92 PRO HA 1 94 TRP HD1 . . 4.150 2.368 2.249 2.538 . 0 0 "[ . 1]" 1
1816 1 92 PRO HA 1 94 TRP HE1 . . 4.460 3.528 3.279 3.892 . 0 0 "[ . 1]" 1
1817 1 92 PRO HB2 1 93 SER H . . 3.990 3.835 3.819 3.847 . 0 0 "[ . 1]" 1
1818 1 92 PRO HB2 1 94 TRP H . . 5.120 4.883 4.867 4.896 . 0 0 "[ . 1]" 1
1819 1 92 PRO HB2 1 96 ASN QD . . 4.480 2.704 2.261 3.232 . 0 0 "[ . 1]" 1
1820 1 92 PRO HB3 1 93 SER H . . 4.520 4.431 4.421 4.437 . 0 0 "[ . 1]" 1
1821 1 92 PRO HB3 1 94 TRP H . . 5.500 5.357 5.341 5.372 . 0 0 "[ . 1]" 1
1822 1 92 PRO HD2 1 93 SER H . . 3.620 2.875 2.860 2.887 . 0 0 "[ . 1]" 1
1823 1 92 PRO HD3 1 93 SER H . . 4.100 3.963 3.955 3.969 . 0 0 "[ . 1]" 1
1824 1 93 SER H 1 93 SER HB2 . . 3.650 2.534 2.207 2.795 . 0 0 "[ . 1]" 1
1825 1 93 SER H 1 93 SER QB . . 2.940 2.415 2.185 2.701 . 0 0 "[ . 1]" 1
1826 1 93 SER H 1 93 SER HB3 . . 3.650 3.272 2.490 3.606 . 0 0 "[ . 1]" 1
1827 1 93 SER H 1 94 TRP HB3 . . 4.670 4.424 4.389 4.472 . 0 0 "[ . 1]" 1
1828 1 93 SER H 1 94 TRP HD1 . . 4.420 3.837 3.727 4.024 . 0 0 "[ . 1]" 1
1829 1 93 SER H 1 95 ARG H . . 4.580 4.344 4.268 4.403 . 0 0 "[ . 1]" 1
1830 1 93 SER HA 1 94 TRP H . . 3.510 3.319 3.298 3.338 . 0 0 "[ . 1]" 1
1831 1 93 SER HA 1 95 ARG H . . 4.230 3.925 3.867 3.982 . 0 0 "[ . 1]" 1
1832 1 93 SER HA 1 96 ASN H . . 3.780 3.204 3.129 3.281 . 0 0 "[ . 1]" 1
1833 1 93 SER HA 1 96 ASN HD21 . . 4.450 2.969 2.575 3.550 . 0 0 "[ . 1]" 1
1834 1 93 SER HA 1 96 ASN QD . . 3.830 2.685 2.074 2.981 . 0 0 "[ . 1]" 1
1835 1 93 SER HA 1 96 ASN HD22 . . 4.450 3.616 2.187 4.431 . 0 0 "[ . 1]" 1
1836 1 93 SER QB 1 94 TRP H . . 3.820 3.296 3.259 3.333 . 0 0 "[ . 1]" 1
1837 1 93 SER QB 1 96 ASN QD . . 4.590 4.415 3.929 4.588 . 0 0 "[ . 1]" 1
1838 1 94 TRP H 1 94 TRP HB2 . . 3.710 3.608 3.601 3.613 . 0 0 "[ . 1]" 1
1839 1 94 TRP H 1 94 TRP HB3 . . 2.890 2.410 2.378 2.427 . 0 0 "[ . 1]" 1
1840 1 94 TRP H 1 94 TRP HD1 . . 3.080 2.135 2.050 2.308 . 0 0 "[ . 1]" 1
1841 1 94 TRP H 1 94 TRP HE1 . . 5.020 4.685 4.603 4.846 . 0 0 "[ . 1]" 1
1842 1 94 TRP H 1 94 TRP HE3 . . 5.500 5.625 5.599 5.657 0.157 5 0 "[ . 1]" 1
1843 1 94 TRP H 1 95 ARG H . . 3.210 2.350 2.297 2.408 . 0 0 "[ . 1]" 1
1844 1 94 TRP H 1 95 ARG HA . . 5.190 5.036 4.993 5.084 . 0 0 "[ . 1]" 1
1845 1 94 TRP H 1 95 ARG HG2 . . 5.020 3.688 3.531 3.792 . 0 0 "[ . 1]" 1
1846 1 94 TRP H 1 95 ARG QG . . 4.340 3.552 3.407 3.647 . 0 0 "[ . 1]" 1
1847 1 94 TRP H 1 95 ARG HG3 . . 5.020 4.635 4.480 4.735 . 0 0 "[ . 1]" 1
1848 1 94 TRP H 1 96 ASN H . . 4.230 3.753 3.686 3.836 . 0 0 "[ . 1]" 1
1849 1 94 TRP H 1 96 ASN QD . . 5.340 4.499 4.128 4.713 . 0 0 "[ . 1]" 1
1850 1 94 TRP HA 1 94 TRP HB2 . . 2.840 2.324 2.298 2.341 . 0 0 "[ . 1]" 1
1851 1 94 TRP HA 1 94 TRP HD1 . . 4.520 4.233 4.200 4.299 . 0 0 "[ . 1]" 1
1852 1 94 TRP HA 1 94 TRP HE3 . . 4.580 4.463 4.339 4.517 . 0 0 "[ . 1]" 1
1853 1 94 TRP HA 1 95 ARG HA . . 5.010 4.627 4.589 4.654 . 0 0 "[ . 1]" 1
1854 1 94 TRP HA 1 96 ASN H . . 4.620 4.420 4.213 4.552 . 0 0 "[ . 1]" 1
1855 1 94 TRP HB2 1 95 ARG H . . 4.290 4.160 4.091 4.218 . 0 0 "[ . 1]" 1
1856 1 94 TRP HB3 1 95 ARG H . . 3.920 3.844 3.794 3.879 . 0 0 "[ . 1]" 1
1857 1 94 TRP HB3 1 95 ARG HA . . 5.500 5.613 5.585 5.639 0.139 8 0 "[ . 1]" 1
1858 1 94 TRP HE1 1 95 ARG H . . 4.110 3.951 3.842 4.065 . 0 0 "[ . 1]" 1
1859 1 94 TRP HE1 1 95 ARG HA . . 5.320 4.918 4.780 5.017 . 0 0 "[ . 1]" 1
1860 1 94 TRP HE1 1 95 ARG QD . . 4.470 4.177 3.626 4.427 . 0 0 "[ . 1]" 1
1861 1 94 TRP HE1 1 95 ARG HE . . 3.570 2.357 2.119 2.590 . 0 0 "[ . 1]" 1
1862 1 94 TRP HE1 1 95 ARG QG . . 3.940 3.131 2.813 3.356 . 0 0 "[ . 1]" 1
1863 1 95 ARG H 1 95 ARG HB2 . . 3.810 3.639 3.624 3.666 . 0 0 "[ . 1]" 1
1864 1 95 ARG H 1 95 ARG HB3 . . 3.160 2.887 2.828 3.056 . 0 0 "[ . 1]" 1
1865 1 95 ARG H 1 95 ARG HD2 . . 4.780 4.447 4.345 4.522 . 0 0 "[ . 1]" 1
1866 1 95 ARG H 1 95 ARG QD . . 4.120 4.061 3.988 4.117 . 0 0 "[ . 1]" 1
1867 1 95 ARG H 1 95 ARG HD3 . . 4.780 4.693 4.642 4.753 . 0 0 "[ . 1]" 1
1868 1 95 ARG H 1 95 ARG HE . . 4.800 4.244 4.050 4.787 . 0 0 "[ . 1]" 1
1869 1 95 ARG H 1 95 ARG HG2 . . 3.110 2.105 2.026 2.173 . 0 0 "[ . 1]" 1
1870 1 95 ARG H 1 95 ARG QG . . 2.700 2.037 1.970 2.097 . 0 0 "[ . 1]" 1
1871 1 95 ARG H 1 95 ARG HG3 . . 3.110 2.721 2.617 2.789 . 0 0 "[ . 1]" 1
1872 1 95 ARG H 1 96 ASN H . . 2.760 2.200 2.081 2.267 . 0 0 "[ . 1]" 1
1873 1 95 ARG H 1 96 ASN HA . . 5.040 4.880 4.761 4.983 . 0 0 "[ . 1]" 1
1874 1 95 ARG HA 1 95 ARG QD . . 5.040 4.504 4.469 4.559 . 0 0 "[ . 1]" 1
1875 1 95 ARG HA 1 95 ARG HG2 . . 3.970 3.800 3.726 3.830 . 0 0 "[ . 1]" 1
1876 1 95 ARG HA 1 95 ARG QG . . 3.440 3.339 3.328 3.343 . 0 0 "[ . 1]" 1
1877 1 95 ARG HA 1 95 ARG HG3 . . 3.970 3.701 3.683 3.746 . 0 0 "[ . 1]" 1
1878 1 95 ARG HA 1 96 ASN H . . 3.530 3.479 3.452 3.506 . 0 0 "[ . 1]" 1
1879 1 95 ARG HB2 1 95 ARG HD2 . . 3.960 3.630 3.610 3.671 . 0 0 "[ . 1]" 1
1880 1 95 ARG HB2 1 95 ARG HD3 . . 3.960 2.429 2.379 2.525 . 0 0 "[ . 1]" 1
1881 1 95 ARG HB2 1 95 ARG HE . . 4.780 3.200 2.986 3.915 . 0 0 "[ . 1]" 1
1882 1 95 ARG HB2 1 96 ASN H . . 4.170 3.861 3.747 3.949 . 0 0 "[ . 1]" 1
1883 1 95 ARG HB2 1 96 ASN QD . . 5.340 4.897 4.357 5.330 . 0 0 "[ . 1]" 1
1884 1 95 ARG HB3 1 95 ARG QD . . 3.630 3.077 3.002 3.141 . 0 0 "[ . 1]" 1
1885 1 95 ARG HB3 1 96 ASN H . . 4.410 4.105 4.056 4.171 . 0 0 "[ . 1]" 1
1886 1 95 ARG QD 1 96 ASN H . . 5.140 4.155 4.036 4.266 . 0 0 "[ . 1]" 1
1887 1 95 ARG QD 1 96 ASN QD . . 3.940 3.499 3.061 3.928 . 0 0 "[ . 1]" 1
1888 1 95 ARG HE 1 95 ARG HG2 . . 3.970 2.571 2.464 2.900 . 0 0 "[ . 1]" 1
1889 1 95 ARG HE 1 95 ARG HG3 . . 3.970 3.634 3.595 3.916 . 0 0 "[ . 1]" 1
1890 1 95 ARG QG 1 96 ASN QD . . 4.540 2.533 1.959 3.103 . 0 0 "[ . 1]" 1
1891 1 95 ARG HG2 1 96 ASN H . . 4.180 3.130 2.998 3.258 . 0 0 "[ . 1]" 1
1892 1 95 ARG HG3 1 96 ASN H . . 4.180 2.306 2.170 2.431 . 0 0 "[ . 1]" 1
1893 1 96 ASN H 1 96 ASN QB . . 2.830 2.502 2.127 2.867 0.037 10 0 "[ . 1]" 1
1894 1 96 ASN H 1 96 ASN QD . . 4.100 2.590 2.290 2.960 . 0 0 "[ . 1]" 1
1895 1 96 ASN HA 1 96 ASN HD22 . . 5.060 4.635 4.054 5.086 0.026 10 0 "[ . 1]" 1
1896 1 96 ASN QB 1 96 ASN QD . . 3.100 2.177 2.071 2.269 . 0 0 "[ . 1]" 1
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