NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
598607 |
2n8i   |
25850 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2n8i
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 1452
_Distance_constraint_stats_list.Viol_count 561
_Distance_constraint_stats_list.Viol_total 1033.154
_Distance_constraint_stats_list.Viol_max 0.448
_Distance_constraint_stats_list.Viol_rms 0.0165
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0018
_Distance_constraint_stats_list.Viol_average_violations_only 0.0921
_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 3 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 PRO 0.176 0.077 9 0 "[ . 1 . 2]"
1 5 ASP 0.176 0.077 9 0 "[ . 1 . 2]"
1 6 GLU 0.053 0.053 6 0 "[ . 1 . 2]"
1 7 ASN 0.021 0.021 5 0 "[ . 1 . 2]"
1 8 ILE 0.148 0.063 7 0 "[ . 1 . 2]"
1 9 ALA 0.082 0.053 6 0 "[ . 1 . 2]"
1 10 LYS 0.021 0.021 5 0 "[ . 1 . 2]"
1 11 PHE 0.001 0.001 5 0 "[ . 1 . 2]"
1 12 GLU 0.131 0.053 8 0 "[ . 1 . 2]"
1 13 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 TYR 7.802 0.309 6 0 "[ . 1 . 2]"
1 16 LYS 1.728 0.242 18 0 "[ . 1 . 2]"
1 17 LYS 1.803 0.199 6 0 "[ . 1 . 2]"
1 18 ALA 4.871 0.419 8 0 "[ . 1 . 2]"
1 19 GLU 0.576 0.123 9 0 "[ . 1 . 2]"
1 20 GLU 1.128 0.239 18 0 "[ . 1 . 2]"
1 21 LEU 0.825 0.199 6 0 "[ . 1 . 2]"
1 22 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 GLN 2.632 0.218 18 0 "[ . 1 . 2]"
1 24 GLY 0.490 0.156 6 0 "[ . 1 . 2]"
1 25 GLU 0.334 0.093 5 0 "[ . 1 . 2]"
1 26 LEU 7.438 0.448 11 0 "[ . 1 . 2]"
1 27 MET 6.936 0.309 6 0 "[ . 1 . 2]"
1 28 GLY 0.017 0.017 1 0 "[ . 1 . 2]"
1 29 ARG 1.215 0.214 12 0 "[ . 1 . 2]"
1 30 ALA 2.858 0.270 13 0 "[ . 1 . 2]"
1 31 LEU 0.098 0.027 17 0 "[ . 1 . 2]"
1 32 TYR 0.122 0.062 13 0 "[ . 1 . 2]"
1 33 ASN 0.341 0.109 11 0 "[ . 1 . 2]"
1 34 ILE 0.595 0.112 4 0 "[ . 1 . 2]"
1 35 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 LEU 1.356 0.144 8 0 "[ . 1 . 2]"
1 37 GLU 0.134 0.116 10 0 "[ . 1 . 2]"
1 38 LYS 1.344 0.275 3 0 "[ . 1 . 2]"
1 39 ASN 0.104 0.097 8 0 "[ . 1 . 2]"
1 40 LYS 0.134 0.116 10 0 "[ . 1 . 2]"
1 41 MET 2.054 0.275 3 0 "[ . 1 . 2]"
1 42 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 LYS 0.695 0.185 12 0 "[ . 1 . 2]"
1 44 VAL 0.123 0.096 11 0 "[ . 1 . 2]"
1 45 LYS 0.823 0.181 1 0 "[ . 1 . 2]"
1 46 GLU 0.710 0.123 6 0 "[ . 1 . 2]"
1 47 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 ILE 3.445 0.215 4 0 "[ . 1 . 2]"
1 49 GLU 0.185 0.125 20 0 "[ . 1 . 2]"
1 50 TYR 4.710 0.258 1 0 "[ . 1 . 2]"
1 51 PHE 3.315 0.194 15 0 "[ . 1 . 2]"
1 52 LEU 3.577 0.258 1 0 "[ . 1 . 2]"
1 53 ARG 0.217 0.054 2 0 "[ . 1 . 2]"
1 54 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 LYS 0.266 0.220 11 0 "[ . 1 . 2]"
1 56 LYS 0.068 0.054 20 0 "[ . 1 . 2]"
1 57 VAL 0.262 0.084 16 0 "[ . 1 . 2]"
1 58 PHE 0.366 0.200 13 0 "[ . 1 . 2]"
1 59 ASP 0.595 0.113 17 0 "[ . 1 . 2]"
1 60 ALA 0.581 0.113 17 0 "[ . 1 . 2]"
1 61 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 HIS 0.529 0.111 17 0 "[ . 1 . 2]"
1 63 ASP 1.048 0.149 20 0 "[ . 1 . 2]"
1 64 THR 0.184 0.150 10 0 "[ . 1 . 2]"
1 65 ASP 0.280 0.243 4 0 "[ . 1 . 2]"
1 66 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 ALA 1.302 0.220 11 0 "[ . 1 . 2]"
1 68 ARG 0.698 0.243 4 0 "[ . 1 . 2]"
1 69 ARG 0.163 0.127 18 0 "[ . 1 . 2]"
1 70 ALA 0.065 0.041 11 0 "[ . 1 . 2]"
1 71 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 LYS 0.268 0.127 18 0 "[ . 1 . 2]"
1 73 SER 0.296 0.169 15 0 "[ . 1 . 2]"
1 74 LEU 6.118 0.215 4 0 "[ . 1 . 2]"
1 75 SER 0.577 0.140 7 0 "[ . 1 . 2]"
1 76 GLU 2.180 0.282 2 0 "[ . 1 . 2]"
1 77 ALA 0.502 0.141 11 0 "[ . 1 . 2]"
1 78 TYR 2.970 0.203 2 0 "[ . 1 . 2]"
1 79 GLN 1.183 0.214 3 0 "[ . 1 . 2]"
1 80 LYS 0.446 0.141 11 0 "[ . 1 . 2]"
1 81 VAL 2.474 0.261 16 0 "[ . 1 . 2]"
1 82 GLU 0.433 0.261 16 0 "[ . 1 . 2]"
1 83 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 LYS 1.198 0.216 1 0 "[ . 1 . 2]"
1 90 ILE 1.759 0.216 1 0 "[ . 1 . 2]"
1 91 PHE 2.411 0.144 6 0 "[ . 1 . 2]"
1 92 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 LYS 0.032 0.032 8 0 "[ . 1 . 2]"
1 94 GLU 0.032 0.032 8 0 "[ . 1 . 2]"
1 96 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 98 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 LEU 0.466 0.111 3 0 "[ . 1 . 2]"
1 100 GLU 0.279 0.111 3 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 SER H 1 6 GLU QB 5.020 . 5.020 3.111 2.121 4.010 . 0 0 "[ . 1 . 2]" 1
2 1 3 SER QB 1 4 PRO QD 2.870 . 2.870 2.495 1.902 2.826 . 0 0 "[ . 1 . 2]" 1
3 1 3 SER QB 1 4 PRO QG 4.890 . 4.890 4.194 3.438 4.645 . 0 0 "[ . 1 . 2]" 1
4 1 3 SER QB 1 5 ASP H 4.440 . 4.440 2.937 2.567 3.454 . 0 0 "[ . 1 . 2]" 1
5 1 3 SER QB 1 6 GLU QB 5.540 . 5.540 3.387 2.116 5.284 . 0 0 "[ . 1 . 2]" 1
6 1 3 SER HB2 1 5 ASP H 5.350 . 5.350 3.418 2.589 4.183 . 0 0 "[ . 1 . 2]" 1
7 1 3 SER HB3 1 5 ASP H 5.350 . 5.350 3.607 2.741 4.657 . 0 0 "[ . 1 . 2]" 1
8 1 4 PRO HA 1 7 ASN H 4.580 . 4.580 3.384 3.153 3.552 . 0 0 "[ . 1 . 2]" 1
9 1 4 PRO HA 1 7 ASN QB 4.640 . 4.640 2.557 2.139 3.141 . 0 0 "[ . 1 . 2]" 1
10 1 4 PRO HA 1 7 ASN HD21 4.750 . 4.750 2.250 1.726 3.592 . 0 0 "[ . 1 . 2]" 1
11 1 4 PRO HA 1 7 ASN HD22 5.400 . 5.400 3.472 2.636 5.113 . 0 0 "[ . 1 . 2]" 1
12 1 4 PRO QB 1 5 ASP H 3.860 . 3.860 2.822 2.548 3.486 . 0 0 "[ . 1 . 2]" 1
13 1 4 PRO QB 1 5 ASP HA 6.100 . 6.100 4.000 3.897 4.146 . 0 0 "[ . 1 . 2]" 1
14 1 4 PRO QB 1 37 GLU HA 5.110 . 5.110 2.997 2.541 4.469 . 0 0 "[ . 1 . 2]" 1
15 1 4 PRO HB2 1 5 ASP H 4.420 . 4.420 2.879 2.580 3.641 . 0 0 "[ . 1 . 2]" 1
16 1 4 PRO HB3 1 5 ASP H 4.420 . 4.420 4.105 3.945 4.452 0.032 3 0 "[ . 1 . 2]" 1
17 1 4 PRO QD 1 5 ASP H 4.140 . 4.140 2.967 2.583 3.370 . 0 0 "[ . 1 . 2]" 1
18 1 4 PRO QD 1 5 ASP QB 5.900 . 5.900 4.358 3.965 4.817 . 0 0 "[ . 1 . 2]" 1
19 1 4 PRO HD2 1 5 ASP H 4.850 . 4.850 3.042 2.624 3.519 . 0 0 "[ . 1 . 2]" 1
20 1 4 PRO HD3 1 5 ASP H 4.850 . 4.850 4.161 3.868 4.324 . 0 0 "[ . 1 . 2]" 1
21 1 4 PRO QG 1 5 ASP H 4.050 . 4.050 3.641 2.539 4.127 0.077 9 0 "[ . 1 . 2]" 1
22 1 4 PRO QG 1 5 ASP HA 6.100 . 6.100 5.527 4.622 5.846 . 0 0 "[ . 1 . 2]" 1
23 1 4 PRO QG 1 41 MET QG 4.210 . 4.210 2.490 2.019 4.164 . 0 0 "[ . 1 . 2]" 1
24 1 4 PRO HG2 1 5 ASP H 4.880 . 4.880 3.886 2.563 4.482 . 0 0 "[ . 1 . 2]" 1
25 1 4 PRO HG3 1 5 ASP H 4.880 . 4.880 4.565 4.106 4.829 . 0 0 "[ . 1 . 2]" 1
26 1 5 ASP H 1 5 ASP HB2 4.270 . 4.270 2.581 2.369 3.664 . 0 0 "[ . 1 . 2]" 1
27 1 5 ASP H 1 5 ASP QB 3.720 . 3.720 2.317 2.206 2.576 . 0 0 "[ . 1 . 2]" 1
28 1 5 ASP H 1 5 ASP HB3 4.270 . 4.270 2.771 2.394 3.669 . 0 0 "[ . 1 . 2]" 1
29 1 5 ASP H 1 6 GLU H 3.960 . 3.960 2.688 2.503 2.816 . 0 0 "[ . 1 . 2]" 1
30 1 5 ASP H 1 41 MET ME 4.600 . 4.600 3.782 2.668 4.521 . 0 0 "[ . 1 . 2]" 1
31 1 5 ASP HA 1 8 ILE HB 4.150 . 4.150 2.813 2.176 4.087 . 0 0 "[ . 1 . 2]" 1
32 1 5 ASP HA 1 8 ILE MD 4.130 . 4.130 1.919 1.609 2.287 . 0 0 "[ . 1 . 2]" 1
33 1 5 ASP HA 1 8 ILE QG 4.240 . 4.240 3.036 2.576 3.373 . 0 0 "[ . 1 . 2]" 1
34 1 5 ASP HA 1 8 ILE MG 5.050 . 5.050 3.992 3.453 4.925 . 0 0 "[ . 1 . 2]" 1
35 1 5 ASP HA 1 37 GLU QB 6.100 . 6.100 4.235 3.591 5.107 . 0 0 "[ . 1 . 2]" 1
36 1 5 ASP HA 1 41 MET ME 4.250 . 4.250 3.319 2.312 4.087 . 0 0 "[ . 1 . 2]" 1
37 1 5 ASP QB 1 8 ILE MD 5.180 . 5.180 3.543 3.107 4.080 . 0 0 "[ . 1 . 2]" 1
38 1 5 ASP HB2 1 6 GLU H 4.890 . 4.890 3.677 2.583 4.064 . 0 0 "[ . 1 . 2]" 1
39 1 5 ASP HB3 1 6 GLU H 4.890 . 4.890 2.972 2.458 4.018 . 0 0 "[ . 1 . 2]" 1
40 1 6 GLU H 1 6 GLU HB2 4.180 . 4.180 2.499 2.186 2.626 . 0 0 "[ . 1 . 2]" 1
41 1 6 GLU H 1 6 GLU HB3 4.180 . 4.180 3.094 2.401 3.654 . 0 0 "[ . 1 . 2]" 1
42 1 6 GLU H 1 6 GLU HG2 4.910 . 4.910 3.738 2.152 4.536 . 0 0 "[ . 1 . 2]" 1
43 1 6 GLU H 1 6 GLU QG 4.180 . 4.180 3.165 2.136 4.079 . 0 0 "[ . 1 . 2]" 1
44 1 6 GLU H 1 6 GLU HG3 4.910 . 4.910 3.748 2.227 4.643 . 0 0 "[ . 1 . 2]" 1
45 1 6 GLU H 1 7 ASN H 3.890 . 3.890 2.541 2.420 2.699 . 0 0 "[ . 1 . 2]" 1
46 1 6 GLU HA 1 6 GLU QG 3.840 . 3.840 2.611 2.414 3.151 . 0 0 "[ . 1 . 2]" 1
47 1 6 GLU HA 1 9 ALA MB 3.580 . 3.580 2.934 2.478 3.633 0.053 6 0 "[ . 1 . 2]" 1
48 1 6 GLU QB 1 7 ASN H 3.800 . 3.800 2.704 2.494 2.931 . 0 0 "[ . 1 . 2]" 1
49 1 6 GLU HB2 1 7 ASN H 4.360 . 4.360 3.325 2.590 4.058 . 0 0 "[ . 1 . 2]" 1
50 1 6 GLU HB3 1 7 ASN H 4.360 . 4.360 3.285 2.526 4.022 . 0 0 "[ . 1 . 2]" 1
51 1 7 ASN H 1 7 ASN QB 3.570 . 3.570 2.445 2.242 2.655 . 0 0 "[ . 1 . 2]" 1
52 1 7 ASN H 1 8 ILE H 4.290 . 4.290 2.612 2.487 2.796 . 0 0 "[ . 1 . 2]" 1
53 1 7 ASN HA 1 9 ALA MB 5.700 . 5.700 4.706 4.328 5.089 . 0 0 "[ . 1 . 2]" 1
54 1 7 ASN HA 1 10 LYS H 5.320 . 5.320 3.394 3.068 3.566 . 0 0 "[ . 1 . 2]" 1
55 1 7 ASN HA 1 10 LYS HB2 4.660 . 4.660 3.326 2.785 4.146 . 0 0 "[ . 1 . 2]" 1
56 1 7 ASN HA 1 10 LYS QB 4.080 . 4.080 2.777 2.213 3.372 . 0 0 "[ . 1 . 2]" 1
57 1 7 ASN HA 1 10 LYS HB3 4.660 . 4.660 3.266 2.296 4.681 0.021 5 0 "[ . 1 . 2]" 1
58 1 7 ASN HA 1 10 LYS QD 5.160 . 5.160 3.629 2.125 4.850 . 0 0 "[ . 1 . 2]" 1
59 1 8 ILE H 1 8 ILE HB 4.150 . 4.150 2.430 2.245 2.552 . 0 0 "[ . 1 . 2]" 1
60 1 8 ILE H 1 8 ILE MD 4.940 . 4.940 3.546 3.308 3.684 . 0 0 "[ . 1 . 2]" 1
61 1 8 ILE HA 1 11 PHE H 4.990 . 4.990 3.399 3.067 3.834 . 0 0 "[ . 1 . 2]" 1
62 1 8 ILE HA 1 11 PHE QD 4.130 . 4.130 2.313 1.903 3.037 . 0 0 "[ . 1 . 2]" 1
63 1 8 ILE HB 1 8 ILE MD 3.650 . 3.650 2.429 2.351 2.499 . 0 0 "[ . 1 . 2]" 1
64 1 8 ILE HB 1 9 ALA H 4.440 . 4.440 2.620 2.391 2.873 . 0 0 "[ . 1 . 2]" 1
65 1 8 ILE HB 1 34 ILE MG 5.500 . 5.500 4.095 3.938 4.320 . 0 0 "[ . 1 . 2]" 1
66 1 8 ILE MD 1 34 ILE MG 3.980 . 3.980 2.617 2.083 3.219 . 0 0 "[ . 1 . 2]" 1
67 1 8 ILE MD 1 37 GLU QB 3.720 . 3.720 2.347 1.905 2.806 . 0 0 "[ . 1 . 2]" 1
68 1 8 ILE MD 1 38 LYS H 4.900 . 4.900 3.433 2.976 4.223 . 0 0 "[ . 1 . 2]" 1
69 1 8 ILE MD 1 38 LYS HA 4.800 . 4.800 3.484 2.845 4.219 . 0 0 "[ . 1 . 2]" 1
70 1 8 ILE MD 1 38 LYS QD 4.080 . 4.080 2.376 1.990 2.908 . 0 0 "[ . 1 . 2]" 1
71 1 8 ILE MD 1 38 LYS HE2 4.840 . 4.840 2.018 1.723 2.704 . 0 0 "[ . 1 . 2]" 1
72 1 8 ILE MD 1 38 LYS QE 3.930 . 3.930 1.965 1.717 2.416 . 0 0 "[ . 1 . 2]" 1
73 1 8 ILE MD 1 38 LYS HE3 4.840 . 4.840 3.389 1.927 3.652 . 0 0 "[ . 1 . 2]" 1
74 1 8 ILE MD 1 38 LYS QG 4.920 . 4.920 2.987 2.112 4.070 . 0 0 "[ . 1 . 2]" 1
75 1 8 ILE MD 1 41 MET ME 3.300 . 3.300 2.607 1.980 3.363 0.063 7 0 "[ . 1 . 2]" 1
76 1 8 ILE MD 1 50 TYR QE 6.080 . 6.080 4.711 4.354 5.186 . 0 0 "[ . 1 . 2]" 1
77 1 8 ILE QG 1 34 ILE HA 4.980 . 4.980 2.440 2.032 3.010 . 0 0 "[ . 1 . 2]" 1
78 1 8 ILE QG 1 34 ILE MG 3.960 . 3.960 2.241 1.817 3.223 . 0 0 "[ . 1 . 2]" 1
79 1 8 ILE MG 1 9 ALA H 4.430 . 4.430 3.207 2.967 3.391 . 0 0 "[ . 1 . 2]" 1
80 1 8 ILE MG 1 9 ALA HA 4.300 . 4.300 3.293 3.005 3.440 . 0 0 "[ . 1 . 2]" 1
81 1 8 ILE MG 1 12 GLU H 5.040 . 5.040 4.088 3.779 4.353 . 0 0 "[ . 1 . 2]" 1
82 1 8 ILE MG 1 12 GLU QB 5.520 . 5.520 3.753 2.871 4.297 . 0 0 "[ . 1 . 2]" 1
83 1 8 ILE MG 1 12 GLU HG2 4.450 . 4.450 3.446 2.170 4.499 0.049 20 0 "[ . 1 . 2]" 1
84 1 8 ILE MG 1 12 GLU QG 3.910 . 3.910 2.730 2.091 3.648 . 0 0 "[ . 1 . 2]" 1
85 1 8 ILE MG 1 12 GLU HG3 4.450 . 4.450 2.981 2.329 3.930 . 0 0 "[ . 1 . 2]" 1
86 1 8 ILE MG 1 34 ILE MG 3.590 . 3.590 1.915 1.579 2.308 . 0 0 "[ . 1 . 2]" 1
87 1 8 ILE MG 1 37 GLU QG 6.100 . 6.100 4.665 4.169 5.853 . 0 0 "[ . 1 . 2]" 1
88 1 8 ILE MG 1 38 LYS QD 5.910 . 5.910 4.204 3.219 5.156 . 0 0 "[ . 1 . 2]" 1
89 1 8 ILE MG 1 38 LYS HE2 5.400 . 5.400 2.899 1.769 3.777 . 0 0 "[ . 1 . 2]" 1
90 1 8 ILE MG 1 38 LYS QE 4.480 . 4.480 2.799 1.759 3.536 . 0 0 "[ . 1 . 2]" 1
91 1 8 ILE MG 1 38 LYS HE3 5.400 . 5.400 4.042 2.925 4.713 . 0 0 "[ . 1 . 2]" 1
92 1 8 ILE MG 1 50 TYR QE 5.460 . 5.460 4.395 3.772 4.638 . 0 0 "[ . 1 . 2]" 1
93 1 9 ALA H 1 9 ALA MB 3.240 . 3.240 2.240 2.219 2.261 . 0 0 "[ . 1 . 2]" 1
94 1 9 ALA HA 1 12 GLU H 5.150 . 5.150 3.444 3.175 3.761 . 0 0 "[ . 1 . 2]" 1
95 1 9 ALA HA 1 12 GLU QB 3.960 . 3.960 2.537 2.159 3.112 . 0 0 "[ . 1 . 2]" 1
96 1 9 ALA HA 1 12 GLU HG2 4.980 . 4.980 4.311 2.732 5.009 0.029 1 0 "[ . 1 . 2]" 1
97 1 9 ALA HA 1 12 GLU QG 4.220 . 4.220 3.175 2.248 3.802 . 0 0 "[ . 1 . 2]" 1
98 1 9 ALA HA 1 12 GLU HG3 4.980 . 4.980 3.287 2.392 3.967 . 0 0 "[ . 1 . 2]" 1
99 1 9 ALA MB 1 10 LYS H 3.990 . 3.990 2.690 2.564 2.809 . 0 0 "[ . 1 . 2]" 1
100 1 9 ALA MB 1 11 PHE H 5.530 . 5.530 4.655 4.536 4.815 . 0 0 "[ . 1 . 2]" 1
101 1 10 LYS H 1 10 LYS HB2 4.130 . 4.130 2.560 2.309 2.732 . 0 0 "[ . 1 . 2]" 1
102 1 10 LYS H 1 10 LYS HB3 4.130 . 4.130 2.736 2.315 3.638 . 0 0 "[ . 1 . 2]" 1
103 1 10 LYS H 1 10 LYS HG2 5.020 . 5.020 4.201 2.294 4.661 . 0 0 "[ . 1 . 2]" 1
104 1 10 LYS H 1 10 LYS QG 4.330 . 4.330 3.680 2.094 4.081 . 0 0 "[ . 1 . 2]" 1
105 1 10 LYS H 1 10 LYS HG3 5.020 . 5.020 4.177 2.120 4.572 . 0 0 "[ . 1 . 2]" 1
106 1 10 LYS H 1 11 PHE H 4.190 . 4.190 2.610 2.522 2.722 . 0 0 "[ . 1 . 2]" 1
107 1 10 LYS HA 1 13 LYS H 5.060 . 5.060 3.540 3.263 3.793 . 0 0 "[ . 1 . 2]" 1
108 1 10 LYS QB 1 11 PHE H 3.910 . 3.910 2.583 2.398 2.776 . 0 0 "[ . 1 . 2]" 1
109 1 10 LYS HB2 1 11 PHE H 4.560 . 4.560 3.601 2.505 4.078 . 0 0 "[ . 1 . 2]" 1
110 1 10 LYS HB3 1 11 PHE H 4.560 . 4.560 2.867 2.426 3.735 . 0 0 "[ . 1 . 2]" 1
111 1 10 LYS QD 1 11 PHE H 5.970 . 5.970 4.693 4.202 5.339 . 0 0 "[ . 1 . 2]" 1
112 1 10 LYS QG 1 11 PHE H 4.800 . 4.800 3.758 3.279 4.653 . 0 0 "[ . 1 . 2]" 1
113 1 11 PHE H 1 11 PHE QB 3.820 . 3.820 2.499 2.428 2.598 . 0 0 "[ . 1 . 2]" 1
114 1 11 PHE H 1 11 PHE QD 4.850 . 4.850 3.242 2.878 3.376 . 0 0 "[ . 1 . 2]" 1
115 1 11 PHE H 1 12 GLU H 4.690 . 4.690 2.547 2.415 2.651 . 0 0 "[ . 1 . 2]" 1
116 1 11 PHE HA 1 11 PHE QD 3.340 . 3.340 2.180 2.014 2.416 . 0 0 "[ . 1 . 2]" 1
117 1 11 PHE HA 1 14 ALA H 4.080 . 4.080 3.230 2.896 3.578 . 0 0 "[ . 1 . 2]" 1
118 1 11 PHE HA 1 14 ALA MB 4.090 . 4.090 2.304 1.950 3.039 . 0 0 "[ . 1 . 2]" 1
119 1 11 PHE QB 1 30 ALA MB 5.040 . 5.040 3.017 2.266 3.621 . 0 0 "[ . 1 . 2]" 1
120 1 11 PHE QB 1 34 ILE H 5.630 . 5.630 3.679 3.340 4.126 . 0 0 "[ . 1 . 2]" 1
121 1 11 PHE QB 1 34 ILE MD 3.780 . 3.780 2.668 2.160 3.023 . 0 0 "[ . 1 . 2]" 1
122 1 11 PHE QB 1 34 ILE QG 3.780 . 3.780 2.076 1.918 2.403 . 0 0 "[ . 1 . 2]" 1
123 1 11 PHE HB2 1 34 ILE MD 4.300 . 4.300 2.878 2.233 3.448 . 0 0 "[ . 1 . 2]" 1
124 1 11 PHE HB3 1 34 ILE MD 4.300 . 4.300 3.201 2.851 3.536 . 0 0 "[ . 1 . 2]" 1
125 1 11 PHE QD 1 14 ALA MB 4.140 . 4.140 3.354 2.944 3.926 . 0 0 "[ . 1 . 2]" 1
126 1 11 PHE QD 1 34 ILE HA 5.040 . 5.040 2.947 2.403 3.715 . 0 0 "[ . 1 . 2]" 1
127 1 11 PHE QD 1 34 ILE MD 4.950 . 4.950 4.178 3.514 4.772 . 0 0 "[ . 1 . 2]" 1
128 1 11 PHE QD 1 34 ILE QG 4.180 . 4.180 2.758 2.120 3.516 . 0 0 "[ . 1 . 2]" 1
129 1 11 PHE QE 1 37 GLU HG2 4.300 . 4.300 2.948 2.304 4.301 0.001 5 0 "[ . 1 . 2]" 1
130 1 11 PHE QE 1 37 GLU QG 3.710 . 3.710 2.382 1.883 3.340 . 0 0 "[ . 1 . 2]" 1
131 1 11 PHE QE 1 37 GLU HG3 4.300 . 4.300 2.559 1.902 3.510 . 0 0 "[ . 1 . 2]" 1
132 1 12 GLU H 1 12 GLU HG2 4.800 . 4.800 3.525 2.369 4.372 . 0 0 "[ . 1 . 2]" 1
133 1 12 GLU H 1 12 GLU QG 4.200 . 4.200 2.830 2.339 3.982 . 0 0 "[ . 1 . 2]" 1
134 1 12 GLU H 1 12 GLU HG3 4.800 . 4.800 3.316 2.394 4.608 . 0 0 "[ . 1 . 2]" 1
135 1 12 GLU H 1 13 LYS H 4.990 . 4.990 2.549 2.415 2.718 . 0 0 "[ . 1 . 2]" 1
136 1 12 GLU HA 1 12 GLU HG2 4.270 . 4.270 2.634 2.464 3.004 . 0 0 "[ . 1 . 2]" 1
137 1 12 GLU HA 1 12 GLU QG 3.690 . 3.690 2.542 2.398 2.903 . 0 0 "[ . 1 . 2]" 1
138 1 12 GLU HA 1 12 GLU HG3 4.270 . 4.270 3.418 2.978 3.844 . 0 0 "[ . 1 . 2]" 1
139 1 12 GLU HA 1 15 TYR H 5.190 . 5.190 3.231 2.995 3.576 . 0 0 "[ . 1 . 2]" 1
140 1 12 GLU HA 1 15 TYR HB2 4.870 . 4.870 2.947 2.539 3.421 . 0 0 "[ . 1 . 2]" 1
141 1 12 GLU HA 1 15 TYR HB3 4.350 . 4.350 2.337 1.881 2.951 . 0 0 "[ . 1 . 2]" 1
142 1 12 GLU HA 1 15 TYR QD 5.580 . 5.580 3.809 3.010 4.429 . 0 0 "[ . 1 . 2]" 1
143 1 12 GLU HA 1 16 LYS H 4.850 . 4.850 4.150 3.802 4.671 . 0 0 "[ . 1 . 2]" 1
144 1 12 GLU HA 1 34 ILE MD 3.840 . 3.840 2.809 2.251 3.650 . 0 0 "[ . 1 . 2]" 1
145 1 12 GLU QB 1 13 LYS H 4.080 . 4.080 2.692 2.360 2.912 . 0 0 "[ . 1 . 2]" 1
146 1 12 GLU HB2 1 13 LYS H 4.650 . 4.650 3.014 2.413 3.807 . 0 0 "[ . 1 . 2]" 1
147 1 12 GLU HB3 1 13 LYS H 4.650 . 4.650 3.448 2.611 3.914 . 0 0 "[ . 1 . 2]" 1
148 1 12 GLU QG 1 34 ILE MD 3.720 . 3.720 2.453 1.971 3.072 . 0 0 "[ . 1 . 2]" 1
149 1 12 GLU HG2 1 34 ILE MD 4.380 . 4.380 2.585 2.007 3.133 . 0 0 "[ . 1 . 2]" 1
150 1 12 GLU HG3 1 34 ILE MD 4.380 . 4.380 3.257 2.374 4.433 0.053 8 0 "[ . 1 . 2]" 1
151 1 13 LYS H 1 13 LYS QB 3.610 . 3.610 2.336 2.134 2.546 . 0 0 "[ . 1 . 2]" 1
152 1 13 LYS H 1 13 LYS QD 5.700 . 5.700 4.110 2.357 4.798 . 0 0 "[ . 1 . 2]" 1
153 1 13 LYS H 1 13 LYS HG2 5.120 . 5.120 4.088 2.418 4.647 . 0 0 "[ . 1 . 2]" 1
154 1 13 LYS H 1 13 LYS HG3 5.120 . 5.120 3.771 2.115 4.610 . 0 0 "[ . 1 . 2]" 1
155 1 13 LYS H 1 14 ALA H 3.650 . 3.650 2.568 2.465 2.662 . 0 0 "[ . 1 . 2]" 1
156 1 13 LYS HA 1 13 LYS QD 4.920 . 4.920 3.469 2.019 4.342 . 0 0 "[ . 1 . 2]" 1
157 1 13 LYS HA 1 13 LYS QG 3.890 . 3.890 2.627 2.426 3.096 . 0 0 "[ . 1 . 2]" 1
158 1 13 LYS HA 1 16 LYS H 5.050 . 5.050 3.470 3.024 3.883 . 0 0 "[ . 1 . 2]" 1
159 1 13 LYS HA 1 16 LYS QB 4.130 . 4.130 2.967 2.341 3.674 . 0 0 "[ . 1 . 2]" 1
160 1 13 LYS HA 1 16 LYS QD 6.300 . 6.300 4.782 2.644 5.918 . 0 0 "[ . 1 . 2]" 1
161 1 13 LYS QB 1 14 ALA H 3.600 . 3.600 2.580 2.322 2.820 . 0 0 "[ . 1 . 2]" 1
162 1 14 ALA H 1 14 ALA MB 3.220 . 3.220 2.248 2.233 2.269 . 0 0 "[ . 1 . 2]" 1
163 1 14 ALA H 1 15 TYR H 4.240 . 4.240 2.571 2.434 2.681 . 0 0 "[ . 1 . 2]" 1
164 1 14 ALA MB 1 15 TYR H 4.740 . 4.740 2.763 2.590 2.860 . 0 0 "[ . 1 . 2]" 1
165 1 15 TYR H 1 16 LYS H 4.640 . 4.640 2.622 2.564 2.780 . 0 0 "[ . 1 . 2]" 1
166 1 15 TYR H 1 30 ALA MB 5.020 . 5.020 3.268 2.924 3.597 . 0 0 "[ . 1 . 2]" 1
167 1 15 TYR HA 1 15 TYR QD 3.480 . 3.480 2.673 2.447 2.950 . 0 0 "[ . 1 . 2]" 1
168 1 15 TYR HA 1 30 ALA MB 4.340 . 4.340 2.588 2.364 2.936 . 0 0 "[ . 1 . 2]" 1
169 1 15 TYR HB2 1 16 LYS H 4.560 . 4.560 3.905 3.724 4.189 . 0 0 "[ . 1 . 2]" 1
170 1 15 TYR HB2 1 30 ALA MB 3.940 . 3.940 2.060 1.860 2.558 . 0 0 "[ . 1 . 2]" 1
171 1 15 TYR HB3 1 16 LYS H 4.020 . 4.020 2.581 2.335 2.938 . 0 0 "[ . 1 . 2]" 1
172 1 15 TYR HB3 1 30 ALA MB 4.380 . 4.380 3.504 3.333 3.996 . 0 0 "[ . 1 . 2]" 1
173 1 15 TYR QD 1 16 LYS H 3.750 . 3.750 3.572 3.341 3.758 0.008 17 0 "[ . 1 . 2]" 1
174 1 15 TYR QD 1 16 LYS QD 4.830 . 4.830 3.473 2.081 4.966 0.136 4 0 "[ . 1 . 2]" 1
175 1 15 TYR QD 1 16 LYS QG 3.710 . 3.710 2.900 2.167 3.271 . 0 0 "[ . 1 . 2]" 1
176 1 15 TYR QD 1 27 MET HA 3.090 . 3.090 2.243 2.003 2.613 . 0 0 "[ . 1 . 2]" 1
177 1 15 TYR QD 1 27 MET ME 4.690 . 4.690 4.831 4.245 4.999 0.309 6 0 "[ . 1 . 2]" 1
178 1 15 TYR QD 1 30 ALA MB 3.110 . 3.110 2.089 1.950 2.259 . 0 0 "[ . 1 . 2]" 1
179 1 15 TYR QD 1 31 LEU MD1 4.880 . 4.880 3.843 3.578 4.006 . 0 0 "[ . 1 . 2]" 1
180 1 15 TYR QD 1 31 LEU HG 4.540 . 4.540 2.921 2.400 3.250 . 0 0 "[ . 1 . 2]" 1
181 1 15 TYR QE 1 16 LYS QG 4.640 . 4.640 4.527 3.693 4.882 0.242 18 0 "[ . 1 . 2]" 1
182 1 15 TYR QE 1 27 MET HA 3.700 . 3.700 3.422 2.595 3.708 0.008 2 0 "[ . 1 . 2]" 1
183 1 15 TYR QE 1 27 MET HB2 3.860 . 3.860 3.694 3.494 3.931 0.071 11 0 "[ . 1 . 2]" 1
184 1 15 TYR QE 1 27 MET HB3 2.940 . 2.940 2.016 1.780 2.306 . 0 0 "[ . 1 . 2]" 1
185 1 15 TYR QE 1 27 MET ME 3.790 . 3.790 3.596 2.942 3.927 0.137 2 0 "[ . 1 . 2]" 1
186 1 15 TYR QE 1 27 MET QG 3.840 . 3.840 3.542 2.909 3.864 0.024 11 0 "[ . 1 . 2]" 1
187 1 15 TYR QE 1 30 ALA MB 3.810 . 3.810 3.937 3.693 4.080 0.270 13 0 "[ . 1 . 2]" 1
188 1 15 TYR QE 1 31 LEU MD1 2.900 . 2.900 2.396 1.931 2.893 . 0 0 "[ . 1 . 2]" 1
189 1 15 TYR QE 1 31 LEU MD2 3.380 . 3.380 3.038 2.694 3.393 0.013 1 0 "[ . 1 . 2]" 1
190 1 15 TYR QE 1 31 LEU HG 4.040 . 4.040 2.764 2.125 3.113 . 0 0 "[ . 1 . 2]" 1
191 1 15 TYR QE 1 57 VAL MG2 3.930 . 3.930 3.757 3.271 4.014 0.084 16 0 "[ . 1 . 2]" 1
192 1 16 LYS H 1 16 LYS QB 3.460 . 3.460 2.391 2.284 2.508 . 0 0 "[ . 1 . 2]" 1
193 1 16 LYS H 1 16 LYS QD 5.020 . 5.020 3.747 3.462 4.182 . 0 0 "[ . 1 . 2]" 1
194 1 16 LYS H 1 16 LYS HG2 4.740 . 4.740 2.797 2.221 3.792 . 0 0 "[ . 1 . 2]" 1
195 1 16 LYS H 1 16 LYS QG 4.150 . 4.150 2.408 2.173 2.693 . 0 0 "[ . 1 . 2]" 1
196 1 16 LYS H 1 16 LYS HG3 4.740 . 4.740 3.356 2.198 3.865 . 0 0 "[ . 1 . 2]" 1
197 1 16 LYS HA 1 16 LYS QD 4.390 . 4.390 2.662 1.880 4.131 . 0 0 "[ . 1 . 2]" 1
198 1 16 LYS HA 1 16 LYS QG 3.910 . 3.910 2.757 2.289 3.011 . 0 0 "[ . 1 . 2]" 1
199 1 16 LYS HA 1 19 GLU H 4.490 . 4.490 3.214 2.839 3.557 . 0 0 "[ . 1 . 2]" 1
200 1 16 LYS HA 1 19 GLU HG2 6.300 . 6.300 4.751 4.011 5.514 . 0 0 "[ . 1 . 2]" 1
201 1 16 LYS HA 1 19 GLU HG3 6.300 . 6.300 4.699 3.771 5.307 . 0 0 "[ . 1 . 2]" 1
202 1 16 LYS QB 1 17 LYS H 3.960 . 3.960 2.748 2.505 3.065 . 0 0 "[ . 1 . 2]" 1
203 1 16 LYS QD 1 17 LYS HA 6.300 . 6.300 6.210 5.891 6.446 0.146 17 0 "[ . 1 . 2]" 1
204 1 17 LYS H 1 17 LYS QB 3.560 . 3.560 2.269 2.212 2.344 . 0 0 "[ . 1 . 2]" 1
205 1 17 LYS H 1 17 LYS QG 4.940 . 4.940 4.042 3.972 4.131 . 0 0 "[ . 1 . 2]" 1
206 1 17 LYS H 1 19 GLU H 6.010 . 6.010 3.887 3.680 4.166 . 0 0 "[ . 1 . 2]" 1
207 1 17 LYS HA 1 17 LYS QD 3.950 . 3.950 3.023 1.966 4.119 0.169 11 0 "[ . 1 . 2]" 1
208 1 17 LYS HA 1 17 LYS QG 3.840 . 3.840 2.717 2.384 3.138 . 0 0 "[ . 1 . 2]" 1
209 1 17 LYS HA 1 19 GLU H 5.260 . 5.260 4.234 3.980 4.564 . 0 0 "[ . 1 . 2]" 1
210 1 17 LYS HA 1 20 GLU H 4.970 . 4.970 3.517 3.096 3.883 . 0 0 "[ . 1 . 2]" 1
211 1 17 LYS HA 1 20 GLU QB 4.260 . 4.260 3.208 2.322 4.327 0.067 11 0 "[ . 1 . 2]" 1
212 1 17 LYS HA 1 20 GLU QG 5.040 . 5.040 2.966 1.833 4.496 . 0 0 "[ . 1 . 2]" 1
213 1 17 LYS HA 1 21 LEU MD1 5.850 . 5.850 4.679 4.387 5.083 . 0 0 "[ . 1 . 2]" 1
214 1 17 LYS QB 1 18 ALA H 4.960 . 4.960 2.559 2.366 2.876 . 0 0 "[ . 1 . 2]" 1
215 1 17 LYS QD 1 21 LEU MD1 5.440 . 5.440 3.659 2.268 4.788 . 0 0 "[ . 1 . 2]" 1
216 1 17 LYS QE 1 21 LEU MD1 4.680 . 4.680 2.726 1.767 4.084 . 0 0 "[ . 1 . 2]" 1
217 1 17 LYS QG 1 18 ALA H 5.340 . 5.340 3.776 3.420 4.593 . 0 0 "[ . 1 . 2]" 1
218 1 17 LYS QG 1 21 LEU MD1 3.840 . 3.840 2.872 2.252 4.039 0.199 6 0 "[ . 1 . 2]" 1
219 1 18 ALA H 1 18 ALA MB 3.560 . 3.560 2.203 2.172 2.254 . 0 0 "[ . 1 . 2]" 1
220 1 18 ALA H 1 19 GLU H 3.960 . 3.960 2.647 2.458 2.785 . 0 0 "[ . 1 . 2]" 1
221 1 18 ALA HA 1 21 LEU MD1 4.350 . 4.350 3.003 2.389 4.277 . 0 0 "[ . 1 . 2]" 1
222 1 18 ALA HA 1 23 GLN H 4.860 . 4.860 3.914 3.465 4.228 . 0 0 "[ . 1 . 2]" 1
223 1 18 ALA HA 1 23 GLN QB 4.020 . 4.020 3.208 2.490 3.747 . 0 0 "[ . 1 . 2]" 1
224 1 18 ALA HA 1 23 GLN QG 5.340 . 5.340 4.185 2.617 5.019 . 0 0 "[ . 1 . 2]" 1
225 1 18 ALA HA 1 26 LEU MD1 4.830 . 4.830 3.025 2.339 4.805 . 0 0 "[ . 1 . 2]" 1
226 1 18 ALA HA 1 26 LEU MD2 4.350 . 4.350 4.575 4.360 4.769 0.419 8 0 "[ . 1 . 2]" 1
227 1 18 ALA HA 1 27 MET QG 6.100 . 6.100 4.052 3.772 4.330 . 0 0 "[ . 1 . 2]" 1
228 1 18 ALA MB 1 19 GLU H 3.930 . 3.930 2.576 2.363 2.873 . 0 0 "[ . 1 . 2]" 1
229 1 18 ALA MB 1 23 GLN H 4.500 . 4.500 3.965 3.599 4.319 . 0 0 "[ . 1 . 2]" 1
230 1 18 ALA MB 1 23 GLN QB 3.550 . 3.550 3.136 1.946 3.643 0.093 1 0 "[ . 1 . 2]" 1
231 1 18 ALA MB 1 26 LEU H 4.860 . 4.860 3.865 3.427 4.228 . 0 0 "[ . 1 . 2]" 1
232 1 18 ALA MB 1 26 LEU QB 3.570 . 3.570 1.900 1.738 2.248 . 0 0 "[ . 1 . 2]" 1
233 1 18 ALA MB 1 26 LEU MD1 4.130 . 4.130 2.985 2.533 3.826 . 0 0 "[ . 1 . 2]" 1
234 1 18 ALA MB 1 27 MET H 3.920 . 3.920 2.780 2.351 3.050 . 0 0 "[ . 1 . 2]" 1
235 1 18 ALA MB 1 27 MET HG2 4.270 . 4.270 2.243 2.008 2.843 . 0 0 "[ . 1 . 2]" 1
236 1 18 ALA MB 1 27 MET QG 3.520 . 3.520 2.026 1.884 2.303 . 0 0 "[ . 1 . 2]" 1
237 1 18 ALA MB 1 27 MET HG3 4.270 . 4.270 2.369 2.111 2.613 . 0 0 "[ . 1 . 2]" 1
238 1 19 GLU H 1 19 GLU HB2 3.770 . 3.770 2.500 2.246 2.726 . 0 0 "[ . 1 . 2]" 1
239 1 19 GLU H 1 19 GLU QB 3.300 . 3.300 2.221 2.156 2.287 . 0 0 "[ . 1 . 2]" 1
240 1 19 GLU H 1 19 GLU HB3 3.770 . 3.770 2.520 2.320 2.796 . 0 0 "[ . 1 . 2]" 1
241 1 19 GLU H 1 19 GLU HG2 5.210 . 5.210 4.433 4.257 4.520 . 0 0 "[ . 1 . 2]" 1
242 1 19 GLU H 1 19 GLU QG 4.500 . 4.500 3.986 3.904 4.034 . 0 0 "[ . 1 . 2]" 1
243 1 19 GLU H 1 19 GLU HG3 5.210 . 5.210 4.521 4.404 4.585 . 0 0 "[ . 1 . 2]" 1
244 1 19 GLU H 1 20 GLU H 4.200 . 4.200 2.586 2.465 2.789 . 0 0 "[ . 1 . 2]" 1
245 1 19 GLU HA 1 19 GLU HG2 4.350 . 4.350 2.983 2.497 3.288 . 0 0 "[ . 1 . 2]" 1
246 1 19 GLU HA 1 19 GLU QG 3.770 . 3.770 2.523 2.456 2.643 . 0 0 "[ . 1 . 2]" 1
247 1 19 GLU HA 1 19 GLU HG3 4.350 . 4.350 2.943 2.566 3.777 . 0 0 "[ . 1 . 2]" 1
248 1 19 GLU HA 1 22 ASN H 4.820 . 4.820 3.305 3.052 3.708 . 0 0 "[ . 1 . 2]" 1
249 1 19 GLU HA 1 27 MET ME 3.570 . 3.570 3.284 2.324 3.693 0.123 9 0 "[ . 1 . 2]" 1
250 1 19 GLU QG 1 20 GLU H 4.710 . 4.710 3.911 3.437 4.611 . 0 0 "[ . 1 . 2]" 1
251 1 19 GLU HG2 1 20 GLU H 5.350 . 5.350 4.143 3.543 5.180 . 0 0 "[ . 1 . 2]" 1
252 1 19 GLU HG2 1 20 GLU HA 6.300 . 6.300 4.373 3.515 6.246 . 0 0 "[ . 1 . 2]" 1
253 1 19 GLU HG3 1 20 GLU H 5.350 . 5.350 4.913 4.636 5.186 . 0 0 "[ . 1 . 2]" 1
254 1 19 GLU HG3 1 20 GLU HA 6.300 . 6.300 5.565 5.000 6.205 . 0 0 "[ . 1 . 2]" 1
255 1 20 GLU H 1 20 GLU HB2 4.050 . 4.050 2.872 2.175 3.670 . 0 0 "[ . 1 . 2]" 1
256 1 20 GLU H 1 20 GLU QB 3.430 . 3.430 2.442 2.098 2.616 . 0 0 "[ . 1 . 2]" 1
257 1 20 GLU H 1 20 GLU HB3 4.050 . 4.050 3.070 2.441 3.652 . 0 0 "[ . 1 . 2]" 1
258 1 20 GLU H 1 20 GLU HG2 4.380 . 4.380 2.865 2.047 4.448 0.068 20 0 "[ . 1 . 2]" 1
259 1 20 GLU H 1 20 GLU QG 3.680 . 3.680 2.570 2.027 3.919 0.239 18 0 "[ . 1 . 2]" 1
260 1 20 GLU H 1 20 GLU HG3 4.380 . 4.380 3.522 2.283 4.461 0.081 17 0 "[ . 1 . 2]" 1
261 1 20 GLU H 1 21 LEU H 4.230 . 4.230 2.592 2.478 2.733 . 0 0 "[ . 1 . 2]" 1
262 1 20 GLU HA 1 20 GLU QG 3.890 . 3.890 2.972 2.448 3.386 . 0 0 "[ . 1 . 2]" 1
263 1 20 GLU QB 1 21 LEU H 4.470 . 4.470 2.973 2.539 3.684 . 0 0 "[ . 1 . 2]" 1
264 1 20 GLU QB 1 21 LEU MD2 5.500 . 5.500 3.753 3.290 4.547 . 0 0 "[ . 1 . 2]" 1
265 1 20 GLU HB2 1 21 LEU H 5.240 . 5.240 3.381 2.616 4.105 . 0 0 "[ . 1 . 2]" 1
266 1 20 GLU HB3 1 21 LEU H 5.240 . 5.240 3.636 2.575 4.167 . 0 0 "[ . 1 . 2]" 1
267 1 20 GLU QG 1 21 LEU H 4.910 . 4.910 3.494 2.213 4.449 . 0 0 "[ . 1 . 2]" 1
268 1 20 GLU QG 1 21 LEU MD2 6.100 . 6.100 4.066 2.513 5.456 . 0 0 "[ . 1 . 2]" 1
269 1 21 LEU H 1 21 LEU MD1 5.540 . 5.540 3.729 3.570 3.904 . 0 0 "[ . 1 . 2]" 1
270 1 21 LEU H 1 21 LEU HG 4.420 . 4.420 2.473 2.292 2.602 . 0 0 "[ . 1 . 2]" 1
271 1 21 LEU H 1 22 ASN H 4.790 . 4.790 2.418 2.244 2.545 . 0 0 "[ . 1 . 2]" 1
272 1 21 LEU HA 1 21 LEU MD2 3.000 . 3.000 2.117 2.039 2.202 . 0 0 "[ . 1 . 2]" 1
273 1 21 LEU HA 1 21 LEU HG 4.000 . 4.000 3.194 3.112 3.317 . 0 0 "[ . 1 . 2]" 1
274 1 21 LEU HA 1 23 GLN HG2 6.300 . 6.300 5.320 4.171 6.055 . 0 0 "[ . 1 . 2]" 1
275 1 21 LEU HA 1 23 GLN QG 5.550 . 5.550 4.115 3.799 4.301 . 0 0 "[ . 1 . 2]" 1
276 1 21 LEU HA 1 23 GLN HG3 6.300 . 6.300 4.611 3.876 5.851 . 0 0 "[ . 1 . 2]" 1
277 1 21 LEU QB 1 23 GLN H 4.570 . 4.570 2.899 2.665 3.231 . 0 0 "[ . 1 . 2]" 1
278 1 21 LEU QB 1 23 GLN QB 4.770 . 4.770 3.136 2.704 3.656 . 0 0 "[ . 1 . 2]" 1
279 1 21 LEU QB 1 23 GLN HE21 5.130 . 5.130 2.461 1.823 4.857 . 0 0 "[ . 1 . 2]" 1
280 1 21 LEU QB 1 23 GLN HG2 4.370 . 4.370 3.177 1.802 4.055 . 0 0 "[ . 1 . 2]" 1
281 1 21 LEU QB 1 23 GLN HG3 4.370 . 4.370 2.390 2.007 2.931 . 0 0 "[ . 1 . 2]" 1
282 1 21 LEU MD1 1 23 GLN H 5.340 . 5.340 4.730 4.467 5.137 . 0 0 "[ . 1 . 2]" 1
283 1 21 LEU MD1 1 23 GLN HE21 4.910 . 4.910 2.784 1.891 5.057 0.147 2 0 "[ . 1 . 2]" 1
284 1 21 LEU MD1 1 23 GLN HE22 4.360 . 4.360 3.161 2.341 4.468 0.108 12 0 "[ . 1 . 2]" 1
285 1 21 LEU MD1 1 23 GLN QG 5.500 . 5.500 3.410 2.601 4.010 . 0 0 "[ . 1 . 2]" 1
286 1 21 LEU MD2 1 23 GLN HG2 6.300 . 6.300 5.285 4.339 5.943 . 0 0 "[ . 1 . 2]" 1
287 1 21 LEU MD2 1 23 GLN QG 5.550 . 5.550 4.236 3.911 4.495 . 0 0 "[ . 1 . 2]" 1
288 1 21 LEU MD2 1 23 GLN HG3 6.300 . 6.300 4.577 4.040 5.207 . 0 0 "[ . 1 . 2]" 1
289 1 22 ASN H 1 23 GLN H 4.050 . 4.050 2.626 2.524 2.721 . 0 0 "[ . 1 . 2]" 1
290 1 22 ASN HA 1 23 GLN H 3.720 . 3.720 2.914 2.734 3.018 . 0 0 "[ . 1 . 2]" 1
291 1 23 GLN H 1 23 GLN QB 3.500 . 3.500 2.482 2.424 2.580 . 0 0 "[ . 1 . 2]" 1
292 1 23 GLN H 1 23 GLN HG2 4.330 . 4.330 3.334 2.136 3.936 . 0 0 "[ . 1 . 2]" 1
293 1 23 GLN H 1 23 GLN QG 3.640 . 3.640 2.530 2.119 2.816 . 0 0 "[ . 1 . 2]" 1
294 1 23 GLN H 1 23 GLN HG3 4.330 . 4.330 2.972 2.416 3.846 . 0 0 "[ . 1 . 2]" 1
295 1 23 GLN H 1 27 MET ME 4.580 . 4.580 4.619 4.207 4.798 0.218 18 0 "[ . 1 . 2]" 1
296 1 23 GLN HA 1 23 GLN HG2 4.370 . 4.370 2.733 2.483 3.232 . 0 0 "[ . 1 . 2]" 1
297 1 23 GLN HA 1 23 GLN HG3 4.370 . 4.370 3.371 3.092 3.913 . 0 0 "[ . 1 . 2]" 1
298 1 23 GLN HA 1 24 GLY H 3.390 . 3.390 2.262 2.125 3.546 0.156 6 0 "[ . 1 . 2]" 1
299 1 23 GLN QB 1 24 GLY H 4.800 . 4.800 3.611 1.949 3.860 . 0 0 "[ . 1 . 2]" 1
300 1 23 GLN QB 1 26 LEU QB 4.450 . 4.450 2.595 2.029 3.047 . 0 0 "[ . 1 . 2]" 1
301 1 23 GLN QB 1 26 LEU MD1 3.730 . 3.730 2.033 1.755 2.892 . 0 0 "[ . 1 . 2]" 1
302 1 23 GLN QB 1 26 LEU MD2 4.600 . 4.600 4.020 3.228 4.531 . 0 0 "[ . 1 . 2]" 1
303 1 23 GLN QB 1 26 LEU HG 4.390 . 4.390 3.264 2.695 4.438 0.048 11 0 "[ . 1 . 2]" 1
304 1 23 GLN HE21 1 26 LEU MD1 4.960 . 4.960 3.671 2.492 4.958 . 0 0 "[ . 1 . 2]" 1
305 1 23 GLN HE22 1 26 LEU MD1 5.000 . 5.000 3.644 2.511 4.862 . 0 0 "[ . 1 . 2]" 1
306 1 23 GLN QG 1 24 GLY H 4.980 . 4.980 4.469 3.755 4.914 . 0 0 "[ . 1 . 2]" 1
307 1 23 GLN QG 1 26 LEU MD1 4.410 . 4.410 3.159 1.920 3.948 . 0 0 "[ . 1 . 2]" 1
308 1 24 GLY H 1 25 GLU H 4.810 . 4.810 2.782 2.571 3.548 . 0 0 "[ . 1 . 2]" 1
309 1 24 GLY H 1 27 MET ME 4.860 . 4.860 4.025 3.577 4.973 0.113 19 0 "[ . 1 . 2]" 1
310 1 24 GLY HA2 1 27 MET H 4.760 . 4.760 3.309 2.926 4.156 . 0 0 "[ . 1 . 2]" 1
311 1 24 GLY HA2 1 27 MET HB2 4.920 . 4.920 2.470 1.905 3.513 . 0 0 "[ . 1 . 2]" 1
312 1 24 GLY HA2 1 27 MET HB3 5.160 . 5.160 4.083 3.513 5.152 . 0 0 "[ . 1 . 2]" 1
313 1 24 GLY HA2 1 27 MET ME 3.770 . 3.770 2.310 1.786 3.596 . 0 0 "[ . 1 . 2]" 1
314 1 24 GLY HA2 1 57 VAL MG1 5.110 . 5.110 2.607 2.259 3.126 . 0 0 "[ . 1 . 2]" 1
315 1 24 GLY HA3 1 27 MET HB2 4.960 . 4.960 3.988 3.495 4.952 . 0 0 "[ . 1 . 2]" 1
316 1 24 GLY HA3 1 27 MET ME 4.810 . 4.810 3.469 2.776 4.687 . 0 0 "[ . 1 . 2]" 1
317 1 24 GLY HA3 1 57 VAL MG1 4.460 . 4.460 2.665 2.350 3.295 . 0 0 "[ . 1 . 2]" 1
318 1 24 GLY HA3 1 61 GLU QG 5.290 . 5.290 2.870 2.312 3.570 . 0 0 "[ . 1 . 2]" 1
319 1 25 GLU H 1 25 GLU HG2 5.300 . 5.300 2.958 1.917 4.489 . 0 0 "[ . 1 . 2]" 1
320 1 25 GLU H 1 25 GLU QG 4.640 . 4.640 2.774 1.896 4.026 . 0 0 "[ . 1 . 2]" 1
321 1 25 GLU H 1 25 GLU HG3 5.300 . 5.300 3.644 2.990 4.561 . 0 0 "[ . 1 . 2]" 1
322 1 25 GLU H 1 61 GLU QG 6.100 . 6.100 2.922 2.165 4.493 . 0 0 "[ . 1 . 2]" 1
323 1 25 GLU QG 1 26 LEU MD1 5.220 . 5.220 3.837 1.603 5.313 0.093 5 0 "[ . 1 . 2]" 1
324 1 25 GLU QG 1 26 LEU MD2 4.940 . 4.940 3.774 3.037 5.011 0.071 5 0 "[ . 1 . 2]" 1
325 1 26 LEU H 1 26 LEU MD1 5.020 . 5.020 3.359 1.998 4.140 . 0 0 "[ . 1 . 2]" 1
326 1 26 LEU H 1 26 LEU HG 4.510 . 4.510 2.788 2.281 4.050 . 0 0 "[ . 1 . 2]" 1
327 1 26 LEU H 1 27 MET H 4.170 . 4.170 2.597 2.413 2.814 . 0 0 "[ . 1 . 2]" 1
328 1 26 LEU HA 1 26 LEU MD1 4.470 . 4.470 3.815 3.132 3.986 . 0 0 "[ . 1 . 2]" 1
329 1 26 LEU HA 1 26 LEU MD2 3.080 . 3.080 2.386 1.981 3.528 0.448 11 0 "[ . 1 . 2]" 1
330 1 26 LEU HA 1 26 LEU HG 4.470 . 4.470 2.864 2.257 3.123 . 0 0 "[ . 1 . 2]" 1
331 1 26 LEU HA 1 29 ARG H 5.090 . 5.090 3.575 3.126 3.903 . 0 0 "[ . 1 . 2]" 1
332 1 26 LEU HA 1 29 ARG HD2 4.790 . 4.790 2.964 1.966 4.354 . 0 0 "[ . 1 . 2]" 1
333 1 26 LEU HA 1 29 ARG QD 4.180 . 4.180 2.601 1.956 3.137 . 0 0 "[ . 1 . 2]" 1
334 1 26 LEU HA 1 29 ARG HD3 4.790 . 4.790 3.814 2.543 4.625 . 0 0 "[ . 1 . 2]" 1
335 1 26 LEU QB 1 26 LEU MD1 3.110 . 3.110 2.151 2.110 2.303 . 0 0 "[ . 1 . 2]" 1
336 1 26 LEU QB 1 27 MET H 3.830 . 3.830 2.639 2.406 2.922 . 0 0 "[ . 1 . 2]" 1
337 1 26 LEU HB2 1 26 LEU MD1 3.570 . 3.570 2.320 2.248 2.357 . 0 0 "[ . 1 . 2]" 1
338 1 26 LEU HB2 1 27 MET H 4.480 . 4.480 2.756 2.452 3.468 . 0 0 "[ . 1 . 2]" 1
339 1 26 LEU HB3 1 26 LEU MD1 3.570 . 3.570 2.607 2.404 3.236 . 0 0 "[ . 1 . 2]" 1
340 1 26 LEU HB3 1 27 MET H 4.480 . 4.480 3.555 2.728 3.847 . 0 0 "[ . 1 . 2]" 1
341 1 26 LEU MD1 1 27 MET H 4.770 . 4.770 4.471 4.031 4.757 . 0 0 "[ . 1 . 2]" 1
342 1 26 LEU MD2 1 27 MET H 5.240 . 5.240 4.808 4.079 5.212 . 0 0 "[ . 1 . 2]" 1
343 1 26 LEU MD2 1 29 ARG QB 4.850 . 4.850 3.881 2.803 4.816 . 0 0 "[ . 1 . 2]" 1
344 1 26 LEU MD2 1 29 ARG HD2 4.400 . 4.400 3.432 2.289 4.614 0.214 12 0 "[ . 1 . 2]" 1
345 1 26 LEU MD2 1 29 ARG QD 3.770 . 3.770 3.087 2.265 3.753 . 0 0 "[ . 1 . 2]" 1
346 1 26 LEU MD2 1 29 ARG HD3 4.400 . 4.400 3.990 2.843 4.524 0.124 10 0 "[ . 1 . 2]" 1
347 1 26 LEU MD2 1 29 ARG QG 5.940 . 5.940 4.648 3.959 5.393 . 0 0 "[ . 1 . 2]" 1
348 1 26 LEU HG 1 27 MET H 4.910 . 4.910 4.671 4.401 5.099 0.189 5 0 "[ . 1 . 2]" 1
349 1 27 MET H 1 27 MET HB2 3.700 . 3.700 2.488 2.413 2.547 . 0 0 "[ . 1 . 2]" 1
350 1 27 MET H 1 27 MET HB3 3.990 . 3.990 3.630 3.587 3.655 . 0 0 "[ . 1 . 2]" 1
351 1 27 MET H 1 27 MET ME 4.710 . 4.710 4.048 3.768 4.706 . 0 0 "[ . 1 . 2]" 1
352 1 27 MET H 1 27 MET HG2 4.400 . 4.400 3.459 3.279 3.735 . 0 0 "[ . 1 . 2]" 1
353 1 27 MET H 1 27 MET QG 3.640 . 3.640 2.419 2.155 2.585 . 0 0 "[ . 1 . 2]" 1
354 1 27 MET H 1 27 MET HG3 4.400 . 4.400 2.475 2.173 2.675 . 0 0 "[ . 1 . 2]" 1
355 1 27 MET H 1 28 GLY H 3.960 . 3.960 2.659 2.575 2.758 . 0 0 "[ . 1 . 2]" 1
356 1 27 MET H 1 57 VAL MG1 4.980 . 4.980 3.943 3.615 4.278 . 0 0 "[ . 1 . 2]" 1
357 1 27 MET HA 1 27 MET ME 5.240 . 5.240 4.383 4.159 4.488 . 0 0 "[ . 1 . 2]" 1
358 1 27 MET HA 1 27 MET QG 3.730 . 3.730 2.417 2.342 2.521 . 0 0 "[ . 1 . 2]" 1
359 1 27 MET HA 1 30 ALA H 4.360 . 4.360 3.490 3.306 3.740 . 0 0 "[ . 1 . 2]" 1
360 1 27 MET HA 1 30 ALA MB 3.950 . 3.950 2.607 2.424 2.963 . 0 0 "[ . 1 . 2]" 1
361 1 27 MET HA 1 31 LEU H 5.400 . 5.400 4.238 3.999 4.536 . 0 0 "[ . 1 . 2]" 1
362 1 27 MET HB2 1 27 MET ME 4.480 . 4.480 2.288 2.079 2.990 . 0 0 "[ . 1 . 2]" 1
363 1 27 MET HB2 1 28 GLY H 5.220 . 5.220 2.640 2.327 2.811 . 0 0 "[ . 1 . 2]" 1
364 1 27 MET HB2 1 57 VAL MG1 4.500 . 4.500 2.351 1.818 2.929 . 0 0 "[ . 1 . 2]" 1
365 1 27 MET HB3 1 27 MET ME 5.010 . 5.010 2.504 2.183 2.663 . 0 0 "[ . 1 . 2]" 1
366 1 27 MET HB3 1 31 LEU MD1 5.790 . 5.790 3.606 3.088 4.210 . 0 0 "[ . 1 . 2]" 1
367 1 27 MET HB3 1 57 VAL MG1 4.090 . 4.090 3.228 2.503 4.032 . 0 0 "[ . 1 . 2]" 1
368 1 27 MET ME 1 57 VAL MG1 3.850 . 3.850 2.536 2.036 3.449 . 0 0 "[ . 1 . 2]" 1
369 1 27 MET ME 1 57 VAL MG2 3.810 . 3.810 3.119 2.614 3.646 . 0 0 "[ . 1 . 2]" 1
370 1 28 GLY H 1 31 LEU MD1 5.340 . 5.340 4.627 3.962 5.261 . 0 0 "[ . 1 . 2]" 1
371 1 28 GLY H 1 57 VAL MG1 4.030 . 4.030 2.729 2.325 3.172 . 0 0 "[ . 1 . 2]" 1
372 1 28 GLY HA2 1 31 LEU H 4.800 . 4.800 3.673 3.501 3.911 . 0 0 "[ . 1 . 2]" 1
373 1 28 GLY HA2 1 31 LEU HB3 6.150 . 6.150 4.723 4.458 5.178 . 0 0 "[ . 1 . 2]" 1
374 1 28 GLY HA2 1 31 LEU MD1 4.290 . 4.290 2.840 2.306 3.525 . 0 0 "[ . 1 . 2]" 1
375 1 28 GLY HA2 1 31 LEU HG 5.000 . 5.000 3.896 3.488 4.339 . 0 0 "[ . 1 . 2]" 1
376 1 28 GLY HA2 1 54 ALA HA 4.370 . 4.370 2.233 2.071 2.503 . 0 0 "[ . 1 . 2]" 1
377 1 28 GLY HA2 1 54 ALA MB 5.000 . 5.000 3.115 2.767 3.455 . 0 0 "[ . 1 . 2]" 1
378 1 28 GLY HA2 1 57 VAL HB 4.790 . 4.790 2.901 2.488 3.339 . 0 0 "[ . 1 . 2]" 1
379 1 28 GLY HA2 1 57 VAL MG1 4.270 . 4.270 3.448 3.080 3.871 . 0 0 "[ . 1 . 2]" 1
380 1 28 GLY HA2 1 57 VAL MG2 5.060 . 5.060 3.356 2.717 3.903 . 0 0 "[ . 1 . 2]" 1
381 1 28 GLY HA2 1 58 PHE QE 5.440 . 5.440 4.339 3.961 4.633 . 0 0 "[ . 1 . 2]" 1
382 1 28 GLY HA3 1 29 ARG QB 5.580 . 5.580 4.947 4.528 5.223 . 0 0 "[ . 1 . 2]" 1
383 1 28 GLY HA3 1 31 LEU MD1 5.060 . 5.060 4.380 3.853 5.077 0.017 1 0 "[ . 1 . 2]" 1
384 1 28 GLY HA3 1 54 ALA HA 4.920 . 4.920 3.375 2.862 3.752 . 0 0 "[ . 1 . 2]" 1
385 1 28 GLY HA3 1 54 ALA MB 5.190 . 5.190 3.655 3.302 3.976 . 0 0 "[ . 1 . 2]" 1
386 1 28 GLY HA3 1 57 VAL HB 4.940 . 4.940 2.964 2.451 3.366 . 0 0 "[ . 1 . 2]" 1
387 1 28 GLY HA3 1 57 VAL MG1 3.980 . 3.980 3.252 2.689 3.685 . 0 0 "[ . 1 . 2]" 1
388 1 28 GLY HA3 1 58 PHE QE 4.270 . 4.270 3.387 2.959 3.710 . 0 0 "[ . 1 . 2]" 1
389 1 29 ARG H 1 29 ARG QD 5.100 . 5.100 3.859 3.524 4.400 . 0 0 "[ . 1 . 2]" 1
390 1 29 ARG H 1 29 ARG HG2 5.320 . 5.320 3.661 3.337 4.510 . 0 0 "[ . 1 . 2]" 1
391 1 29 ARG H 1 29 ARG QG 4.470 . 4.470 2.424 2.093 3.981 . 0 0 "[ . 1 . 2]" 1
392 1 29 ARG H 1 29 ARG HG3 5.320 . 5.320 2.476 2.115 4.431 . 0 0 "[ . 1 . 2]" 1
393 1 29 ARG H 1 30 ALA H 4.170 . 4.170 2.651 2.533 2.734 . 0 0 "[ . 1 . 2]" 1
394 1 29 ARG H 1 30 ALA MB 5.200 . 5.200 4.306 4.183 4.394 . 0 0 "[ . 1 . 2]" 1
395 1 29 ARG H 1 58 PHE QE 4.330 . 4.330 3.499 3.043 3.999 . 0 0 "[ . 1 . 2]" 1
396 1 29 ARG H 1 58 PHE HZ 4.280 . 4.280 3.166 2.593 3.588 . 0 0 "[ . 1 . 2]" 1
397 1 29 ARG HA 1 29 ARG HG2 4.250 . 4.250 2.663 2.544 2.999 . 0 0 "[ . 1 . 2]" 1
398 1 29 ARG HA 1 29 ARG HG3 4.250 . 4.250 2.996 2.681 3.228 . 0 0 "[ . 1 . 2]" 1
399 1 29 ARG HA 1 32 TYR H 4.410 . 4.410 3.598 3.369 4.011 . 0 0 "[ . 1 . 2]" 1
400 1 29 ARG HA 1 32 TYR HB2 4.270 . 4.270 3.331 3.036 3.904 . 0 0 "[ . 1 . 2]" 1
401 1 29 ARG HA 1 32 TYR HB3 3.940 . 3.940 2.494 2.140 2.915 . 0 0 "[ . 1 . 2]" 1
402 1 29 ARG HA 1 32 TYR QD 5.250 . 5.250 3.718 3.209 4.315 . 0 0 "[ . 1 . 2]" 1
403 1 29 ARG HA 1 33 ASN H 4.480 . 4.480 4.099 3.893 4.279 . 0 0 "[ . 1 . 2]" 1
404 1 29 ARG HA 1 58 PHE QE 4.690 . 4.690 3.515 3.081 3.807 . 0 0 "[ . 1 . 2]" 1
405 1 29 ARG HA 1 58 PHE HZ 3.350 . 3.350 2.511 2.144 3.371 0.021 15 0 "[ . 1 . 2]" 1
406 1 29 ARG QB 1 30 ALA H 3.970 . 3.970 2.639 2.326 2.851 . 0 0 "[ . 1 . 2]" 1
407 1 29 ARG QB 1 32 TYR QD 5.660 . 5.660 4.700 4.031 5.345 . 0 0 "[ . 1 . 2]" 1
408 1 29 ARG QB 1 33 ASN QD 5.130 . 5.130 3.469 2.679 5.230 0.100 3 0 "[ . 1 . 2]" 1
409 1 29 ARG QB 1 58 PHE QE 6.040 . 6.040 4.307 2.992 4.698 . 0 0 "[ . 1 . 2]" 1
410 1 29 ARG QB 1 58 PHE HZ 4.230 . 4.230 3.750 2.278 4.209 . 0 0 "[ . 1 . 2]" 1
411 1 29 ARG QD 1 58 PHE HZ 5.290 . 5.290 4.381 3.726 5.007 . 0 0 "[ . 1 . 2]" 1
412 1 29 ARG QG 1 58 PHE QE 4.470 . 4.470 2.645 2.091 4.122 . 0 0 "[ . 1 . 2]" 1
413 1 29 ARG HG2 1 58 PHE QE 5.160 . 5.160 3.578 2.799 5.292 0.132 13 0 "[ . 1 . 2]" 1
414 1 29 ARG HG2 1 58 PHE HZ 4.120 . 4.120 2.802 2.294 4.320 0.200 13 0 "[ . 1 . 2]" 1
415 1 29 ARG HG3 1 58 PHE QE 5.160 . 5.160 2.743 2.140 4.300 . 0 0 "[ . 1 . 2]" 1
416 1 29 ARG HG3 1 58 PHE HZ 4.120 . 4.120 2.636 1.784 3.265 . 0 0 "[ . 1 . 2]" 1
417 1 30 ALA H 1 30 ALA MB 3.510 . 3.510 2.239 2.218 2.261 . 0 0 "[ . 1 . 2]" 1
418 1 30 ALA H 1 31 LEU H 3.800 . 3.800 2.754 2.673 2.834 . 0 0 "[ . 1 . 2]" 1
419 1 30 ALA HA 1 33 ASN H 4.750 . 4.750 3.686 3.444 3.854 . 0 0 "[ . 1 . 2]" 1
420 1 30 ALA HA 1 33 ASN QB 4.370 . 4.370 2.965 2.580 3.246 . 0 0 "[ . 1 . 2]" 1
421 1 30 ALA HA 1 33 ASN QD 5.150 . 5.150 3.349 2.089 4.537 . 0 0 "[ . 1 . 2]" 1
422 1 30 ALA MB 1 31 LEU H 3.390 . 3.390 2.367 2.286 2.486 . 0 0 "[ . 1 . 2]" 1
423 1 30 ALA MB 1 33 ASN H 5.550 . 5.550 4.727 4.574 4.845 . 0 0 "[ . 1 . 2]" 1
424 1 30 ALA MB 1 33 ASN QD 5.440 . 5.440 4.607 3.702 5.549 0.109 11 0 "[ . 1 . 2]" 1
425 1 30 ALA MB 1 34 ILE MD 5.020 . 5.020 3.247 3.012 3.575 . 0 0 "[ . 1 . 2]" 1
426 1 31 LEU H 1 31 LEU HB2 4.080 . 4.080 2.482 2.434 2.530 . 0 0 "[ . 1 . 2]" 1
427 1 31 LEU H 1 31 LEU MD1 3.940 . 3.940 3.568 3.346 3.705 . 0 0 "[ . 1 . 2]" 1
428 1 31 LEU H 1 31 LEU MD2 4.650 . 4.650 3.397 3.250 3.554 . 0 0 "[ . 1 . 2]" 1
429 1 31 LEU H 1 31 LEU HG 3.280 . 3.280 2.288 2.193 2.374 . 0 0 "[ . 1 . 2]" 1
430 1 31 LEU H 1 32 TYR H 3.640 . 3.640 2.626 2.533 2.809 . 0 0 "[ . 1 . 2]" 1
431 1 31 LEU H 1 54 ALA MB 4.670 . 4.670 4.009 3.785 4.265 . 0 0 "[ . 1 . 2]" 1
432 1 31 LEU HA 1 31 LEU MD2 3.730 . 3.730 2.099 2.048 2.198 . 0 0 "[ . 1 . 2]" 1
433 1 31 LEU HA 1 34 ILE H 5.050 . 5.050 3.529 3.358 3.744 . 0 0 "[ . 1 . 2]" 1
434 1 31 LEU HA 1 34 ILE HB 4.270 . 4.270 2.604 2.355 2.887 . 0 0 "[ . 1 . 2]" 1
435 1 31 LEU HA 1 34 ILE MD 3.840 . 3.840 2.335 1.890 2.851 . 0 0 "[ . 1 . 2]" 1
436 1 31 LEU HA 1 34 ILE QG 5.100 . 5.100 3.394 3.078 3.839 . 0 0 "[ . 1 . 2]" 1
437 1 31 LEU HA 1 50 TYR QD 4.120 . 4.120 2.991 2.455 3.423 . 0 0 "[ . 1 . 2]" 1
438 1 31 LEU HB2 1 32 TYR H 3.490 . 3.490 2.687 2.432 2.857 . 0 0 "[ . 1 . 2]" 1
439 1 31 LEU HB2 1 50 TYR QD 4.580 . 4.580 4.355 4.091 4.584 0.004 17 0 "[ . 1 . 2]" 1
440 1 31 LEU HB2 1 54 ALA H 4.550 . 4.550 3.656 3.484 3.837 . 0 0 "[ . 1 . 2]" 1
441 1 31 LEU HB2 1 54 ALA HA 4.610 . 4.610 2.809 2.420 3.197 . 0 0 "[ . 1 . 2]" 1
442 1 31 LEU HB3 1 32 TYR H 3.940 . 3.940 3.705 3.431 3.858 . 0 0 "[ . 1 . 2]" 1
443 1 31 LEU HB3 1 32 TYR HB2 6.300 . 6.300 5.413 5.065 5.576 . 0 0 "[ . 1 . 2]" 1
444 1 31 LEU HB3 1 35 GLY H 5.960 . 5.960 5.047 4.871 5.193 . 0 0 "[ . 1 . 2]" 1
445 1 31 LEU HB3 1 50 TYR QD 2.960 . 2.960 2.705 2.392 2.980 0.020 12 0 "[ . 1 . 2]" 1
446 1 31 LEU HB3 1 53 ARG QD 4.810 . 4.810 4.152 3.144 4.610 . 0 0 "[ . 1 . 2]" 1
447 1 31 LEU HB3 1 54 ALA H 5.410 . 5.410 3.507 3.218 3.835 . 0 0 "[ . 1 . 2]" 1
448 1 31 LEU HB3 1 54 ALA HA 4.750 . 4.750 3.954 3.483 4.416 . 0 0 "[ . 1 . 2]" 1
449 1 31 LEU HB3 1 54 ALA MB 3.660 . 3.660 2.891 2.729 3.146 . 0 0 "[ . 1 . 2]" 1
450 1 31 LEU MD1 1 32 TYR H 5.250 . 5.250 4.568 4.313 4.749 . 0 0 "[ . 1 . 2]" 1
451 1 31 LEU MD1 1 50 TYR HA 5.510 . 5.510 4.052 3.636 4.464 . 0 0 "[ . 1 . 2]" 1
452 1 31 LEU MD1 1 50 TYR QD 5.380 . 5.380 3.858 3.486 4.361 . 0 0 "[ . 1 . 2]" 1
453 1 31 LEU MD1 1 53 ARG HB2 4.140 . 4.140 2.399 2.166 2.663 . 0 0 "[ . 1 . 2]" 1
454 1 31 LEU MD1 1 53 ARG HB3 3.380 . 3.380 2.035 1.709 2.402 . 0 0 "[ . 1 . 2]" 1
455 1 31 LEU MD1 1 53 ARG QD 5.300 . 5.300 3.153 2.393 3.548 . 0 0 "[ . 1 . 2]" 1
456 1 31 LEU MD1 1 53 ARG QG 4.550 . 4.550 3.734 3.456 3.884 . 0 0 "[ . 1 . 2]" 1
457 1 31 LEU MD1 1 54 ALA H 4.610 . 4.610 3.376 3.094 3.715 . 0 0 "[ . 1 . 2]" 1
458 1 31 LEU MD1 1 54 ALA HA 3.950 . 3.950 2.684 2.473 3.094 . 0 0 "[ . 1 . 2]" 1
459 1 31 LEU MD1 1 54 ALA MB 4.040 . 4.040 3.414 3.080 3.746 . 0 0 "[ . 1 . 2]" 1
460 1 31 LEU MD2 1 50 TYR HA 5.510 . 5.510 3.703 2.858 4.072 . 0 0 "[ . 1 . 2]" 1
461 1 31 LEU MD2 1 50 TYR QD 3.130 . 3.130 2.149 1.864 2.540 . 0 0 "[ . 1 . 2]" 1
462 1 31 LEU MD2 1 50 TYR QE 3.210 . 3.210 2.792 2.463 3.237 0.027 17 0 "[ . 1 . 2]" 1
463 1 31 LEU MD2 1 53 ARG HB3 5.070 . 5.070 3.815 2.728 4.356 . 0 0 "[ . 1 . 2]" 1
464 1 31 LEU MD2 1 53 ARG HD2 5.070 . 5.070 3.847 2.450 4.773 . 0 0 "[ . 1 . 2]" 1
465 1 31 LEU MD2 1 53 ARG HD3 5.070 . 5.070 3.480 2.313 4.445 . 0 0 "[ . 1 . 2]" 1
466 1 31 LEU HG 1 54 ALA HA 5.280 . 5.280 4.538 4.253 4.889 . 0 0 "[ . 1 . 2]" 1
467 1 32 TYR H 1 32 TYR HB2 3.680 . 3.680 2.558 2.471 2.632 . 0 0 "[ . 1 . 2]" 1
468 1 32 TYR H 1 32 TYR HB3 3.770 . 3.770 2.497 2.391 2.583 . 0 0 "[ . 1 . 2]" 1
469 1 32 TYR H 1 32 TYR QD 4.790 . 4.790 4.230 4.203 4.261 . 0 0 "[ . 1 . 2]" 1
470 1 32 TYR H 1 33 ASN H 3.720 . 3.720 2.692 2.606 2.792 . 0 0 "[ . 1 . 2]" 1
471 1 32 TYR H 1 54 ALA MB 3.600 . 3.600 2.705 2.426 2.981 . 0 0 "[ . 1 . 2]" 1
472 1 32 TYR HA 1 32 TYR QD 3.350 . 3.350 2.597 2.255 2.876 . 0 0 "[ . 1 . 2]" 1
473 1 32 TYR HA 1 35 GLY H 4.750 . 4.750 3.586 3.480 3.686 . 0 0 "[ . 1 . 2]" 1
474 1 32 TYR HA 1 51 PHE QD 3.560 . 3.560 2.374 2.137 2.561 . 0 0 "[ . 1 . 2]" 1
475 1 32 TYR HA 1 51 PHE QE 3.910 . 3.910 3.241 2.790 3.587 . 0 0 "[ . 1 . 2]" 1
476 1 32 TYR HA 1 54 ALA H 6.040 . 6.040 5.135 4.846 5.630 . 0 0 "[ . 1 . 2]" 1
477 1 32 TYR HA 1 54 ALA MB 4.620 . 4.620 2.821 2.526 3.282 . 0 0 "[ . 1 . 2]" 1
478 1 32 TYR HB2 1 33 ASN H 4.440 . 4.440 3.888 3.835 3.964 . 0 0 "[ . 1 . 2]" 1
479 1 32 TYR HB2 1 54 ALA MB 3.690 . 3.690 2.253 1.961 2.796 . 0 0 "[ . 1 . 2]" 1
480 1 32 TYR HB3 1 33 ASN H 3.990 . 3.990 2.580 2.466 2.707 . 0 0 "[ . 1 . 2]" 1
481 1 32 TYR HB3 1 54 ALA MB 4.080 . 4.080 3.580 3.269 4.004 . 0 0 "[ . 1 . 2]" 1
482 1 32 TYR HB3 1 58 PHE HZ 5.730 . 5.730 4.152 3.385 5.418 . 0 0 "[ . 1 . 2]" 1
483 1 32 TYR QD 1 33 ASN H 3.980 . 3.980 3.703 3.447 4.016 0.036 3 0 "[ . 1 . 2]" 1
484 1 32 TYR QD 1 36 LEU MD1 3.680 . 3.680 3.118 2.768 3.316 . 0 0 "[ . 1 . 2]" 1
485 1 32 TYR QD 1 54 ALA MB 4.080 . 4.080 3.128 2.722 3.663 . 0 0 "[ . 1 . 2]" 1
486 1 32 TYR QD 1 70 ALA HA 3.580 . 3.580 2.721 2.457 3.100 . 0 0 "[ . 1 . 2]" 1
487 1 32 TYR QD 1 70 ALA MB 3.040 . 3.040 2.735 2.524 2.997 . 0 0 "[ . 1 . 2]" 1
488 1 32 TYR QE 1 36 LEU MD1 3.150 . 3.150 2.481 2.199 2.738 . 0 0 "[ . 1 . 2]" 1
489 1 32 TYR QE 1 36 LEU MD2 4.600 . 4.600 3.237 3.026 3.645 . 0 0 "[ . 1 . 2]" 1
490 1 32 TYR QE 1 51 PHE QE 4.480 . 4.480 3.797 3.387 4.159 . 0 0 "[ . 1 . 2]" 1
491 1 32 TYR QE 1 69 ARG QD 4.040 . 4.040 3.331 2.882 4.064 0.024 12 0 "[ . 1 . 2]" 1
492 1 32 TYR QE 1 70 ALA HA 2.800 . 2.800 1.960 1.695 2.204 . 0 0 "[ . 1 . 2]" 1
493 1 32 TYR QE 1 70 ALA MB 3.730 . 3.730 3.429 3.150 3.698 . 0 0 "[ . 1 . 2]" 1
494 1 32 TYR QE 1 73 SER H 3.850 . 3.850 3.670 3.375 3.851 0.001 15 0 "[ . 1 . 2]" 1
495 1 32 TYR QE 1 73 SER HB2 3.550 . 3.550 2.436 2.188 2.738 . 0 0 "[ . 1 . 2]" 1
496 1 32 TYR QE 1 73 SER QB 2.950 . 2.950 2.288 2.025 2.583 . 0 0 "[ . 1 . 2]" 1
497 1 32 TYR QE 1 73 SER HB3 3.550 . 3.550 3.013 2.259 3.612 0.062 13 0 "[ . 1 . 2]" 1
498 1 33 ASN H 1 33 ASN QD 5.070 . 5.070 3.354 2.149 4.507 . 0 0 "[ . 1 . 2]" 1
499 1 33 ASN HA 1 36 LEU HB2 4.740 . 4.740 2.815 2.523 3.307 . 0 0 "[ . 1 . 2]" 1
500 1 33 ASN HA 1 36 LEU MD1 3.580 . 3.580 2.234 1.956 2.563 . 0 0 "[ . 1 . 2]" 1
501 1 33 ASN HA 1 36 LEU HG 4.550 . 4.550 2.991 2.314 3.415 . 0 0 "[ . 1 . 2]" 1
502 1 33 ASN QB 1 34 ILE H 3.910 . 3.910 2.599 2.357 2.821 . 0 0 "[ . 1 . 2]" 1
503 1 33 ASN QB 1 35 GLY H 6.300 . 6.300 4.691 4.556 4.830 . 0 0 "[ . 1 . 2]" 1
504 1 34 ILE H 1 34 ILE HB 3.770 . 3.770 2.500 2.389 2.593 . 0 0 "[ . 1 . 2]" 1
505 1 34 ILE H 1 34 ILE MD 4.370 . 4.370 3.575 3.460 3.682 . 0 0 "[ . 1 . 2]" 1
506 1 34 ILE H 1 34 ILE QG 4.090 . 4.090 2.207 2.087 2.383 . 0 0 "[ . 1 . 2]" 1
507 1 34 ILE H 1 34 ILE MG 4.550 . 4.550 3.805 3.753 3.828 . 0 0 "[ . 1 . 2]" 1
508 1 34 ILE H 1 35 GLY H 4.020 . 4.020 2.683 2.523 2.772 . 0 0 "[ . 1 . 2]" 1
509 1 34 ILE H 1 35 GLY QA 5.940 . 5.940 4.537 4.418 4.617 . 0 0 "[ . 1 . 2]" 1
510 1 34 ILE HA 1 34 ILE MD 4.350 . 4.350 3.905 3.868 3.949 . 0 0 "[ . 1 . 2]" 1
511 1 34 ILE HA 1 34 ILE HG12 4.340 . 4.340 2.620 2.552 2.716 . 0 0 "[ . 1 . 2]" 1
512 1 34 ILE HA 1 34 ILE QG 3.750 . 3.750 2.454 2.401 2.521 . 0 0 "[ . 1 . 2]" 1
513 1 34 ILE HA 1 34 ILE HG13 4.340 . 4.340 2.965 2.898 3.033 . 0 0 "[ . 1 . 2]" 1
514 1 34 ILE HA 1 37 GLU H 4.540 . 4.540 3.484 3.225 3.733 . 0 0 "[ . 1 . 2]" 1
515 1 34 ILE HB 1 35 GLY H 4.000 . 4.000 2.637 2.471 2.832 . 0 0 "[ . 1 . 2]" 1
516 1 34 ILE HB 1 50 TYR QD 3.790 . 3.790 3.453 3.217 3.705 . 0 0 "[ . 1 . 2]" 1
517 1 34 ILE MD 1 34 ILE MG 3.220 . 3.220 2.027 1.962 2.084 . 0 0 "[ . 1 . 2]" 1
518 1 34 ILE MD 1 35 GLY H 4.970 . 4.970 4.617 4.434 4.768 . 0 0 "[ . 1 . 2]" 1
519 1 34 ILE MD 1 50 TYR QD 4.110 . 4.110 3.576 3.155 3.926 . 0 0 "[ . 1 . 2]" 1
520 1 34 ILE MD 1 50 TYR QE 3.280 . 3.280 3.193 2.766 3.392 0.112 4 0 "[ . 1 . 2]" 1
521 1 34 ILE QG 1 35 GLY H 5.420 . 5.420 4.105 4.043 4.177 . 0 0 "[ . 1 . 2]" 1
522 1 34 ILE MG 1 35 GLY H 4.670 . 4.670 3.377 3.150 3.609 . 0 0 "[ . 1 . 2]" 1
523 1 34 ILE MG 1 35 GLY QA 4.950 . 4.950 3.345 3.143 3.567 . 0 0 "[ . 1 . 2]" 1
524 1 34 ILE MG 1 37 GLU H 5.340 . 5.340 4.659 4.512 4.825 . 0 0 "[ . 1 . 2]" 1
525 1 34 ILE MG 1 38 LYS H 4.980 . 4.980 4.045 3.881 4.288 . 0 0 "[ . 1 . 2]" 1
526 1 34 ILE MG 1 38 LYS QB 6.080 . 6.080 4.129 3.787 4.357 . 0 0 "[ . 1 . 2]" 1
527 1 34 ILE MG 1 38 LYS QD 4.650 . 4.650 3.460 2.199 4.363 . 0 0 "[ . 1 . 2]" 1
528 1 34 ILE MG 1 38 LYS HE2 4.470 . 4.470 2.776 2.150 4.091 . 0 0 "[ . 1 . 2]" 1
529 1 34 ILE MG 1 38 LYS QE 3.850 . 3.850 2.567 2.105 3.253 . 0 0 "[ . 1 . 2]" 1
530 1 34 ILE MG 1 38 LYS HE3 4.470 . 4.470 3.227 2.663 3.910 . 0 0 "[ . 1 . 2]" 1
531 1 34 ILE MG 1 38 LYS HG2 4.920 . 4.920 3.130 2.340 4.574 . 0 0 "[ . 1 . 2]" 1
532 1 34 ILE MG 1 38 LYS HG3 4.920 . 4.920 3.668 2.786 4.931 0.011 14 0 "[ . 1 . 2]" 1
533 1 34 ILE MG 1 50 TYR QD 4.040 . 4.040 3.075 2.838 3.339 . 0 0 "[ . 1 . 2]" 1
534 1 34 ILE MG 1 50 TYR QE 3.430 . 3.430 2.810 2.715 2.945 . 0 0 "[ . 1 . 2]" 1
535 1 35 GLY H 1 36 LEU H 4.140 . 4.140 2.713 2.665 2.770 . 0 0 "[ . 1 . 2]" 1
536 1 35 GLY H 1 36 LEU HB2 6.300 . 6.300 4.880 4.798 4.987 . 0 0 "[ . 1 . 2]" 1
537 1 35 GLY H 1 50 TYR HB2 4.950 . 4.950 3.663 3.456 3.870 . 0 0 "[ . 1 . 2]" 1
538 1 35 GLY H 1 50 TYR HB3 4.350 . 4.350 3.021 2.859 3.230 . 0 0 "[ . 1 . 2]" 1
539 1 35 GLY H 1 50 TYR QD 5.270 . 5.270 4.307 4.134 4.469 . 0 0 "[ . 1 . 2]" 1
540 1 35 GLY H 1 51 PHE QD 6.040 . 6.040 4.624 4.424 4.796 . 0 0 "[ . 1 . 2]" 1
541 1 35 GLY H 1 51 PHE QE 6.260 . 6.260 4.029 3.835 4.203 . 0 0 "[ . 1 . 2]" 1
542 1 35 GLY QA 1 38 LYS H 5.160 . 5.160 3.379 3.246 3.600 . 0 0 "[ . 1 . 2]" 1
543 1 35 GLY QA 1 38 LYS QB 4.970 . 4.970 2.614 2.343 2.895 . 0 0 "[ . 1 . 2]" 1
544 1 35 GLY QA 1 47 ALA HA 3.760 . 3.760 2.119 1.952 2.475 . 0 0 "[ . 1 . 2]" 1
545 1 35 GLY QA 1 47 ALA MB 4.390 . 4.390 3.009 2.824 3.505 . 0 0 "[ . 1 . 2]" 1
546 1 35 GLY QA 1 50 TYR H 5.100 . 5.100 4.126 4.004 4.295 . 0 0 "[ . 1 . 2]" 1
547 1 35 GLY QA 1 51 PHE QD 4.150 . 4.150 3.401 3.220 3.637 . 0 0 "[ . 1 . 2]" 1
548 1 35 GLY QA 1 51 PHE QE 4.000 . 4.000 2.851 2.697 3.006 . 0 0 "[ . 1 . 2]" 1
549 1 35 GLY QA 1 51 PHE HZ 4.410 . 4.410 3.640 3.400 4.155 . 0 0 "[ . 1 . 2]" 1
550 1 35 GLY HA2 1 47 ALA HA 4.360 . 4.360 2.156 1.974 2.558 . 0 0 "[ . 1 . 2]" 1
551 1 35 GLY HA2 1 47 ALA MB 5.040 . 5.040 3.228 3.023 3.823 . 0 0 "[ . 1 . 2]" 1
552 1 35 GLY HA2 1 50 TYR H 6.020 . 6.020 4.525 4.338 4.746 . 0 0 "[ . 1 . 2]" 1
553 1 35 GLY HA2 1 50 TYR HB2 4.980 . 4.980 2.602 2.389 2.757 . 0 0 "[ . 1 . 2]" 1
554 1 35 GLY HA3 1 47 ALA HA 4.360 . 4.360 3.136 2.971 3.317 . 0 0 "[ . 1 . 2]" 1
555 1 35 GLY HA3 1 47 ALA MB 5.040 . 5.040 3.597 3.389 4.073 . 0 0 "[ . 1 . 2]" 1
556 1 35 GLY HA3 1 50 TYR H 6.020 . 6.020 4.763 4.556 4.937 . 0 0 "[ . 1 . 2]" 1
557 1 35 GLY HA3 1 50 TYR HB2 4.980 . 4.980 2.723 2.452 2.924 . 0 0 "[ . 1 . 2]" 1
558 1 36 LEU H 1 36 LEU HB2 3.760 . 3.760 2.509 2.450 2.595 . 0 0 "[ . 1 . 2]" 1
559 1 36 LEU H 1 36 LEU MD1 4.120 . 4.120 3.655 3.569 3.735 . 0 0 "[ . 1 . 2]" 1
560 1 36 LEU H 1 36 LEU MD2 4.680 . 4.680 3.368 3.093 3.504 . 0 0 "[ . 1 . 2]" 1
561 1 36 LEU H 1 36 LEU HG 3.510 . 3.510 2.341 2.182 2.448 . 0 0 "[ . 1 . 2]" 1
562 1 36 LEU H 1 37 GLU H 3.950 . 3.950 2.671 2.586 2.767 . 0 0 "[ . 1 . 2]" 1
563 1 36 LEU H 1 51 PHE QE 3.910 . 3.910 2.838 2.537 3.124 . 0 0 "[ . 1 . 2]" 1
564 1 36 LEU HA 1 36 LEU MD2 3.220 . 3.220 2.099 2.063 2.156 . 0 0 "[ . 1 . 2]" 1
565 1 36 LEU HA 1 39 ASN H 4.450 . 4.450 3.464 3.276 3.743 . 0 0 "[ . 1 . 2]" 1
566 1 36 LEU HA 1 39 ASN HB2 4.230 . 4.230 3.075 2.704 3.427 . 0 0 "[ . 1 . 2]" 1
567 1 36 LEU HA 1 39 ASN HB3 4.180 . 4.180 2.699 2.331 3.128 . 0 0 "[ . 1 . 2]" 1
568 1 36 LEU HA 1 39 ASN HD21 5.000 . 5.000 3.777 3.181 5.006 0.006 14 0 "[ . 1 . 2]" 1
569 1 36 LEU HA 1 47 ALA MB 4.810 . 4.810 4.110 3.856 4.261 . 0 0 "[ . 1 . 2]" 1
570 1 36 LEU HA 1 51 PHE QE 4.350 . 4.350 3.523 3.038 3.951 . 0 0 "[ . 1 . 2]" 1
571 1 36 LEU HA 1 51 PHE HZ 3.460 . 3.460 2.563 2.274 2.851 . 0 0 "[ . 1 . 2]" 1
572 1 36 LEU HB2 1 36 LEU MD1 3.090 . 3.090 2.358 2.334 2.420 . 0 0 "[ . 1 . 2]" 1
573 1 36 LEU HB2 1 37 GLU H 3.550 . 3.550 2.715 2.557 2.894 . 0 0 "[ . 1 . 2]" 1
574 1 36 LEU HB3 1 36 LEU MD2 3.430 . 3.430 2.446 2.414 2.499 . 0 0 "[ . 1 . 2]" 1
575 1 36 LEU HB3 1 37 GLU H 4.410 . 4.410 3.714 3.503 3.847 . 0 0 "[ . 1 . 2]" 1
576 1 36 LEU MD1 1 37 GLU H 5.200 . 5.200 4.626 4.489 4.772 . 0 0 "[ . 1 . 2]" 1
577 1 36 LEU MD1 1 51 PHE QE 3.890 . 3.890 3.935 3.768 4.034 0.144 8 0 "[ . 1 . 2]" 1
578 1 36 LEU MD1 1 51 PHE HZ 4.870 . 4.870 4.788 4.545 4.913 0.043 8 0 "[ . 1 . 2]" 1
579 1 36 LEU MD2 1 37 GLU H 5.730 . 5.730 4.748 4.622 4.834 . 0 0 "[ . 1 . 2]" 1
580 1 36 LEU MD2 1 39 ASN HD21 5.230 . 5.230 3.592 2.745 5.088 . 0 0 "[ . 1 . 2]" 1
581 1 36 LEU MD2 1 39 ASN HD22 5.510 . 5.510 4.691 3.933 5.607 0.097 8 0 "[ . 1 . 2]" 1
582 1 36 LEU MD2 1 51 PHE QE 3.660 . 3.660 2.594 2.193 2.847 . 0 0 "[ . 1 . 2]" 1
583 1 36 LEU MD2 1 51 PHE HZ 3.300 . 3.300 2.090 1.959 2.217 . 0 0 "[ . 1 . 2]" 1
584 1 36 LEU HG 1 51 PHE QE 3.840 . 3.840 2.450 2.222 2.732 . 0 0 "[ . 1 . 2]" 1
585 1 36 LEU HG 1 51 PHE HZ 4.390 . 4.390 3.678 3.283 4.027 . 0 0 "[ . 1 . 2]" 1
586 1 37 GLU H 1 37 GLU QB 3.870 . 3.870 2.518 2.375 2.656 . 0 0 "[ . 1 . 2]" 1
587 1 37 GLU H 1 37 GLU HG2 4.280 . 4.280 2.353 2.189 3.350 . 0 0 "[ . 1 . 2]" 1
588 1 37 GLU H 1 37 GLU QG 3.620 . 3.620 2.293 2.173 2.523 . 0 0 "[ . 1 . 2]" 1
589 1 37 GLU H 1 37 GLU HG3 4.280 . 4.280 3.694 2.609 3.883 . 0 0 "[ . 1 . 2]" 1
590 1 37 GLU H 1 38 LYS H 3.760 . 3.760 2.650 2.518 2.748 . 0 0 "[ . 1 . 2]" 1
591 1 37 GLU HA 1 40 LYS QD 4.790 . 4.790 2.852 1.740 4.654 . 0 0 "[ . 1 . 2]" 1
592 1 37 GLU HA 1 40 LYS QE 5.160 . 5.160 3.032 1.532 4.473 . 0 0 "[ . 1 . 2]" 1
593 1 37 GLU HA 1 40 LYS HG2 4.690 . 4.690 2.794 1.723 4.806 0.116 10 0 "[ . 1 . 2]" 1
594 1 37 GLU HA 1 40 LYS QG 4.130 . 4.130 2.457 1.712 3.402 . 0 0 "[ . 1 . 2]" 1
595 1 37 GLU HA 1 40 LYS HG3 4.690 . 4.690 3.453 2.476 4.688 . 0 0 "[ . 1 . 2]" 1
596 1 37 GLU QB 1 38 LYS H 3.870 . 3.870 2.622 2.424 3.001 . 0 0 "[ . 1 . 2]" 1
597 1 37 GLU HB2 1 38 LYS H 4.800 . 4.800 2.679 2.467 3.106 . 0 0 "[ . 1 . 2]" 1
598 1 37 GLU HB3 1 38 LYS H 4.800 . 4.800 3.743 3.559 3.971 . 0 0 "[ . 1 . 2]" 1
599 1 37 GLU QG 1 38 LYS H 5.740 . 5.740 4.067 3.873 4.282 . 0 0 "[ . 1 . 2]" 1
600 1 38 LYS H 1 38 LYS QB 3.550 . 3.550 2.360 2.135 2.586 . 0 0 "[ . 1 . 2]" 1
601 1 38 LYS H 1 38 LYS HD2 5.280 . 5.280 4.153 2.473 4.860 . 0 0 "[ . 1 . 2]" 1
602 1 38 LYS H 1 38 LYS QD 4.570 . 4.570 3.300 2.344 3.844 . 0 0 "[ . 1 . 2]" 1
603 1 38 LYS H 1 38 LYS HD3 5.280 . 5.280 3.505 2.492 4.029 . 0 0 "[ . 1 . 2]" 1
604 1 38 LYS H 1 38 LYS HG2 4.630 . 4.630 2.900 2.186 4.204 . 0 0 "[ . 1 . 2]" 1
605 1 38 LYS H 1 38 LYS QG 4.000 . 4.000 2.731 2.168 3.725 . 0 0 "[ . 1 . 2]" 1
606 1 38 LYS H 1 38 LYS HG3 4.630 . 4.630 3.803 3.600 4.248 . 0 0 "[ . 1 . 2]" 1
607 1 38 LYS H 1 39 ASN H 3.730 . 3.730 2.635 2.474 2.803 . 0 0 "[ . 1 . 2]" 1
608 1 38 LYS H 1 39 ASN HB2 6.300 . 6.300 4.771 4.606 5.003 . 0 0 "[ . 1 . 2]" 1
609 1 38 LYS H 1 47 ALA MB 4.940 . 4.940 4.046 3.876 4.224 . 0 0 "[ . 1 . 2]" 1
610 1 38 LYS HA 1 38 LYS QD 3.730 . 3.730 2.325 2.071 3.142 . 0 0 "[ . 1 . 2]" 1
611 1 38 LYS HA 1 38 LYS QG 3.930 . 3.930 2.799 2.339 3.082 . 0 0 "[ . 1 . 2]" 1
612 1 38 LYS HA 1 41 MET H 4.670 . 4.670 3.601 3.450 3.756 . 0 0 "[ . 1 . 2]" 1
613 1 38 LYS HA 1 41 MET HB2 5.150 . 5.150 2.901 2.362 4.885 . 0 0 "[ . 1 . 2]" 1
614 1 38 LYS HA 1 41 MET QB 4.290 . 4.290 2.834 2.343 4.111 . 0 0 "[ . 1 . 2]" 1
615 1 38 LYS HA 1 41 MET HB3 5.150 . 5.150 4.408 3.899 4.884 . 0 0 "[ . 1 . 2]" 1
616 1 38 LYS HA 1 41 MET ME 3.830 . 3.830 2.685 1.892 4.105 0.275 3 0 "[ . 1 . 2]" 1
617 1 38 LYS HA 1 41 MET HG2 5.190 . 5.190 4.968 2.083 5.317 0.127 20 0 "[ . 1 . 2]" 1
618 1 38 LYS HA 1 41 MET QG 4.530 . 4.530 3.640 2.046 4.063 . 0 0 "[ . 1 . 2]" 1
619 1 38 LYS HA 1 41 MET HG3 5.190 . 5.190 3.786 2.997 4.241 . 0 0 "[ . 1 . 2]" 1
620 1 38 LYS HA 1 43 LYS H 5.370 . 5.370 3.942 3.735 4.140 . 0 0 "[ . 1 . 2]" 1
621 1 38 LYS HA 1 43 LYS QB 4.610 . 4.610 2.732 2.472 3.405 . 0 0 "[ . 1 . 2]" 1
622 1 38 LYS QB 1 39 ASN H 3.920 . 3.920 2.582 2.387 2.743 . 0 0 "[ . 1 . 2]" 1
623 1 38 LYS QB 1 39 ASN HA 4.760 . 4.760 3.818 3.724 3.906 . 0 0 "[ . 1 . 2]" 1
624 1 38 LYS QB 1 47 ALA HA 4.190 . 4.190 2.515 2.228 2.752 . 0 0 "[ . 1 . 2]" 1
625 1 38 LYS QB 1 47 ALA MB 3.560 . 3.560 2.156 1.966 2.458 . 0 0 "[ . 1 . 2]" 1
626 1 38 LYS HB2 1 47 ALA H 4.490 . 4.490 3.476 3.077 3.847 . 0 0 "[ . 1 . 2]" 1
627 1 38 LYS HB3 1 47 ALA H 4.490 . 4.490 2.853 2.698 3.219 . 0 0 "[ . 1 . 2]" 1
628 1 38 LYS QE 1 46 GLU QB 5.620 . 5.620 2.883 2.385 4.152 . 0 0 "[ . 1 . 2]" 1
629 1 38 LYS QE 1 50 TYR QE 3.320 . 3.320 2.070 1.705 3.245 . 0 0 "[ . 1 . 2]" 1
630 1 38 LYS HE2 1 50 TYR QE 3.940 . 3.940 3.442 3.061 4.140 0.200 8 0 "[ . 1 . 2]" 1
631 1 38 LYS HE3 1 50 TYR QE 3.940 . 3.940 2.094 1.713 3.391 . 0 0 "[ . 1 . 2]" 1
632 1 39 ASN H 1 39 ASN HB2 3.510 . 3.510 2.381 2.311 2.495 . 0 0 "[ . 1 . 2]" 1
633 1 39 ASN H 1 39 ASN HB3 3.760 . 3.760 2.645 2.529 2.764 . 0 0 "[ . 1 . 2]" 1
634 1 39 ASN H 1 40 LYS H 3.860 . 3.860 2.695 2.590 2.807 . 0 0 "[ . 1 . 2]" 1
635 1 39 ASN H 1 41 MET H 5.100 . 5.100 4.018 3.784 4.196 . 0 0 "[ . 1 . 2]" 1
636 1 39 ASN H 1 47 ALA MB 3.900 . 3.900 2.715 2.583 2.912 . 0 0 "[ . 1 . 2]" 1
637 1 39 ASN HA 1 41 MET H 5.230 . 5.230 4.256 4.137 4.388 . 0 0 "[ . 1 . 2]" 1
638 1 39 ASN HA 1 42 GLY H 4.850 . 4.850 3.741 3.483 4.021 . 0 0 "[ . 1 . 2]" 1
639 1 39 ASN HA 1 43 LYS H 4.750 . 4.750 4.078 3.715 4.432 . 0 0 "[ . 1 . 2]" 1
640 1 39 ASN HA 1 44 VAL H 5.710 . 5.710 4.241 3.804 4.597 . 0 0 "[ . 1 . 2]" 1
641 1 39 ASN HA 1 44 VAL HA 4.400 . 4.400 2.653 2.207 3.274 . 0 0 "[ . 1 . 2]" 1
642 1 39 ASN HA 1 44 VAL MG2 4.130 . 4.130 2.488 1.933 3.418 . 0 0 "[ . 1 . 2]" 1
643 1 39 ASN HA 1 47 ALA MB 3.940 . 3.940 2.782 2.581 2.985 . 0 0 "[ . 1 . 2]" 1
644 1 39 ASN HB2 1 40 LYS H 4.380 . 4.380 3.838 3.676 4.034 . 0 0 "[ . 1 . 2]" 1
645 1 39 ASN HB2 1 47 ALA MB 3.800 . 3.800 2.291 2.021 2.595 . 0 0 "[ . 1 . 2]" 1
646 1 39 ASN HB2 1 51 PHE QE 5.130 . 5.130 3.406 3.081 3.721 . 0 0 "[ . 1 . 2]" 1
647 1 39 ASN HB2 1 51 PHE HZ 4.840 . 4.840 3.039 2.646 3.423 . 0 0 "[ . 1 . 2]" 1
648 1 39 ASN HB3 1 40 LYS H 3.980 . 3.980 2.679 2.517 2.926 . 0 0 "[ . 1 . 2]" 1
649 1 39 ASN HB3 1 47 ALA MB 4.270 . 4.270 3.698 3.424 3.995 . 0 0 "[ . 1 . 2]" 1
650 1 39 ASN HB3 1 51 PHE QE 5.210 . 5.210 4.568 4.254 4.884 . 0 0 "[ . 1 . 2]" 1
651 1 39 ASN HB3 1 51 PHE HZ 4.880 . 4.880 3.769 3.301 4.235 . 0 0 "[ . 1 . 2]" 1
652 1 39 ASN HD21 1 51 PHE QE 5.260 . 5.260 2.923 1.643 4.266 . 0 0 "[ . 1 . 2]" 1
653 1 39 ASN HD21 1 51 PHE HZ 4.440 . 4.440 2.985 1.889 3.757 . 0 0 "[ . 1 . 2]" 1
654 1 39 ASN HD22 1 44 VAL MG1 5.550 . 5.550 3.784 2.103 5.551 0.001 1 0 "[ . 1 . 2]" 1
655 1 39 ASN HD22 1 51 PHE QE 4.710 . 4.710 3.783 2.726 4.704 . 0 0 "[ . 1 . 2]" 1
656 1 39 ASN HD22 1 51 PHE HZ 4.970 . 4.970 4.441 3.549 4.936 . 0 0 "[ . 1 . 2]" 1
657 1 39 ASN HD22 1 77 ALA MB 5.170 . 5.170 3.382 2.308 4.584 . 0 0 "[ . 1 . 2]" 1
658 1 40 LYS H 1 40 LYS HB2 4.110 . 4.110 3.251 2.288 3.679 . 0 0 "[ . 1 . 2]" 1
659 1 40 LYS H 1 40 LYS QB 3.600 . 3.600 2.520 2.263 2.643 . 0 0 "[ . 1 . 2]" 1
660 1 40 LYS H 1 40 LYS HB3 4.110 . 4.110 2.965 2.386 3.657 . 0 0 "[ . 1 . 2]" 1
661 1 40 LYS H 1 40 LYS QD 5.120 . 5.120 3.939 2.431 4.491 . 0 0 "[ . 1 . 2]" 1
662 1 40 LYS H 1 40 LYS HG2 4.730 . 4.730 2.612 2.126 4.128 . 0 0 "[ . 1 . 2]" 1
663 1 40 LYS H 1 40 LYS HG3 4.730 . 4.730 3.277 2.116 4.014 . 0 0 "[ . 1 . 2]" 1
664 1 40 LYS H 1 41 MET H 3.510 . 3.510 2.564 2.499 2.672 . 0 0 "[ . 1 . 2]" 1
665 1 40 LYS HA 1 40 LYS QD 5.070 . 5.070 4.153 2.131 4.632 . 0 0 "[ . 1 . 2]" 1
666 1 40 LYS HA 1 40 LYS QE 6.100 . 6.100 4.454 4.014 5.538 . 0 0 "[ . 1 . 2]" 1
667 1 40 LYS HA 1 40 LYS QG 3.600 . 3.600 3.127 2.402 3.401 . 0 0 "[ . 1 . 2]" 1
668 1 40 LYS HA 1 42 GLY H 5.290 . 5.290 3.726 3.434 4.002 . 0 0 "[ . 1 . 2]" 1
669 1 40 LYS HB2 1 41 MET H 4.470 . 4.470 3.667 2.571 4.306 . 0 0 "[ . 1 . 2]" 1
670 1 40 LYS HB3 1 41 MET H 4.470 . 4.470 4.013 3.444 4.290 . 0 0 "[ . 1 . 2]" 1
671 1 40 LYS QD 1 41 MET H 6.300 . 6.300 4.720 4.320 5.634 . 0 0 "[ . 1 . 2]" 1
672 1 40 LYS QG 1 41 MET H 5.550 . 5.550 3.157 2.486 4.640 . 0 0 "[ . 1 . 2]" 1
673 1 41 MET H 1 41 MET HB2 4.130 . 4.130 2.495 2.336 3.686 . 0 0 "[ . 1 . 2]" 1
674 1 41 MET H 1 41 MET QB 3.460 . 3.460 2.413 2.308 2.712 . 0 0 "[ . 1 . 2]" 1
675 1 41 MET H 1 41 MET HB3 4.130 . 4.130 3.592 2.792 3.662 . 0 0 "[ . 1 . 2]" 1
676 1 41 MET H 1 41 MET ME 4.740 . 4.740 4.050 3.533 4.793 0.053 9 0 "[ . 1 . 2]" 1
677 1 41 MET H 1 41 MET HG2 4.340 . 4.340 3.667 2.010 4.058 . 0 0 "[ . 1 . 2]" 1
678 1 41 MET H 1 41 MET HG3 4.340 . 4.340 2.668 2.238 3.340 . 0 0 "[ . 1 . 2]" 1
679 1 41 MET H 1 42 GLY H 3.590 . 3.590 2.537 2.427 2.635 . 0 0 "[ . 1 . 2]" 1
680 1 41 MET H 1 42 GLY QA 5.960 . 5.960 4.455 4.349 4.547 . 0 0 "[ . 1 . 2]" 1
681 1 41 MET H 1 43 LYS H 4.440 . 4.440 3.575 3.384 3.888 . 0 0 "[ . 1 . 2]" 1
682 1 41 MET HA 1 41 MET ME 4.610 . 4.610 4.404 4.079 4.615 0.005 15 0 "[ . 1 . 2]" 1
683 1 41 MET HA 1 41 MET HG2 4.330 . 4.330 2.623 2.459 3.737 . 0 0 "[ . 1 . 2]" 1
684 1 41 MET HA 1 41 MET QG 3.770 . 3.770 2.482 2.365 3.374 . 0 0 "[ . 1 . 2]" 1
685 1 41 MET HA 1 41 MET HG3 4.330 . 4.330 3.107 2.835 3.844 . 0 0 "[ . 1 . 2]" 1
686 1 41 MET QB 1 43 LYS H 4.740 . 4.740 2.835 2.514 3.963 . 0 0 "[ . 1 . 2]" 1
687 1 41 MET QB 1 43 LYS QG 4.350 . 4.350 2.758 2.231 3.939 . 0 0 "[ . 1 . 2]" 1
688 1 41 MET HB2 1 43 LYS QG 4.960 . 4.960 3.122 2.520 4.185 . 0 0 "[ . 1 . 2]" 1
689 1 41 MET HB3 1 43 LYS QG 4.960 . 4.960 3.131 2.428 4.972 0.012 3 0 "[ . 1 . 2]" 1
690 1 41 MET ME 1 43 LYS HE2 4.180 . 4.180 3.653 1.784 4.365 0.185 12 0 "[ . 1 . 2]" 1
691 1 41 MET ME 1 43 LYS QE 3.600 . 3.600 2.842 1.772 3.438 . 0 0 "[ . 1 . 2]" 1
692 1 41 MET ME 1 43 LYS HE3 4.180 . 4.180 3.121 2.345 4.279 0.099 13 0 "[ . 1 . 2]" 1
693 1 41 MET ME 1 43 LYS QG 5.050 . 5.050 3.255 2.861 3.559 . 0 0 "[ . 1 . 2]" 1
694 1 42 GLY QA 1 44 VAL H 6.100 . 6.100 3.655 3.395 3.932 . 0 0 "[ . 1 . 2]" 1
695 1 42 GLY QA 1 44 VAL MG2 4.210 . 4.210 2.547 2.171 3.042 . 0 0 "[ . 1 . 2]" 1
696 1 43 LYS H 1 43 LYS HB2 4.190 . 4.190 2.483 2.346 2.576 . 0 0 "[ . 1 . 2]" 1
697 1 43 LYS H 1 43 LYS QB 3.510 . 3.510 2.443 2.317 2.526 . 0 0 "[ . 1 . 2]" 1
698 1 43 LYS H 1 43 LYS HB3 4.190 . 4.190 3.637 3.582 3.699 . 0 0 "[ . 1 . 2]" 1
699 1 43 LYS H 1 43 LYS QD 4.910 . 4.910 3.844 2.107 4.569 . 0 0 "[ . 1 . 2]" 1
700 1 43 LYS H 1 43 LYS QG 3.870 . 3.870 2.537 2.217 3.507 . 0 0 "[ . 1 . 2]" 1
701 1 43 LYS H 1 44 VAL H 4.570 . 4.570 3.525 3.251 3.733 . 0 0 "[ . 1 . 2]" 1
702 1 43 LYS H 1 44 VAL MG2 4.770 . 4.770 3.766 3.458 4.167 . 0 0 "[ . 1 . 2]" 1
703 1 43 LYS HA 1 43 LYS QG 3.970 . 3.970 2.490 2.397 2.601 . 0 0 "[ . 1 . 2]" 1
704 1 43 LYS HA 1 44 VAL H 3.290 . 3.290 2.457 2.315 2.578 . 0 0 "[ . 1 . 2]" 1
705 1 43 LYS HA 1 44 VAL MG2 4.920 . 4.920 3.991 3.836 4.142 . 0 0 "[ . 1 . 2]" 1
706 1 43 LYS HA 1 45 LYS H 4.850 . 4.850 3.473 3.135 3.751 . 0 0 "[ . 1 . 2]" 1
707 1 43 LYS QB 1 43 LYS QD 3.480 . 3.480 2.212 2.151 2.390 . 0 0 "[ . 1 . 2]" 1
708 1 43 LYS QB 1 44 VAL H 4.330 . 4.330 3.900 3.856 3.933 . 0 0 "[ . 1 . 2]" 1
709 1 43 LYS QG 1 44 VAL H 4.770 . 4.770 4.501 4.413 4.746 . 0 0 "[ . 1 . 2]" 1
710 1 44 VAL H 1 44 VAL HB 3.290 . 3.290 2.565 2.442 2.757 . 0 0 "[ . 1 . 2]" 1
711 1 44 VAL H 1 44 VAL MG2 3.100 . 3.100 2.029 1.883 2.148 . 0 0 "[ . 1 . 2]" 1
712 1 44 VAL H 1 45 LYS H 3.630 . 3.630 2.551 2.410 2.634 . 0 0 "[ . 1 . 2]" 1
713 1 44 VAL H 1 45 LYS QD 5.680 . 5.680 3.780 2.477 5.706 0.026 13 0 "[ . 1 . 2]" 1
714 1 44 VAL HA 1 44 VAL MG1 3.450 . 3.450 2.432 2.350 2.513 . 0 0 "[ . 1 . 2]" 1
715 1 44 VAL HA 1 44 VAL MG2 3.270 . 3.270 2.488 2.432 2.586 . 0 0 "[ . 1 . 2]" 1
716 1 44 VAL HA 1 46 GLU H 5.230 . 5.230 4.392 4.115 4.648 . 0 0 "[ . 1 . 2]" 1
717 1 44 VAL HA 1 47 ALA H 4.090 . 4.090 3.166 2.818 3.522 . 0 0 "[ . 1 . 2]" 1
718 1 44 VAL HA 1 47 ALA MB 3.320 . 3.320 2.134 1.927 2.522 . 0 0 "[ . 1 . 2]" 1
719 1 44 VAL HA 1 48 ILE H 5.000 . 5.000 4.063 3.821 4.352 . 0 0 "[ . 1 . 2]" 1
720 1 44 VAL HB 1 45 LYS H 3.640 . 3.640 3.020 2.572 3.203 . 0 0 "[ . 1 . 2]" 1
721 1 44 VAL MG1 1 45 LYS H 4.390 . 4.390 3.847 3.396 4.100 . 0 0 "[ . 1 . 2]" 1
722 1 44 VAL MG1 1 45 LYS HA 4.590 . 4.590 3.924 3.400 4.321 . 0 0 "[ . 1 . 2]" 1
723 1 44 VAL MG1 1 47 ALA H 5.250 . 5.250 4.506 4.201 4.764 . 0 0 "[ . 1 . 2]" 1
724 1 44 VAL MG1 1 48 ILE H 5.060 . 5.060 3.850 3.574 4.261 . 0 0 "[ . 1 . 2]" 1
725 1 44 VAL MG1 1 48 ILE QG 5.060 . 5.060 2.694 2.429 3.076 . 0 0 "[ . 1 . 2]" 1
726 1 44 VAL MG1 1 77 ALA H 5.780 . 5.780 4.514 4.332 4.700 . 0 0 "[ . 1 . 2]" 1
727 1 44 VAL MG1 1 77 ALA HA 3.960 . 3.960 2.403 2.100 2.804 . 0 0 "[ . 1 . 2]" 1
728 1 44 VAL MG1 1 77 ALA MB 3.300 . 3.300 2.108 1.883 2.339 . 0 0 "[ . 1 . 2]" 1
729 1 44 VAL MG1 1 80 LYS H 6.260 . 6.260 3.767 3.289 4.545 . 0 0 "[ . 1 . 2]" 1
730 1 44 VAL MG1 1 80 LYS QB 4.700 . 4.700 2.141 1.666 4.269 . 0 0 "[ . 1 . 2]" 1
731 1 44 VAL MG1 1 80 LYS QD 4.120 . 4.120 2.708 2.046 3.464 . 0 0 "[ . 1 . 2]" 1
732 1 44 VAL MG1 1 81 VAL H 6.300 . 6.300 3.488 3.039 4.178 . 0 0 "[ . 1 . 2]" 1
733 1 44 VAL MG2 1 45 LYS H 4.680 . 4.680 3.922 3.817 3.985 . 0 0 "[ . 1 . 2]" 1
734 1 44 VAL MG2 1 77 ALA HA 5.950 . 5.950 4.058 3.784 4.453 . 0 0 "[ . 1 . 2]" 1
735 1 44 VAL MG2 1 80 LYS QB 5.430 . 5.430 2.437 2.037 3.787 . 0 0 "[ . 1 . 2]" 1
736 1 44 VAL MG2 1 80 LYS QD 3.800 . 3.800 2.570 2.013 3.896 0.096 11 0 "[ . 1 . 2]" 1
737 1 44 VAL MG2 1 80 LYS QE 5.020 . 5.020 3.882 1.940 4.678 . 0 0 "[ . 1 . 2]" 1
738 1 45 LYS H 1 45 LYS HB2 3.260 . 3.260 2.481 2.340 2.675 . 0 0 "[ . 1 . 2]" 1
739 1 45 LYS H 1 45 LYS HB3 3.740 . 3.740 3.626 3.585 3.682 . 0 0 "[ . 1 . 2]" 1
740 1 45 LYS H 1 45 LYS QD 4.690 . 4.690 2.366 1.529 3.806 . 0 0 "[ . 1 . 2]" 1
741 1 45 LYS H 1 45 LYS HG2 4.490 . 4.490 3.649 2.210 4.065 . 0 0 "[ . 1 . 2]" 1
742 1 45 LYS H 1 45 LYS QG 3.650 . 3.650 3.059 2.067 3.495 . 0 0 "[ . 1 . 2]" 1
743 1 45 LYS H 1 45 LYS HG3 4.490 . 4.490 3.486 2.088 3.918 . 0 0 "[ . 1 . 2]" 1
744 1 45 LYS H 1 46 GLU H 3.490 . 3.490 2.678 2.513 2.927 . 0 0 "[ . 1 . 2]" 1
745 1 45 LYS H 1 48 ILE MD 6.140 . 6.140 4.532 4.181 4.915 . 0 0 "[ . 1 . 2]" 1
746 1 45 LYS H 1 48 ILE QG 5.690 . 5.690 4.890 4.539 5.063 . 0 0 "[ . 1 . 2]" 1
747 1 45 LYS HA 1 45 LYS QD 4.290 . 4.290 2.964 2.060 4.097 . 0 0 "[ . 1 . 2]" 1
748 1 45 LYS HA 1 45 LYS QG 3.770 . 3.770 2.571 2.427 3.045 . 0 0 "[ . 1 . 2]" 1
749 1 45 LYS HA 1 47 ALA H 5.170 . 5.170 4.435 4.247 4.693 . 0 0 "[ . 1 . 2]" 1
750 1 45 LYS HA 1 48 ILE H 4.430 . 4.430 3.745 3.384 4.379 . 0 0 "[ . 1 . 2]" 1
751 1 45 LYS HA 1 48 ILE HB 4.230 . 4.230 3.225 2.921 3.838 . 0 0 "[ . 1 . 2]" 1
752 1 45 LYS HA 1 48 ILE MD 3.650 . 3.650 2.402 1.858 3.074 . 0 0 "[ . 1 . 2]" 1
753 1 45 LYS HA 1 81 VAL MG1 4.780 . 4.780 4.304 3.362 4.961 0.181 1 0 "[ . 1 . 2]" 1
754 1 45 LYS HA 1 81 VAL MG2 4.110 . 4.110 3.258 2.442 3.876 . 0 0 "[ . 1 . 2]" 1
755 1 45 LYS HB2 1 46 GLU H 3.620 . 3.620 2.608 2.271 2.883 . 0 0 "[ . 1 . 2]" 1
756 1 45 LYS QD 1 46 GLU H 4.630 . 4.630 4.163 3.478 4.753 0.123 6 0 "[ . 1 . 2]" 1
757 1 45 LYS QE 1 81 VAL MG1 4.430 . 4.430 2.589 1.654 4.509 0.079 15 0 "[ . 1 . 2]" 1
758 1 45 LYS QE 1 81 VAL MG2 5.600 . 5.600 2.979 1.904 4.768 . 0 0 "[ . 1 . 2]" 1
759 1 45 LYS QG 1 46 GLU H 5.250 . 5.250 4.385 3.930 4.643 . 0 0 "[ . 1 . 2]" 1
760 1 46 GLU H 1 46 GLU QB 3.350 . 3.350 2.498 2.392 2.630 . 0 0 "[ . 1 . 2]" 1
761 1 46 GLU H 1 46 GLU HG2 4.060 . 4.060 3.455 2.049 3.965 . 0 0 "[ . 1 . 2]" 1
762 1 46 GLU H 1 46 GLU QG 3.500 . 3.500 2.404 2.038 3.338 . 0 0 "[ . 1 . 2]" 1
763 1 46 GLU H 1 46 GLU HG3 4.060 . 4.060 2.538 2.198 3.643 . 0 0 "[ . 1 . 2]" 1
764 1 46 GLU H 1 47 ALA H 3.540 . 3.540 2.545 2.401 2.696 . 0 0 "[ . 1 . 2]" 1
765 1 46 GLU H 1 47 ALA MB 4.950 . 4.950 4.194 4.063 4.327 . 0 0 "[ . 1 . 2]" 1
766 1 46 GLU HA 1 46 GLU HG2 3.940 . 3.940 2.795 2.474 3.784 . 0 0 "[ . 1 . 2]" 1
767 1 46 GLU HA 1 46 GLU QG 3.410 . 3.410 2.517 2.414 3.163 . 0 0 "[ . 1 . 2]" 1
768 1 46 GLU HA 1 46 GLU HG3 3.940 . 3.940 3.108 2.515 3.864 . 0 0 "[ . 1 . 2]" 1
769 1 46 GLU HA 1 49 GLU H 4.140 . 4.140 3.444 3.199 3.730 . 0 0 "[ . 1 . 2]" 1
770 1 46 GLU HA 1 49 GLU QB 3.630 . 3.630 2.934 2.431 3.399 . 0 0 "[ . 1 . 2]" 1
771 1 46 GLU HA 1 49 GLU QG 4.090 . 4.090 3.015 2.343 3.767 . 0 0 "[ . 1 . 2]" 1
772 1 46 GLU QB 1 47 ALA H 3.500 . 3.500 2.655 2.506 2.850 . 0 0 "[ . 1 . 2]" 1
773 1 46 GLU QB 1 47 ALA MB 4.240 . 4.240 3.952 3.832 4.156 . 0 0 "[ . 1 . 2]" 1
774 1 46 GLU QB 1 50 TYR QE 3.690 . 3.690 2.459 2.034 3.105 . 0 0 "[ . 1 . 2]" 1
775 1 46 GLU HB2 1 50 TYR QD 5.450 . 5.450 3.991 3.556 4.556 . 0 0 "[ . 1 . 2]" 1
776 1 46 GLU HB3 1 50 TYR QD 5.450 . 5.450 3.163 2.706 3.466 . 0 0 "[ . 1 . 2]" 1
777 1 46 GLU QG 1 50 TYR QD 5.070 . 5.070 4.999 4.595 5.148 0.078 20 0 "[ . 1 . 2]" 1
778 1 47 ALA H 1 47 ALA MB 3.220 . 3.220 2.242 2.225 2.266 . 0 0 "[ . 1 . 2]" 1
779 1 47 ALA H 1 48 ILE H 3.910 . 3.910 2.795 2.711 2.838 . 0 0 "[ . 1 . 2]" 1
780 1 47 ALA H 1 49 GLU H 5.460 . 5.460 4.308 4.173 4.499 . 0 0 "[ . 1 . 2]" 1
781 1 47 ALA HA 1 50 TYR H 4.810 . 4.810 3.628 3.451 3.829 . 0 0 "[ . 1 . 2]" 1
782 1 47 ALA HA 1 50 TYR HB2 5.190 . 5.190 2.862 2.501 3.173 . 0 0 "[ . 1 . 2]" 1
783 1 47 ALA HA 1 50 TYR QD 4.210 . 4.210 2.854 2.248 3.655 . 0 0 "[ . 1 . 2]" 1
784 1 47 ALA HA 1 51 PHE QE 5.530 . 5.530 4.514 4.367 4.688 . 0 0 "[ . 1 . 2]" 1
785 1 47 ALA MB 1 48 ILE H 3.730 . 3.730 2.423 2.300 2.558 . 0 0 "[ . 1 . 2]" 1
786 1 47 ALA MB 1 51 PHE QD 4.920 . 4.920 3.693 3.438 3.827 . 0 0 "[ . 1 . 2]" 1
787 1 47 ALA MB 1 51 PHE QE 3.570 . 3.570 2.636 2.396 2.881 . 0 0 "[ . 1 . 2]" 1
788 1 47 ALA MB 1 51 PHE HZ 4.150 . 4.150 3.173 2.971 3.374 . 0 0 "[ . 1 . 2]" 1
789 1 48 ILE H 1 48 ILE HB 3.310 . 3.310 2.435 2.382 2.539 . 0 0 "[ . 1 . 2]" 1
790 1 48 ILE H 1 48 ILE MD 4.200 . 4.200 3.577 3.482 3.697 . 0 0 "[ . 1 . 2]" 1
791 1 48 ILE H 1 48 ILE HG12 4.110 . 4.110 3.514 3.416 3.614 . 0 0 "[ . 1 . 2]" 1
792 1 48 ILE H 1 48 ILE QG 3.450 . 3.450 2.212 2.107 2.349 . 0 0 "[ . 1 . 2]" 1
793 1 48 ILE H 1 48 ILE HG13 4.110 . 4.110 2.236 2.126 2.380 . 0 0 "[ . 1 . 2]" 1
794 1 48 ILE H 1 48 ILE MG 4.160 . 4.160 3.783 3.760 3.817 . 0 0 "[ . 1 . 2]" 1
795 1 48 ILE H 1 49 GLU H 3.780 . 3.780 2.853 2.787 2.936 . 0 0 "[ . 1 . 2]" 1
796 1 48 ILE H 1 74 LEU MD2 5.290 . 5.290 4.296 4.206 4.416 . 0 0 "[ . 1 . 2]" 1
797 1 48 ILE HA 1 48 ILE MD 4.150 . 4.150 3.863 3.834 3.889 . 0 0 "[ . 1 . 2]" 1
798 1 48 ILE HA 1 48 ILE HG12 3.970 . 3.970 2.548 2.483 2.610 . 0 0 "[ . 1 . 2]" 1
799 1 48 ILE HA 1 48 ILE QG 3.410 . 3.410 2.397 2.360 2.449 . 0 0 "[ . 1 . 2]" 1
800 1 48 ILE HA 1 48 ILE HG13 3.970 . 3.970 2.922 2.854 3.032 . 0 0 "[ . 1 . 2]" 1
801 1 48 ILE HA 1 48 ILE MG 3.570 . 3.570 2.606 2.552 2.656 . 0 0 "[ . 1 . 2]" 1
802 1 48 ILE HA 1 51 PHE H 4.460 . 4.460 3.579 3.361 3.687 . 0 0 "[ . 1 . 2]" 1
803 1 48 ILE HA 1 51 PHE QD 3.500 . 3.500 2.520 2.332 2.727 . 0 0 "[ . 1 . 2]" 1
804 1 48 ILE HA 1 52 LEU H 5.470 . 5.470 4.267 4.153 4.405 . 0 0 "[ . 1 . 2]" 1
805 1 48 ILE HA 1 74 LEU HA 5.480 . 5.480 3.926 3.667 4.296 . 0 0 "[ . 1 . 2]" 1
806 1 48 ILE HA 1 74 LEU MD1 4.250 . 4.250 4.393 4.262 4.465 0.215 4 0 "[ . 1 . 2]" 1
807 1 48 ILE HA 1 74 LEU MD2 4.010 . 4.010 2.049 1.976 2.135 . 0 0 "[ . 1 . 2]" 1
808 1 48 ILE HA 1 77 ALA MB 4.740 . 4.740 3.503 3.249 3.940 . 0 0 "[ . 1 . 2]" 1
809 1 48 ILE HB 1 48 ILE MD 3.440 . 3.440 2.449 2.412 2.494 . 0 0 "[ . 1 . 2]" 1
810 1 48 ILE HB 1 49 GLU H 3.690 . 3.690 2.496 2.424 2.630 . 0 0 "[ . 1 . 2]" 1
811 1 48 ILE HB 1 74 LEU MD2 4.820 . 4.820 4.024 3.975 4.080 . 0 0 "[ . 1 . 2]" 1
812 1 48 ILE MD 1 49 GLU H 5.750 . 5.750 4.549 4.476 4.695 . 0 0 "[ . 1 . 2]" 1
813 1 48 ILE MD 1 77 ALA H 5.750 . 5.750 5.563 5.163 5.809 0.059 2 0 "[ . 1 . 2]" 1
814 1 48 ILE MD 1 77 ALA MB 3.690 . 3.690 3.000 2.578 3.328 . 0 0 "[ . 1 . 2]" 1
815 1 48 ILE MD 1 78 TYR H 4.860 . 4.860 4.221 3.819 4.686 . 0 0 "[ . 1 . 2]" 1
816 1 48 ILE MD 1 78 TYR HA 3.940 . 3.940 3.027 2.778 3.519 . 0 0 "[ . 1 . 2]" 1
817 1 48 ILE MD 1 78 TYR QD 3.190 . 3.190 2.732 2.436 3.061 . 0 0 "[ . 1 . 2]" 1
818 1 48 ILE MD 1 78 TYR QE 3.260 . 3.260 2.323 2.060 2.644 . 0 0 "[ . 1 . 2]" 1
819 1 48 ILE MD 1 81 VAL H 5.520 . 5.520 4.459 4.184 4.799 . 0 0 "[ . 1 . 2]" 1
820 1 48 ILE MD 1 81 VAL HB 5.030 . 5.030 3.307 2.607 3.972 . 0 0 "[ . 1 . 2]" 1
821 1 48 ILE MD 1 81 VAL MG2 3.110 . 3.110 1.804 1.580 1.945 . 0 0 "[ . 1 . 2]" 1
822 1 48 ILE QG 1 49 GLU H 5.050 . 5.050 4.123 4.056 4.204 . 0 0 "[ . 1 . 2]" 1
823 1 48 ILE QG 1 74 LEU MD2 3.980 . 3.980 2.516 2.304 2.693 . 0 0 "[ . 1 . 2]" 1
824 1 48 ILE QG 1 77 ALA MB 3.430 . 3.430 2.219 2.019 2.651 . 0 0 "[ . 1 . 2]" 1
825 1 48 ILE QG 1 78 TYR QE 4.800 . 4.800 3.636 2.732 3.973 . 0 0 "[ . 1 . 2]" 1
826 1 48 ILE HG12 1 77 ALA MB 4.090 . 4.090 2.465 2.224 2.953 . 0 0 "[ . 1 . 2]" 1
827 1 48 ILE HG13 1 77 ALA MB 4.090 . 4.090 2.527 2.255 3.000 . 0 0 "[ . 1 . 2]" 1
828 1 48 ILE MG 1 49 GLU H 4.000 . 4.000 3.110 2.991 3.230 . 0 0 "[ . 1 . 2]" 1
829 1 48 ILE MG 1 49 GLU HA 3.990 . 3.990 3.160 3.088 3.342 . 0 0 "[ . 1 . 2]" 1
830 1 48 ILE MG 1 49 GLU QG 4.840 . 4.840 3.419 3.067 4.263 . 0 0 "[ . 1 . 2]" 1
831 1 48 ILE MG 1 51 PHE H 5.780 . 5.780 4.779 4.659 4.865 . 0 0 "[ . 1 . 2]" 1
832 1 48 ILE MG 1 51 PHE QD 4.820 . 4.820 4.416 4.214 4.587 . 0 0 "[ . 1 . 2]" 1
833 1 48 ILE MG 1 52 LEU H 5.000 . 5.000 4.225 4.123 4.323 . 0 0 "[ . 1 . 2]" 1
834 1 48 ILE MG 1 52 LEU HG 4.220 . 4.220 2.603 2.359 2.795 . 0 0 "[ . 1 . 2]" 1
835 1 48 ILE MG 1 77 ALA MB 4.470 . 4.470 4.054 3.874 4.455 . 0 0 "[ . 1 . 2]" 1
836 1 48 ILE MG 1 78 TYR H 5.860 . 5.860 5.702 5.478 5.927 0.067 10 0 "[ . 1 . 2]" 1
837 1 48 ILE MG 1 78 TYR QD 4.190 . 4.190 4.080 3.843 4.299 0.109 16 0 "[ . 1 . 2]" 1
838 1 48 ILE MG 1 78 TYR QE 2.990 . 2.990 2.604 2.144 3.018 0.028 4 0 "[ . 1 . 2]" 1
839 1 49 GLU H 1 49 GLU HB2 3.990 . 3.990 2.536 2.050 2.650 . 0 0 "[ . 1 . 2]" 1
840 1 49 GLU H 1 49 GLU QB 3.480 . 3.480 2.486 2.015 2.588 . 0 0 "[ . 1 . 2]" 1
841 1 49 GLU H 1 49 GLU HB3 3.990 . 3.990 3.583 2.973 3.650 . 0 0 "[ . 1 . 2]" 1
842 1 49 GLU H 1 49 GLU HG2 4.160 . 4.160 3.134 2.103 3.972 . 0 0 "[ . 1 . 2]" 1
843 1 49 GLU H 1 49 GLU QG 3.600 . 3.600 2.231 2.039 3.660 0.060 20 0 "[ . 1 . 2]" 1
844 1 49 GLU H 1 49 GLU HG3 4.160 . 4.160 2.566 2.061 4.285 0.125 20 0 "[ . 1 . 2]" 1
845 1 49 GLU H 1 50 TYR H 3.430 . 3.430 2.741 2.646 2.833 . 0 0 "[ . 1 . 2]" 1
846 1 49 GLU H 1 51 PHE H 5.010 . 5.010 4.185 4.068 4.296 . 0 0 "[ . 1 . 2]" 1
847 1 49 GLU H 1 52 LEU MD1 5.060 . 5.060 4.072 3.843 4.311 . 0 0 "[ . 1 . 2]" 1
848 1 49 GLU HA 1 49 GLU HG2 4.300 . 4.300 2.664 2.337 3.274 . 0 0 "[ . 1 . 2]" 1
849 1 49 GLU HA 1 49 GLU HG3 4.300 . 4.300 3.301 3.052 3.837 . 0 0 "[ . 1 . 2]" 1
850 1 49 GLU HA 1 52 LEU H 4.440 . 4.440 3.550 3.169 3.804 . 0 0 "[ . 1 . 2]" 1
851 1 49 GLU HA 1 52 LEU HB2 4.350 . 4.350 2.651 2.212 3.067 . 0 0 "[ . 1 . 2]" 1
852 1 49 GLU HA 1 52 LEU HB3 5.040 . 5.040 4.184 3.771 4.608 . 0 0 "[ . 1 . 2]" 1
853 1 49 GLU HA 1 52 LEU MD1 3.730 . 3.730 2.220 1.834 2.757 . 0 0 "[ . 1 . 2]" 1
854 1 49 GLU HA 1 52 LEU HG 5.400 . 5.400 3.436 2.663 4.119 . 0 0 "[ . 1 . 2]" 1
855 1 49 GLU QB 1 50 TYR HA 5.340 . 5.340 3.970 3.784 4.079 . 0 0 "[ . 1 . 2]" 1
856 1 49 GLU HB2 1 50 TYR H 4.110 . 4.110 2.729 2.453 3.443 . 0 0 "[ . 1 . 2]" 1
857 1 49 GLU HB3 1 50 TYR H 4.110 . 4.110 3.672 2.633 3.867 . 0 0 "[ . 1 . 2]" 1
858 1 50 TYR H 1 50 TYR HB2 3.740 . 3.740 2.329 2.281 2.381 . 0 0 "[ . 1 . 2]" 1
859 1 50 TYR H 1 50 TYR HB3 4.200 . 4.200 3.573 3.548 3.609 . 0 0 "[ . 1 . 2]" 1
860 1 50 TYR H 1 50 TYR QD 3.410 . 3.410 2.909 2.726 3.093 . 0 0 "[ . 1 . 2]" 1
861 1 50 TYR H 1 51 PHE H 3.750 . 3.750 2.625 2.537 2.709 . 0 0 "[ . 1 . 2]" 1
862 1 50 TYR HA 1 50 TYR QD 3.560 . 3.560 2.593 2.418 2.868 . 0 0 "[ . 1 . 2]" 1
863 1 50 TYR HA 1 52 LEU H 5.250 . 5.250 4.135 4.043 4.215 . 0 0 "[ . 1 . 2]" 1
864 1 50 TYR HA 1 52 LEU HB2 6.300 . 6.300 5.022 4.782 5.199 . 0 0 "[ . 1 . 2]" 1
865 1 50 TYR HA 1 53 ARG H 4.410 . 4.410 3.459 3.229 3.602 . 0 0 "[ . 1 . 2]" 1
866 1 50 TYR HA 1 53 ARG HB2 4.250 . 4.250 2.726 2.370 2.937 . 0 0 "[ . 1 . 2]" 1
867 1 50 TYR HA 1 53 ARG HB3 5.030 . 5.030 4.361 3.973 4.596 . 0 0 "[ . 1 . 2]" 1
868 1 50 TYR HA 1 53 ARG HD2 4.700 . 4.700 3.420 2.297 4.541 . 0 0 "[ . 1 . 2]" 1
869 1 50 TYR HA 1 53 ARG HD3 4.700 . 4.700 3.737 2.672 4.514 . 0 0 "[ . 1 . 2]" 1
870 1 50 TYR HA 1 53 ARG QG 5.100 . 5.100 3.526 2.649 4.070 . 0 0 "[ . 1 . 2]" 1
871 1 50 TYR HA 1 54 ALA H 5.190 . 5.190 3.888 3.761 4.057 . 0 0 "[ . 1 . 2]" 1
872 1 50 TYR HB2 1 51 PHE H 4.510 . 4.510 2.924 2.772 3.106 . 0 0 "[ . 1 . 2]" 1
873 1 50 TYR HB3 1 51 PHE H 4.640 . 4.640 3.631 3.482 3.741 . 0 0 "[ . 1 . 2]" 1
874 1 50 TYR HB3 1 52 LEU H 5.210 . 5.210 5.389 5.319 5.468 0.258 1 0 "[ . 1 . 2]" 1
875 1 50 TYR QD 1 51 PHE H 5.460 . 5.460 4.585 4.426 4.744 . 0 0 "[ . 1 . 2]" 1
876 1 50 TYR QD 1 53 ARG HB2 5.070 . 5.070 4.077 3.493 4.459 . 0 0 "[ . 1 . 2]" 1
877 1 50 TYR QD 1 53 ARG QG 6.100 . 6.100 5.041 4.201 5.657 . 0 0 "[ . 1 . 2]" 1
878 1 51 PHE H 1 51 PHE HB2 3.870 . 3.870 2.547 2.500 2.600 . 0 0 "[ . 1 . 2]" 1
879 1 51 PHE H 1 51 PHE QD 4.080 . 4.080 3.350 3.267 3.434 . 0 0 "[ . 1 . 2]" 1
880 1 51 PHE H 1 54 ALA MB 5.860 . 5.860 4.421 4.277 4.535 . 0 0 "[ . 1 . 2]" 1
881 1 51 PHE H 1 74 LEU MD1 6.020 . 6.020 4.848 4.682 5.018 . 0 0 "[ . 1 . 2]" 1
882 1 51 PHE H 1 74 LEU MD2 5.440 . 5.440 3.831 3.734 3.917 . 0 0 "[ . 1 . 2]" 1
883 1 51 PHE H 1 74 LEU HG 6.220 . 6.220 4.850 4.675 5.084 . 0 0 "[ . 1 . 2]" 1
884 1 51 PHE HA 1 51 PHE QD 3.200 . 3.200 2.165 2.084 2.206 . 0 0 "[ . 1 . 2]" 1
885 1 51 PHE HA 1 54 ALA H 4.680 . 4.680 3.396 3.158 3.596 . 0 0 "[ . 1 . 2]" 1
886 1 51 PHE HA 1 54 ALA MB 3.750 . 3.750 2.273 2.164 2.442 . 0 0 "[ . 1 . 2]" 1
887 1 51 PHE HA 1 55 LYS H 5.440 . 5.440 3.728 3.535 3.971 . 0 0 "[ . 1 . 2]" 1
888 1 51 PHE HB2 1 52 LEU H 4.170 . 4.170 2.923 2.866 2.972 . 0 0 "[ . 1 . 2]" 1
889 1 51 PHE HB2 1 70 ALA MB 5.510 . 5.510 4.085 3.773 4.481 . 0 0 "[ . 1 . 2]" 1
890 1 51 PHE HB2 1 74 LEU HA 5.020 . 5.020 4.071 3.856 4.350 . 0 0 "[ . 1 . 2]" 1
891 1 51 PHE HB2 1 74 LEU QB 4.990 . 4.990 4.372 4.249 4.568 . 0 0 "[ . 1 . 2]" 1
892 1 51 PHE HB2 1 74 LEU MD1 4.230 . 4.230 3.005 2.818 3.160 . 0 0 "[ . 1 . 2]" 1
893 1 51 PHE HB2 1 74 LEU MD2 4.020 . 4.020 2.159 1.989 2.299 . 0 0 "[ . 1 . 2]" 1
894 1 51 PHE HB2 1 74 LEU HG 3.990 . 3.990 2.308 2.120 2.577 . 0 0 "[ . 1 . 2]" 1
895 1 51 PHE HB3 1 52 LEU H 4.540 . 4.540 3.910 3.778 3.967 . 0 0 "[ . 1 . 2]" 1
896 1 51 PHE HB3 1 74 LEU HA 5.240 . 5.240 4.435 4.261 4.676 . 0 0 "[ . 1 . 2]" 1
897 1 51 PHE HB3 1 74 LEU HB2 5.170 . 5.170 4.404 4.286 4.595 . 0 0 "[ . 1 . 2]" 1
898 1 51 PHE HB3 1 74 LEU QB 4.530 . 4.530 4.172 4.074 4.317 . 0 0 "[ . 1 . 2]" 1
899 1 51 PHE HB3 1 74 LEU HB3 5.170 . 5.170 5.170 5.074 5.245 0.075 5 0 "[ . 1 . 2]" 1
900 1 51 PHE HB3 1 74 LEU MD1 4.270 . 4.270 2.979 2.761 3.191 . 0 0 "[ . 1 . 2]" 1
901 1 51 PHE HB3 1 74 LEU MD2 4.290 . 4.290 3.231 3.036 3.400 . 0 0 "[ . 1 . 2]" 1
902 1 51 PHE HB3 1 74 LEU HG 4.440 . 4.440 2.151 2.039 2.230 . 0 0 "[ . 1 . 2]" 1
903 1 51 PHE QD 1 52 LEU H 5.400 . 5.400 4.586 4.495 4.615 . 0 0 "[ . 1 . 2]" 1
904 1 51 PHE QD 1 54 ALA MB 4.780 . 4.780 3.408 3.255 3.573 . 0 0 "[ . 1 . 2]" 1
905 1 51 PHE QD 1 70 ALA HA 5.030 . 5.030 3.813 3.569 4.097 . 0 0 "[ . 1 . 2]" 1
906 1 51 PHE QD 1 70 ALA MB 4.240 . 4.240 3.566 3.302 4.039 . 0 0 "[ . 1 . 2]" 1
907 1 51 PHE QD 1 73 SER QB 5.010 . 5.010 3.426 3.192 3.610 . 0 0 "[ . 1 . 2]" 1
908 1 51 PHE QD 1 74 LEU HA 3.830 . 3.830 2.708 2.422 3.082 . 0 0 "[ . 1 . 2]" 1
909 1 51 PHE QD 1 74 LEU MD1 4.080 . 4.080 4.154 4.023 4.274 0.194 15 0 "[ . 1 . 2]" 1
910 1 51 PHE QD 1 74 LEU MD2 4.090 . 4.090 2.289 2.114 2.547 . 0 0 "[ . 1 . 2]" 1
911 1 51 PHE QD 1 74 LEU HG 4.000 . 4.000 2.878 2.729 3.072 . 0 0 "[ . 1 . 2]" 1
912 1 51 PHE QD 1 77 ALA MB 4.140 . 4.140 3.018 2.793 3.350 . 0 0 "[ . 1 . 2]" 1
913 1 51 PHE QE 1 70 ALA HA 5.570 . 5.570 4.928 4.668 5.298 . 0 0 "[ . 1 . 2]" 1
914 1 51 PHE QE 1 73 SER QB 4.120 . 4.120 3.204 2.843 3.816 . 0 0 "[ . 1 . 2]" 1
915 1 51 PHE QE 1 77 ALA MB 3.420 . 3.420 2.437 2.118 2.943 . 0 0 "[ . 1 . 2]" 1
916 1 51 PHE HZ 1 73 SER QB 5.340 . 5.340 3.381 2.699 4.399 . 0 0 "[ . 1 . 2]" 1
917 1 52 LEU H 1 52 LEU HB2 3.490 . 3.490 2.404 2.340 2.480 . 0 0 "[ . 1 . 2]" 1
918 1 52 LEU H 1 52 LEU HB3 3.960 . 3.960 3.623 3.610 3.650 . 0 0 "[ . 1 . 2]" 1
919 1 52 LEU H 1 52 LEU MD1 4.450 . 4.450 3.753 3.627 3.843 . 0 0 "[ . 1 . 2]" 1
920 1 52 LEU H 1 52 LEU MD2 4.390 . 4.390 3.678 3.469 3.868 . 0 0 "[ . 1 . 2]" 1
921 1 52 LEU H 1 52 LEU HG 3.620 . 3.620 2.674 2.548 2.916 . 0 0 "[ . 1 . 2]" 1
922 1 52 LEU H 1 53 ARG H 3.540 . 3.540 2.522 2.432 2.580 . 0 0 "[ . 1 . 2]" 1
923 1 52 LEU H 1 74 LEU MD1 4.430 . 4.430 3.657 3.375 3.839 . 0 0 "[ . 1 . 2]" 1
924 1 52 LEU H 1 74 LEU MD2 4.330 . 4.330 3.375 3.206 3.569 . 0 0 "[ . 1 . 2]" 1
925 1 52 LEU HA 1 52 LEU MD1 4.290 . 4.290 3.935 3.917 3.958 . 0 0 "[ . 1 . 2]" 1
926 1 52 LEU HA 1 52 LEU MD2 3.030 . 3.030 2.072 1.997 2.135 . 0 0 "[ . 1 . 2]" 1
927 1 52 LEU HA 1 52 LEU HG 4.360 . 4.360 3.047 2.928 3.187 . 0 0 "[ . 1 . 2]" 1
928 1 52 LEU HA 1 54 ALA H 6.300 . 6.300 4.592 4.368 4.740 . 0 0 "[ . 1 . 2]" 1
929 1 52 LEU HA 1 55 LYS H 4.370 . 4.370 3.743 3.570 3.980 . 0 0 "[ . 1 . 2]" 1
930 1 52 LEU HA 1 55 LYS HB3 4.630 . 4.630 2.943 2.678 3.196 . 0 0 "[ . 1 . 2]" 1
931 1 52 LEU HA 1 55 LYS QD 4.820 . 4.820 3.730 3.401 4.090 . 0 0 "[ . 1 . 2]" 1
932 1 52 LEU HA 1 74 LEU MD1 3.890 . 3.890 2.695 2.280 2.934 . 0 0 "[ . 1 . 2]" 1
933 1 52 LEU HA 1 74 LEU MD2 4.500 . 4.500 3.988 3.760 4.283 . 0 0 "[ . 1 . 2]" 1
934 1 52 LEU HB2 1 52 LEU MD1 3.530 . 3.530 2.349 2.317 2.382 . 0 0 "[ . 1 . 2]" 1
935 1 52 LEU HB2 1 53 ARG H 3.270 . 3.270 2.527 2.374 2.671 . 0 0 "[ . 1 . 2]" 1
936 1 52 LEU HB2 1 74 LEU MD2 5.370 . 5.370 4.440 4.120 4.776 . 0 0 "[ . 1 . 2]" 1
937 1 52 LEU HB3 1 52 LEU MD2 3.370 . 3.370 2.428 2.394 2.475 . 0 0 "[ . 1 . 2]" 1
938 1 52 LEU HB3 1 53 ARG H 4.370 . 4.370 3.435 3.323 3.532 . 0 0 "[ . 1 . 2]" 1
939 1 52 LEU HB3 1 53 ARG HA 5.340 . 5.340 4.381 4.228 4.544 . 0 0 "[ . 1 . 2]" 1
940 1 52 LEU MD1 1 53 ARG H 5.450 . 5.450 4.479 4.366 4.583 . 0 0 "[ . 1 . 2]" 1
941 1 52 LEU MD2 1 53 ARG H 5.920 . 5.920 4.709 4.604 4.771 . 0 0 "[ . 1 . 2]" 1
942 1 52 LEU HG 1 74 LEU MD1 4.500 . 4.500 3.018 2.705 3.365 . 0 0 "[ . 1 . 2]" 1
943 1 52 LEU HG 1 74 LEU MD2 3.810 . 3.810 2.438 2.211 2.870 . 0 0 "[ . 1 . 2]" 1
944 1 53 ARG H 1 53 ARG HB2 3.580 . 3.580 2.465 2.373 2.647 . 0 0 "[ . 1 . 2]" 1
945 1 53 ARG H 1 53 ARG HB3 4.220 . 4.220 3.605 3.568 3.649 . 0 0 "[ . 1 . 2]" 1
946 1 53 ARG H 1 53 ARG HD2 5.060 . 5.060 4.290 3.783 4.894 . 0 0 "[ . 1 . 2]" 1
947 1 53 ARG H 1 53 ARG HD3 5.060 . 5.060 4.518 3.874 4.952 . 0 0 "[ . 1 . 2]" 1
948 1 53 ARG H 1 53 ARG HG2 4.300 . 4.300 3.580 3.370 3.760 . 0 0 "[ . 1 . 2]" 1
949 1 53 ARG H 1 53 ARG QG 3.610 . 3.610 2.327 2.182 2.513 . 0 0 "[ . 1 . 2]" 1
950 1 53 ARG H 1 53 ARG HG3 4.300 . 4.300 2.359 2.202 2.558 . 0 0 "[ . 1 . 2]" 1
951 1 53 ARG H 1 54 ALA H 3.720 . 3.720 2.650 2.499 2.748 . 0 0 "[ . 1 . 2]" 1
952 1 53 ARG H 1 54 ALA MB 5.320 . 5.320 4.288 4.175 4.372 . 0 0 "[ . 1 . 2]" 1
953 1 53 ARG H 1 74 LEU MD1 5.470 . 5.470 5.334 4.933 5.524 0.054 2 0 "[ . 1 . 2]" 1
954 1 53 ARG HA 1 53 ARG QD 4.880 . 4.880 4.165 4.026 4.285 . 0 0 "[ . 1 . 2]" 1
955 1 53 ARG HA 1 53 ARG HG2 4.030 . 4.030 2.616 2.484 2.725 . 0 0 "[ . 1 . 2]" 1
956 1 53 ARG HA 1 53 ARG QG 3.230 . 3.230 2.469 2.371 2.590 . 0 0 "[ . 1 . 2]" 1
957 1 53 ARG HA 1 53 ARG HG3 4.030 . 4.030 3.041 2.896 3.237 . 0 0 "[ . 1 . 2]" 1
958 1 53 ARG HA 1 56 LYS H 4.500 . 4.500 3.614 3.317 3.926 . 0 0 "[ . 1 . 2]" 1
959 1 53 ARG HA 1 56 LYS QE 5.990 . 5.990 4.372 2.055 6.044 0.054 20 0 "[ . 1 . 2]" 1
960 1 53 ARG HA 1 57 VAL MG2 4.750 . 4.750 3.773 3.351 4.056 . 0 0 "[ . 1 . 2]" 1
961 1 53 ARG HB2 1 54 ALA H 4.030 . 4.030 2.554 2.338 2.872 . 0 0 "[ . 1 . 2]" 1
962 1 53 ARG HB2 1 54 ALA HA 4.960 . 4.960 4.338 3.995 4.574 . 0 0 "[ . 1 . 2]" 1
963 1 53 ARG HB3 1 53 ARG QD 3.680 . 3.680 2.697 2.396 3.056 . 0 0 "[ . 1 . 2]" 1
964 1 53 ARG HB3 1 54 ALA H 4.160 . 4.160 3.553 3.395 3.770 . 0 0 "[ . 1 . 2]" 1
965 1 53 ARG HB3 1 54 ALA HA 5.170 . 5.170 4.422 4.215 4.688 . 0 0 "[ . 1 . 2]" 1
966 1 54 ALA H 1 54 ALA MB 3.320 . 3.320 2.242 2.199 2.270 . 0 0 "[ . 1 . 2]" 1
967 1 54 ALA H 1 55 LYS H 3.790 . 3.790 2.754 2.662 2.826 . 0 0 "[ . 1 . 2]" 1
968 1 54 ALA H 1 56 LYS H 5.130 . 5.130 4.123 3.919 4.347 . 0 0 "[ . 1 . 2]" 1
969 1 54 ALA HA 1 56 LYS QB 5.860 . 5.860 5.088 4.809 5.513 . 0 0 "[ . 1 . 2]" 1
970 1 54 ALA HA 1 57 VAL H 4.880 . 4.880 3.706 3.553 3.840 . 0 0 "[ . 1 . 2]" 1
971 1 54 ALA HA 1 57 VAL HB 4.160 . 4.160 3.138 2.782 3.723 . 0 0 "[ . 1 . 2]" 1
972 1 54 ALA HA 1 57 VAL MG2 4.600 . 4.600 3.266 3.046 3.531 . 0 0 "[ . 1 . 2]" 1
973 1 54 ALA MB 1 55 LYS H 3.510 . 3.510 2.363 2.269 2.517 . 0 0 "[ . 1 . 2]" 1
974 1 54 ALA MB 1 55 LYS HA 4.590 . 4.590 3.801 3.748 3.871 . 0 0 "[ . 1 . 2]" 1
975 1 54 ALA MB 1 56 LYS H 5.160 . 5.160 4.449 4.329 4.596 . 0 0 "[ . 1 . 2]" 1
976 1 54 ALA MB 1 57 VAL H 5.540 . 5.540 4.718 4.583 4.841 . 0 0 "[ . 1 . 2]" 1
977 1 54 ALA MB 1 58 PHE H 5.530 . 5.530 4.712 4.539 5.085 . 0 0 "[ . 1 . 2]" 1
978 1 54 ALA MB 1 58 PHE QD 3.950 . 3.950 3.318 3.081 3.635 . 0 0 "[ . 1 . 2]" 1
979 1 54 ALA MB 1 58 PHE QE 3.720 . 3.720 2.628 2.373 3.066 . 0 0 "[ . 1 . 2]" 1
980 1 54 ALA MB 1 58 PHE HZ 5.250 . 5.250 4.256 3.828 5.037 . 0 0 "[ . 1 . 2]" 1
981 1 55 LYS H 1 55 LYS HB2 3.500 . 3.500 2.515 2.326 2.690 . 0 0 "[ . 1 . 2]" 1
982 1 55 LYS H 1 55 LYS HB3 3.580 . 3.580 2.515 2.383 2.735 . 0 0 "[ . 1 . 2]" 1
983 1 55 LYS H 1 55 LYS HG2 4.690 . 4.690 4.469 4.385 4.520 . 0 0 "[ . 1 . 2]" 1
984 1 55 LYS H 1 55 LYS QG 4.110 . 4.110 3.981 3.929 4.006 . 0 0 "[ . 1 . 2]" 1
985 1 55 LYS H 1 55 LYS HG3 4.690 . 4.690 4.469 4.317 4.556 . 0 0 "[ . 1 . 2]" 1
986 1 55 LYS H 1 56 LYS H 3.860 . 3.860 2.670 2.534 2.795 . 0 0 "[ . 1 . 2]" 1
987 1 55 LYS H 1 74 LEU MD1 5.260 . 5.260 4.701 4.372 4.960 . 0 0 "[ . 1 . 2]" 1
988 1 55 LYS HA 1 55 LYS HG2 4.020 . 4.020 3.157 2.742 3.365 . 0 0 "[ . 1 . 2]" 1
989 1 55 LYS HA 1 55 LYS HG3 4.020 . 4.020 2.637 2.554 2.747 . 0 0 "[ . 1 . 2]" 1
990 1 55 LYS HA 1 58 PHE H 4.620 . 4.620 3.505 3.231 3.794 . 0 0 "[ . 1 . 2]" 1
991 1 55 LYS HA 1 58 PHE HB2 4.410 . 4.410 2.569 2.262 2.946 . 0 0 "[ . 1 . 2]" 1
992 1 55 LYS HA 1 58 PHE HB3 4.860 . 4.860 4.182 3.834 4.618 . 0 0 "[ . 1 . 2]" 1
993 1 55 LYS HA 1 58 PHE QD 3.870 . 3.870 2.298 1.922 2.794 . 0 0 "[ . 1 . 2]" 1
994 1 55 LYS HA 1 58 PHE QE 4.910 . 4.910 4.422 3.961 4.878 . 0 0 "[ . 1 . 2]" 1
995 1 55 LYS HA 1 59 ASP H 5.440 . 5.440 4.157 4.013 4.327 . 0 0 "[ . 1 . 2]" 1
996 1 55 LYS HA 1 70 ALA MB 4.070 . 4.070 2.806 2.603 3.173 . 0 0 "[ . 1 . 2]" 1
997 1 55 LYS HB2 1 70 ALA MB 3.740 . 3.740 2.039 1.808 2.584 . 0 0 "[ . 1 . 2]" 1
998 1 55 LYS HB3 1 55 LYS QD 3.750 . 3.750 2.462 2.359 2.730 . 0 0 "[ . 1 . 2]" 1
999 1 55 LYS HB3 1 56 LYS H 3.780 . 3.780 2.623 2.433 2.777 . 0 0 "[ . 1 . 2]" 1
1000 1 55 LYS HB3 1 70 ALA MB 4.390 . 4.390 3.483 3.126 4.050 . 0 0 "[ . 1 . 2]" 1
1001 1 55 LYS QD 1 56 LYS H 5.340 . 5.340 4.610 4.301 5.171 . 0 0 "[ . 1 . 2]" 1
1002 1 55 LYS QD 1 71 ALA H 4.450 . 4.450 3.437 3.056 3.911 . 0 0 "[ . 1 . 2]" 1
1003 1 55 LYS QD 1 71 ALA HA 4.410 . 4.410 3.170 2.606 3.641 . 0 0 "[ . 1 . 2]" 1
1004 1 55 LYS QE 1 67 ALA MB 4.060 . 4.060 3.085 2.319 4.280 0.220 11 0 "[ . 1 . 2]" 1
1005 1 55 LYS QE 1 71 ALA MB 3.710 . 3.710 2.429 1.979 3.587 . 0 0 "[ . 1 . 2]" 1
1006 1 55 LYS QG 1 56 LYS H 5.400 . 5.400 3.669 3.366 4.132 . 0 0 "[ . 1 . 2]" 1
1007 1 55 LYS QG 1 58 PHE H 5.950 . 5.950 4.949 4.711 5.261 . 0 0 "[ . 1 . 2]" 1
1008 1 55 LYS QG 1 58 PHE HB2 5.290 . 5.290 3.869 3.411 4.282 . 0 0 "[ . 1 . 2]" 1
1009 1 55 LYS QG 1 59 ASP H 5.110 . 5.110 4.227 4.004 4.469 . 0 0 "[ . 1 . 2]" 1
1010 1 55 LYS QG 1 67 ALA H 4.960 . 4.960 4.704 4.482 5.006 0.046 12 0 "[ . 1 . 2]" 1
1011 1 55 LYS QG 1 67 ALA HA 4.370 . 4.370 2.283 1.956 2.678 . 0 0 "[ . 1 . 2]" 1
1012 1 56 LYS H 1 56 LYS QB 3.060 . 3.060 2.234 2.186 2.281 . 0 0 "[ . 1 . 2]" 1
1013 1 56 LYS H 1 56 LYS QD 5.240 . 5.240 4.539 3.962 4.816 . 0 0 "[ . 1 . 2]" 1
1014 1 56 LYS H 1 56 LYS QG 4.590 . 4.590 4.015 3.968 4.089 . 0 0 "[ . 1 . 2]" 1
1015 1 56 LYS H 1 57 VAL MG2 4.920 . 4.920 4.106 3.939 4.325 . 0 0 "[ . 1 . 2]" 1
1016 1 56 LYS H 1 58 PHE H 5.530 . 5.530 4.152 3.921 4.513 . 0 0 "[ . 1 . 2]" 1
1017 1 56 LYS HA 1 56 LYS QD 4.910 . 4.910 3.940 2.087 4.394 . 0 0 "[ . 1 . 2]" 1
1018 1 56 LYS HA 1 56 LYS HG2 4.150 . 4.150 3.207 2.610 3.843 . 0 0 "[ . 1 . 2]" 1
1019 1 56 LYS HA 1 56 LYS HG3 4.150 . 4.150 2.779 2.511 3.709 . 0 0 "[ . 1 . 2]" 1
1020 1 56 LYS HA 1 59 ASP H 4.670 . 4.670 3.464 3.174 3.690 . 0 0 "[ . 1 . 2]" 1
1021 1 56 LYS HA 1 59 ASP HB2 4.120 . 4.120 2.914 2.209 3.451 . 0 0 "[ . 1 . 2]" 1
1022 1 56 LYS HA 1 59 ASP HB3 4.510 . 4.510 3.405 2.183 4.524 0.014 7 0 "[ . 1 . 2]" 1
1023 1 56 LYS HA 1 60 ALA H 4.910 . 4.910 4.321 3.953 4.678 . 0 0 "[ . 1 . 2]" 1
1024 1 56 LYS QB 1 57 VAL H 3.680 . 3.680 2.625 2.473 2.798 . 0 0 "[ . 1 . 2]" 1
1025 1 56 LYS QB 1 57 VAL HA 4.780 . 4.780 4.251 4.077 4.356 . 0 0 "[ . 1 . 2]" 1
1026 1 56 LYS QB 1 57 VAL MG2 4.190 . 4.190 3.090 2.869 3.314 . 0 0 "[ . 1 . 2]" 1
1027 1 56 LYS QG 1 57 VAL H 5.900 . 5.900 3.743 3.427 4.306 . 0 0 "[ . 1 . 2]" 1
1028 1 56 LYS QG 1 57 VAL HA 5.000 . 5.000 3.819 3.326 4.718 . 0 0 "[ . 1 . 2]" 1
1029 1 56 LYS QG 1 59 ASP HB2 5.680 . 5.680 4.468 3.429 5.361 . 0 0 "[ . 1 . 2]" 1
1030 1 57 VAL H 1 57 VAL HB 3.430 . 3.430 2.551 2.430 2.651 . 0 0 "[ . 1 . 2]" 1
1031 1 57 VAL H 1 57 VAL MG1 4.350 . 4.350 3.804 3.764 3.832 . 0 0 "[ . 1 . 2]" 1
1032 1 57 VAL H 1 57 VAL MG2 3.280 . 3.280 2.179 2.068 2.307 . 0 0 "[ . 1 . 2]" 1
1033 1 57 VAL H 1 58 PHE H 3.840 . 3.840 2.594 2.504 2.751 . 0 0 "[ . 1 . 2]" 1
1034 1 57 VAL H 1 60 ALA MB 6.300 . 6.300 4.805 4.597 4.989 . 0 0 "[ . 1 . 2]" 1
1035 1 57 VAL HA 1 57 VAL MG1 3.380 . 3.380 2.443 2.382 2.526 . 0 0 "[ . 1 . 2]" 1
1036 1 57 VAL HA 1 57 VAL MG2 3.210 . 3.210 2.456 2.375 2.521 . 0 0 "[ . 1 . 2]" 1
1037 1 57 VAL HA 1 60 ALA H 4.240 . 4.240 3.375 3.157 3.863 . 0 0 "[ . 1 . 2]" 1
1038 1 57 VAL HA 1 60 ALA MB 3.510 . 3.510 2.656 2.394 3.209 . 0 0 "[ . 1 . 2]" 1
1039 1 57 VAL HA 1 61 GLU H 5.370 . 5.370 4.397 4.196 4.752 . 0 0 "[ . 1 . 2]" 1
1040 1 57 VAL HB 1 58 PHE H 3.970 . 3.970 2.705 2.319 2.900 . 0 0 "[ . 1 . 2]" 1
1041 1 57 VAL MG1 1 58 PHE H 4.400 . 4.400 3.548 3.125 3.772 . 0 0 "[ . 1 . 2]" 1
1042 1 57 VAL MG1 1 58 PHE HA 4.780 . 4.780 3.754 3.367 3.992 . 0 0 "[ . 1 . 2]" 1
1043 1 57 VAL MG1 1 60 ALA H 5.280 . 5.280 4.651 4.416 4.982 . 0 0 "[ . 1 . 2]" 1
1044 1 57 VAL MG1 1 61 GLU H 5.250 . 5.250 4.293 4.022 4.697 . 0 0 "[ . 1 . 2]" 1
1045 1 57 VAL MG1 1 61 GLU QB 4.980 . 4.980 4.330 3.984 4.572 . 0 0 "[ . 1 . 2]" 1
1046 1 57 VAL MG1 1 61 GLU HG2 5.150 . 5.150 3.015 2.462 4.397 . 0 0 "[ . 1 . 2]" 1
1047 1 57 VAL MG1 1 61 GLU QG 4.300 . 4.300 2.793 2.338 3.359 . 0 0 "[ . 1 . 2]" 1
1048 1 57 VAL MG1 1 61 GLU HG3 5.150 . 5.150 3.387 2.912 3.858 . 0 0 "[ . 1 . 2]" 1
1049 1 57 VAL MG2 1 58 PHE H 4.590 . 4.590 3.894 3.698 4.009 . 0 0 "[ . 1 . 2]" 1
1050 1 58 PHE H 1 58 PHE HB2 4.070 . 4.070 2.438 2.313 2.518 . 0 0 "[ . 1 . 2]" 1
1051 1 58 PHE H 1 58 PHE QD 4.810 . 4.810 3.271 2.990 3.486 . 0 0 "[ . 1 . 2]" 1
1052 1 58 PHE H 1 59 ASP H 4.160 . 4.160 2.644 2.565 2.752 . 0 0 "[ . 1 . 2]" 1
1053 1 58 PHE H 1 60 ALA MB 5.990 . 5.990 4.803 4.612 5.161 . 0 0 "[ . 1 . 2]" 1
1054 1 58 PHE H 1 67 ALA MB 6.300 . 6.300 4.629 4.234 5.460 . 0 0 "[ . 1 . 2]" 1
1055 1 58 PHE HA 1 58 PHE QD 3.450 . 3.450 2.256 2.047 2.493 . 0 0 "[ . 1 . 2]" 1
1056 1 58 PHE HA 1 58 PHE QE 4.680 . 4.680 4.415 4.336 4.514 . 0 0 "[ . 1 . 2]" 1
1057 1 58 PHE HA 1 61 GLU H 4.890 . 4.890 3.260 3.028 3.532 . 0 0 "[ . 1 . 2]" 1
1058 1 58 PHE HA 1 61 GLU HB2 5.250 . 5.250 2.483 2.127 2.916 . 0 0 "[ . 1 . 2]" 1
1059 1 58 PHE HA 1 61 GLU QB 4.590 . 4.590 2.463 2.116 2.884 . 0 0 "[ . 1 . 2]" 1
1060 1 58 PHE HA 1 61 GLU HB3 5.250 . 5.250 4.117 3.762 4.549 . 0 0 "[ . 1 . 2]" 1
1061 1 58 PHE HA 1 63 ASP H 5.000 . 5.000 3.706 3.373 4.149 . 0 0 "[ . 1 . 2]" 1
1062 1 58 PHE HA 1 63 ASP HB2 5.040 . 5.040 4.048 3.035 4.782 . 0 0 "[ . 1 . 2]" 1
1063 1 58 PHE HA 1 63 ASP QB 4.440 . 4.440 2.960 2.588 3.711 . 0 0 "[ . 1 . 2]" 1
1064 1 58 PHE HA 1 63 ASP HB3 5.040 . 5.040 3.195 2.646 4.832 . 0 0 "[ . 1 . 2]" 1
1065 1 58 PHE HB2 1 59 ASP H 4.160 . 4.160 2.890 2.678 3.025 . 0 0 "[ . 1 . 2]" 1
1066 1 58 PHE HB2 1 67 ALA H 4.480 . 4.480 3.595 3.173 4.039 . 0 0 "[ . 1 . 2]" 1
1067 1 58 PHE HB2 1 67 ALA HA 4.510 . 4.510 2.857 2.554 3.437 . 0 0 "[ . 1 . 2]" 1
1068 1 58 PHE HB2 1 67 ALA MB 3.990 . 3.990 2.719 2.302 3.647 . 0 0 "[ . 1 . 2]" 1
1069 1 58 PHE HB3 1 59 ASP H 4.970 . 4.970 3.714 3.382 3.873 . 0 0 "[ . 1 . 2]" 1
1070 1 58 PHE HB3 1 63 ASP H 5.020 . 5.020 3.899 3.698 4.280 . 0 0 "[ . 1 . 2]" 1
1071 1 58 PHE HB3 1 63 ASP HB2 5.070 . 5.070 4.231 2.540 4.869 . 0 0 "[ . 1 . 2]" 1
1072 1 58 PHE HB3 1 63 ASP QB 4.390 . 4.390 2.654 2.103 3.112 . 0 0 "[ . 1 . 2]" 1
1073 1 58 PHE HB3 1 63 ASP HB3 5.070 . 5.070 2.777 2.113 3.755 . 0 0 "[ . 1 . 2]" 1
1074 1 58 PHE HB3 1 67 ALA H 4.050 . 4.050 2.789 2.612 3.031 . 0 0 "[ . 1 . 2]" 1
1075 1 58 PHE HB3 1 67 ALA HA 4.600 . 4.600 3.582 3.318 3.999 . 0 0 "[ . 1 . 2]" 1
1076 1 58 PHE HB3 1 67 ALA MB 3.980 . 3.980 2.692 2.138 3.519 . 0 0 "[ . 1 . 2]" 1
1077 1 58 PHE QD 1 63 ASP H 5.420 . 5.420 4.508 4.043 5.231 . 0 0 "[ . 1 . 2]" 1
1078 1 58 PHE QD 1 63 ASP HB2 4.740 . 4.740 3.514 2.418 4.753 0.013 17 0 "[ . 1 . 2]" 1
1079 1 58 PHE QD 1 63 ASP QB 4.060 . 4.060 2.511 1.954 3.633 . 0 0 "[ . 1 . 2]" 1
1080 1 58 PHE QD 1 63 ASP HB3 4.740 . 4.740 2.674 1.976 3.770 . 0 0 "[ . 1 . 2]" 1
1081 1 58 PHE QD 1 66 GLY H 5.590 . 5.590 4.621 4.204 5.225 . 0 0 "[ . 1 . 2]" 1
1082 1 58 PHE QD 1 66 GLY QA 4.200 . 4.200 3.282 2.984 3.614 . 0 0 "[ . 1 . 2]" 1
1083 1 58 PHE QD 1 67 ALA H 5.170 . 5.170 4.008 3.545 4.451 . 0 0 "[ . 1 . 2]" 1
1084 1 58 PHE QD 1 67 ALA HA 4.140 . 4.140 3.008 2.279 3.994 . 0 0 "[ . 1 . 2]" 1
1085 1 58 PHE QD 1 70 ALA MB 4.490 . 4.490 3.025 2.698 3.680 . 0 0 "[ . 1 . 2]" 1
1086 1 58 PHE QE 1 70 ALA MB 4.190 . 4.190 3.173 2.669 4.161 . 0 0 "[ . 1 . 2]" 1
1087 1 58 PHE HZ 1 66 GLY QA 5.530 . 5.530 3.969 3.412 5.005 . 0 0 "[ . 1 . 2]" 1
1088 1 59 ASP H 1 59 ASP HB2 4.170 . 4.170 2.509 2.334 2.612 . 0 0 "[ . 1 . 2]" 1
1089 1 59 ASP H 1 59 ASP HB3 4.170 . 4.170 3.091 2.396 3.657 . 0 0 "[ . 1 . 2]" 1
1090 1 59 ASP H 1 60 ALA H 3.760 . 3.760 2.554 2.381 2.712 . 0 0 "[ . 1 . 2]" 1
1091 1 59 ASP H 1 60 ALA MB 5.040 . 5.040 4.229 4.119 4.307 . 0 0 "[ . 1 . 2]" 1
1092 1 59 ASP H 1 67 ALA MB 5.470 . 5.470 3.602 3.099 4.206 . 0 0 "[ . 1 . 2]" 1
1093 1 59 ASP HA 1 62 HIS H 4.370 . 4.370 3.336 3.036 3.497 . 0 0 "[ . 1 . 2]" 1
1094 1 59 ASP HA 1 63 ASP H 5.490 . 5.490 4.078 3.858 4.499 . 0 0 "[ . 1 . 2]" 1
1095 1 59 ASP HA 1 67 ALA MB 4.410 . 4.410 3.395 2.731 3.746 . 0 0 "[ . 1 . 2]" 1
1096 1 59 ASP HB2 1 60 ALA H 3.800 . 3.800 3.322 2.646 3.913 0.113 17 0 "[ . 1 . 2]" 1
1097 1 59 ASP HB2 1 60 ALA MB 6.160 . 6.160 4.714 3.923 5.413 . 0 0 "[ . 1 . 2]" 1
1098 1 59 ASP HB3 1 60 ALA H 4.120 . 4.120 3.175 2.558 3.827 . 0 0 "[ . 1 . 2]" 1
1099 1 59 ASP HB3 1 60 ALA MB 5.210 . 5.210 4.415 3.861 4.995 . 0 0 "[ . 1 . 2]" 1
1100 1 60 ALA H 1 60 ALA MB 3.010 . 3.010 2.249 2.221 2.277 . 0 0 "[ . 1 . 2]" 1
1101 1 60 ALA H 1 61 GLU H 3.540 . 3.540 2.590 2.486 2.686 . 0 0 "[ . 1 . 2]" 1
1102 1 60 ALA MB 1 61 GLU H 3.820 . 3.820 2.671 2.561 2.841 . 0 0 "[ . 1 . 2]" 1
1103 1 60 ALA MB 1 61 GLU QG 4.420 . 4.420 3.187 2.621 3.479 . 0 0 "[ . 1 . 2]" 1
1104 1 60 ALA MB 1 62 HIS H 5.060 . 5.060 4.265 4.185 4.338 . 0 0 "[ . 1 . 2]" 1
1105 1 61 GLU H 1 61 GLU HB2 3.940 . 3.940 2.469 2.390 2.530 . 0 0 "[ . 1 . 2]" 1
1106 1 61 GLU H 1 61 GLU QB 3.440 . 3.440 2.429 2.357 2.485 . 0 0 "[ . 1 . 2]" 1
1107 1 61 GLU H 1 61 GLU HB3 3.940 . 3.940 3.615 3.590 3.643 . 0 0 "[ . 1 . 2]" 1
1108 1 61 GLU H 1 61 GLU HG2 4.600 . 4.600 2.444 2.241 3.517 . 0 0 "[ . 1 . 2]" 1
1109 1 61 GLU H 1 61 GLU QG 3.970 . 3.970 2.352 2.174 2.510 . 0 0 "[ . 1 . 2]" 1
1110 1 61 GLU H 1 61 GLU HG3 4.600 . 4.600 3.658 2.195 3.890 . 0 0 "[ . 1 . 2]" 1
1111 1 61 GLU H 1 63 ASP H 5.310 . 5.310 3.755 3.566 3.935 . 0 0 "[ . 1 . 2]" 1
1112 1 61 GLU H 1 63 ASP QB 5.870 . 5.870 4.616 4.359 4.943 . 0 0 "[ . 1 . 2]" 1
1113 1 61 GLU HA 1 61 GLU HG2 4.190 . 4.190 3.101 2.717 3.242 . 0 0 "[ . 1 . 2]" 1
1114 1 61 GLU HA 1 61 GLU HG3 4.190 . 4.190 3.775 3.094 3.840 . 0 0 "[ . 1 . 2]" 1
1115 1 61 GLU QB 1 62 HIS H 4.460 . 4.460 3.193 3.102 3.412 . 0 0 "[ . 1 . 2]" 1
1116 1 61 GLU QB 1 63 ASP H 4.270 . 4.270 2.593 2.404 2.845 . 0 0 "[ . 1 . 2]" 1
1117 1 61 GLU QB 1 63 ASP QB 4.960 . 4.960 2.613 2.406 2.931 . 0 0 "[ . 1 . 2]" 1
1118 1 61 GLU HB2 1 62 HIS H 5.170 . 5.170 3.317 3.206 3.585 . 0 0 "[ . 1 . 2]" 1
1119 1 61 GLU HB2 1 63 ASP H 4.880 . 4.880 2.664 2.453 2.943 . 0 0 "[ . 1 . 2]" 1
1120 1 61 GLU HB3 1 62 HIS H 5.170 . 5.170 4.165 4.098 4.281 . 0 0 "[ . 1 . 2]" 1
1121 1 61 GLU HB3 1 63 ASP H 4.880 . 4.880 3.562 3.291 3.944 . 0 0 "[ . 1 . 2]" 1
1122 1 62 HIS H 1 62 HIS HD2 3.720 . 3.720 3.460 2.913 3.831 0.111 17 0 "[ . 1 . 2]" 1
1123 1 62 HIS H 1 63 ASP H 3.750 . 3.750 2.608 2.504 2.681 . 0 0 "[ . 1 . 2]" 1
1124 1 62 HIS HA 1 62 HIS HD2 3.740 . 3.740 2.971 2.382 3.822 0.082 6 0 "[ . 1 . 2]" 1
1125 1 62 HIS QB 1 62 HIS HD2 3.490 . 3.490 3.022 2.931 3.168 . 0 0 "[ . 1 . 2]" 1
1126 1 62 HIS HB2 1 62 HIS HD2 4.010 . 4.010 3.697 3.017 3.989 . 0 0 "[ . 1 . 2]" 1
1127 1 62 HIS HB3 1 62 HIS HD2 4.010 . 4.010 3.415 3.055 3.992 . 0 0 "[ . 1 . 2]" 1
1128 1 63 ASP H 1 63 ASP HB2 4.050 . 4.050 2.654 2.382 2.881 . 0 0 "[ . 1 . 2]" 1
1129 1 63 ASP H 1 63 ASP QB 3.550 . 3.550 2.305 2.256 2.416 . 0 0 "[ . 1 . 2]" 1
1130 1 63 ASP H 1 63 ASP HB3 4.050 . 4.050 2.626 2.371 3.655 . 0 0 "[ . 1 . 2]" 1
1131 1 63 ASP H 1 67 ALA MB 5.460 . 5.460 4.719 4.340 4.962 . 0 0 "[ . 1 . 2]" 1
1132 1 63 ASP HA 1 64 THR H 3.280 . 3.280 2.212 2.144 2.380 . 0 0 "[ . 1 . 2]" 1
1133 1 63 ASP HA 1 64 THR MG 4.730 . 4.730 3.748 3.579 4.048 . 0 0 "[ . 1 . 2]" 1
1134 1 63 ASP QB 1 64 THR H 4.700 . 4.700 3.993 3.839 4.068 . 0 0 "[ . 1 . 2]" 1
1135 1 63 ASP QB 1 66 GLY H 4.190 . 4.190 3.607 2.413 4.142 . 0 0 "[ . 1 . 2]" 1
1136 1 63 ASP QB 1 67 ALA H 4.790 . 4.790 4.014 3.553 4.242 . 0 0 "[ . 1 . 2]" 1
1137 1 63 ASP HB2 1 67 ALA H 5.630 . 5.630 5.533 4.186 5.779 0.149 20 0 "[ . 1 . 2]" 1
1138 1 63 ASP HB3 1 67 ALA H 5.630 . 5.630 4.137 3.842 4.376 . 0 0 "[ . 1 . 2]" 1
1139 1 64 THR H 1 64 THR HB 3.790 . 3.790 2.643 2.578 2.731 . 0 0 "[ . 1 . 2]" 1
1140 1 64 THR H 1 64 THR MG 3.650 . 3.650 2.056 1.935 2.157 . 0 0 "[ . 1 . 2]" 1
1141 1 64 THR H 1 65 ASP H 3.810 . 3.810 2.660 2.490 2.754 . 0 0 "[ . 1 . 2]" 1
1142 1 64 THR HA 1 64 THR MG 3.340 . 3.340 3.261 3.247 3.274 . 0 0 "[ . 1 . 2]" 1
1143 1 64 THR HA 1 67 ALA MB 3.530 . 3.530 2.572 2.195 3.225 . 0 0 "[ . 1 . 2]" 1
1144 1 64 THR HA 1 68 ARG H 4.780 . 4.780 4.060 3.794 4.259 . 0 0 "[ . 1 . 2]" 1
1145 1 64 THR HB 1 65 ASP H 4.180 . 4.180 4.120 4.030 4.205 0.025 1 0 "[ . 1 . 2]" 1
1146 1 64 THR MG 1 65 ASP H 4.990 . 4.990 2.353 2.171 2.530 . 0 0 "[ . 1 . 2]" 1
1147 1 64 THR MG 1 65 ASP HA 4.330 . 4.330 3.360 3.205 3.499 . 0 0 "[ . 1 . 2]" 1
1148 1 64 THR MG 1 68 ARG QD 4.550 . 4.550 3.608 2.877 4.700 0.150 10 0 "[ . 1 . 2]" 1
1149 1 65 ASP H 1 65 ASP HB2 3.810 . 3.810 2.586 2.416 2.726 . 0 0 "[ . 1 . 2]" 1
1150 1 65 ASP H 1 65 ASP HB3 3.810 . 3.810 2.765 2.343 3.661 . 0 0 "[ . 1 . 2]" 1
1151 1 65 ASP HA 1 68 ARG H 4.320 . 4.320 3.734 3.178 4.197 . 0 0 "[ . 1 . 2]" 1
1152 1 65 ASP HA 1 68 ARG QB 3.650 . 3.650 2.942 1.985 3.893 0.243 4 0 "[ . 1 . 2]" 1
1153 1 65 ASP HA 1 68 ARG QD 5.070 . 5.070 3.061 1.909 4.177 . 0 0 "[ . 1 . 2]" 1
1154 1 65 ASP HA 1 68 ARG QG 4.920 . 4.920 3.953 2.251 4.922 0.002 6 0 "[ . 1 . 2]" 1
1155 1 65 ASP HB2 1 66 GLY H 4.170 . 4.170 3.552 2.359 4.027 . 0 0 "[ . 1 . 2]" 1
1156 1 65 ASP HB3 1 66 GLY H 4.170 . 4.170 2.792 2.294 3.892 . 0 0 "[ . 1 . 2]" 1
1157 1 66 GLY H 1 67 ALA H 3.590 . 3.590 2.611 2.493 2.703 . 0 0 "[ . 1 . 2]" 1
1158 1 66 GLY QA 1 69 ARG H 4.600 . 4.600 3.245 2.923 3.581 . 0 0 "[ . 1 . 2]" 1
1159 1 67 ALA H 1 67 ALA MB 3.120 . 3.120 2.240 2.216 2.277 . 0 0 "[ . 1 . 2]" 1
1160 1 67 ALA H 1 68 ARG QB 5.200 . 5.200 4.613 4.222 4.845 . 0 0 "[ . 1 . 2]" 1
1161 1 67 ALA HA 1 70 ALA H 4.610 . 4.610 3.661 3.359 3.962 . 0 0 "[ . 1 . 2]" 1
1162 1 67 ALA HA 1 70 ALA MB 3.780 . 3.780 2.942 2.586 3.370 . 0 0 "[ . 1 . 2]" 1
1163 1 67 ALA MB 1 68 ARG H 3.550 . 3.550 2.551 2.332 2.776 . 0 0 "[ . 1 . 2]" 1
1164 1 67 ALA MB 1 69 ARG H 5.350 . 5.350 4.447 4.301 4.804 . 0 0 "[ . 1 . 2]" 1
1165 1 68 ARG H 1 68 ARG QB 3.210 . 3.210 2.362 2.114 2.454 . 0 0 "[ . 1 . 2]" 1
1166 1 68 ARG H 1 68 ARG QD 5.130 . 5.130 3.779 2.376 4.510 . 0 0 "[ . 1 . 2]" 1
1167 1 68 ARG H 1 68 ARG HG2 4.320 . 4.320 3.744 2.495 4.327 0.007 10 0 "[ . 1 . 2]" 1
1168 1 68 ARG H 1 68 ARG QG 3.740 . 3.740 2.618 2.308 3.906 0.166 10 0 "[ . 1 . 2]" 1
1169 1 68 ARG H 1 68 ARG HG3 4.320 . 4.320 2.759 2.334 4.448 0.128 10 0 "[ . 1 . 2]" 1
1170 1 68 ARG H 1 69 ARG H 3.610 . 3.610 2.548 2.467 2.694 . 0 0 "[ . 1 . 2]" 1
1171 1 68 ARG HA 1 68 ARG QD 4.960 . 4.960 4.148 2.600 4.377 . 0 0 "[ . 1 . 2]" 1
1172 1 68 ARG HA 1 68 ARG HG2 4.460 . 4.460 2.776 2.525 3.857 . 0 0 "[ . 1 . 2]" 1
1173 1 68 ARG HA 1 68 ARG QG 3.930 . 3.930 2.511 2.389 3.388 . 0 0 "[ . 1 . 2]" 1
1174 1 68 ARG HA 1 68 ARG HG3 4.460 . 4.460 2.970 2.563 3.754 . 0 0 "[ . 1 . 2]" 1
1175 1 68 ARG HA 1 71 ALA H 4.450 . 4.450 3.363 3.033 4.046 . 0 0 "[ . 1 . 2]" 1
1176 1 68 ARG HA 1 71 ALA MB 3.350 . 3.350 2.354 2.050 3.217 . 0 0 "[ . 1 . 2]" 1
1177 1 68 ARG HA 1 72 LYS H 5.250 . 5.250 4.090 3.409 4.496 . 0 0 "[ . 1 . 2]" 1
1178 1 68 ARG QB 1 69 ARG H 3.720 . 3.720 2.833 2.396 3.587 . 0 0 "[ . 1 . 2]" 1
1179 1 68 ARG QG 1 69 ARG H 5.130 . 5.130 4.198 2.485 4.743 . 0 0 "[ . 1 . 2]" 1
1180 1 69 ARG H 1 69 ARG HB2 3.730 . 3.730 2.525 2.117 3.634 . 0 0 "[ . 1 . 2]" 1
1181 1 69 ARG H 1 69 ARG QB 3.160 . 3.160 2.280 2.091 2.590 . 0 0 "[ . 1 . 2]" 1
1182 1 69 ARG H 1 69 ARG HB3 3.730 . 3.730 2.816 2.299 3.664 . 0 0 "[ . 1 . 2]" 1
1183 1 69 ARG H 1 69 ARG QG 4.670 . 4.670 3.560 2.148 4.069 . 0 0 "[ . 1 . 2]" 1
1184 1 69 ARG H 1 70 ALA H 3.620 . 3.620 2.582 2.429 2.730 . 0 0 "[ . 1 . 2]" 1
1185 1 69 ARG HA 1 69 ARG QD 5.130 . 5.130 3.796 2.135 4.625 . 0 0 "[ . 1 . 2]" 1
1186 1 69 ARG HA 1 69 ARG QG 3.570 . 3.570 2.589 2.340 3.401 . 0 0 "[ . 1 . 2]" 1
1187 1 69 ARG HA 1 72 LYS H 4.190 . 4.190 3.427 3.099 4.202 0.012 15 0 "[ . 1 . 2]" 1
1188 1 69 ARG HA 1 72 LYS QB 4.110 . 4.110 2.627 2.232 3.297 . 0 0 "[ . 1 . 2]" 1
1189 1 69 ARG HA 1 72 LYS QE 6.210 . 6.210 4.746 2.691 6.337 0.127 18 0 "[ . 1 . 2]" 1
1190 1 69 ARG QB 1 69 ARG QD 3.390 . 3.390 2.356 2.106 2.838 . 0 0 "[ . 1 . 2]" 1
1191 1 69 ARG QB 1 70 ALA H 4.010 . 4.010 2.608 2.247 3.563 . 0 0 "[ . 1 . 2]" 1
1192 1 69 ARG QB 1 70 ALA HA 5.610 . 5.610 4.164 3.732 4.553 . 0 0 "[ . 1 . 2]" 1
1193 1 69 ARG HB2 1 70 ALA H 4.760 . 4.760 3.530 2.277 4.109 . 0 0 "[ . 1 . 2]" 1
1194 1 69 ARG HB3 1 70 ALA H 4.760 . 4.760 2.878 2.359 4.030 . 0 0 "[ . 1 . 2]" 1
1195 1 70 ALA H 1 70 ALA MB 3.260 . 3.260 2.253 2.223 2.278 . 0 0 "[ . 1 . 2]" 1
1196 1 70 ALA H 1 71 ALA H 3.730 . 3.730 2.549 2.444 2.622 . 0 0 "[ . 1 . 2]" 1
1197 1 70 ALA HA 1 72 LYS H 5.370 . 5.370 4.249 4.068 4.566 . 0 0 "[ . 1 . 2]" 1
1198 1 70 ALA HA 1 73 SER H 5.550 . 5.550 3.524 3.310 3.731 . 0 0 "[ . 1 . 2]" 1
1199 1 70 ALA HA 1 73 SER HB2 4.570 . 4.570 3.130 2.545 3.880 . 0 0 "[ . 1 . 2]" 1
1200 1 70 ALA HA 1 73 SER QB 3.970 . 3.970 2.774 2.351 3.039 . 0 0 "[ . 1 . 2]" 1
1201 1 70 ALA HA 1 73 SER HB3 4.570 . 4.570 3.814 2.403 4.611 0.041 11 0 "[ . 1 . 2]" 1
1202 1 70 ALA MB 1 71 ALA H 3.820 . 3.820 2.660 2.558 2.805 . 0 0 "[ . 1 . 2]" 1
1203 1 70 ALA MB 1 73 SER H 4.990 . 4.990 4.733 4.612 4.838 . 0 0 "[ . 1 . 2]" 1
1204 1 71 ALA H 1 71 ALA MB 3.070 . 3.070 2.251 2.224 2.306 . 0 0 "[ . 1 . 2]" 1
1205 1 71 ALA H 1 72 LYS H 3.630 . 3.630 2.581 2.510 2.672 . 0 0 "[ . 1 . 2]" 1
1206 1 71 ALA H 1 74 LEU MD1 6.100 . 6.100 3.995 3.793 4.205 . 0 0 "[ . 1 . 2]" 1
1207 1 71 ALA HA 1 74 LEU H 4.000 . 4.000 3.316 3.145 3.671 . 0 0 "[ . 1 . 2]" 1
1208 1 71 ALA HA 1 74 LEU HB2 4.130 . 4.130 2.138 1.927 2.508 . 0 0 "[ . 1 . 2]" 1
1209 1 71 ALA HA 1 74 LEU QB 3.560 . 3.560 2.123 1.917 2.482 . 0 0 "[ . 1 . 2]" 1
1210 1 71 ALA HA 1 74 LEU HB3 4.130 . 4.130 3.632 3.427 3.958 . 0 0 "[ . 1 . 2]" 1
1211 1 71 ALA HA 1 74 LEU MD1 4.020 . 4.020 2.074 1.752 2.470 . 0 0 "[ . 1 . 2]" 1
1212 1 71 ALA HA 1 74 LEU MD2 4.940 . 4.940 4.484 4.242 4.885 . 0 0 "[ . 1 . 2]" 1
1213 1 71 ALA HA 1 75 SER H 5.300 . 5.300 4.150 3.927 4.346 . 0 0 "[ . 1 . 2]" 1
1214 1 71 ALA MB 1 72 LYS H 3.560 . 3.560 2.767 2.535 2.881 . 0 0 "[ . 1 . 2]" 1
1215 1 71 ALA MB 1 74 LEU H 4.900 . 4.900 4.514 4.390 4.708 . 0 0 "[ . 1 . 2]" 1
1216 1 71 ALA MB 1 75 SER H 4.810 . 4.810 4.618 4.455 4.760 . 0 0 "[ . 1 . 2]" 1
1217 1 72 LYS H 1 72 LYS HB2 3.480 . 3.480 2.544 2.212 2.709 . 0 0 "[ . 1 . 2]" 1
1218 1 72 LYS H 1 72 LYS HB3 3.480 . 3.480 2.628 2.412 3.607 0.127 2 0 "[ . 1 . 2]" 1
1219 1 72 LYS H 1 72 LYS HG2 5.480 . 5.480 4.469 3.586 4.711 . 0 0 "[ . 1 . 2]" 1
1220 1 72 LYS H 1 72 LYS QG 4.570 . 4.570 3.936 2.337 4.128 . 0 0 "[ . 1 . 2]" 1
1221 1 72 LYS H 1 72 LYS HG3 5.480 . 5.480 4.409 2.368 4.612 . 0 0 "[ . 1 . 2]" 1
1222 1 72 LYS HA 1 72 LYS HG2 4.290 . 4.290 3.298 2.515 3.870 . 0 0 "[ . 1 . 2]" 1
1223 1 72 LYS HA 1 72 LYS HG3 4.290 . 4.290 2.940 2.504 3.740 . 0 0 "[ . 1 . 2]" 1
1224 1 72 LYS QB 1 73 SER H 3.560 . 3.560 2.478 2.339 2.722 . 0 0 "[ . 1 . 2]" 1
1225 1 72 LYS QB 1 73 SER HA 5.190 . 5.190 4.195 3.955 4.345 . 0 0 "[ . 1 . 2]" 1
1226 1 72 LYS HB2 1 73 SER H 4.200 . 4.200 3.681 2.485 3.944 . 0 0 "[ . 1 . 2]" 1
1227 1 72 LYS HB3 1 73 SER H 4.200 . 4.200 2.588 2.364 3.508 . 0 0 "[ . 1 . 2]" 1
1228 1 72 LYS QG 1 73 SER H 5.030 . 5.030 3.744 3.394 4.596 . 0 0 "[ . 1 . 2]" 1
1229 1 72 LYS HG2 1 73 SER H 5.810 . 5.810 4.235 3.510 5.205 . 0 0 "[ . 1 . 2]" 1
1230 1 72 LYS HG3 1 73 SER H 5.810 . 5.810 4.457 3.507 5.115 . 0 0 "[ . 1 . 2]" 1
1231 1 73 SER H 1 73 SER HB2 4.290 . 4.290 2.474 2.381 2.520 . 0 0 "[ . 1 . 2]" 1
1232 1 73 SER H 1 73 SER QB 3.550 . 3.550 2.368 2.216 2.464 . 0 0 "[ . 1 . 2]" 1
1233 1 73 SER H 1 73 SER HB3 4.290 . 4.290 3.202 2.614 3.609 . 0 0 "[ . 1 . 2]" 1
1234 1 73 SER H 1 74 LEU H 3.530 . 3.530 2.599 2.466 2.674 . 0 0 "[ . 1 . 2]" 1
1235 1 73 SER HA 1 76 GLU H 4.540 . 4.540 3.456 3.201 3.726 . 0 0 "[ . 1 . 2]" 1
1236 1 73 SER HA 1 76 GLU QB 3.890 . 3.890 2.844 2.232 4.059 0.169 15 0 "[ . 1 . 2]" 1
1237 1 73 SER HA 1 77 ALA H 5.370 . 5.370 4.225 4.015 4.387 . 0 0 "[ . 1 . 2]" 1
1238 1 73 SER QB 1 74 LEU H 3.900 . 3.900 2.778 2.642 2.879 . 0 0 "[ . 1 . 2]" 1
1239 1 73 SER HB2 1 74 LEU H 4.670 . 4.670 3.281 2.702 4.033 . 0 0 "[ . 1 . 2]" 1
1240 1 73 SER HB3 1 74 LEU H 4.670 . 4.670 3.459 2.733 3.936 . 0 0 "[ . 1 . 2]" 1
1241 1 74 LEU H 1 74 LEU HB2 3.710 . 3.710 2.272 2.227 2.330 . 0 0 "[ . 1 . 2]" 1
1242 1 74 LEU H 1 74 LEU QB 3.200 . 3.200 2.247 2.204 2.300 . 0 0 "[ . 1 . 2]" 1
1243 1 74 LEU H 1 74 LEU HB3 3.710 . 3.710 3.555 3.522 3.582 . 0 0 "[ . 1 . 2]" 1
1244 1 74 LEU H 1 74 LEU MD1 4.590 . 4.590 3.706 3.474 3.781 . 0 0 "[ . 1 . 2]" 1
1245 1 74 LEU H 1 74 LEU MD2 4.760 . 4.760 3.898 3.741 3.997 . 0 0 "[ . 1 . 2]" 1
1246 1 74 LEU H 1 74 LEU HG 3.900 . 3.900 2.876 2.543 2.999 . 0 0 "[ . 1 . 2]" 1
1247 1 74 LEU H 1 75 SER H 3.590 . 3.590 2.704 2.573 2.807 . 0 0 "[ . 1 . 2]" 1
1248 1 74 LEU HA 1 74 LEU MD1 3.970 . 3.970 3.879 3.852 3.908 . 0 0 "[ . 1 . 2]" 1
1249 1 74 LEU HA 1 74 LEU MD2 3.690 . 3.690 2.024 1.972 2.097 . 0 0 "[ . 1 . 2]" 1
1250 1 74 LEU HA 1 74 LEU HG 4.210 . 4.210 2.761 2.689 2.846 . 0 0 "[ . 1 . 2]" 1
1251 1 74 LEU HA 1 77 ALA H 4.420 . 4.420 3.275 3.122 3.382 . 0 0 "[ . 1 . 2]" 1
1252 1 74 LEU HA 1 77 ALA MB 3.830 . 3.830 2.290 2.064 2.523 . 0 0 "[ . 1 . 2]" 1
1253 1 74 LEU HA 1 78 TYR H 4.900 . 4.900 4.007 3.764 4.158 . 0 0 "[ . 1 . 2]" 1
1254 1 74 LEU HA 1 78 TYR QD 5.200 . 5.200 4.345 3.831 4.801 . 0 0 "[ . 1 . 2]" 1
1255 1 74 LEU HA 1 78 TYR QE 4.540 . 4.540 4.320 4.014 4.582 0.042 6 0 "[ . 1 . 2]" 1
1256 1 74 LEU QB 1 78 TYR QE 3.540 . 3.540 2.227 1.975 2.508 . 0 0 "[ . 1 . 2]" 1
1257 1 74 LEU HB2 1 74 LEU MD1 3.590 . 3.590 2.341 2.311 2.371 . 0 0 "[ . 1 . 2]" 1
1258 1 74 LEU HB2 1 75 SER H 3.890 . 3.890 2.772 2.658 2.901 . 0 0 "[ . 1 . 2]" 1
1259 1 74 LEU HB3 1 74 LEU MD1 3.590 . 3.590 2.520 2.494 2.562 . 0 0 "[ . 1 . 2]" 1
1260 1 74 LEU HB3 1 75 SER H 3.890 . 3.890 3.337 3.130 3.572 . 0 0 "[ . 1 . 2]" 1
1261 1 74 LEU MD1 1 75 SER H 4.920 . 4.920 4.671 4.540 4.798 . 0 0 "[ . 1 . 2]" 1
1262 1 74 LEU MD1 1 78 TYR QD 5.350 . 5.350 4.842 4.625 5.123 . 0 0 "[ . 1 . 2]" 1
1263 1 74 LEU MD1 1 78 TYR QE 4.430 . 4.430 3.160 2.891 3.460 . 0 0 "[ . 1 . 2]" 1
1264 1 74 LEU MD2 1 75 SER H 5.810 . 5.810 4.715 4.637 4.813 . 0 0 "[ . 1 . 2]" 1
1265 1 74 LEU MD2 1 77 ALA H 6.170 . 6.170 4.715 4.560 4.912 . 0 0 "[ . 1 . 2]" 1
1266 1 74 LEU MD2 1 77 ALA MB 4.200 . 4.200 2.881 2.627 3.135 . 0 0 "[ . 1 . 2]" 1
1267 1 74 LEU MD2 1 78 TYR H 6.010 . 6.010 4.621 4.406 4.786 . 0 0 "[ . 1 . 2]" 1
1268 1 74 LEU MD2 1 78 TYR HB2 5.470 . 5.470 5.498 5.295 5.673 0.203 2 0 "[ . 1 . 2]" 1
1269 1 74 LEU MD2 1 78 TYR QD 4.340 . 4.340 3.905 3.668 4.131 . 0 0 "[ . 1 . 2]" 1
1270 1 74 LEU MD2 1 78 TYR QE 3.070 . 3.070 2.675 2.224 3.017 . 0 0 "[ . 1 . 2]" 1
1271 1 74 LEU HG 1 75 SER H 5.130 . 5.130 4.774 4.578 4.870 . 0 0 "[ . 1 . 2]" 1
1272 1 74 LEU HG 1 78 TYR QD 6.300 . 6.300 5.878 5.550 6.219 . 0 0 "[ . 1 . 2]" 1
1273 1 74 LEU HG 1 78 TYR QE 5.130 . 5.130 4.799 4.566 5.046 . 0 0 "[ . 1 . 2]" 1
1274 1 75 SER H 1 75 SER QB 3.090 . 3.090 2.370 2.232 2.627 . 0 0 "[ . 1 . 2]" 1
1275 1 75 SER H 1 76 GLU H 3.560 . 3.560 2.720 2.623 2.790 . 0 0 "[ . 1 . 2]" 1
1276 1 75 SER HA 1 78 TYR H 4.430 . 4.430 3.674 3.271 3.934 . 0 0 "[ . 1 . 2]" 1
1277 1 75 SER HA 1 78 TYR HB2 4.420 . 4.420 3.097 2.562 3.399 . 0 0 "[ . 1 . 2]" 1
1278 1 75 SER HA 1 78 TYR HB3 4.910 . 4.910 4.745 4.217 5.050 0.140 7 0 "[ . 1 . 2]" 1
1279 1 75 SER HA 1 78 TYR QD 3.200 . 3.200 2.593 2.097 3.018 . 0 0 "[ . 1 . 2]" 1
1280 1 75 SER HA 1 78 TYR QE 4.760 . 4.760 4.484 3.944 4.883 0.123 13 0 "[ . 1 . 2]" 1
1281 1 75 SER QB 1 76 GLU H 3.530 . 3.530 2.679 2.400 3.452 . 0 0 "[ . 1 . 2]" 1
1282 1 75 SER QB 1 78 TYR H 5.950 . 5.950 5.182 4.863 5.460 . 0 0 "[ . 1 . 2]" 1
1283 1 76 GLU H 1 76 GLU HB2 3.700 . 3.700 2.475 2.010 3.621 . 0 0 "[ . 1 . 2]" 1
1284 1 76 GLU H 1 76 GLU QB 3.190 . 3.190 2.382 1.981 2.634 . 0 0 "[ . 1 . 2]" 1
1285 1 76 GLU H 1 76 GLU HB3 3.700 . 3.700 3.426 2.664 3.639 . 0 0 "[ . 1 . 2]" 1
1286 1 76 GLU H 1 76 GLU HG2 4.130 . 4.130 3.049 1.995 4.013 . 0 0 "[ . 1 . 2]" 1
1287 1 76 GLU H 1 76 GLU QG 3.410 . 3.410 2.500 1.977 3.692 0.282 2 0 "[ . 1 . 2]" 1
1288 1 76 GLU H 1 76 GLU HG3 4.130 . 4.130 3.214 2.152 4.323 0.193 10 0 "[ . 1 . 2]" 1
1289 1 76 GLU H 1 77 ALA H 3.630 . 3.630 2.592 2.451 2.779 . 0 0 "[ . 1 . 2]" 1
1290 1 76 GLU H 1 77 ALA MB 5.000 . 5.000 4.257 4.090 4.439 . 0 0 "[ . 1 . 2]" 1
1291 1 76 GLU H 1 78 TYR H 5.240 . 5.240 4.272 4.113 4.489 . 0 0 "[ . 1 . 2]" 1
1292 1 76 GLU HA 1 76 GLU QG 3.490 . 3.490 2.712 2.343 3.364 . 0 0 "[ . 1 . 2]" 1
1293 1 76 GLU HA 1 78 TYR H 6.140 . 6.140 4.572 4.396 4.773 . 0 0 "[ . 1 . 2]" 1
1294 1 76 GLU HA 1 79 GLN H 4.260 . 4.260 3.791 3.454 4.247 . 0 0 "[ . 1 . 2]" 1
1295 1 76 GLU HA 1 79 GLN QB 4.250 . 4.250 3.278 2.568 4.268 0.018 2 0 "[ . 1 . 2]" 1
1296 1 76 GLU HA 1 79 GLN HE21 4.940 . 4.940 2.932 1.750 4.933 . 0 0 "[ . 1 . 2]" 1
1297 1 76 GLU HA 1 79 GLN HE22 5.250 . 5.250 3.387 2.558 5.336 0.086 5 0 "[ . 1 . 2]" 1
1298 1 76 GLU HA 1 79 GLN HG2 5.010 . 5.010 4.429 2.397 5.092 0.082 6 0 "[ . 1 . 2]" 1
1299 1 76 GLU HA 1 79 GLN QG 4.320 . 4.320 3.161 2.237 3.693 . 0 0 "[ . 1 . 2]" 1
1300 1 76 GLU HA 1 79 GLN HG3 5.010 . 5.010 3.265 2.679 3.859 . 0 0 "[ . 1 . 2]" 1
1301 1 76 GLU QB 1 77 ALA H 3.620 . 3.620 2.700 2.436 3.637 0.017 15 0 "[ . 1 . 2]" 1
1302 1 76 GLU HB2 1 77 ALA H 4.180 . 4.180 2.921 2.476 4.006 . 0 0 "[ . 1 . 2]" 1
1303 1 76 GLU HB3 1 77 ALA H 4.180 . 4.180 3.586 2.673 4.170 . 0 0 "[ . 1 . 2]" 1
1304 1 76 GLU QG 1 77 ALA H 4.760 . 4.760 4.073 2.460 4.683 . 0 0 "[ . 1 . 2]" 1
1305 1 76 GLU QG 1 79 GLN HE22 6.100 . 6.100 4.300 2.798 6.211 0.111 5 0 "[ . 1 . 2]" 1
1306 1 77 ALA H 1 77 ALA MB 3.160 . 3.160 2.239 2.214 2.281 . 0 0 "[ . 1 . 2]" 1
1307 1 77 ALA H 1 78 TYR H 3.580 . 3.580 2.668 2.550 2.848 . 0 0 "[ . 1 . 2]" 1
1308 1 77 ALA H 1 78 TYR HB2 5.310 . 5.310 4.768 4.576 4.963 . 0 0 "[ . 1 . 2]" 1
1309 1 77 ALA H 1 79 GLN QB 6.300 . 6.300 5.124 4.806 5.608 . 0 0 "[ . 1 . 2]" 1
1310 1 77 ALA HA 1 80 LYS H 4.200 . 4.200 3.637 3.399 3.866 . 0 0 "[ . 1 . 2]" 1
1311 1 77 ALA HA 1 80 LYS QB 4.590 . 4.590 3.305 2.666 4.632 0.042 5 0 "[ . 1 . 2]" 1
1312 1 77 ALA HA 1 80 LYS QD 4.260 . 4.260 2.788 2.300 3.589 . 0 0 "[ . 1 . 2]" 1
1313 1 77 ALA HA 1 80 LYS QE 4.240 . 4.240 3.524 2.090 4.356 0.116 13 0 "[ . 1 . 2]" 1
1314 1 77 ALA HA 1 80 LYS QG 4.600 . 4.600 3.389 2.557 4.741 0.141 11 0 "[ . 1 . 2]" 1
1315 1 77 ALA HA 1 81 VAL H 5.490 . 5.490 4.693 4.307 5.304 . 0 0 "[ . 1 . 2]" 1
1316 1 77 ALA HA 1 81 VAL MG2 4.650 . 4.650 4.080 3.742 4.481 . 0 0 "[ . 1 . 2]" 1
1317 1 77 ALA MB 1 78 TYR H 3.580 . 3.580 2.573 2.429 2.693 . 0 0 "[ . 1 . 2]" 1
1318 1 77 ALA MB 1 78 TYR HA 5.040 . 5.040 3.862 3.762 3.929 . 0 0 "[ . 1 . 2]" 1
1319 1 77 ALA MB 1 78 TYR QD 5.080 . 5.080 3.994 3.665 4.216 . 0 0 "[ . 1 . 2]" 1
1320 1 78 TYR H 1 78 TYR HB2 3.500 . 3.500 2.399 2.302 2.454 . 0 0 "[ . 1 . 2]" 1
1321 1 78 TYR H 1 78 TYR HB3 3.850 . 3.850 3.605 3.564 3.633 . 0 0 "[ . 1 . 2]" 1
1322 1 78 TYR H 1 78 TYR QD 3.600 . 3.600 3.182 2.934 3.402 . 0 0 "[ . 1 . 2]" 1
1323 1 78 TYR H 1 79 GLN H 3.650 . 3.650 2.647 2.558 2.762 . 0 0 "[ . 1 . 2]" 1
1324 1 78 TYR H 1 79 GLN QB 5.170 . 5.170 4.708 4.543 5.016 . 0 0 "[ . 1 . 2]" 1
1325 1 78 TYR H 1 80 LYS H 5.200 . 5.200 4.218 4.009 4.548 . 0 0 "[ . 1 . 2]" 1
1326 1 78 TYR H 1 81 VAL H 6.280 . 6.280 4.846 4.666 5.085 . 0 0 "[ . 1 . 2]" 1
1327 1 78 TYR H 1 81 VAL MG2 5.500 . 5.500 4.481 3.935 4.871 . 0 0 "[ . 1 . 2]" 1
1328 1 78 TYR HA 1 78 TYR QD 2.740 . 2.740 2.290 1.953 2.620 . 0 0 "[ . 1 . 2]" 1
1329 1 78 TYR HA 1 78 TYR QE 4.710 . 4.710 4.373 4.262 4.537 . 0 0 "[ . 1 . 2]" 1
1330 1 78 TYR HA 1 80 LYS H 4.850 . 4.850 4.122 3.914 4.422 . 0 0 "[ . 1 . 2]" 1
1331 1 78 TYR HA 1 81 VAL H 4.360 . 4.360 3.222 2.983 3.441 . 0 0 "[ . 1 . 2]" 1
1332 1 78 TYR HA 1 81 VAL HB 4.340 . 4.340 2.452 2.135 2.752 . 0 0 "[ . 1 . 2]" 1
1333 1 78 TYR HA 1 81 VAL MG1 4.300 . 4.300 3.828 3.391 3.988 . 0 0 "[ . 1 . 2]" 1
1334 1 78 TYR HA 1 81 VAL MG2 3.580 . 3.580 2.934 2.160 3.527 . 0 0 "[ . 1 . 2]" 1
1335 1 78 TYR HA 1 82 GLU H 5.120 . 5.120 3.816 3.077 4.552 . 0 0 "[ . 1 . 2]" 1
1336 1 78 TYR HB2 1 79 GLN H 4.210 . 4.210 3.023 2.824 3.192 . 0 0 "[ . 1 . 2]" 1
1337 1 78 TYR HB3 1 79 GLN H 4.550 . 4.550 3.809 3.600 3.941 . 0 0 "[ . 1 . 2]" 1
1338 1 78 TYR QD 1 81 VAL MG1 4.760 . 4.760 3.612 3.211 3.819 . 0 0 "[ . 1 . 2]" 1
1339 1 78 TYR QD 1 81 VAL MG2 4.450 . 4.450 3.611 2.300 4.316 . 0 0 "[ . 1 . 2]" 1
1340 1 78 TYR QE 1 81 VAL MG1 4.570 . 4.570 4.547 4.003 4.743 0.173 6 0 "[ . 1 . 2]" 1
1341 1 79 GLN H 1 79 GLN QB 3.200 . 3.200 2.482 2.352 2.666 . 0 0 "[ . 1 . 2]" 1
1342 1 79 GLN H 1 79 GLN HG2 4.270 . 4.270 3.391 2.027 3.818 . 0 0 "[ . 1 . 2]" 1
1343 1 79 GLN H 1 79 GLN QG 3.620 . 3.620 2.231 1.944 2.552 . 0 0 "[ . 1 . 2]" 1
1344 1 79 GLN H 1 79 GLN HG3 4.270 . 4.270 2.403 1.967 3.638 . 0 0 "[ . 1 . 2]" 1
1345 1 79 GLN HA 1 79 GLN HG2 4.180 . 4.180 2.717 2.554 3.200 . 0 0 "[ . 1 . 2]" 1
1346 1 79 GLN HA 1 79 GLN QG 3.550 . 3.550 2.552 2.425 3.058 . 0 0 "[ . 1 . 2]" 1
1347 1 79 GLN HA 1 79 GLN HG3 4.180 . 4.180 3.117 2.737 3.883 . 0 0 "[ . 1 . 2]" 1
1348 1 79 GLN HA 1 81 VAL H 5.730 . 5.730 4.360 3.878 4.670 . 0 0 "[ . 1 . 2]" 1
1349 1 79 GLN HA 1 81 VAL HB 5.670 . 5.670 5.535 5.147 5.884 0.214 3 0 "[ . 1 . 2]" 1
1350 1 79 GLN HA 1 82 GLU QB 4.500 . 4.500 3.433 2.603 4.466 . 0 0 "[ . 1 . 2]" 1
1351 1 79 GLN QB 1 80 LYS H 3.850 . 3.850 2.675 2.472 2.989 . 0 0 "[ . 1 . 2]" 1
1352 1 79 GLN QB 1 80 LYS HA 4.400 . 4.400 3.973 3.780 4.197 . 0 0 "[ . 1 . 2]" 1
1353 1 79 GLN QB 1 80 LYS HG2 5.200 . 5.200 4.105 3.541 4.973 . 0 0 "[ . 1 . 2]" 1
1354 1 79 GLN QB 1 80 LYS QG 4.570 . 4.570 3.127 2.471 4.076 . 0 0 "[ . 1 . 2]" 1
1355 1 79 GLN QB 1 80 LYS HG3 5.200 . 5.200 3.306 2.505 5.199 . 0 0 "[ . 1 . 2]" 1
1356 1 80 LYS H 1 80 LYS QB 3.230 . 3.230 2.492 2.361 2.729 . 0 0 "[ . 1 . 2]" 1
1357 1 80 LYS H 1 80 LYS QD 4.700 . 4.700 3.682 2.006 4.076 . 0 0 "[ . 1 . 2]" 1
1358 1 80 LYS H 1 80 LYS HG2 4.390 . 4.390 3.435 2.010 4.112 . 0 0 "[ . 1 . 2]" 1
1359 1 80 LYS H 1 80 LYS QG 3.750 . 3.750 2.315 1.928 3.432 . 0 0 "[ . 1 . 2]" 1
1360 1 80 LYS H 1 80 LYS HG3 4.390 . 4.390 2.416 1.942 3.746 . 0 0 "[ . 1 . 2]" 1
1361 1 80 LYS H 1 81 VAL HA 5.340 . 5.340 5.140 5.056 5.226 . 0 0 "[ . 1 . 2]" 1
1362 1 80 LYS H 1 81 VAL MG2 4.450 . 4.450 3.889 3.601 4.296 . 0 0 "[ . 1 . 2]" 1
1363 1 80 LYS H 1 82 GLU H 5.170 . 5.170 4.178 3.810 4.778 . 0 0 "[ . 1 . 2]" 1
1364 1 80 LYS HA 1 80 LYS HG2 4.190 . 4.190 2.822 2.500 3.792 . 0 0 "[ . 1 . 2]" 1
1365 1 80 LYS HA 1 80 LYS QG 3.560 . 3.560 2.563 2.388 3.393 . 0 0 "[ . 1 . 2]" 1
1366 1 80 LYS HA 1 80 LYS HG3 4.190 . 4.190 3.123 2.475 3.824 . 0 0 "[ . 1 . 2]" 1
1367 1 80 LYS QB 1 81 VAL H 3.700 . 3.700 2.876 2.483 3.559 . 0 0 "[ . 1 . 2]" 1
1368 1 80 LYS QB 1 81 VAL HA 4.610 . 4.610 4.090 3.910 4.436 . 0 0 "[ . 1 . 2]" 1
1369 1 80 LYS QB 1 81 VAL MG2 5.310 . 5.310 3.160 2.735 4.195 . 0 0 "[ . 1 . 2]" 1
1370 1 81 VAL H 1 81 VAL HB 3.510 . 3.510 2.462 2.286 2.652 . 0 0 "[ . 1 . 2]" 1
1371 1 81 VAL H 1 81 VAL MG1 4.140 . 4.140 3.804 3.730 3.896 . 0 0 "[ . 1 . 2]" 1
1372 1 81 VAL H 1 81 VAL MG2 3.280 . 3.280 2.319 2.032 2.789 . 0 0 "[ . 1 . 2]" 1
1373 1 81 VAL H 1 82 GLU H 3.710 . 3.710 2.572 2.244 2.990 . 0 0 "[ . 1 . 2]" 1
1374 1 81 VAL HA 1 81 VAL MG1 3.380 . 3.380 2.543 2.461 2.713 . 0 0 "[ . 1 . 2]" 1
1375 1 81 VAL HA 1 81 VAL MG2 3.300 . 3.300 2.391 2.278 2.493 . 0 0 "[ . 1 . 2]" 1
1376 1 81 VAL HA 1 82 GLU H 3.630 . 3.630 3.543 3.439 3.650 0.020 12 0 "[ . 1 . 2]" 1
1377 1 81 VAL HB 1 82 GLU H 3.860 . 3.860 2.650 2.046 3.383 . 0 0 "[ . 1 . 2]" 1
1378 1 81 VAL HB 1 82 GLU HA 5.580 . 5.580 4.530 4.033 4.776 . 0 0 "[ . 1 . 2]" 1
1379 1 81 VAL MG1 1 82 GLU H 4.250 . 4.250 3.351 2.705 3.946 . 0 0 "[ . 1 . 2]" 1
1380 1 81 VAL MG1 1 82 GLU HA 4.400 . 4.400 3.578 2.984 4.042 . 0 0 "[ . 1 . 2]" 1
1381 1 81 VAL MG1 1 82 GLU QG 4.860 . 4.860 3.717 2.402 5.121 0.261 16 0 "[ . 1 . 2]" 1
1382 1 81 VAL MG2 1 82 GLU H 4.230 . 4.230 3.897 3.688 4.196 . 0 0 "[ . 1 . 2]" 1
1383 1 82 GLU H 1 82 GLU QB 3.640 . 3.640 2.468 2.211 3.221 . 0 0 "[ . 1 . 2]" 1
1384 1 82 GLU H 1 82 GLU HG2 5.390 . 5.390 3.601 2.126 4.679 . 0 0 "[ . 1 . 2]" 1
1385 1 82 GLU H 1 82 GLU QG 4.480 . 4.480 2.700 2.113 4.245 . 0 0 "[ . 1 . 2]" 1
1386 1 82 GLU H 1 82 GLU HG3 5.390 . 5.390 3.040 2.176 4.863 . 0 0 "[ . 1 . 2]" 1
1387 1 82 GLU HA 1 82 GLU QG 3.910 . 3.910 2.598 2.335 3.107 . 0 0 "[ . 1 . 2]" 1
1388 1 82 GLU QB 1 83 GLY H 4.640 . 4.640 3.176 1.791 4.020 . 0 0 "[ . 1 . 2]" 1
1389 1 82 GLU QB 1 83 GLY QA 5.060 . 5.060 4.053 3.595 4.412 . 0 0 "[ . 1 . 2]" 1
1390 1 82 GLU HB2 1 83 GLY H 5.480 . 5.480 3.712 2.063 4.597 . 0 0 "[ . 1 . 2]" 1
1391 1 82 GLU HB2 1 83 GLY QA 5.850 . 5.850 4.682 3.957 5.480 . 0 0 "[ . 1 . 2]" 1
1392 1 82 GLU HB3 1 83 GLY H 5.480 . 5.480 3.724 1.808 4.533 . 0 0 "[ . 1 . 2]" 1
1393 1 82 GLU HB3 1 83 GLY QA 5.850 . 5.850 4.508 3.805 4.984 . 0 0 "[ . 1 . 2]" 1
1394 1 82 GLU QG 1 83 GLY H 5.010 . 5.010 4.137 2.250 4.611 . 0 0 "[ . 1 . 2]" 1
1395 1 82 GLU HG2 1 83 GLY H 5.880 . 5.880 4.762 3.839 5.635 . 0 0 "[ . 1 . 2]" 1
1396 1 82 GLU HG3 1 83 GLY H 5.880 . 5.880 4.747 2.265 5.593 . 0 0 "[ . 1 . 2]" 1
1397 1 87 LYS H 1 87 LYS QB 3.830 . 3.830 2.604 2.190 3.402 . 0 0 "[ . 1 . 2]" 1
1398 1 89 LYS H 1 89 LYS QB 3.800 . 3.800 2.657 2.246 3.398 . 0 0 "[ . 1 . 2]" 1
1399 1 89 LYS H 1 89 LYS HG2 5.390 . 5.390 3.838 2.004 4.753 . 0 0 "[ . 1 . 2]" 1
1400 1 89 LYS H 1 89 LYS QG 4.600 . 4.600 3.231 1.983 4.152 . 0 0 "[ . 1 . 2]" 1
1401 1 89 LYS H 1 89 LYS HG3 5.390 . 5.390 3.675 2.358 4.703 . 0 0 "[ . 1 . 2]" 1
1402 1 89 LYS HA 1 89 LYS QD 4.540 . 4.540 3.905 2.755 4.596 0.056 17 0 "[ . 1 . 2]" 1
1403 1 89 LYS HA 1 90 ILE H 3.390 . 3.390 2.233 2.079 2.639 . 0 0 "[ . 1 . 2]" 1
1404 1 89 LYS HA 1 90 ILE MD 5.010 . 5.010 4.520 2.834 5.226 0.216 1 0 "[ . 1 . 2]" 1
1405 1 89 LYS QB 1 90 ILE H 4.410 . 4.410 3.530 1.996 4.044 . 0 0 "[ . 1 . 2]" 1
1406 1 89 LYS QG 1 90 ILE H 4.760 . 4.760 3.996 3.222 4.535 . 0 0 "[ . 1 . 2]" 1
1407 1 90 ILE H 1 90 ILE HB 4.120 . 4.120 3.333 2.450 3.834 . 0 0 "[ . 1 . 2]" 1
1408 1 90 ILE H 1 90 ILE MD 5.020 . 5.020 3.224 1.956 3.953 . 0 0 "[ . 1 . 2]" 1
1409 1 90 ILE H 1 90 ILE QG 4.010 . 4.010 2.416 1.756 3.606 . 0 0 "[ . 1 . 2]" 1
1410 1 90 ILE H 1 90 ILE MG 4.640 . 4.640 3.170 2.241 4.073 . 0 0 "[ . 1 . 2]" 1
1411 1 90 ILE H 1 91 PHE H 4.340 . 4.340 3.664 2.425 4.445 0.105 1 0 "[ . 1 . 2]" 1
1412 1 90 ILE HA 1 90 ILE MD 4.600 . 4.600 3.683 2.122 4.284 . 0 0 "[ . 1 . 2]" 1
1413 1 90 ILE HA 1 90 ILE MG 3.720 . 3.720 2.393 2.293 2.578 . 0 0 "[ . 1 . 2]" 1
1414 1 90 ILE HA 1 91 PHE H 3.400 . 3.400 2.483 2.109 3.437 0.037 7 0 "[ . 1 . 2]" 1
1415 1 90 ILE HB 1 91 PHE H 4.440 . 4.440 4.207 3.449 4.526 0.086 17 0 "[ . 1 . 2]" 1
1416 1 90 ILE MG 1 91 PHE H 4.600 . 4.600 3.856 2.855 4.417 . 0 0 "[ . 1 . 2]" 1
1417 1 91 PHE H 1 91 PHE HB2 4.380 . 4.380 2.648 2.416 3.259 . 0 0 "[ . 1 . 2]" 1
1418 1 91 PHE H 1 91 PHE QB 3.620 . 3.620 2.442 2.244 3.040 . 0 0 "[ . 1 . 2]" 1
1419 1 91 PHE H 1 91 PHE HB3 4.380 . 4.380 3.103 2.481 3.730 . 0 0 "[ . 1 . 2]" 1
1420 1 91 PHE H 1 91 PHE QD 5.080 . 5.080 3.632 2.318 4.410 . 0 0 "[ . 1 . 2]" 1
1421 1 91 PHE HA 1 91 PHE QD 3.760 . 3.760 2.690 2.384 2.936 . 0 0 "[ . 1 . 2]" 1
1422 1 91 PHE HA 1 91 PHE QE 4.490 . 4.490 4.576 4.414 4.634 0.144 6 0 "[ . 1 . 2]" 1
1423 1 91 PHE HA 1 92 GLN H 3.610 . 3.610 2.427 2.104 3.567 . 0 0 "[ . 1 . 2]" 1
1424 1 92 GLN HA 1 93 LYS H 3.530 . 3.530 2.484 2.134 3.059 . 0 0 "[ . 1 . 2]" 1
1425 1 92 GLN QB 1 93 LYS H 4.690 . 4.690 3.336 2.037 4.081 . 0 0 "[ . 1 . 2]" 1
1426 1 93 LYS H 1 93 LYS QG 4.920 . 4.920 3.350 1.949 4.295 . 0 0 "[ . 1 . 2]" 1
1427 1 93 LYS HA 1 94 GLU H 3.450 . 3.450 2.403 2.104 3.482 0.032 8 0 "[ . 1 . 2]" 1
1428 1 93 LYS QB 1 94 GLU H 4.610 . 4.610 3.577 2.072 4.070 . 0 0 "[ . 1 . 2]" 1
1429 1 93 LYS QD 1 94 GLU H 6.170 . 6.170 5.324 3.538 6.161 . 0 0 "[ . 1 . 2]" 1
1430 1 94 GLU H 1 94 GLU QB 3.790 . 3.790 2.516 2.225 3.459 . 0 0 "[ . 1 . 2]" 1
1431 1 94 GLU H 1 94 GLU QG 4.680 . 4.680 2.940 1.912 4.182 . 0 0 "[ . 1 . 2]" 1
1432 1 96 GLU H 1 96 GLU QB 3.760 . 3.760 2.616 2.246 3.475 . 0 0 "[ . 1 . 2]" 1
1433 1 96 GLU H 1 96 GLU QG 4.760 . 4.760 3.269 1.998 4.572 . 0 0 "[ . 1 . 2]" 1
1434 1 97 SER HA 1 98 ILE H 3.510 . 3.510 2.560 2.191 3.454 . 0 0 "[ . 1 . 2]" 1
1435 1 97 SER QB 1 98 ILE H 4.700 . 4.700 3.638 2.191 4.080 . 0 0 "[ . 1 . 2]" 1
1436 1 98 ILE H 1 98 ILE HB 4.200 . 4.200 3.217 2.437 3.819 . 0 0 "[ . 1 . 2]" 1
1437 1 98 ILE H 1 98 ILE HG12 4.710 . 4.710 3.185 2.070 4.540 . 0 0 "[ . 1 . 2]" 1
1438 1 98 ILE H 1 98 ILE QG 4.110 . 4.110 2.638 2.038 4.046 . 0 0 "[ . 1 . 2]" 1
1439 1 98 ILE H 1 98 ILE HG13 4.710 . 4.710 3.175 2.056 4.577 . 0 0 "[ . 1 . 2]" 1
1440 1 98 ILE H 1 98 ILE MG 4.770 . 4.770 3.070 1.966 4.100 . 0 0 "[ . 1 . 2]" 1
1441 1 98 ILE HA 1 98 ILE MD 4.800 . 4.800 3.885 3.015 4.274 . 0 0 "[ . 1 . 2]" 1
1442 1 98 ILE HA 1 99 LEU H 3.420 . 3.420 2.257 2.068 2.641 . 0 0 "[ . 1 . 2]" 1
1443 1 98 ILE HB 1 99 LEU H 5.040 . 5.040 3.625 2.375 4.566 . 0 0 "[ . 1 . 2]" 1
1444 1 98 ILE MG 1 99 LEU H 5.230 . 5.230 3.709 2.865 4.307 . 0 0 "[ . 1 . 2]" 1
1445 1 99 LEU H 1 99 LEU QB 3.840 . 3.840 2.839 2.243 3.399 . 0 0 "[ . 1 . 2]" 1
1446 1 99 LEU H 1 99 LEU HG 4.390 . 4.390 3.266 1.887 4.494 0.104 20 0 "[ . 1 . 2]" 1
1447 1 99 LEU HA 1 99 LEU MD2 4.330 . 4.330 3.464 2.074 4.180 . 0 0 "[ . 1 . 2]" 1
1448 1 99 LEU HA 1 100 GLU H 3.560 . 3.560 2.513 2.125 3.582 0.022 5 0 "[ . 1 . 2]" 1
1449 1 99 LEU QB 1 100 GLU H 4.960 . 4.960 3.109 1.897 4.021 . 0 0 "[ . 1 . 2]" 1
1450 1 99 LEU MD1 1 100 GLU H 5.480 . 5.480 4.057 2.793 5.591 0.111 3 0 "[ . 1 . 2]" 1
1451 1 99 LEU MD2 1 100 GLU H 6.160 . 6.160 4.748 3.725 5.596 . 0 0 "[ . 1 . 2]" 1
1452 1 99 LEU HG 1 100 GLU H 5.520 . 5.520 4.601 3.442 5.572 0.052 12 0 "[ . 1 . 2]" 1
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