Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
528322 | 2lmg RC | 18115 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lmg
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 1234
_Distance_constraint_stats_list.Viol_count 2252
_Distance_constraint_stats_list.Viol_total 4320.898
_Distance_constraint_stats_list.Viol_max 0.984
_Distance_constraint_stats_list.Viol_rms 0.0489
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0088
_Distance_constraint_stats_list.Viol_average_violations_only 0.0959
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 SER 4.962 0.741 9 4 "[ . +1* - *]"
1 3 ALA 1.141 0.244 3 0 "[ . 1 . 2]"
1 4 LYS 25.473 0.888 10 10 "[ * .* *+*** * * -]"
1 5 ASN 7.568 0.564 17 3 "[ . 1 . +- *]"
1 6 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 LEU 7.531 0.364 4 0 "[ . 1 . 2]"
1 8 GLU 10.355 0.564 17 3 "[ . 1 . +- *]"
1 9 SER 1.646 0.984 15 2 "[ . 1 + - 2]"
1 10 TYR 2.565 0.134 17 0 "[ . 1 . 2]"
1 11 ALA 1.770 0.373 12 0 "[ . 1 . 2]"
1 12 PHE 6.005 0.135 8 0 "[ . 1 . 2]"
1 13 ASN 3.759 0.984 15 2 "[ . 1 + - 2]"
1 14 MET 3.380 0.408 5 0 "[ . 1 . 2]"
1 15 LYS 8.663 0.692 12 2 "[ . - 1 + . 2]"
1 16 SER 8.490 0.310 6 0 "[ . 1 . 2]"
1 17 ALA 0.124 0.033 6 0 "[ . 1 . 2]"
1 18 VAL 0.625 0.369 2 0 "[ . 1 . 2]"
1 19 GLU 7.772 0.188 8 0 "[ . 1 . 2]"
1 20 ASP 3.966 0.157 6 0 "[ . 1 . 2]"
1 21 GLU 8.300 0.766 11 2 "[ . 1+ .- 2]"
1 22 GLY 3.969 0.277 18 0 "[ . 1 . 2]"
1 23 LEU 5.204 0.388 9 0 "[ . 1 . 2]"
1 24 LYS 6.563 0.766 11 2 "[ . 1+ .- 2]"
1 25 GLY 0.023 0.013 20 0 "[ . 1 . 2]"
1 26 LYS 3.449 0.388 9 0 "[ . 1 . 2]"
1 27 ILE 2.638 0.099 3 0 "[ . 1 . 2]"
1 28 SER 3.383 0.224 10 0 "[ . 1 . 2]"
1 29 GLU 1.227 0.105 12 0 "[ . 1 . 2]"
1 30 ALA 0.374 0.072 10 0 "[ . 1 . 2]"
1 31 ASP 3.013 0.103 9 0 "[ . 1 . 2]"
1 32 LYS 2.088 0.369 2 0 "[ . 1 . 2]"
1 33 LYS 4.919 0.984 7 3 "[ * . + 1 . -2]"
1 34 LYS 6.393 0.984 7 1 "[ . + 1 . 2]"
1 35 VAL 0.222 0.079 7 0 "[ . 1 . 2]"
1 36 LEU 7.879 0.188 8 0 "[ . 1 . 2]"
1 37 ASP 1.313 0.107 14 0 "[ . 1 . 2]"
1 38 LYS 12.872 0.380 5 0 "[ . 1 . 2]"
1 39 CYS 7.021 0.692 12 2 "[ . - 1 + . 2]"
1 40 GLN 4.975 0.675 17 1 "[ . 1 . + 2]"
1 41 GLU 2.945 0.230 16 0 "[ . 1 . 2]"
1 42 VAL 6.648 0.364 4 0 "[ . 1 . 2]"
1 43 ILE 4.233 0.675 17 1 "[ . 1 . + 2]"
1 44 SER 2.913 0.481 3 0 "[ . 1 . 2]"
1 45 TRP 2.106 0.133 20 0 "[ . 1 . 2]"
1 46 LEU 15.037 0.900 5 9 "[ * +* ** ** . * -]"
1 47 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 ASN 2.860 0.900 5 2 "[ * + 1 . 2]"
1 50 THR 2.073 0.682 20 1 "[ . 1 . +]"
1 51 LEU 3.163 0.219 13 0 "[ . 1 . 2]"
1 52 ALA 1.776 0.522 5 1 "[ + 1 . 2]"
1 53 GLU 0.986 0.183 3 0 "[ . 1 . 2]"
1 54 LYS 11.499 0.980 16 8 "[ . ***1** -+ * 2]"
1 55 ASP 5.523 0.641 18 2 "[ . 1 - + 2]"
1 56 GLU 1.851 0.249 4 0 "[ . 1 . 2]"
1 57 PHE 4.521 0.249 4 0 "[ . 1 . 2]"
1 58 GLU 1.548 0.393 17 0 "[ . 1 . 2]"
1 59 HIS 0.029 0.029 18 0 "[ . 1 . 2]"
1 60 LYS 10.228 0.621 9 2 "[ . +1 . -]"
1 61 ARG 0.947 0.098 9 0 "[ . 1 . 2]"
1 62 LYS 7.051 0.892 20 3 "[ . * 1 - +]"
1 63 GLU 8.651 0.923 19 6 "[ * * * 1 . *+-]"
1 64 LEU 11.930 0.380 5 0 "[ . 1 . 2]"
1 65 GLU 2.647 0.289 9 0 "[ . 1 . 2]"
1 66 GLN 2.753 0.225 9 0 "[ . 1 . 2]"
1 67 VAL 1.191 0.072 10 0 "[ . 1 . 2]"
1 68 CYS 3.748 0.143 14 0 "[ . 1 . 2]"
1 69 ASN 3.659 0.138 2 0 "[ . 1 . 2]"
1 70 PRO 4.145 0.138 2 0 "[ . 1 . 2]"
1 71 ILE 8.181 0.205 10 0 "[ . 1 . 2]"
1 72 ILE 2.154 0.139 20 0 "[ . 1 . 2]"
1 73 SER 3.679 0.329 11 0 "[ . 1 . 2]"
1 74 GLY 0.272 0.272 20 0 "[ . 1 . 2]"
1 75 LEU 2.280 0.272 20 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 SER HA 1 2 SER HB2 2.470 . 3.233 2.834 2.425 3.031 . 0 0 "[ . 1 . 2]" 1
2 1 2 SER HA 1 2 SER HB3 2.400 . 3.120 2.472 2.338 3.016 . 0 0 "[ . 1 . 2]" 1
3 1 2 SER HA 1 5 ASN QB 3.054 . 4.220 3.875 2.693 4.275 0.055 14 0 "[ . 1 . 2]" 1
4 1 2 SER HA 1 5 ASN HD22 3.874 . 5.750 5.531 4.275 5.889 0.139 18 0 "[ . 1 . 2]" 1
5 1 2 SER HB3 1 4 LYS H 3.406 . 4.856 4.863 4.008 5.597 0.741 9 4 "[ . +1* - *]" 1
6 1 2 SER HB3 1 5 ASN QB 3.647 . 5.310 3.278 1.893 5.670 0.360 15 0 "[ . 1 . 2]" 1
7 1 3 ALA H 1 3 ALA MB 3.672 . 5.357 2.187 2.147 2.218 . 0 0 "[ . 1 . 2]" 1
8 1 3 ALA HA 1 3 ALA MB 2.359 . 3.055 2.113 2.103 2.120 . 0 0 "[ . 1 . 2]" 1
9 1 3 ALA HA 1 4 LYS H 3.001 . 4.126 3.494 3.409 3.564 . 0 0 "[ . 1 . 2]" 1
10 1 3 ALA MB 1 4 LYS H 2.520 . 3.314 2.846 2.596 3.084 . 0 0 "[ . 1 . 2]" 1
11 1 3 ALA MB 1 54 LYS HA 2.117 . 2.677 2.373 2.020 2.651 . 0 0 "[ . 1 . 2]" 1
12 1 3 ALA MB 1 54 LYS HB3 3.014 . 4.150 3.380 2.833 3.789 . 0 0 "[ . 1 . 2]" 1
13 1 3 ALA MB 1 57 PHE HB2 2.492 . 3.268 1.697 1.472 2.004 0.244 3 0 "[ . 1 . 2]" 1
14 1 3 ALA MB 1 57 PHE HD1 3.074 . 4.255 4.071 3.985 4.134 . 0 0 "[ . 1 . 2]" 1
15 1 3 ALA MB 1 58 GLU QG 3.118 . 4.333 3.013 2.782 3.219 . 0 0 "[ . 1 . 2]" 1
16 1 4 LYS H 1 4 LYS HA 2.973 . 4.078 2.822 2.783 2.861 . 0 0 "[ . 1 . 2]" 1
17 1 4 LYS H 1 4 LYS HB2 2.595 . 3.437 2.398 2.330 2.505 . 0 0 "[ . 1 . 2]" 1
18 1 4 LYS H 1 4 LYS HD3 3.410 . 4.864 4.854 4.641 4.920 0.056 7 0 "[ . 1 . 2]" 1
19 1 4 LYS H 1 5 ASN H 2.508 . 3.294 2.645 2.502 2.768 . 0 0 "[ . 1 . 2]" 1
20 1 4 LYS H 1 57 PHE HD1 3.469 . 4.973 4.757 4.538 4.904 . 0 0 "[ . 1 . 2]" 1
21 1 4 LYS HA 1 4 LYS HB2 2.187 . 2.785 2.542 2.512 2.566 . 0 0 "[ . 1 . 2]" 1
22 1 4 LYS HA 1 4 LYS HB3 2.628 . 3.491 3.025 3.016 3.033 . 0 0 "[ . 1 . 2]" 1
23 1 4 LYS HA 1 4 LYS QG 2.753 . 3.606 2.378 2.242 2.474 . 0 0 "[ . 1 . 2]" 1
24 1 4 LYS HA 1 5 ASN H 3.238 . 4.549 3.527 3.493 3.560 . 0 0 "[ . 1 . 2]" 1
25 1 4 LYS HA 1 7 LEU H 3.097 . 4.296 3.557 3.278 3.760 . 0 0 "[ . 1 . 2]" 1
26 1 4 LYS HA 1 7 LEU HB3 3.212 . 4.502 3.373 2.818 3.945 . 0 0 "[ . 1 . 2]" 1
27 1 4 LYS HA 1 46 LEU MD2 3.242 . 4.556 2.557 2.317 2.842 . 0 0 "[ . 1 . 2]" 1
28 1 4 LYS HA 1 57 PHE HD1 2.995 . 4.116 2.615 2.462 2.769 . 0 0 "[ . 1 . 2]" 1
29 1 4 LYS HB2 1 4 LYS HD2 2.589 . 3.427 3.497 3.133 3.580 0.153 10 0 "[ . 1 . 2]" 1
30 1 4 LYS HB2 1 5 ASN H 2.853 . 3.871 3.675 3.582 3.822 . 0 0 "[ . 1 . 2]" 1
31 1 4 LYS HB2 1 5 ASN HA 3.874 . 5.750 5.564 5.497 5.608 . 0 0 "[ . 1 . 2]" 1
32 1 4 LYS HB2 1 57 PHE HD1 3.183 . 4.449 4.306 3.748 4.515 0.066 10 0 "[ . 1 . 2]" 1
33 1 4 LYS HB3 1 4 LYS HD2 2.524 . 3.320 2.393 2.258 2.737 . 0 0 "[ . 1 . 2]" 1
34 1 4 LYS HB3 1 5 ASN H 2.626 . 3.488 2.456 2.314 2.665 . 0 0 "[ . 1 . 2]" 1
35 1 4 LYS HD3 1 5 ASN H 3.612 . 5.243 3.788 3.404 4.025 . 0 0 "[ . 1 . 2]" 1
36 1 4 LYS HE2 1 4 LYS QG 2.710 . 3.628 2.443 2.282 2.510 . 0 0 "[ . 1 . 2]" 1
37 1 4 LYS HE2 1 46 LEU MD1 3.211 . 4.500 4.187 2.861 5.388 0.888 10 8 "[ * .* *+ -* . * *]" 1
38 1 4 LYS HE2 1 46 LEU MD2 2.714 . 3.635 3.509 2.658 4.164 0.529 3 4 "[ + . * * . -]" 1
39 1 4 LYS HE3 1 4 LYS QG 2.043 . 2.565 2.729 2.317 3.300 0.735 9 8 "[ * .* +* ** . * -]" 1
40 1 4 LYS HE3 1 50 THR MG 2.887 . 3.929 3.033 1.634 4.611 0.682 20 1 "[ . 1 . +]" 1
41 1 4 LYS QG 1 57 PHE QE 1.689 . 2.046 2.084 2.044 2.131 0.085 2 0 "[ . 1 . 2]" 1
42 1 5 ASN H 1 5 ASN HA 2.767 . 3.724 2.809 2.782 2.835 . 0 0 "[ . 1 . 2]" 1
43 1 5 ASN H 1 5 ASN QB 2.504 . 3.287 2.335 2.097 2.455 . 0 0 "[ . 1 . 2]" 1
44 1 5 ASN H 1 6 ALA H 2.743 . 3.684 2.700 2.635 2.788 . 0 0 "[ . 1 . 2]" 1
45 1 5 ASN H 1 8 GLU HB3 3.839 . 5.681 5.877 5.607 6.245 0.564 17 3 "[ . 1 . +- *]" 1
46 1 5 ASN HA 1 5 ASN QB 2.301 . 2.963 2.391 2.235 2.532 . 0 0 "[ . 1 . 2]" 1
47 1 5 ASN HA 1 6 ALA H 3.071 . 4.250 3.546 3.535 3.557 . 0 0 "[ . 1 . 2]" 1
48 1 5 ASN HA 1 8 GLU HB3 2.589 . 3.427 3.526 3.220 3.927 0.500 18 1 "[ . 1 . + 2]" 1
49 1 5 ASN QB 1 5 ASN HD21 2.065 . 2.598 2.169 2.127 2.256 . 0 0 "[ . 1 . 2]" 1
50 1 5 ASN QB 1 6 ALA H 2.775 . 3.738 2.463 2.306 2.726 . 0 0 "[ . 1 . 2]" 1
51 1 6 ALA H 1 6 ALA HA 2.672 . 3.564 2.808 2.788 2.825 . 0 0 "[ . 1 . 2]" 1
52 1 6 ALA H 1 6 ALA MB 2.749 . 3.694 2.233 2.212 2.242 . 0 0 "[ . 1 . 2]" 1
53 1 6 ALA H 1 7 LEU H 2.528 . 3.327 2.678 2.599 2.794 . 0 0 "[ . 1 . 2]" 1
54 1 6 ALA HA 1 6 ALA MB 1.936 . 2.405 2.126 2.122 2.129 . 0 0 "[ . 1 . 2]" 1
55 1 6 ALA HA 1 7 LEU H 2.928 . 4.000 3.527 3.491 3.553 . 0 0 "[ . 1 . 2]" 1
56 1 6 ALA HA 1 9 SER QB 2.443 . 3.189 2.946 2.630 3.123 . 0 0 "[ . 1 . 2]" 1
57 1 6 ALA MB 1 7 LEU H 2.969 . 4.071 2.504 2.398 2.655 . 0 0 "[ . 1 . 2]" 1
58 1 6 ALA MB 1 9 SER QB 3.769 . 5.544 4.298 4.007 4.493 . 0 0 "[ . 1 . 2]" 1
59 1 6 ALA MB 1 61 ARG QD 3.200 . 3.852 3.169 3.001 3.333 . 0 0 "[ . 1 . 2]" 1
60 1 7 LEU H 1 7 LEU HA 2.817 . 3.809 2.813 2.793 2.844 . 0 0 "[ . 1 . 2]" 1
61 1 7 LEU H 1 7 LEU HB2 2.594 . 3.435 2.092 2.011 2.305 . 0 0 "[ . 1 . 2]" 1
62 1 7 LEU H 1 7 LEU HB3 2.464 . 3.223 3.065 2.590 3.288 0.065 9 0 "[ . 1 . 2]" 1
63 1 7 LEU H 1 7 LEU MD2 3.004 . 4.132 3.205 2.799 3.852 . 0 0 "[ . 1 . 2]" 1
64 1 7 LEU H 1 8 GLU H 2.478 . 3.246 2.716 2.636 2.773 . 0 0 "[ . 1 . 2]" 1
65 1 7 LEU HA 1 7 LEU HB2 2.490 . 3.265 2.751 2.527 2.858 . 0 0 "[ . 1 . 2]" 1
66 1 7 LEU HA 1 7 LEU HB3 2.662 . 3.548 2.901 2.824 3.014 . 0 0 "[ . 1 . 2]" 1
67 1 7 LEU HA 1 7 LEU MD2 2.320 . 2.993 1.914 1.613 2.107 0.034 10 0 "[ . 1 . 2]" 1
68 1 7 LEU HA 1 7 LEU HG 2.687 . 3.590 3.607 3.587 3.641 0.051 6 0 "[ . 1 . 2]" 1
69 1 7 LEU HA 1 8 GLU H 4.021 . 6.042 3.558 3.535 3.581 . 0 0 "[ . 1 . 2]" 1
70 1 7 LEU HA 1 10 TYR HB2 2.504 . 3.288 3.094 2.922 3.313 0.025 1 0 "[ . 1 . 2]" 1
71 1 7 LEU HA 1 10 TYR HB3 2.914 . 3.975 2.807 2.692 2.999 . 0 0 "[ . 1 . 2]" 1
72 1 7 LEU HA 1 46 LEU MD2 3.581 . 5.184 4.311 4.136 4.668 . 0 0 "[ . 1 . 2]" 1
73 1 7 LEU HA 1 61 ARG HG2 3.858 . 5.718 5.379 4.685 5.638 . 0 0 "[ . 1 . 2]" 1
74 1 7 LEU HB2 1 7 LEU MD2 2.893 . 3.939 2.348 2.240 2.558 . 0 0 "[ . 1 . 2]" 1
75 1 7 LEU HB2 1 8 GLU H 2.877 . 3.911 3.243 3.008 3.709 . 0 0 "[ . 1 . 2]" 1
76 1 7 LEU HB3 1 7 LEU MD1 2.872 . 3.903 2.334 2.205 2.431 . 0 0 "[ . 1 . 2]" 1
77 1 7 LEU HB3 1 7 LEU MD2 2.397 . 3.115 3.166 3.136 3.177 0.062 4 0 "[ . 1 . 2]" 1
78 1 7 LEU HB3 1 7 LEU HG 2.467 . 3.228 2.467 2.407 2.565 . 0 0 "[ . 1 . 2]" 1
79 1 7 LEU MD1 1 7 LEU MD2 2.045 . 2.568 2.065 2.050 2.074 . 0 0 "[ . 1 . 2]" 1
80 1 7 LEU MD1 1 42 VAL MG2 3.150 . 4.390 1.689 1.546 1.818 0.364 4 0 "[ . 1 . 2]" 1
81 1 7 LEU MD2 1 10 TYR HB2 3.026 . 4.171 3.999 3.587 4.268 0.097 9 0 "[ . 1 . 2]" 1
82 1 7 LEU MD2 1 10 TYR HD2 3.384 . 4.816 4.601 4.511 4.663 . 0 0 "[ . 1 . 2]" 1
83 1 7 LEU MD2 1 57 PHE HD1 3.583 . 5.188 3.766 3.526 4.175 . 0 0 "[ . 1 . 2]" 1
84 1 7 LEU MD2 1 60 LYS HB2 3.112 . 4.323 4.158 3.988 4.227 . 0 0 "[ . 1 . 2]" 1
85 1 7 LEU MD2 1 60 LYS HB3 3.115 . 4.328 2.795 2.474 3.152 . 0 0 "[ . 1 . 2]" 1
86 1 7 LEU MD2 1 61 ARG HA 2.318 . 2.990 2.545 2.123 2.774 . 0 0 "[ . 1 . 2]" 1
87 1 7 LEU MD2 1 61 ARG HB2 2.443 . 3.189 1.725 1.599 1.969 0.098 9 0 "[ . 1 . 2]" 1
88 1 7 LEU MD2 1 61 ARG HG3 2.265 . 2.907 2.600 2.000 2.825 . 0 0 "[ . 1 . 2]" 1
89 1 7 LEU MD2 1 62 LYS H 4.280 . 6.570 4.370 4.242 4.456 . 0 0 "[ . 1 . 2]" 1
90 1 7 LEU HG 1 45 TRP HZ3 2.950 . 4.038 3.260 2.950 3.516 . 0 0 "[ . 1 . 2]" 1
91 1 7 LEU HG 1 46 LEU HA 4.036 . 6.072 5.983 5.781 6.142 0.070 6 0 "[ . 1 . 2]" 1
92 1 7 LEU HG 1 57 PHE HB2 3.041 . 4.197 4.161 3.805 4.271 0.074 1 0 "[ . 1 . 2]" 1
93 1 7 LEU HG 1 57 PHE HD1 2.678 . 3.574 2.614 2.437 2.878 . 0 0 "[ . 1 . 2]" 1
94 1 8 GLU H 1 8 GLU HA 2.819 . 3.813 2.814 2.801 2.828 . 0 0 "[ . 1 . 2]" 1
95 1 8 GLU H 1 8 GLU HG2 3.088 . 4.280 4.446 4.414 4.475 0.195 10 0 "[ . 1 . 2]" 1
96 1 8 GLU H 1 8 GLU HG3 3.149 . 4.389 4.128 3.846 4.300 . 0 0 "[ . 1 . 2]" 1
97 1 8 GLU H 1 46 LEU MD1 3.154 . 4.398 2.832 2.636 3.190 . 0 0 "[ . 1 . 2]" 1
98 1 8 GLU H 1 46 LEU MD2 3.125 . 4.345 3.144 2.924 3.348 . 0 0 "[ . 1 . 2]" 1
99 1 8 GLU HA 1 8 GLU HB3 2.326 . 3.002 2.976 2.917 3.006 0.004 13 0 "[ . 1 . 2]" 1
100 1 8 GLU HA 1 8 GLU HG2 2.628 . 3.491 2.586 2.460 2.763 . 0 0 "[ . 1 . 2]" 1
101 1 8 GLU HA 1 8 GLU HG3 2.731 . 3.663 2.534 2.340 2.633 . 0 0 "[ . 1 . 2]" 1
102 1 8 GLU HA 1 9 SER H 3.370 . 4.789 3.539 3.521 3.560 . 0 0 "[ . 1 . 2]" 1
103 1 8 GLU HA 1 10 TYR H 3.996 . 5.992 4.261 4.119 4.412 . 0 0 "[ . 1 . 2]" 1
104 1 8 GLU HA 1 11 ALA H 2.676 . 3.571 3.445 3.346 3.584 0.013 15 0 "[ . 1 . 2]" 1
105 1 8 GLU HA 1 11 ALA MB 2.962 . 3.912 2.899 2.763 3.019 . 0 0 "[ . 1 . 2]" 1
106 1 8 GLU HA 1 46 LEU MD1 2.206 . 2.814 1.938 1.787 2.117 . 0 0 "[ . 1 . 2]" 1
107 1 8 GLU HA 1 46 LEU MD2 3.300 . 4.661 3.697 3.433 3.959 . 0 0 "[ . 1 . 2]" 1
108 1 8 GLU HB3 1 9 SER H 2.463 . 3.222 2.536 2.394 2.676 . 0 0 "[ . 1 . 2]" 1
109 1 8 GLU HB3 1 46 LEU MD1 2.742 . 3.682 3.489 3.326 3.720 0.038 18 0 "[ . 1 . 2]" 1
110 1 8 GLU HG2 1 10 TYR H 3.945 . 5.891 5.853 5.556 6.025 0.134 17 0 "[ . 1 . 2]" 1
111 1 8 GLU HG2 1 11 ALA MB 3.572 . 5.166 4.102 3.996 4.215 . 0 0 "[ . 1 . 2]" 1
112 1 8 GLU HG2 1 12 PHE HD1 3.153 . 4.395 2.318 2.155 2.510 . 0 0 "[ . 1 . 2]" 1
113 1 8 GLU HG2 1 43 ILE MD 3.426 . 4.893 3.414 3.332 3.481 . 0 0 "[ . 1 . 2]" 1
114 1 8 GLU HG2 1 46 LEU MD1 2.397 . 3.115 2.949 2.775 3.024 . 0 0 "[ . 1 . 2]" 1
115 1 8 GLU HG3 1 12 PHE HE1 3.150 . 4.390 3.668 3.277 3.998 . 0 0 "[ . 1 . 2]" 1
116 1 8 GLU HG3 1 46 LEU MD1 1.796 . 2.199 1.548 1.355 1.749 0.038 10 0 "[ . 1 . 2]" 1
117 1 9 SER H 1 9 SER HA 2.743 . 3.684 2.813 2.786 2.830 . 0 0 "[ . 1 . 2]" 1
118 1 9 SER H 1 9 SER QB 2.487 . 3.260 2.409 2.144 2.606 . 0 0 "[ . 1 . 2]" 1
119 1 9 SER H 1 10 TYR H 2.668 . 3.558 2.636 2.581 2.751 . 0 0 "[ . 1 . 2]" 1
120 1 9 SER HA 1 9 SER QB 2.428 . 3.165 2.373 2.307 2.509 . 0 0 "[ . 1 . 2]" 1
121 1 9 SER HA 1 10 TYR H 3.139 . 4.371 3.520 3.498 3.549 . 0 0 "[ . 1 . 2]" 1
122 1 9 SER QB 1 10 TYR H 2.834 . 3.838 2.666 2.524 2.829 . 0 0 "[ . 1 . 2]" 1
123 1 9 SER QB 1 12 PHE HB2 3.544 . 5.114 4.238 3.803 4.451 . 0 0 "[ . 1 . 2]" 1
124 1 9 SER QB 1 13 ASN HD21 3.565 . 5.154 4.103 2.955 6.138 0.984 15 2 "[ . 1 + - 2]" 1
125 1 10 TYR H 1 10 TYR HA 2.890 . 3.934 2.824 2.810 2.842 . 0 0 "[ . 1 . 2]" 1
126 1 10 TYR H 1 10 TYR HB2 2.570 . 3.396 2.341 2.285 2.398 . 0 0 "[ . 1 . 2]" 1
127 1 10 TYR H 1 10 TYR HB3 2.579 . 3.410 2.699 2.620 2.752 . 0 0 "[ . 1 . 2]" 1
128 1 10 TYR H 1 10 TYR HD1 3.369 . 4.788 4.811 4.766 4.851 0.063 13 0 "[ . 1 . 2]" 1
129 1 10 TYR H 1 11 ALA H 2.473 . 3.237 2.696 2.621 2.752 . 0 0 "[ . 1 . 2]" 1
130 1 10 TYR HA 1 10 TYR HB2 2.398 . 3.117 2.574 2.536 2.614 . 0 0 "[ . 1 . 2]" 1
131 1 10 TYR HA 1 10 TYR HB3 2.642 . 3.515 3.025 3.013 3.035 . 0 0 "[ . 1 . 2]" 1
132 1 10 TYR HA 1 10 TYR HD1 2.672 . 3.564 3.339 3.234 3.476 . 0 0 "[ . 1 . 2]" 1
133 1 10 TYR HA 1 11 ALA H 4.459 . 6.945 3.562 3.550 3.579 . 0 0 "[ . 1 . 2]" 1
134 1 10 TYR HA 1 13 ASN QB 2.425 . 3.160 2.495 2.405 2.684 . 0 0 "[ . 1 . 2]" 1
135 1 10 TYR HB2 1 10 TYR HD1 2.789 . 3.761 3.741 3.731 3.749 . 0 0 "[ . 1 . 2]" 1
136 1 10 TYR HB2 1 11 ALA H 2.743 . 3.684 3.603 3.549 3.659 . 0 0 "[ . 1 . 2]" 1
137 1 10 TYR HB3 1 10 TYR HD1 2.802 . 3.783 2.724 2.645 2.795 . 0 0 "[ . 1 . 2]" 1
138 1 10 TYR HB3 1 11 ALA H 3.008 . 4.139 2.364 2.303 2.400 . 0 0 "[ . 1 . 2]" 1
139 1 10 TYR HB3 1 14 MET ME 4.064 . 6.129 5.706 5.632 5.785 . 0 0 "[ . 1 . 2]" 1
140 1 10 TYR HD1 1 11 ALA H 3.199 . 4.478 3.606 3.491 3.709 . 0 0 "[ . 1 . 2]" 1
141 1 10 TYR HD1 1 14 MET ME 3.087 . 4.278 3.951 3.748 4.077 . 0 0 "[ . 1 . 2]" 1
142 1 10 TYR HD1 1 64 LEU HG 2.833 . 3.836 3.421 3.277 3.548 . 0 0 "[ . 1 . 2]" 1
143 1 10 TYR HE1 1 14 MET ME 3.070 . 4.248 3.841 3.537 3.950 . 0 0 "[ . 1 . 2]" 1
144 1 10 TYR HE1 1 64 LEU HB3 3.207 . 4.492 4.079 3.879 4.375 . 0 0 "[ . 1 . 2]" 1
145 1 10 TYR HE1 1 64 LEU MD1 3.011 . 4.144 2.318 2.264 2.380 . 0 0 "[ . 1 . 2]" 1
146 1 10 TYR HE1 1 64 LEU HG 3.322 . 4.702 4.766 4.729 4.805 0.103 9 0 "[ . 1 . 2]" 1
147 1 10 TYR HE1 1 65 GLU HA 3.196 . 4.473 2.893 2.648 3.214 . 0 0 "[ . 1 . 2]" 1
148 1 11 ALA H 1 11 ALA HA 2.749 . 3.694 2.824 2.817 2.831 . 0 0 "[ . 1 . 2]" 1
149 1 11 ALA H 1 11 ALA MB 2.693 . 3.599 2.203 2.170 2.230 . 0 0 "[ . 1 . 2]" 1
150 1 11 ALA H 1 43 ILE HG12 3.653 . 5.321 5.307 5.205 5.367 0.046 13 0 "[ . 1 . 2]" 1
151 1 11 ALA H 1 43 ILE HG13 3.326 . 4.708 4.746 4.695 4.793 0.085 10 0 "[ . 1 . 2]" 1
152 1 11 ALA H 1 45 TRP HZ3 6.011 . 10.528 8.806 8.291 9.367 . 0 0 "[ . 1 . 2]" 1
153 1 11 ALA HA 1 11 ALA MB 2.228 . 2.848 2.126 2.117 2.135 . 0 0 "[ . 1 . 2]" 1
154 1 11 ALA HA 1 12 PHE H 3.092 . 4.287 3.542 3.529 3.550 . 0 0 "[ . 1 . 2]" 1
155 1 11 ALA HA 1 14 MET H 3.149 . 4.389 3.458 3.346 3.517 . 0 0 "[ . 1 . 2]" 1
156 1 11 ALA HA 1 14 MET HB2 2.815 . 3.805 3.213 2.879 3.303 . 0 0 "[ . 1 . 2]" 1
157 1 11 ALA HA 1 14 MET HB3 3.535 . 5.097 4.831 4.561 4.927 . 0 0 "[ . 1 . 2]" 1
158 1 11 ALA HA 1 14 MET ME 3.755 . 5.518 5.080 5.051 5.128 . 0 0 "[ . 1 . 2]" 1
159 1 11 ALA HA 1 14 MET HG3 2.897 . 3.946 3.642 3.543 3.929 . 0 0 "[ . 1 . 2]" 1
160 1 11 ALA HA 1 64 LEU MD2 2.815 . 3.805 2.958 2.759 3.111 . 0 0 "[ . 1 . 2]" 1
161 1 11 ALA HA 1 64 LEU HG 2.401 . 3.122 2.704 2.596 2.881 . 0 0 "[ . 1 . 2]" 1
162 1 11 ALA MB 1 12 PHE H 2.913 . 3.974 2.483 2.418 2.543 . 0 0 "[ . 1 . 2]" 1
163 1 11 ALA MB 1 12 PHE HA 3.298 . 4.657 3.873 3.842 3.899 . 0 0 "[ . 1 . 2]" 1
164 1 11 ALA MB 1 15 LYS H 3.746 . 5.500 4.531 4.485 4.575 . 0 0 "[ . 1 . 2]" 1
165 1 11 ALA MB 1 39 CYS HA 2.964 . 4.062 2.298 2.173 2.388 . 0 0 "[ . 1 . 2]" 1
166 1 11 ALA MB 1 39 CYS HB2 2.973 . 4.078 3.841 3.049 3.968 . 0 0 "[ . 1 . 2]" 1
167 1 11 ALA MB 1 39 CYS HB3 2.707 . 3.623 2.701 2.508 3.996 0.373 12 0 "[ . 1 . 2]" 1
168 1 11 ALA MB 1 42 VAL HB 3.565 . 5.153 4.274 4.102 4.458 . 0 0 "[ . 1 . 2]" 1
169 1 11 ALA MB 1 42 VAL MG1 3.002 . 4.129 2.081 1.970 2.182 . 0 0 "[ . 1 . 2]" 1
170 1 11 ALA MB 1 42 VAL MG2 2.852 . 3.869 2.686 2.534 2.850 . 0 0 "[ . 1 . 2]" 1
171 1 11 ALA MB 1 43 ILE H 3.473 . 4.981 3.602 3.509 3.716 . 0 0 "[ . 1 . 2]" 1
172 1 11 ALA MB 1 43 ILE HA 3.736 . 5.480 3.957 3.877 4.032 . 0 0 "[ . 1 . 2]" 1
173 1 11 ALA MB 1 43 ILE HB 3.644 . 5.304 4.036 3.984 4.069 . 0 0 "[ . 1 . 2]" 1
174 1 11 ALA MB 1 43 ILE MD 2.512 . 3.301 2.381 2.240 2.517 . 0 0 "[ . 1 . 2]" 1
175 1 11 ALA MB 1 43 ILE HG13 2.879 . 3.915 2.093 2.029 2.162 . 0 0 "[ . 1 . 2]" 1
176 1 11 ALA MB 1 64 LEU HB3 3.769 . 5.544 4.473 4.330 4.610 . 0 0 "[ . 1 . 2]" 1
177 1 11 ALA MB 1 64 LEU MD2 2.857 . 3.877 2.610 2.468 2.706 . 0 0 "[ . 1 . 2]" 1
178 1 11 ALA MB 1 64 LEU HG 2.424 . 3.158 2.479 2.327 2.593 . 0 0 "[ . 1 . 2]" 1
179 1 12 PHE H 1 12 PHE HA 2.710 . 3.628 2.784 2.774 2.794 . 0 0 "[ . 1 . 2]" 1
180 1 12 PHE H 1 12 PHE HB2 2.370 . 3.072 2.127 2.101 2.161 . 0 0 "[ . 1 . 2]" 1
181 1 12 PHE H 1 12 PHE HD1 3.495 . 5.021 2.663 2.493 2.803 . 0 0 "[ . 1 . 2]" 1
182 1 12 PHE H 1 13 ASN H 2.738 . 3.675 2.718 2.681 2.750 . 0 0 "[ . 1 . 2]" 1
183 1 12 PHE H 1 16 SER H 4.121 . 6.244 5.811 5.745 5.870 . 0 0 "[ . 1 . 2]" 1
184 1 12 PHE H 1 43 ILE HG13 3.605 . 5.230 4.273 4.241 4.333 . 0 0 "[ . 1 . 2]" 1
185 1 12 PHE HA 1 12 PHE HB2 2.214 . 2.827 2.927 2.907 2.944 0.117 5 0 "[ . 1 . 2]" 1
186 1 12 PHE HA 1 12 PHE HD1 2.425 . 3.160 3.226 3.148 3.262 0.102 15 0 "[ . 1 . 2]" 1
187 1 12 PHE HA 1 13 ASN H 3.356 . 4.764 3.525 3.502 3.540 . 0 0 "[ . 1 . 2]" 1
188 1 12 PHE HA 1 15 LYS H 2.834 . 3.838 3.774 3.695 3.849 0.011 6 0 "[ . 1 . 2]" 1
189 1 12 PHE HA 1 15 LYS HB2 2.847 . 3.860 3.910 3.885 3.936 0.076 5 0 "[ . 1 . 2]" 1
190 1 12 PHE HA 1 15 LYS HB3 2.428 . 3.165 2.487 2.441 2.544 . 0 0 "[ . 1 . 2]" 1
191 1 12 PHE HA 1 15 LYS HD2 2.819 . 3.812 3.251 3.041 3.501 . 0 0 "[ . 1 . 2]" 1
192 1 12 PHE HA 1 43 ILE MD 2.815 . 3.805 2.737 2.628 2.881 . 0 0 "[ . 1 . 2]" 1
193 1 12 PHE HB2 1 12 PHE HD1 2.157 . 2.739 2.570 2.513 2.660 . 0 0 "[ . 1 . 2]" 1
194 1 12 PHE HB2 1 13 ASN H 2.810 . 3.797 2.893 2.785 3.025 . 0 0 "[ . 1 . 2]" 1
195 1 12 PHE HD1 1 15 LYS HD2 3.603 . 5.226 5.154 4.918 5.267 0.041 3 0 "[ . 1 . 2]" 1
196 1 12 PHE HD1 1 43 ILE MD 3.001 . 4.127 2.010 1.852 2.146 0.023 8 0 "[ . 1 . 2]" 1
197 1 12 PHE HD1 1 43 ILE HG12 2.109 . 2.665 2.742 2.693 2.800 0.135 8 0 "[ . 1 . 2]" 1
198 1 12 PHE HE1 1 43 ILE MG 3.217 . 4.510 2.678 2.550 2.770 . 0 0 "[ . 1 . 2]" 1
199 1 13 ASN H 1 13 ASN HA 2.577 . 3.407 2.804 2.789 2.827 . 0 0 "[ . 1 . 2]" 1
200 1 13 ASN H 1 13 ASN QB 2.834 . 3.301 2.193 2.078 2.345 . 0 0 "[ . 1 . 2]" 1
201 1 13 ASN H 1 14 MET H 2.600 . 3.445 2.814 2.714 2.855 . 0 0 "[ . 1 . 2]" 1
202 1 13 ASN H 1 16 SER H 3.269 . 4.605 4.550 4.483 4.613 0.008 3 0 "[ . 1 . 2]" 1
203 1 13 ASN HA 1 13 ASN QB 2.577 . 3.407 2.483 2.433 2.529 . 0 0 "[ . 1 . 2]" 1
204 1 13 ASN HA 1 14 MET H 3.885 . 5.772 3.585 3.572 3.597 . 0 0 "[ . 1 . 2]" 1
205 1 13 ASN HA 1 16 SER H 3.517 . 5.063 3.553 3.431 3.685 . 0 0 "[ . 1 . 2]" 1
206 1 13 ASN HA 1 16 SER HB3 3.044 . 4.202 3.444 2.722 4.283 0.081 18 0 "[ . 1 . 2]" 1
207 1 13 ASN QB 1 13 ASN HD21 3.244 . 4.043 2.218 2.132 2.815 . 0 0 "[ . 1 . 2]" 1
208 1 13 ASN QB 1 14 MET H 2.916 . 3.979 2.533 2.350 2.651 . 0 0 "[ . 1 . 2]" 1
209 1 13 ASN QB 1 14 MET ME 2.915 . 3.548 2.165 2.003 2.361 . 0 0 "[ . 1 . 2]" 1
210 1 13 ASN QB 1 16 SER HB2 3.711 . 5.432 5.183 4.510 5.727 0.295 4 0 "[ . 1 . 2]" 1
211 1 14 MET H 1 14 MET HB2 2.368 . 3.069 2.587 2.443 2.633 . 0 0 "[ . 1 . 2]" 1
212 1 14 MET H 1 14 MET HB3 2.710 . 3.628 3.577 3.567 3.594 . 0 0 "[ . 1 . 2]" 1
213 1 14 MET H 1 14 MET HG3 2.521 . 3.316 3.449 3.401 3.724 0.408 5 0 "[ . 1 . 2]" 1
214 1 14 MET H 1 15 LYS H 2.739 . 3.677 2.599 2.566 2.632 . 0 0 "[ . 1 . 2]" 1
215 1 14 MET H 1 64 LEU MD2 4.344 . 6.703 5.390 5.220 5.518 . 0 0 "[ . 1 . 2]" 1
216 1 14 MET HA 1 14 MET HB3 2.999 . 4.124 2.419 2.404 2.486 . 0 0 "[ . 1 . 2]" 1
217 1 14 MET HA 1 14 MET ME 2.487 . 3.260 1.847 1.763 1.880 . 0 0 "[ . 1 . 2]" 1
218 1 14 MET HA 1 14 MET HG2 2.594 . 3.435 3.128 3.077 3.150 . 0 0 "[ . 1 . 2]" 1
219 1 14 MET HA 1 14 MET HG3 3.407 . 4.858 3.824 3.674 3.863 . 0 0 "[ . 1 . 2]" 1
220 1 14 MET HA 1 17 ALA MB 2.114 . 2.673 2.547 2.508 2.594 . 0 0 "[ . 1 . 2]" 1
221 1 14 MET HA 1 72 ILE MD 3.736 . 5.480 3.368 3.176 3.580 . 0 0 "[ . 1 . 2]" 1
222 1 14 MET HB2 1 15 LYS H 2.969 . 4.071 2.442 2.399 2.492 . 0 0 "[ . 1 . 2]" 1
223 1 14 MET HB2 1 35 VAL MG2 2.520 . 3.314 2.653 2.573 2.858 . 0 0 "[ . 1 . 2]" 1
224 1 14 MET HB3 1 14 MET HG3 2.508 . 3.294 2.474 2.386 2.492 . 0 0 "[ . 1 . 2]" 1
225 1 14 MET HB3 1 15 LYS H 2.701 . 3.613 3.641 3.492 3.667 0.054 18 0 "[ . 1 . 2]" 1
226 1 14 MET HB3 1 35 VAL MG2 3.278 . 4.621 2.023 1.909 2.162 0.026 12 0 "[ . 1 . 2]" 1
227 1 14 MET ME 1 17 ALA H 3.889 . 5.780 4.223 4.007 4.305 . 0 0 "[ . 1 . 2]" 1
228 1 14 MET ME 1 17 ALA MB 3.145 . 4.381 2.924 2.665 3.038 . 0 0 "[ . 1 . 2]" 1
229 1 14 MET ME 1 68 CYS HB2 3.628 . 5.274 4.103 4.039 4.151 . 0 0 "[ . 1 . 2]" 1
230 1 14 MET ME 1 68 CYS HB3 3.658 . 5.331 4.635 4.605 4.663 . 0 0 "[ . 1 . 2]" 1
231 1 14 MET ME 1 72 ILE MD 3.180 . 4.444 2.792 2.639 2.879 . 0 0 "[ . 1 . 2]" 1
232 1 14 MET ME 1 72 ILE HG13 4.132 . 6.266 3.949 3.738 4.073 . 0 0 "[ . 1 . 2]" 1
233 1 14 MET HG3 1 72 ILE MD 3.409 . 4.862 4.200 4.019 4.246 . 0 0 "[ . 1 . 2]" 1
234 1 15 LYS H 1 15 LYS HA 2.795 . 3.771 2.789 2.776 2.802 . 0 0 "[ . 1 . 2]" 1
235 1 15 LYS H 1 15 LYS HB2 2.160 . 2.743 2.720 2.675 2.763 0.020 2 0 "[ . 1 . 2]" 1
236 1 15 LYS H 1 15 LYS HB3 4.138 . 6.279 2.216 2.151 2.281 . 0 0 "[ . 1 . 2]" 1
237 1 15 LYS H 1 36 LEU MD2 3.325 . 4.707 4.386 4.318 4.442 . 0 0 "[ . 1 . 2]" 1
238 1 15 LYS HA 1 15 LYS HB2 2.128 . 2.694 2.328 2.307 2.350 . 0 0 "[ . 1 . 2]" 1
239 1 15 LYS HA 1 15 LYS HB3 2.325 . 3.001 2.995 2.983 3.006 0.005 3 0 "[ . 1 . 2]" 1
240 1 15 LYS HA 1 15 LYS HD2 3.329 . 4.715 4.497 4.479 4.514 . 0 0 "[ . 1 . 2]" 1
241 1 15 LYS HA 1 15 LYS HG2 2.982 . 4.093 3.605 3.583 3.635 . 0 0 "[ . 1 . 2]" 1
242 1 15 LYS HA 1 15 LYS HG3 3.104 . 4.309 2.767 2.696 2.832 . 0 0 "[ . 1 . 2]" 1
243 1 15 LYS HA 1 18 VAL H 3.535 . 5.097 3.811 3.724 3.872 . 0 0 "[ . 1 . 2]" 1
244 1 15 LYS HA 1 18 VAL QG 2.654 . 3.534 2.343 2.281 2.448 . 0 0 "[ . 1 . 2]" 1
245 1 15 LYS HA 1 19 GLU H 3.621 . 5.260 4.120 4.028 4.219 . 0 0 "[ . 1 . 2]" 1
246 1 15 LYS HA 1 36 LEU MD2 2.516 . 3.307 2.078 1.975 2.161 . 0 0 "[ . 1 . 2]" 1
247 1 15 LYS HB2 1 15 LYS HD2 1.952 . 2.428 2.464 2.443 2.485 0.057 9 0 "[ . 1 . 2]" 1
248 1 15 LYS HB2 1 15 LYS HE2 2.245 . 2.875 2.263 2.187 2.398 . 0 0 "[ . 1 . 2]" 1
249 1 15 LYS HB2 1 16 SER H 2.986 . 4.101 3.976 3.933 4.014 . 0 0 "[ . 1 . 2]" 1
250 1 15 LYS HB2 1 36 LEU MD2 2.201 . 2.806 2.788 2.754 2.863 0.057 5 0 "[ . 1 . 2]" 1
251 1 15 LYS HB3 1 36 LEU MD2 2.852 . 3.869 3.698 3.680 3.727 . 0 0 "[ . 1 . 2]" 1
252 1 15 LYS HB3 1 39 CYS HB2 3.093 . 4.289 3.987 3.875 4.050 . 0 0 "[ . 1 . 2]" 1
253 1 15 LYS HB3 1 39 CYS HB3 2.828 . 3.828 3.491 3.269 4.139 0.311 12 0 "[ . 1 . 2]" 1
254 1 15 LYS HB3 1 43 ILE MD 3.129 . 4.353 3.797 3.713 3.891 . 0 0 "[ . 1 . 2]" 1
255 1 15 LYS HD2 1 15 LYS HE2 2.308 . 2.974 2.678 2.621 2.728 . 0 0 "[ . 1 . 2]" 1
256 1 15 LYS HD2 1 15 LYS HG3 2.450 . 3.200 2.987 2.976 2.995 . 0 0 "[ . 1 . 2]" 1
257 1 15 LYS HD2 1 16 SER H 3.442 . 4.923 4.880 4.776 4.940 0.017 3 0 "[ . 1 . 2]" 1
258 1 15 LYS HD2 1 39 CYS H 4.325 . 6.663 6.009 5.933 6.086 . 0 0 "[ . 1 . 2]" 1
259 1 15 LYS HD2 1 39 CYS HB2 2.717 . 3.640 3.734 3.624 4.332 0.692 12 2 "[ . - 1 + . 2]" 1
260 1 15 LYS HD2 1 39 CYS HB3 3.064 . 4.238 3.243 3.067 3.662 . 0 0 "[ . 1 . 2]" 1
261 1 15 LYS HD2 1 43 ILE MD 2.617 . 3.473 2.721 2.623 2.876 . 0 0 "[ . 1 . 2]" 1
262 1 15 LYS HE2 1 15 LYS HG3 2.066 . 2.600 2.340 2.227 2.439 . 0 0 "[ . 1 . 2]" 1
263 1 15 LYS HE2 1 36 LEU MD2 2.246 . 2.876 2.255 2.126 2.456 . 0 0 "[ . 1 . 2]" 1
264 1 15 LYS HE2 1 36 LEU HG 2.995 . 4.116 4.202 4.152 4.257 0.141 18 0 "[ . 1 . 2]" 1
265 1 15 LYS HE2 1 43 ILE MD 3.268 . 4.603 4.324 4.258 4.393 . 0 0 "[ . 1 . 2]" 1
266 1 15 LYS HE3 1 39 CYS H 3.333 . 4.722 4.811 4.754 4.848 0.126 11 0 "[ . 1 . 2]" 1
267 1 15 LYS HG3 1 16 SER H 3.318 . 4.694 4.129 4.028 4.211 . 0 0 "[ . 1 . 2]" 1
268 1 15 LYS HG3 1 19 GLU QG 3.451 . 4.940 3.531 3.422 3.744 . 0 0 "[ . 1 . 2]" 1
269 1 15 LYS HG3 1 36 LEU HG 3.070 . 4.248 4.071 3.968 4.185 . 0 0 "[ . 1 . 2]" 1
270 1 16 SER H 1 16 SER HA 2.710 . 3.628 2.820 2.799 2.833 . 0 0 "[ . 1 . 2]" 1
271 1 16 SER H 1 16 SER HB3 2.571 . 3.397 3.004 2.593 3.546 0.149 10 0 "[ . 1 . 2]" 1
272 1 16 SER H 1 17 ALA H 2.510 . 3.297 2.627 2.585 2.685 . 0 0 "[ . 1 . 2]" 1
273 1 16 SER HA 1 16 SER HB3 2.146 . 2.722 2.816 2.469 3.032 0.310 6 0 "[ . 1 . 2]" 1
274 1 16 SER HA 1 19 GLU HB2 2.793 . 3.768 3.196 3.056 3.354 . 0 0 "[ . 1 . 2]" 1
275 1 16 SER HA 1 19 GLU HB3 2.642 . 3.515 3.592 3.504 3.657 0.142 8 0 "[ . 1 . 2]" 1
276 1 16 SER HA 1 19 GLU QG 3.579 . 5.180 4.747 4.624 4.857 . 0 0 "[ . 1 . 2]" 1
277 1 16 SER HB3 1 17 ALA H 2.801 . 3.782 3.144 2.703 3.807 0.025 5 0 "[ . 1 . 2]" 1
278 1 17 ALA H 1 17 ALA HA 2.558 . 3.376 2.815 2.805 2.825 . 0 0 "[ . 1 . 2]" 1
279 1 17 ALA H 1 17 ALA MB 2.359 . 3.055 2.238 2.225 2.252 . 0 0 "[ . 1 . 2]" 1
280 1 17 ALA H 1 18 VAL H 2.736 . 3.671 2.746 2.716 2.772 . 0 0 "[ . 1 . 2]" 1
281 1 17 ALA H 1 18 VAL QG 3.874 . 5.750 3.620 3.581 3.645 . 0 0 "[ . 1 . 2]" 1
282 1 17 ALA H 1 35 VAL MG2 4.586 . 7.215 5.726 5.618 5.837 . 0 0 "[ . 1 . 2]" 1
283 1 17 ALA HA 1 17 ALA MB 2.272 . 2.917 2.121 2.118 2.123 . 0 0 "[ . 1 . 2]" 1
284 1 17 ALA HA 1 20 ASP H 3.149 . 4.389 3.747 3.650 3.851 . 0 0 "[ . 1 . 2]" 1
285 1 17 ALA HA 1 20 ASP HB2 2.287 . 2.941 2.780 2.541 2.965 0.024 1 0 "[ . 1 . 2]" 1
286 1 17 ALA HA 1 20 ASP HB3 2.690 . 3.595 3.489 3.249 3.628 0.033 6 0 "[ . 1 . 2]" 1
287 1 17 ALA MB 1 18 VAL H 2.801 . 3.782 2.477 2.456 2.504 . 0 0 "[ . 1 . 2]" 1
288 1 17 ALA MB 1 18 VAL HA 3.866 . 5.734 3.827 3.810 3.838 . 0 0 "[ . 1 . 2]" 1
289 1 17 ALA MB 1 18 VAL QG 2.975 . 4.081 2.818 2.784 2.863 . 0 0 "[ . 1 . 2]" 1
290 1 17 ALA MB 1 20 ASP HB2 3.899 . 5.799 4.346 4.158 4.507 . 0 0 "[ . 1 . 2]" 1
291 1 17 ALA MB 1 72 ILE MD 2.920 . 3.986 3.372 3.275 3.416 . 0 0 "[ . 1 . 2]" 1
292 1 18 VAL H 1 18 VAL HA 2.745 . 3.687 2.874 2.866 2.879 . 0 0 "[ . 1 . 2]" 1
293 1 18 VAL H 1 18 VAL HB 2.851 . 3.867 3.628 3.619 3.635 . 0 0 "[ . 1 . 2]" 1
294 1 18 VAL H 1 18 VAL QG 2.540 . 3.346 1.877 1.834 1.897 . 0 0 "[ . 1 . 2]" 1
295 1 18 VAL H 1 19 GLU H 2.829 . 3.829 2.436 2.408 2.456 . 0 0 "[ . 1 . 2]" 1
296 1 18 VAL H 1 32 LYS HB2 4.489 . 7.008 6.195 5.926 6.381 . 0 0 "[ . 1 . 2]" 1
297 1 18 VAL H 1 35 VAL MG2 3.758 . 5.524 4.929 4.831 5.009 . 0 0 "[ . 1 . 2]" 1
298 1 18 VAL HA 1 18 VAL HB 2.351 . 3.042 2.446 2.430 2.466 . 0 0 "[ . 1 . 2]" 1
299 1 18 VAL HA 1 18 VAL QG 1.866 . 2.301 2.206 2.184 2.230 . 0 0 "[ . 1 . 2]" 1
300 1 18 VAL HA 1 19 GLU H 2.861 . 3.884 3.488 3.474 3.508 . 0 0 "[ . 1 . 2]" 1
301 1 18 VAL HA 1 23 LEU QD 3.565 . 5.153 3.884 3.679 4.056 . 0 0 "[ . 1 . 2]" 1
302 1 18 VAL HA 1 27 ILE MD 2.757 . 3.707 3.348 3.292 3.407 . 0 0 "[ . 1 . 2]" 1
303 1 18 VAL HA 1 27 ILE MG 3.024 . 4.167 2.494 2.451 2.533 . 0 0 "[ . 1 . 2]" 1
304 1 18 VAL HB 1 18 VAL QG 2.083 . 2.625 1.896 1.878 1.899 . 0 0 "[ . 1 . 2]" 1
305 1 18 VAL HB 1 27 ILE MD 2.845 . 3.856 2.704 2.529 2.888 . 0 0 "[ . 1 . 2]" 1
306 1 18 VAL HB 1 27 ILE MG 2.977 . 4.085 2.565 2.409 2.763 . 0 0 "[ . 1 . 2]" 1
307 1 18 VAL HB 1 32 LYS HA 2.360 . 3.056 2.105 2.004 2.202 . 0 0 "[ . 1 . 2]" 1
308 1 18 VAL HB 1 32 LYS HG2 2.469 . 3.231 3.213 3.058 3.600 0.369 2 0 "[ . 1 . 2]" 1
309 1 18 VAL QG 1 19 GLU H 1.725 . 2.097 2.047 2.019 2.074 . 0 0 "[ . 1 . 2]" 1
310 1 18 VAL QG 1 19 GLU QG 2.810 . 3.797 2.791 2.630 2.979 . 0 0 "[ . 1 . 2]" 1
311 1 18 VAL QG 1 31 ASP HB2 3.489 . 5.011 4.330 4.148 4.439 . 0 0 "[ . 1 . 2]" 1
312 1 18 VAL QG 1 31 ASP HB3 3.283 . 4.630 4.181 4.109 4.248 . 0 0 "[ . 1 . 2]" 1
313 1 18 VAL QG 1 32 LYS HA 2.777 . 3.741 2.087 1.975 2.283 . 0 0 "[ . 1 . 2]" 1
314 1 18 VAL QG 1 32 LYS QE 2.910 . 3.969 3.368 2.977 3.631 . 0 0 "[ . 1 . 2]" 1
315 1 18 VAL QG 1 32 LYS HG2 2.700 . 3.611 2.920 2.742 3.303 . 0 0 "[ . 1 . 2]" 1
316 1 18 VAL QG 1 36 LEU MD1 2.373 . 3.077 2.448 2.372 2.639 . 0 0 "[ . 1 . 2]" 1
317 1 18 VAL QG 1 36 LEU MD2 2.862 . 3.886 2.291 2.226 2.374 . 0 0 "[ . 1 . 2]" 1
318 1 19 GLU H 1 19 GLU HA 2.953 . 4.043 2.883 2.873 2.891 . 0 0 "[ . 1 . 2]" 1
319 1 19 GLU H 1 19 GLU HB3 3.034 . 4.185 3.270 3.213 3.302 . 0 0 "[ . 1 . 2]" 1
320 1 19 GLU H 1 19 GLU QG 2.997 . 3.753 3.325 3.224 3.409 . 0 0 "[ . 1 . 2]" 1
321 1 19 GLU H 1 20 ASP H 2.734 . 3.668 2.532 2.494 2.560 . 0 0 "[ . 1 . 2]" 1
322 1 19 GLU H 1 20 ASP HB3 3.423 . 4.887 4.869 4.755 4.917 0.030 14 0 "[ . 1 . 2]" 1
323 1 19 GLU H 1 32 LYS HD3 4.471 . 6.970 6.378 5.060 6.888 . 0 0 "[ . 1 . 2]" 1
324 1 19 GLU H 1 36 LEU HB3 4.316 . 6.644 6.755 6.706 6.832 0.188 8 0 "[ . 1 . 2]" 1
325 1 19 GLU H 1 36 LEU MD2 3.255 . 4.579 3.259 3.173 3.351 . 0 0 "[ . 1 . 2]" 1
326 1 19 GLU HA 1 19 GLU HB2 2.353 . 3.045 2.886 2.861 2.904 . 0 0 "[ . 1 . 2]" 1
327 1 19 GLU HA 1 19 GLU QG 2.264 . 2.905 2.281 2.163 2.394 . 0 0 "[ . 1 . 2]" 1
328 1 19 GLU HA 1 32 LYS QE 2.558 . 3.376 2.360 1.615 3.241 0.125 12 0 "[ . 1 . 2]" 1
329 1 19 GLU HB2 1 20 ASP H 3.587 . 5.196 3.806 3.767 3.850 . 0 0 "[ . 1 . 2]" 1
330 1 19 GLU HB2 1 36 LEU MD2 2.587 . 3.423 2.202 2.131 2.294 . 0 0 "[ . 1 . 2]" 1
331 1 19 GLU HB2 1 36 LEU HG 3.075 . 4.257 4.347 4.299 4.390 0.133 17 0 "[ . 1 . 2]" 1
332 1 19 GLU HB3 1 20 ASP H 2.831 . 3.833 3.908 3.861 3.944 0.111 8 0 "[ . 1 . 2]" 1
333 1 19 GLU QG 1 32 LYS QE 3.692 . 5.396 2.491 1.829 3.626 0.159 2 0 "[ . 1 . 2]" 1
334 1 19 GLU QG 1 36 LEU MD2 2.612 . 3.465 1.822 1.732 1.876 0.027 8 0 "[ . 1 . 2]" 1
335 1 20 ASP H 1 20 ASP HB2 2.626 . 3.488 2.592 2.476 2.720 . 0 0 "[ . 1 . 2]" 1
336 1 20 ASP H 1 20 ASP HB3 2.641 . 3.513 2.494 2.407 2.547 . 0 0 "[ . 1 . 2]" 1
337 1 20 ASP H 1 21 GLU H 3.483 . 5.000 4.581 4.511 4.620 . 0 0 "[ . 1 . 2]" 1
338 1 20 ASP H 1 23 LEU QD 3.357 . 4.766 4.047 3.918 4.182 . 0 0 "[ . 1 . 2]" 1
339 1 20 ASP HA 1 20 ASP HB2 2.556 . 3.373 2.451 2.396 2.489 . 0 0 "[ . 1 . 2]" 1
340 1 20 ASP HA 1 20 ASP HB3 2.520 . 3.314 3.024 3.015 3.029 . 0 0 "[ . 1 . 2]" 1
341 1 20 ASP HA 1 21 GLU H 2.565 . 3.388 2.184 2.127 2.243 . 0 0 "[ . 1 . 2]" 1
342 1 20 ASP HB2 1 21 GLU H 3.705 . 5.421 4.057 3.904 4.184 . 0 0 "[ . 1 . 2]" 1
343 1 20 ASP HB2 1 22 GLY H 3.079 . 4.264 4.328 4.229 4.421 0.157 6 0 "[ . 1 . 2]" 1
344 1 20 ASP HB2 1 23 LEU H 3.075 . 4.257 4.076 3.897 4.279 0.022 17 0 "[ . 1 . 2]" 1
345 1 20 ASP HB2 1 23 LEU HB3 3.527 . 5.082 4.968 4.825 5.117 0.035 20 0 "[ . 1 . 2]" 1
346 1 20 ASP HB2 1 23 LEU QD 2.393 . 3.109 2.984 2.890 3.051 . 0 0 "[ . 1 . 2]" 1
347 1 20 ASP HB3 1 21 GLU H 2.919 . 3.984 4.020 3.948 4.099 0.115 20 0 "[ . 1 . 2]" 1
348 1 20 ASP HB3 1 22 GLY H 2.959 . 4.054 3.453 3.340 3.586 . 0 0 "[ . 1 . 2]" 1
349 1 20 ASP HB3 1 23 LEU QD 2.365 . 3.064 2.478 2.331 2.631 . 0 0 "[ . 1 . 2]" 1
350 1 21 GLU H 1 21 GLU HA 2.969 . 4.071 2.837 2.828 2.848 . 0 0 "[ . 1 . 2]" 1
351 1 21 GLU H 1 21 GLU HB3 2.672 . 3.564 3.113 2.616 3.588 0.024 4 0 "[ . 1 . 2]" 1
352 1 21 GLU H 1 21 GLU QG 2.916 . 3.979 2.153 1.776 2.821 0.077 18 0 "[ . 1 . 2]" 1
353 1 21 GLU HA 1 21 GLU HB3 2.235 . 2.859 2.416 2.339 2.529 . 0 0 "[ . 1 . 2]" 1
354 1 21 GLU HA 1 21 GLU QG 2.728 . 3.658 3.050 2.336 3.454 . 0 0 "[ . 1 . 2]" 1
355 1 21 GLU HB3 1 22 GLY H 3.001 . 4.126 4.239 3.966 4.403 0.277 18 0 "[ . 1 . 2]" 1
356 1 21 GLU HB3 1 24 LYS QG 2.893 . 3.939 4.146 3.839 4.705 0.766 11 2 "[ . 1+ .- 2]" 1
357 1 21 GLU QG 1 22 GLY H 3.687 . 5.386 3.509 2.605 4.592 . 0 0 "[ . 1 . 2]" 1
358 1 21 GLU QG 1 23 LEU H 4.099 . 6.199 5.199 4.548 5.968 . 0 0 "[ . 1 . 2]" 1
359 1 22 GLY H 1 22 GLY HA2 2.537 . 3.342 2.944 2.928 2.953 . 0 0 "[ . 1 . 2]" 1
360 1 22 GLY H 1 23 LEU H 2.808 . 3.794 2.110 2.060 2.225 . 0 0 "[ . 1 . 2]" 1
361 1 22 GLY H 1 23 LEU HB2 3.030 . 4.178 4.060 3.978 4.163 . 0 0 "[ . 1 . 2]" 1
362 1 22 GLY H 1 23 LEU HB3 3.829 . 5.661 5.552 5.471 5.644 . 0 0 "[ . 1 . 2]" 1
363 1 22 GLY HA2 1 23 LEU H 2.922 . 3.989 3.483 3.406 3.528 . 0 0 "[ . 1 . 2]" 1
364 1 22 GLY HA2 1 24 LYS QG 3.259 . 4.587 3.627 3.280 3.903 . 0 0 "[ . 1 . 2]" 1
365 1 23 LEU H 1 23 LEU HA 2.973 . 4.078 2.887 2.836 2.927 . 0 0 "[ . 1 . 2]" 1
366 1 23 LEU H 1 23 LEU HB2 2.629 . 3.493 2.237 2.170 2.287 . 0 0 "[ . 1 . 2]" 1
367 1 23 LEU H 1 23 LEU HB3 2.639 . 3.510 3.517 3.463 3.551 0.041 5 0 "[ . 1 . 2]" 1
368 1 23 LEU H 1 23 LEU QD . . 3.845 3.296 3.134 3.441 . 0 0 "[ . 1 . 2]" 1
369 1 23 LEU H 1 24 LYS QG 3.907 . 5.816 3.846 3.113 4.262 . 0 0 "[ . 1 . 2]" 1
370 1 23 LEU HA 1 23 LEU HB2 2.785 . 3.754 2.977 2.963 2.992 . 0 0 "[ . 1 . 2]" 1
371 1 23 LEU HA 1 23 LEU HB3 2.154 . 2.734 2.611 2.567 2.664 . 0 0 "[ . 1 . 2]" 1
372 1 23 LEU HA 1 23 LEU QD 2.306 . 2.970 2.241 2.052 2.495 . 0 0 "[ . 1 . 2]" 1
373 1 23 LEU HA 1 23 LEU HG 2.881 . 3.919 2.563 2.379 2.718 . 0 0 "[ . 1 . 2]" 1
374 1 23 LEU HA 1 24 LYS H 3.101 . 4.303 3.350 3.174 3.446 . 0 0 "[ . 1 . 2]" 1
375 1 23 LEU HB2 1 23 LEU QD 2.331 . 3.010 2.148 2.119 2.181 . 0 0 "[ . 1 . 2]" 1
376 1 23 LEU HB3 1 23 LEU QD 2.742 . 3.682 2.095 2.081 2.110 . 0 0 "[ . 1 . 2]" 1
377 1 23 LEU HB3 1 24 LYS HA 3.138 . 4.369 4.439 4.380 4.566 0.197 17 0 "[ . 1 . 2]" 1
378 1 23 LEU QD 1 26 LYS H 3.501 . 5.033 4.195 3.940 4.359 . 0 0 "[ . 1 . 2]" 1
379 1 23 LEU QD 1 26 LYS HB2 2.496 . 3.275 2.410 2.142 2.611 . 0 0 "[ . 1 . 2]" 1
380 1 23 LEU QD 1 26 LYS HB3 2.446 . 3.194 2.837 2.410 3.080 . 0 0 "[ . 1 . 2]" 1
381 1 23 LEU QD 1 26 LYS QD 2.299 . 2.960 2.021 1.250 2.865 0.388 9 0 "[ . 1 . 2]" 1
382 1 23 LEU QD 1 26 LYS QG 2.636 . 3.505 2.500 1.772 3.189 0.095 8 0 "[ . 1 . 2]" 1
383 1 23 LEU HG 1 26 LYS QE 3.334 . 4.723 3.967 3.091 4.655 . 0 0 "[ . 1 . 2]" 1
384 1 24 LYS H 1 24 LYS HA 2.749 . 3.694 2.810 2.698 2.851 . 0 0 "[ . 1 . 2]" 1
385 1 24 LYS H 1 24 LYS HB3 2.375 . 3.080 2.717 2.582 3.481 0.401 17 0 "[ . 1 . 2]" 1
386 1 24 LYS H 1 24 LYS QG 3.560 . 4.605 2.122 1.883 2.371 0.092 17 0 "[ . 1 . 2]" 1
387 1 24 LYS H 1 25 GLY H 3.246 . 4.563 3.965 2.588 4.576 0.013 20 0 "[ . 1 . 2]" 1
388 1 24 LYS H 1 26 LYS H 4.035 . 6.070 4.176 3.868 4.394 . 0 0 "[ . 1 . 2]" 1
389 1 24 LYS HA 1 24 LYS HB3 1.966 . 2.449 2.417 2.269 2.464 0.015 12 0 "[ . 1 . 2]" 1
390 1 24 LYS HA 1 24 LYS QG 2.855 . 3.874 3.342 2.660 3.504 . 0 0 "[ . 1 . 2]" 1
391 1 24 LYS HB3 1 25 GLY H 3.159 . 4.407 4.156 3.585 4.377 . 0 0 "[ . 1 . 2]" 1
392 1 24 LYS HD3 1 24 LYS QG 2.166 . 2.753 2.302 2.167 2.415 . 0 0 "[ . 1 . 2]" 1
393 1 24 LYS HE3 1 24 LYS QG 2.876 . 3.910 2.658 2.331 3.536 . 0 0 "[ . 1 . 2]" 1
394 1 25 GLY H 1 25 GLY HA2 2.429 . 3.166 2.564 2.336 2.952 . 0 0 "[ . 1 . 2]" 1
395 1 25 GLY H 1 26 LYS H 2.907 . 3.964 2.596 2.160 2.970 . 0 0 "[ . 1 . 2]" 1
396 1 25 GLY HA2 1 26 LYS H 3.231 . 4.536 3.416 3.221 3.523 . 0 0 "[ . 1 . 2]" 1
397 1 26 LYS H 1 26 LYS HA 2.779 . 3.745 2.873 2.818 2.936 . 0 0 "[ . 1 . 2]" 1
398 1 26 LYS H 1 26 LYS HB2 2.481 . 3.250 2.463 2.248 2.580 . 0 0 "[ . 1 . 2]" 1
399 1 26 LYS H 1 26 LYS QG 2.569 . 3.394 2.417 2.128 3.291 . 0 0 "[ . 1 . 2]" 1
400 1 26 LYS H 1 27 ILE H 2.473 . 3.237 2.358 2.012 2.616 . 0 0 "[ . 1 . 2]" 1
401 1 26 LYS H 1 27 ILE MG 3.442 . 4.923 3.787 3.446 4.034 . 0 0 "[ . 1 . 2]" 1
402 1 26 LYS HA 1 26 LYS HB2 2.428 . 3.165 3.016 2.973 3.032 . 0 0 "[ . 1 . 2]" 1
403 1 26 LYS HA 1 26 LYS HB3 2.307 . 2.972 2.479 2.411 2.605 . 0 0 "[ . 1 . 2]" 1
404 1 26 LYS HA 1 26 LYS QD 2.932 . 4.006 3.215 2.322 3.932 . 0 0 "[ . 1 . 2]" 1
405 1 26 LYS HA 1 26 LYS QG 2.893 . 3.250 2.528 2.264 2.826 . 0 0 "[ . 1 . 2]" 1
406 1 26 LYS HA 1 27 ILE H 3.720 . 5.449 3.492 3.461 3.523 . 0 0 "[ . 1 . 2]" 1
407 1 26 LYS HB3 1 26 LYS QG 2.599 . 3.443 2.399 2.131 2.483 . 0 0 "[ . 1 . 2]" 1
408 1 26 LYS HB3 1 27 ILE H 3.328 . 4.712 3.701 3.280 3.952 . 0 0 "[ . 1 . 2]" 1
409 1 26 LYS HB3 1 75 LEU QD 2.561 . 3.381 2.852 2.401 3.286 . 0 0 "[ . 1 . 2]" 1
410 1 26 LYS QD 1 26 LYS QE 1.966 . 2.449 2.064 2.007 2.086 . 0 0 "[ . 1 . 2]" 1
411 1 26 LYS QD 1 26 LYS QG 2.202 . 2.808 2.077 2.053 2.086 . 0 0 "[ . 1 . 2]" 1
412 1 26 LYS QE 1 26 LYS QG 2.179 . 2.598 2.158 2.081 2.295 . 0 0 "[ . 1 . 2]" 1
413 1 27 ILE H 1 27 ILE HB 2.509 . 3.296 2.818 2.766 2.901 . 0 0 "[ . 1 . 2]" 1
414 1 27 ILE H 1 27 ILE HG12 3.220 . 4.516 4.479 4.437 4.504 . 0 0 "[ . 1 . 2]" 1
415 1 27 ILE H 1 27 ILE MG 2.670 . 3.561 2.114 2.015 2.186 . 0 0 "[ . 1 . 2]" 1
416 1 27 ILE H 1 28 SER H 3.933 . 5.867 4.516 4.479 4.535 . 0 0 "[ . 1 . 2]" 1
417 1 27 ILE HA 1 27 ILE HB 2.579 . 3.411 2.513 2.492 2.532 . 0 0 "[ . 1 . 2]" 1
418 1 27 ILE HA 1 27 ILE MD 3.127 . 4.349 3.783 3.771 3.801 . 0 0 "[ . 1 . 2]" 1
419 1 27 ILE HA 1 27 ILE HG12 2.851 . 3.867 2.815 2.782 2.859 . 0 0 "[ . 1 . 2]" 1
420 1 27 ILE HA 1 27 ILE HG13 2.659 . 3.543 2.479 2.453 2.514 . 0 0 "[ . 1 . 2]" 1
421 1 27 ILE HA 1 27 ILE MG 2.728 . 3.658 3.208 3.202 3.216 . 0 0 "[ . 1 . 2]" 1
422 1 27 ILE HB 1 27 ILE MD 2.472 . 3.236 2.470 2.465 2.477 . 0 0 "[ . 1 . 2]" 1
423 1 27 ILE HB 1 27 ILE HG12 2.274 . 2.921 3.003 3.000 3.006 0.085 19 0 "[ . 1 . 2]" 1
424 1 27 ILE HB 1 27 ILE MG 2.341 . 3.026 2.124 2.122 2.127 . 0 0 "[ . 1 . 2]" 1
425 1 27 ILE HB 1 28 SER H 3.097 . 4.296 4.038 3.963 4.115 . 0 0 "[ . 1 . 2]" 1
426 1 27 ILE HB 1 31 ASP HB2 3.303 . 4.667 4.715 4.655 4.766 0.099 3 0 "[ . 1 . 2]" 1
427 1 27 ILE HB 1 31 ASP HB3 4.025 . 6.050 5.469 5.380 5.586 . 0 0 "[ . 1 . 2]" 1
428 1 27 ILE MD 1 27 ILE HG12 2.153 . 2.733 2.111 2.109 2.113 . 0 0 "[ . 1 . 2]" 1
429 1 27 ILE MD 1 27 ILE HG13 2.344 . 3.031 2.114 2.112 2.118 . 0 0 "[ . 1 . 2]" 1
430 1 27 ILE MD 1 27 ILE MG 2.006 . 2.509 1.842 1.804 1.875 . 0 0 "[ . 1 . 2]" 1
431 1 27 ILE MD 1 31 ASP HB2 3.019 . 4.158 2.077 1.976 2.182 . 0 0 "[ . 1 . 2]" 1
432 1 27 ILE MD 1 31 ASP HB3 3.229 . 4.532 1.977 1.909 2.032 0.017 10 0 "[ . 1 . 2]" 1
433 1 27 ILE MD 1 32 LYS H 2.132 . 2.700 2.610 2.579 2.637 . 0 0 "[ . 1 . 2]" 1
434 1 27 ILE MD 1 32 LYS HA 2.599 . 3.443 2.385 2.256 2.487 . 0 0 "[ . 1 . 2]" 1
435 1 27 ILE HG12 1 27 ILE MG 2.427 . 3.163 2.430 2.410 2.441 . 0 0 "[ . 1 . 2]" 1
436 1 27 ILE HG12 1 28 SER H 3.159 . 4.407 2.057 1.906 2.222 0.005 3 0 "[ . 1 . 2]" 1
437 1 27 ILE HG12 1 31 ASP HB2 2.014 . 2.521 1.937 1.863 1.995 . 0 0 "[ . 1 . 2]" 1
438 1 27 ILE HG12 1 31 ASP HB3 2.965 . 4.064 3.299 3.203 3.409 . 0 0 "[ . 1 . 2]" 1
439 1 27 ILE HG13 1 27 ILE MG 2.746 . 3.688 3.178 3.171 3.182 . 0 0 "[ . 1 . 2]" 1
440 1 27 ILE HG13 1 28 SER H 3.187 . 4.457 2.862 2.733 2.985 . 0 0 "[ . 1 . 2]" 1
441 1 27 ILE HG13 1 31 ASP HB2 2.870 . 3.900 2.916 2.801 2.973 . 0 0 "[ . 1 . 2]" 1
442 1 27 ILE HG13 1 31 ASP HB3 3.007 . 4.137 3.485 3.337 3.642 . 0 0 "[ . 1 . 2]" 1
443 1 27 ILE MG 1 28 SER H 2.943 . 4.026 3.458 3.386 3.558 . 0 0 "[ . 1 . 2]" 1
444 1 27 ILE MG 1 31 ASP H 3.762 . 5.531 4.846 4.754 4.924 . 0 0 "[ . 1 . 2]" 1
445 1 27 ILE MG 1 31 ASP HB2 2.917 . 3.981 3.676 3.618 3.746 . 0 0 "[ . 1 . 2]" 1
446 1 27 ILE MG 1 31 ASP HB3 3.647 . 5.310 4.673 4.645 4.716 . 0 0 "[ . 1 . 2]" 1
447 1 27 ILE MG 1 32 LYS H 2.530 . 3.330 3.177 3.157 3.197 . 0 0 "[ . 1 . 2]" 1
448 1 27 ILE MG 1 32 LYS HA 2.930 . 4.003 3.301 3.199 3.379 . 0 0 "[ . 1 . 2]" 1
449 1 27 ILE MG 1 32 LYS HB2 1.820 . 2.234 2.049 1.953 2.148 . 0 0 "[ . 1 . 2]" 1
450 1 27 ILE MG 1 33 LYS H 3.787 . 5.580 5.081 5.026 5.137 . 0 0 "[ . 1 . 2]" 1
451 1 28 SER H 1 28 SER HA 2.879 . 3.915 2.870 2.849 2.888 . 0 0 "[ . 1 . 2]" 1
452 1 28 SER H 1 28 SER HB2 3.062 . 4.234 2.753 2.511 3.413 . 0 0 "[ . 1 . 2]" 1
453 1 28 SER H 1 31 ASP H 3.019 . 4.158 4.211 4.167 4.261 0.103 9 0 "[ . 1 . 2]" 1
454 1 28 SER H 1 31 ASP HB2 3.174 . 4.433 3.166 3.011 3.359 . 0 0 "[ . 1 . 2]" 1
455 1 28 SER H 1 31 ASP HB3 3.457 . 4.951 4.632 4.479 4.805 . 0 0 "[ . 1 . 2]" 1
456 1 28 SER HA 1 28 SER HB2 2.203 . 2.810 2.835 2.440 3.034 0.224 10 0 "[ . 1 . 2]" 1
457 1 28 SER HA 1 28 SER HB3 2.451 . 3.202 2.535 2.242 3.032 . 0 0 "[ . 1 . 2]" 1
458 1 28 SER HA 1 29 GLU H 2.645 . 3.520 2.328 2.242 2.474 . 0 0 "[ . 1 . 2]" 1
459 1 28 SER HB3 1 30 ALA H 3.781 . 5.568 3.579 3.011 4.580 . 0 0 "[ . 1 . 2]" 1
460 1 29 GLU H 1 29 GLU HA 2.565 . 3.388 2.782 2.747 2.796 . 0 0 "[ . 1 . 2]" 1
461 1 29 GLU H 1 29 GLU QB 2.160 . 2.743 2.617 2.532 2.791 0.048 3 0 "[ . 1 . 2]" 1
462 1 29 GLU H 1 29 GLU QG 1.488 . 1.765 1.813 1.567 1.870 0.105 12 0 "[ . 1 . 2]" 1
463 1 29 GLU H 1 30 ALA H 2.478 . 3.246 2.753 2.663 2.816 . 0 0 "[ . 1 . 2]" 1
464 1 29 GLU H 1 30 ALA MB 4.128 . 6.258 4.404 4.353 4.454 . 0 0 "[ . 1 . 2]" 1
465 1 29 GLU HA 1 29 GLU QB 2.377 . 3.083 2.246 2.132 2.339 . 0 0 "[ . 1 . 2]" 1
466 1 29 GLU HA 1 29 GLU QG 2.648 . 3.524 3.038 2.493 3.404 . 0 0 "[ . 1 . 2]" 1
467 1 29 GLU HA 1 30 ALA H 3.092 . 4.287 3.521 3.483 3.551 . 0 0 "[ . 1 . 2]" 1
468 1 29 GLU HA 1 32 LYS H 3.038 . 4.192 3.608 3.248 3.871 . 0 0 "[ . 1 . 2]" 1
469 1 29 GLU HA 1 32 LYS HB2 2.867 . 3.894 3.414 2.915 3.845 . 0 0 "[ . 1 . 2]" 1
470 1 29 GLU HA 1 32 LYS HB3 2.296 . 2.955 2.433 2.071 2.862 . 0 0 "[ . 1 . 2]" 1
471 1 29 GLU HA 1 32 LYS QE 3.811 . 5.627 4.672 3.158 5.247 . 0 0 "[ . 1 . 2]" 1
472 1 29 GLU QB 1 29 GLU QG 2.258 . 2.895 2.038 1.988 2.084 . 0 0 "[ . 1 . 2]" 1
473 1 29 GLU QB 1 30 ALA H 2.934 . 4.010 2.862 2.332 3.498 . 0 0 "[ . 1 . 2]" 1
474 1 29 GLU QG 1 30 ALA H 2.888 . 3.930 3.173 1.844 3.891 0.002 11 0 "[ . 1 . 2]" 1
475 1 30 ALA H 1 30 ALA HA 2.245 . 2.875 2.795 2.781 2.815 . 0 0 "[ . 1 . 2]" 1
476 1 30 ALA H 1 30 ALA MB 2.710 . 3.628 2.230 2.208 2.258 . 0 0 "[ . 1 . 2]" 1
477 1 30 ALA H 1 31 ASP H 2.426 . 3.162 2.783 2.712 2.850 . 0 0 "[ . 1 . 2]" 1
478 1 30 ALA HA 1 30 ALA MB 1.963 . 2.445 2.123 2.116 2.126 . 0 0 "[ . 1 . 2]" 1
479 1 30 ALA HA 1 31 ASP H 2.846 . 3.858 3.559 3.531 3.587 . 0 0 "[ . 1 . 2]" 1
480 1 30 ALA HA 1 33 LYS H 3.058 . 4.227 3.543 3.362 3.696 . 0 0 "[ . 1 . 2]" 1
481 1 30 ALA HA 1 33 LYS HB2 2.522 . 3.317 2.648 2.483 2.972 . 0 0 "[ . 1 . 2]" 1
482 1 30 ALA HA 1 33 LYS QD 2.131 . 2.699 2.689 2.380 2.771 0.072 10 0 "[ . 1 . 2]" 1
483 1 30 ALA MB 1 31 ASP H 2.693 . 3.599 2.521 2.485 2.597 . 0 0 "[ . 1 . 2]" 1
484 1 30 ALA MB 1 31 ASP HA 3.329 . 4.715 3.838 3.800 3.878 . 0 0 "[ . 1 . 2]" 1
485 1 30 ALA MB 1 34 LYS HB3 3.190 . 4.462 4.236 4.144 4.308 . 0 0 "[ . 1 . 2]" 1
486 1 31 ASP H 1 31 ASP HA 2.916 . 3.979 2.844 2.836 2.852 . 0 0 "[ . 1 . 2]" 1
487 1 31 ASP H 1 31 ASP HB2 2.651 . 3.530 2.540 2.481 2.602 . 0 0 "[ . 1 . 2]" 1
488 1 31 ASP H 1 31 ASP HB3 2.858 . 3.879 3.615 3.600 3.632 . 0 0 "[ . 1 . 2]" 1
489 1 31 ASP H 1 32 LYS H 2.474 . 3.239 2.596 2.555 2.655 . 0 0 "[ . 1 . 2]" 1
490 1 31 ASP H 1 32 LYS HB2 3.500 . 5.031 4.897 4.771 5.048 0.017 11 0 "[ . 1 . 2]" 1
491 1 31 ASP H 1 32 LYS HB3 3.404 . 4.852 4.496 4.342 4.669 . 0 0 "[ . 1 . 2]" 1
492 1 31 ASP HA 1 31 ASP HB2 2.669 . 3.559 3.031 3.022 3.039 . 0 0 "[ . 1 . 2]" 1
493 1 31 ASP HA 1 31 ASP HB3 2.675 . 3.569 2.466 2.434 2.505 . 0 0 "[ . 1 . 2]" 1
494 1 31 ASP HA 1 34 LYS HB2 3.437 . 4.913 4.690 4.589 4.777 . 0 0 "[ . 1 . 2]" 1
495 1 31 ASP HA 1 34 LYS HB3 2.675 . 3.569 3.604 3.565 3.658 0.089 11 0 "[ . 1 . 2]" 1
496 1 31 ASP HA 1 34 LYS HD2 2.636 . 3.505 3.005 2.601 3.566 0.061 15 0 "[ . 1 . 2]" 1
497 1 31 ASP HA 1 34 LYS QE 3.707 . 5.425 3.970 2.791 4.542 . 0 0 "[ . 1 . 2]" 1
498 1 31 ASP HA 1 34 LYS HG3 3.364 . 4.778 3.694 3.524 3.867 . 0 0 "[ . 1 . 2]" 1
499 1 31 ASP HA 1 35 VAL MG1 3.506 . 5.042 4.421 4.337 4.499 . 0 0 "[ . 1 . 2]" 1
500 1 31 ASP HA 1 71 ILE HB 3.121 . 4.339 4.234 4.010 4.406 0.067 10 0 "[ . 1 . 2]" 1
501 1 31 ASP HA 1 71 ILE MD 3.504 . 5.038 4.630 4.528 4.704 . 0 0 "[ . 1 . 2]" 1
502 1 31 ASP HA 1 71 ILE MG 2.833 . 3.836 3.117 2.918 3.324 . 0 0 "[ . 1 . 2]" 1
503 1 31 ASP HB2 1 32 LYS H 3.030 . 4.178 2.379 2.247 2.507 . 0 0 "[ . 1 . 2]" 1
504 1 31 ASP HB2 1 71 ILE MD 3.235 . 4.543 4.361 4.330 4.396 . 0 0 "[ . 1 . 2]" 1
505 1 31 ASP HB2 1 71 ILE MG 2.956 . 4.048 3.616 3.549 3.653 . 0 0 "[ . 1 . 2]" 1
506 1 31 ASP HB3 1 32 LYS H 2.997 . 4.120 3.502 3.455 3.601 . 0 0 "[ . 1 . 2]" 1
507 1 31 ASP HB3 1 35 VAL H 4.071 . 6.142 5.012 4.855 5.111 . 0 0 "[ . 1 . 2]" 1
508 1 31 ASP HB3 1 71 ILE MD 3.235 . 4.543 3.429 3.294 3.577 . 0 0 "[ . 1 . 2]" 1
509 1 31 ASP HB3 1 71 ILE MG 2.318 . 2.990 2.158 2.078 2.208 . 0 0 "[ . 1 . 2]" 1
510 1 32 LYS H 1 32 LYS HA 2.925 . 3.994 2.758 2.752 2.771 . 0 0 "[ . 1 . 2]" 1
511 1 32 LYS H 1 32 LYS HB2 2.355 . 3.049 2.459 2.357 2.576 . 0 0 "[ . 1 . 2]" 1
512 1 32 LYS H 1 32 LYS HB3 2.486 . 3.258 2.443 2.302 2.535 . 0 0 "[ . 1 . 2]" 1
513 1 32 LYS H 1 32 LYS HG2 3.134 . 4.362 4.389 4.282 4.410 0.048 12 0 "[ . 1 . 2]" 1
514 1 32 LYS H 1 33 LYS H 2.447 . 3.196 2.838 2.775 2.883 . 0 0 "[ . 1 . 2]" 1
515 1 32 LYS H 1 35 VAL HB 4.298 . 6.607 5.976 5.892 6.066 . 0 0 "[ . 1 . 2]" 1
516 1 32 LYS HA 1 32 LYS HB2 2.547 . 3.358 2.432 2.364 2.459 . 0 0 "[ . 1 . 2]" 1
517 1 32 LYS HA 1 32 LYS HB3 2.377 . 3.083 3.017 3.004 3.024 . 0 0 "[ . 1 . 2]" 1
518 1 32 LYS HA 1 32 LYS HG2 2.416 . 3.146 3.054 2.866 3.343 0.197 2 0 "[ . 1 . 2]" 1
519 1 32 LYS HA 1 33 LYS H 3.344 . 4.742 3.552 3.537 3.559 . 0 0 "[ . 1 . 2]" 1
520 1 32 LYS HA 1 35 VAL HB 3.291 . 4.645 4.582 4.497 4.655 0.010 13 0 "[ . 1 . 2]" 1
521 1 32 LYS HA 1 36 LEU H 3.001 . 4.126 4.045 3.977 4.131 0.005 3 0 "[ . 1 . 2]" 1
522 1 32 LYS HB2 1 32 LYS QE 3.378 . 4.804 3.762 2.145 4.258 . 0 0 "[ . 1 . 2]" 1
523 1 32 LYS HB3 1 32 LYS QE 3.046 . 4.206 3.746 2.824 4.053 . 0 0 "[ . 1 . 2]" 1
524 1 32 LYS HB3 1 35 VAL MG1 3.474 . 4.982 4.648 4.609 4.686 . 0 0 "[ . 1 . 2]" 1
525 1 32 LYS HD3 1 32 LYS QE 2.206 . 2.814 2.299 2.153 2.431 . 0 0 "[ . 1 . 2]" 1
526 1 32 LYS QE 1 32 LYS HG3 2.338 . 3.021 2.457 2.158 2.772 . 0 0 "[ . 1 . 2]" 1
527 1 32 LYS HG2 1 33 LYS H 3.038 . 4.192 3.507 3.150 3.606 . 0 0 "[ . 1 . 2]" 1
528 1 32 LYS HG3 1 36 LEU MD1 3.068 . 4.245 2.777 2.355 3.006 . 0 0 "[ . 1 . 2]" 1
529 1 32 LYS HG3 1 36 LEU HG 2.896 . 3.944 3.732 3.306 3.955 0.011 18 0 "[ . 1 . 2]" 1
530 1 33 LYS H 1 33 LYS HA 2.696 . 3.605 2.810 2.767 2.831 . 0 0 "[ . 1 . 2]" 1
531 1 33 LYS H 1 33 LYS HB2 2.207 . 2.816 2.361 2.198 2.489 . 0 0 "[ . 1 . 2]" 1
532 1 33 LYS H 1 33 LYS QD 2.963 . 4.060 3.716 3.217 4.057 . 0 0 "[ . 1 . 2]" 1
533 1 33 LYS H 1 33 LYS HG3 3.054 . 4.220 2.534 2.281 4.238 0.018 7 0 "[ . 1 . 2]" 1
534 1 33 LYS H 1 34 LYS H 2.653 . 3.533 2.732 2.670 2.801 . 0 0 "[ . 1 . 2]" 1
535 1 33 LYS H 1 36 LEU HG 3.653 . 5.321 5.346 5.221 5.397 0.076 5 0 "[ . 1 . 2]" 1
536 1 33 LYS HA 1 33 LYS HB2 2.364 . 3.063 2.984 2.510 3.024 . 0 0 "[ . 1 . 2]" 1
537 1 33 LYS HA 1 33 LYS QD 3.320 . 4.697 4.117 3.983 4.183 . 0 0 "[ . 1 . 2]" 1
538 1 33 LYS HA 1 33 LYS HG3 2.428 . 3.165 2.863 2.483 3.070 . 0 0 "[ . 1 . 2]" 1
539 1 33 LYS HA 1 34 LYS H 3.524 . 5.076 3.561 3.554 3.573 . 0 0 "[ . 1 . 2]" 1
540 1 33 LYS HB2 1 33 LYS HE3 2.915 . 3.977 3.719 2.702 4.660 0.683 2 2 "[ + . 1 . -2]" 1
541 1 33 LYS HB2 1 34 LYS H 2.081 . 2.622 2.651 2.497 3.606 0.984 7 1 "[ . + 1 . 2]" 1
542 1 34 LYS H 1 34 LYS HG2 2.717 . 3.640 2.495 2.401 2.606 . 0 0 "[ . 1 . 2]" 1
543 1 34 LYS H 1 34 LYS HG3 2.691 . 3.596 3.710 3.677 3.758 0.162 10 0 "[ . 1 . 2]" 1
544 1 34 LYS HA 1 34 LYS HB2 2.458 . 3.213 2.363 2.340 2.391 . 0 0 "[ . 1 . 2]" 1
545 1 34 LYS HA 1 34 LYS HB3 2.122 . 2.685 2.557 2.526 2.584 . 0 0 "[ . 1 . 2]" 1
546 1 34 LYS HA 1 34 LYS HG2 2.887 . 3.929 3.793 3.732 3.846 . 0 0 "[ . 1 . 2]" 1
547 1 34 LYS HA 1 34 LYS HG3 2.806 . 3.790 3.708 3.652 3.757 . 0 0 "[ . 1 . 2]" 1
548 1 34 LYS HA 1 35 VAL H 3.023 . 4.165 3.547 3.536 3.557 . 0 0 "[ . 1 . 2]" 1
549 1 34 LYS HA 1 37 ASP H 3.366 . 4.783 3.739 3.630 3.847 . 0 0 "[ . 1 . 2]" 1
550 1 34 LYS HA 1 37 ASP HB2 2.753 . 3.701 3.746 3.697 3.808 0.107 14 0 "[ . 1 . 2]" 1
551 1 34 LYS HA 1 37 ASP HB3 2.657 . 3.539 2.973 2.681 3.473 . 0 0 "[ . 1 . 2]" 1
552 1 34 LYS HA 1 38 LYS H 3.427 . 4.895 3.957 3.853 4.069 . 0 0 "[ . 1 . 2]" 1
553 1 34 LYS HB2 1 34 LYS HD2 2.164 . 2.749 2.741 2.400 2.909 0.160 1 0 "[ . 1 . 2]" 1
554 1 34 LYS HB2 1 34 LYS QE 2.675 . 3.569 2.782 1.954 3.518 . 0 0 "[ . 1 . 2]" 1
555 1 34 LYS HB2 1 34 LYS HG3 2.684 . 3.585 2.401 2.328 2.453 . 0 0 "[ . 1 . 2]" 1
556 1 34 LYS HB2 1 67 VAL MG2 2.862 . 3.886 3.064 2.882 3.226 . 0 0 "[ . 1 . 2]" 1
557 1 34 LYS HB2 1 71 ILE MD 5.497 . 9.275 6.589 6.322 6.737 . 0 0 "[ . 1 . 2]" 1
558 1 34 LYS HD2 1 34 LYS QE 2.335 . 3.017 2.376 2.320 2.429 . 0 0 "[ . 1 . 2]" 1
559 1 34 LYS QE 1 34 LYS HG3 2.998 . 4.122 2.245 2.135 2.336 . 0 0 "[ . 1 . 2]" 1
560 1 34 LYS QE 1 67 VAL HA 2.552 . 3.366 2.712 2.483 3.192 . 0 0 "[ . 1 . 2]" 1
561 1 34 LYS QE 1 67 VAL MG2 2.913 . 3.974 2.126 1.886 2.401 . 0 0 "[ . 1 . 2]" 1
562 1 34 LYS QE 1 70 PRO QD 3.246 . 4.563 3.623 2.956 4.158 . 0 0 "[ . 1 . 2]" 1
563 1 34 LYS HG2 1 67 VAL MG2 2.862 . 3.886 3.584 3.471 3.763 . 0 0 "[ . 1 . 2]" 1
564 1 34 LYS HG2 1 71 ILE MD 6.123 . 10.810 4.423 4.262 4.554 . 0 0 "[ . 1 . 2]" 1
565 1 34 LYS HG3 1 67 VAL MG1 3.555 . 5.135 3.714 3.630 3.880 . 0 0 "[ . 1 . 2]" 1
566 1 35 VAL H 1 35 VAL HA 2.797 . 3.775 2.836 2.831 2.842 . 0 0 "[ . 1 . 2]" 1
567 1 35 VAL H 1 35 VAL HB 2.351 . 3.042 2.585 2.560 2.614 . 0 0 "[ . 1 . 2]" 1
568 1 35 VAL H 1 35 VAL MG1 2.430 . 3.168 2.070 2.041 2.100 . 0 0 "[ . 1 . 2]" 1
569 1 35 VAL H 1 35 VAL MG2 3.208 . 4.495 3.782 3.764 3.793 . 0 0 "[ . 1 . 2]" 1
570 1 35 VAL H 1 36 LEU H 2.639 . 3.510 2.643 2.614 2.685 . 0 0 "[ . 1 . 2]" 1
571 1 35 VAL HA 1 35 VAL HB 2.710 . 3.628 2.467 2.458 2.473 . 0 0 "[ . 1 . 2]" 1
572 1 35 VAL HA 1 35 VAL MG1 2.704 . 3.618 3.199 3.197 3.204 . 0 0 "[ . 1 . 2]" 1
573 1 35 VAL HA 1 35 VAL MG2 2.266 . 2.908 2.334 2.319 2.347 . 0 0 "[ . 1 . 2]" 1
574 1 35 VAL HA 1 36 LEU H 2.675 . 3.569 3.569 3.554 3.585 0.016 9 0 "[ . 1 . 2]" 1
575 1 35 VAL HA 1 38 LYS H 3.485 . 5.003 3.424 3.263 3.530 . 0 0 "[ . 1 . 2]" 1
576 1 35 VAL HA 1 38 LYS HB3 2.728 . 3.658 2.363 2.225 2.507 . 0 0 "[ . 1 . 2]" 1
577 1 35 VAL HA 1 64 LEU HA 3.904 . 5.809 5.742 5.595 5.888 0.079 7 0 "[ . 1 . 2]" 1
578 1 35 VAL HA 1 67 VAL MG2 2.704 . 3.618 2.385 2.283 2.486 . 0 0 "[ . 1 . 2]" 1
579 1 35 VAL HA 1 68 CYS HA 3.675 . 5.363 4.527 4.341 4.697 . 0 0 "[ . 1 . 2]" 1
580 1 35 VAL HB 1 35 VAL MG1 2.121 . 2.683 2.118 2.116 2.121 . 0 0 "[ . 1 . 2]" 1
581 1 35 VAL HB 1 35 VAL MG2 2.304 . 2.968 2.125 2.121 2.129 . 0 0 "[ . 1 . 2]" 1
582 1 35 VAL HB 1 36 LEU H 2.959 . 4.054 3.961 3.917 3.997 . 0 0 "[ . 1 . 2]" 1
583 1 35 VAL HB 1 38 LYS H 3.917 . 5.835 5.713 5.579 5.811 . 0 0 "[ . 1 . 2]" 1
584 1 35 VAL HB 1 71 ILE MG 2.978 . 4.086 2.514 2.478 2.563 . 0 0 "[ . 1 . 2]" 1
585 1 35 VAL MG1 1 35 VAL MG2 2.877 . 3.912 2.087 2.079 2.092 . 0 0 "[ . 1 . 2]" 1
586 1 35 VAL MG1 1 36 LEU H 2.969 . 4.071 2.106 2.055 2.155 . 0 0 "[ . 1 . 2]" 1
587 1 35 VAL MG1 1 68 CYS HA 3.579 . 5.180 3.851 3.815 3.883 . 0 0 "[ . 1 . 2]" 1
588 1 35 VAL MG1 1 68 CYS HB2 4.020 . 6.040 4.656 4.551 4.741 . 0 0 "[ . 1 . 2]" 1
589 1 35 VAL MG1 1 68 CYS HB3 3.291 . 4.645 4.208 4.128 4.248 . 0 0 "[ . 1 . 2]" 1
590 1 35 VAL MG2 1 36 LEU HA 2.874 . 3.906 3.788 3.765 3.812 . 0 0 "[ . 1 . 2]" 1
591 1 35 VAL MG2 1 39 CYS HB2 2.943 . 4.026 3.842 3.115 3.951 . 0 0 "[ . 1 . 2]" 1
592 1 35 VAL MG2 1 39 CYS HB3 3.504 . 5.038 4.521 3.950 4.651 . 0 0 "[ . 1 . 2]" 1
593 1 35 VAL MG2 1 64 LEU MD1 3.370 . 4.789 3.085 2.976 3.157 . 0 0 "[ . 1 . 2]" 1
594 1 35 VAL MG2 1 68 CYS HA 3.302 . 4.665 2.642 2.597 2.707 . 0 0 "[ . 1 . 2]" 1
595 1 35 VAL MG2 1 68 CYS HB2 3.233 . 4.539 3.037 2.924 3.093 . 0 0 "[ . 1 . 2]" 1
596 1 35 VAL MG2 1 68 CYS HB3 2.504 . 3.288 2.028 1.976 2.080 . 0 0 "[ . 1 . 2]" 1
597 1 36 LEU H 1 36 LEU HA 2.651 . 3.530 2.809 2.796 2.820 . 0 0 "[ . 1 . 2]" 1
598 1 36 LEU H 1 36 LEU HB2 2.533 . 3.335 2.413 2.372 2.469 . 0 0 "[ . 1 . 2]" 1
599 1 36 LEU H 1 36 LEU HB3 2.858 . 3.879 3.595 3.582 3.615 . 0 0 "[ . 1 . 2]" 1
600 1 36 LEU H 1 36 LEU MD1 3.276 . 4.618 3.411 3.309 3.448 . 0 0 "[ . 1 . 2]" 1
601 1 36 LEU H 1 36 LEU MD2 3.214 . 4.505 3.813 3.764 3.863 . 0 0 "[ . 1 . 2]" 1
602 1 36 LEU H 1 37 ASP H 2.861 . 3.884 2.733 2.697 2.773 . 0 0 "[ . 1 . 2]" 1
603 1 36 LEU HA 1 36 LEU HB2 2.395 . 3.112 3.018 3.012 3.026 . 0 0 "[ . 1 . 2]" 1
604 1 36 LEU HA 1 36 LEU HB3 2.453 . 3.205 2.555 2.536 2.572 . 0 0 "[ . 1 . 2]" 1
605 1 36 LEU HA 1 36 LEU MD1 3.623 . 5.264 3.892 3.876 3.909 . 0 0 "[ . 1 . 2]" 1
606 1 36 LEU HA 1 36 LEU MD2 2.223 . 2.841 2.335 2.254 2.441 . 0 0 "[ . 1 . 2]" 1
607 1 36 LEU HA 1 36 LEU HG 2.252 . 2.886 2.827 2.797 2.875 . 0 0 "[ . 1 . 2]" 1
608 1 36 LEU HA 1 37 ASP H 2.773 . 3.734 3.541 3.527 3.551 . 0 0 "[ . 1 . 2]" 1
609 1 36 LEU HA 1 39 CYS HB2 2.851 . 3.867 2.595 2.457 3.509 . 0 0 "[ . 1 . 2]" 1
610 1 36 LEU HA 1 39 CYS HB3 2.932 . 4.006 3.910 2.412 4.130 0.124 7 0 "[ . 1 . 2]" 1
611 1 36 LEU HB2 1 36 LEU HG 2.168 . 2.755 2.585 2.566 2.619 . 0 0 "[ . 1 . 2]" 1
612 1 36 LEU HB2 1 37 ASP H 2.647 . 3.523 2.470 2.391 2.550 . 0 0 "[ . 1 . 2]" 1
613 1 36 LEU HB3 1 36 LEU MD1 2.802 . 3.783 2.505 2.469 2.544 . 0 0 "[ . 1 . 2]" 1
614 1 36 LEU HB3 1 36 LEU MD2 2.631 . 3.496 2.171 2.150 2.197 . 0 0 "[ . 1 . 2]" 1
615 1 36 LEU HB3 1 36 LEU HG 2.395 . 3.112 2.998 2.988 3.004 . 0 0 "[ . 1 . 2]" 1
616 1 36 LEU HB3 1 37 ASP H 2.947 . 4.032 3.336 3.284 3.386 . 0 0 "[ . 1 . 2]" 1
617 1 36 LEU MD1 1 36 LEU MD2 2.862 . 3.886 2.057 2.052 2.064 . 0 0 "[ . 1 . 2]" 1
618 1 36 LEU MD2 1 37 ASP H 3.973 . 5.946 4.718 4.696 4.763 . 0 0 "[ . 1 . 2]" 1
619 1 37 ASP H 1 37 ASP HA 2.925 . 3.994 2.811 2.799 2.831 . 0 0 "[ . 1 . 2]" 1
620 1 37 ASP H 1 37 ASP HB2 2.815 . 3.805 2.442 2.282 2.638 . 0 0 "[ . 1 . 2]" 1
621 1 37 ASP H 1 37 ASP HB3 2.625 . 3.486 2.588 2.428 2.846 . 0 0 "[ . 1 . 2]" 1
622 1 37 ASP H 1 38 LYS H 2.765 . 3.721 2.686 2.604 2.731 . 0 0 "[ . 1 . 2]" 1
623 1 37 ASP H 1 40 GLN HB2 3.396 . 4.838 4.822 4.749 4.902 0.064 5 0 "[ . 1 . 2]" 1
624 1 37 ASP HA 1 37 ASP HB3 2.388 . 3.101 3.025 2.997 3.030 . 0 0 "[ . 1 . 2]" 1
625 1 37 ASP HA 1 40 GLN H 3.066 . 4.241 3.499 3.369 3.591 . 0 0 "[ . 1 . 2]" 1
626 1 37 ASP HA 1 40 GLN HB2 2.142 . 2.715 2.595 2.461 2.710 . 0 0 "[ . 1 . 2]" 1
627 1 37 ASP HA 1 40 GLN HB3 3.114 . 4.326 3.897 3.691 4.013 . 0 0 "[ . 1 . 2]" 1
628 1 37 ASP HA 1 40 GLN HG2 3.299 . 4.659 4.520 3.844 4.710 0.051 14 0 "[ . 1 . 2]" 1
629 1 37 ASP HB2 1 38 LYS H 3.004 . 4.132 3.709 3.577 3.833 . 0 0 "[ . 1 . 2]" 1
630 1 37 ASP HB3 1 38 LYS H 2.856 . 3.875 2.418 2.338 2.599 . 0 0 "[ . 1 . 2]" 1
631 1 38 LYS H 1 38 LYS HA 2.928 . 4.000 2.811 2.794 2.831 . 0 0 "[ . 1 . 2]" 1
632 1 38 LYS H 1 38 LYS HB3 2.391 . 3.106 2.250 2.193 2.297 . 0 0 "[ . 1 . 2]" 1
633 1 38 LYS H 1 38 LYS HG3 3.050 . 4.213 4.249 4.210 4.284 0.071 10 0 "[ . 1 . 2]" 1
634 1 38 LYS H 1 39 CYS H 2.745 . 3.687 2.669 2.613 2.723 . 0 0 "[ . 1 . 2]" 1
635 1 38 LYS H 1 67 VAL MG1 3.817 . 5.638 4.188 4.094 4.317 . 0 0 "[ . 1 . 2]" 1
636 1 38 LYS H 1 67 VAL MG2 3.202 . 4.484 3.577 3.442 3.752 . 0 0 "[ . 1 . 2]" 1
637 1 38 LYS HA 1 38 LYS HB3 2.380 . 3.088 3.000 2.990 3.005 . 0 0 "[ . 1 . 2]" 1
638 1 38 LYS HA 1 38 LYS HD2 2.440 . 3.184 2.462 2.293 2.664 . 0 0 "[ . 1 . 2]" 1
639 1 38 LYS HA 1 38 LYS HD3 2.339 . 3.023 2.898 2.780 3.028 0.005 7 0 "[ . 1 . 2]" 1
640 1 38 LYS HA 1 39 CYS H 3.375 . 4.798 3.542 3.527 3.553 . 0 0 "[ . 1 . 2]" 1
641 1 38 LYS HA 1 41 GLU H 2.928 . 4.000 3.190 3.082 3.331 . 0 0 "[ . 1 . 2]" 1
642 1 38 LYS HA 1 41 GLU QB . . 2.811 2.461 2.209 2.735 . 0 0 "[ . 1 . 2]" 1
643 1 38 LYS HA 1 42 VAL MG1 3.179 . 4.442 4.247 4.173 4.293 . 0 0 "[ . 1 . 2]" 1
644 1 38 LYS HA 1 67 VAL MG2 4.036 . 4.638 4.207 4.174 4.246 . 0 0 "[ . 1 . 2]" 1
645 1 38 LYS HB3 1 38 LYS HD2 2.893 . 3.939 3.746 3.686 3.830 . 0 0 "[ . 1 . 2]" 1
646 1 38 LYS HB3 1 38 LYS HG3 2.333 . 3.013 2.413 2.383 2.477 . 0 0 "[ . 1 . 2]" 1
647 1 38 LYS HB3 1 39 CYS H 2.815 . 3.805 2.687 2.597 2.767 . 0 0 "[ . 1 . 2]" 1
648 1 38 LYS HB3 1 67 VAL MG1 2.498 . 3.278 2.281 2.173 2.440 . 0 0 "[ . 1 . 2]" 1
649 1 38 LYS HB3 1 67 VAL MG2 2.212 . 2.824 2.140 2.029 2.267 . 0 0 "[ . 1 . 2]" 1
650 1 38 LYS HD2 1 38 LYS HE2 2.645 . 3.519 3.004 3.000 3.009 . 0 0 "[ . 1 . 2]" 1
651 1 38 LYS HD2 1 38 LYS HE3 2.490 . 3.265 2.443 2.379 2.472 . 0 0 "[ . 1 . 2]" 1
652 1 38 LYS HD2 1 67 VAL MG1 3.181 . 4.446 4.062 4.032 4.100 . 0 0 "[ . 1 . 2]" 1
653 1 38 LYS HD3 1 38 LYS HE2 2.440 . 3.184 2.433 2.402 2.509 . 0 0 "[ . 1 . 2]" 1
654 1 38 LYS HD3 1 38 LYS HE3 2.361 . 3.058 3.017 3.011 3.024 . 0 0 "[ . 1 . 2]" 1
655 1 38 LYS HD3 1 38 LYS HG3 2.252 . 2.886 3.009 2.999 3.013 0.127 2 0 "[ . 1 . 2]" 1
656 1 38 LYS HD3 1 64 LEU HA 3.025 . 4.169 4.433 4.297 4.549 0.380 5 0 "[ . 1 . 2]" 1
657 1 38 LYS HD3 1 64 LEU MD2 2.989 . 4.105 4.065 3.998 4.125 0.020 9 0 "[ . 1 . 2]" 1
658 1 38 LYS HD3 1 67 VAL MG1 3.442 . 4.923 3.925 3.852 3.987 . 0 0 "[ . 1 . 2]" 1
659 1 38 LYS HE2 1 38 LYS HG3 2.494 . 3.272 3.132 3.062 3.173 . 0 0 "[ . 1 . 2]" 1
660 1 38 LYS HE2 1 63 GLU HB3 2.700 . 3.611 2.568 2.278 3.311 . 0 0 "[ . 1 . 2]" 1
661 1 38 LYS HE2 1 64 LEU MD2 3.026 . 4.170 3.477 3.170 3.581 . 0 0 "[ . 1 . 2]" 1
662 1 38 LYS HE2 1 67 VAL MG1 2.961 . 4.057 3.513 3.125 3.637 . 0 0 "[ . 1 . 2]" 1
663 1 38 LYS HE2 1 67 VAL MG2 3.729 . 5.467 4.109 3.782 4.310 . 0 0 "[ . 1 . 2]" 1
664 1 38 LYS HE3 1 38 LYS HG3 2.455 . 3.208 2.516 2.413 2.677 . 0 0 "[ . 1 . 2]" 1
665 1 38 LYS HE3 1 63 GLU HB2 3.690 . 5.392 3.504 3.180 3.743 . 0 0 "[ . 1 . 2]" 1
666 1 38 LYS HE3 1 63 GLU HB3 2.810 . 3.797 3.246 2.952 3.498 . 0 0 "[ . 1 . 2]" 1
667 1 38 LYS HE3 1 64 LEU HA 3.174 . 4.433 2.261 2.152 2.352 . 0 0 "[ . 1 . 2]" 1
668 1 38 LYS HE3 1 64 LEU MD2 3.846 . 5.695 2.349 2.245 2.470 . 0 0 "[ . 1 . 2]" 1
669 1 38 LYS HE3 1 64 LEU HG 3.095 . 4.292 4.421 4.351 4.507 0.215 18 0 "[ . 1 . 2]" 1
670 1 38 LYS HE3 1 67 VAL H 3.765 . 5.537 5.071 4.859 5.174 . 0 0 "[ . 1 . 2]" 1
671 1 38 LYS HE3 1 67 VAL MG1 2.802 . 3.783 3.644 3.614 3.664 . 0 0 "[ . 1 . 2]" 1
672 1 38 LYS HE3 1 68 CYS H 4.145 . 6.293 6.352 6.298 6.383 0.090 12 0 "[ . 1 . 2]" 1
673 1 38 LYS HG3 1 39 CYS H 3.813 . 5.631 3.341 3.224 3.442 . 0 0 "[ . 1 . 2]" 1
674 1 38 LYS HG3 1 64 LEU MD2 1.915 . 2.373 1.805 1.730 1.892 . 0 0 "[ . 1 . 2]" 1
675 1 38 LYS HG3 1 67 VAL HB 2.657 . 3.539 3.571 3.548 3.604 0.065 7 0 "[ . 1 . 2]" 1
676 1 38 LYS HG3 1 67 VAL MG1 2.363 . 3.061 2.089 2.012 2.200 . 0 0 "[ . 1 . 2]" 1
677 1 39 CYS H 1 39 CYS HA 2.730 . 3.662 2.806 2.788 2.816 . 0 0 "[ . 1 . 2]" 1
678 1 39 CYS H 1 39 CYS HB2 2.910 . 3.969 2.431 2.363 2.738 . 0 0 "[ . 1 . 2]" 1
679 1 39 CYS H 1 39 CYS HB3 2.755 . 3.704 3.457 2.314 3.595 . 0 0 "[ . 1 . 2]" 1
680 1 39 CYS H 1 40 GLN H 2.784 . 3.753 2.675 2.603 2.758 . 0 0 "[ . 1 . 2]" 1
681 1 39 CYS H 1 40 GLN HB3 3.924 . 5.848 5.870 5.769 5.959 0.111 10 0 "[ . 1 . 2]" 1
682 1 39 CYS H 1 67 VAL MG2 3.324 . 4.705 4.532 4.464 4.630 . 0 0 "[ . 1 . 2]" 1
683 1 39 CYS HA 1 39 CYS HB2 2.492 . 3.268 2.953 2.362 3.024 . 0 0 "[ . 1 . 2]" 1
684 1 39 CYS HA 1 39 CYS HB3 2.597 . 3.440 2.594 2.532 3.011 . 0 0 "[ . 1 . 2]" 1
685 1 39 CYS HA 1 42 VAL HB 3.247 . 4.565 4.534 4.334 4.604 0.039 11 0 "[ . 1 . 2]" 1
686 1 39 CYS HA 1 42 VAL MG1 2.684 . 3.585 2.033 1.926 2.075 . 0 0 "[ . 1 . 2]" 1
687 1 39 CYS HA 1 64 LEU MD2 2.577 . 3.407 1.960 1.887 2.058 . 0 0 "[ . 1 . 2]" 1
688 1 39 CYS HB2 1 43 ILE MD 3.207 . 4.492 3.822 3.695 4.157 . 0 0 "[ . 1 . 2]" 1
689 1 39 CYS HB3 1 40 GLN H 2.725 . 3.653 3.478 2.465 3.630 . 0 0 "[ . 1 . 2]" 1
690 1 39 CYS HB3 1 43 ILE MD 3.149 . 4.388 2.694 2.449 3.980 . 0 0 "[ . 1 . 2]" 1
691 1 40 GLN H 1 40 GLN HA 2.761 . 3.714 2.824 2.797 2.839 . 0 0 "[ . 1 . 2]" 1
692 1 40 GLN H 1 40 GLN HB3 2.548 . 3.359 3.364 3.255 3.454 0.095 10 0 "[ . 1 . 2]" 1
693 1 40 GLN H 1 40 GLN HG2 2.622 . 3.482 3.235 2.711 3.533 0.051 14 0 "[ . 1 . 2]" 1
694 1 40 GLN HA 1 40 GLN HB2 2.446 . 3.194 2.916 2.856 2.976 . 0 0 "[ . 1 . 2]" 1
695 1 40 GLN HA 1 40 GLN HB3 2.351 . 3.042 2.762 2.624 2.846 . 0 0 "[ . 1 . 2]" 1
696 1 40 GLN HA 1 40 GLN HE21 4.007 . 6.014 2.221 1.825 3.690 0.175 13 0 "[ . 1 . 2]" 1
697 1 40 GLN HA 1 40 GLN HG2 2.335 . 3.017 2.532 2.399 2.845 . 0 0 "[ . 1 . 2]" 1
698 1 40 GLN HA 1 43 ILE H 2.907 . 3.964 3.493 3.347 3.575 . 0 0 "[ . 1 . 2]" 1
699 1 40 GLN HA 1 43 ILE HA 3.826 . 5.656 5.280 5.092 5.353 . 0 0 "[ . 1 . 2]" 1
700 1 40 GLN HA 1 43 ILE HB 2.107 . 2.662 2.399 2.206 2.468 . 0 0 "[ . 1 . 2]" 1
701 1 40 GLN HA 1 43 ILE MD 2.864 . 3.889 3.228 3.056 3.328 . 0 0 "[ . 1 . 2]" 1
702 1 40 GLN HA 1 43 ILE HG12 3.600 . 5.220 5.216 5.007 5.276 0.056 6 0 "[ . 1 . 2]" 1
703 1 40 GLN HA 1 43 ILE MG 2.885 . 3.925 3.470 3.378 3.514 . 0 0 "[ . 1 . 2]" 1
704 1 40 GLN HB2 1 40 GLN HG2 2.428 . 3.165 2.473 2.336 2.586 . 0 0 "[ . 1 . 2]" 1
705 1 40 GLN HB3 1 40 GLN HE21 3.753 . 5.514 3.588 1.906 4.471 0.086 10 0 "[ . 1 . 2]" 1
706 1 40 GLN HB3 1 40 GLN HG2 2.714 . 3.635 3.004 2.982 3.013 . 0 0 "[ . 1 . 2]" 1
707 1 40 GLN HB3 1 41 GLU H 2.358 . 3.053 3.125 3.008 3.279 0.226 10 0 "[ . 1 . 2]" 1
708 1 40 GLN HB3 1 44 SER H 3.649 . 5.313 4.863 4.672 5.002 . 0 0 "[ . 1 . 2]" 1
709 1 40 GLN HE21 1 40 GLN HG2 2.829 . 3.829 2.437 2.221 3.483 . 0 0 "[ . 1 . 2]" 1
710 1 40 GLN HE21 1 43 ILE MG 2.736 . 3.671 3.094 2.747 4.346 0.675 17 1 "[ . 1 . + 2]" 1
711 1 40 GLN HE22 1 43 ILE MG 3.356 . 4.764 2.917 2.625 3.576 . 0 0 "[ . 1 . 2]" 1
712 1 40 GLN HG2 1 43 ILE MD 3.261 . 4.591 4.188 4.029 4.339 . 0 0 "[ . 1 . 2]" 1
713 1 41 GLU H 1 41 GLU HA 2.590 . 3.429 2.790 2.780 2.798 . 0 0 "[ . 1 . 2]" 1
714 1 41 GLU H 1 41 GLU QB 2.422 . 3.156 2.298 2.202 2.504 . 0 0 "[ . 1 . 2]" 1
715 1 41 GLU H 1 42 VAL MG1 2.864 . 3.889 3.697 3.656 3.735 . 0 0 "[ . 1 . 2]" 1
716 1 41 GLU H 1 42 VAL MG2 4.637 . 7.325 5.941 5.898 5.971 . 0 0 "[ . 1 . 2]" 1
717 1 41 GLU HA 1 41 GLU QB 2.297 . 2.757 2.347 2.302 2.446 . 0 0 "[ . 1 . 2]" 1
718 1 41 GLU HA 1 41 GLU HG2 2.443 . 3.189 2.628 2.343 3.090 . 0 0 "[ . 1 . 2]" 1
719 1 41 GLU HA 1 41 GLU HG3 2.455 . 3.208 3.132 2.588 3.438 0.230 16 0 "[ . 1 . 2]" 1
720 1 41 GLU HA 1 42 VAL H 2.639 . 3.510 3.550 3.538 3.566 0.056 2 0 "[ . 1 . 2]" 1
721 1 41 GLU QB 1 44 SER H 4.135 . 6.272 5.111 4.953 5.226 . 0 0 "[ . 1 . 2]" 1
722 1 42 VAL H 1 42 VAL HA 2.314 . 2.983 2.821 2.807 2.832 . 0 0 "[ . 1 . 2]" 1
723 1 42 VAL H 1 42 VAL HB 2.290 . 2.946 2.865 2.798 2.926 . 0 0 "[ . 1 . 2]" 1
724 1 42 VAL H 1 42 VAL MG1 2.308 . 2.974 1.737 1.703 1.823 . 0 0 "[ . 1 . 2]" 1
725 1 42 VAL H 1 43 ILE H 2.795 . 3.771 2.693 2.666 2.737 . 0 0 "[ . 1 . 2]" 1
726 1 42 VAL HA 1 42 VAL HB 2.669 . 3.559 2.324 2.306 2.356 . 0 0 "[ . 1 . 2]" 1
727 1 42 VAL HA 1 42 VAL MG1 2.877 . 3.574 3.171 3.160 3.186 . 0 0 "[ . 1 . 2]" 1
728 1 42 VAL HA 1 42 VAL MG2 2.690 . 3.595 2.553 2.438 2.632 . 0 0 "[ . 1 . 2]" 1
729 1 42 VAL HA 1 43 ILE H 2.786 . 3.756 3.550 3.539 3.557 . 0 0 "[ . 1 . 2]" 1
730 1 42 VAL HA 1 45 TRP HA 3.711 . 5.432 4.972 4.788 5.239 . 0 0 "[ . 1 . 2]" 1
731 1 42 VAL HA 1 45 TRP HB2 2.910 . 3.969 3.141 2.815 3.453 . 0 0 "[ . 1 . 2]" 1
732 1 42 VAL HB 1 42 VAL MG1 2.024 . 2.536 2.117 2.112 2.122 . 0 0 "[ . 1 . 2]" 1
733 1 42 VAL HB 1 42 VAL MG2 2.273 . 2.919 2.109 2.096 2.122 . 0 0 "[ . 1 . 2]" 1
734 1 42 VAL HB 1 43 ILE H 3.101 . 4.303 4.117 4.066 4.152 . 0 0 "[ . 1 . 2]" 1
735 1 42 VAL MG1 1 60 LYS HG2 3.621 . 5.260 4.317 4.243 4.389 . 0 0 "[ . 1 . 2]" 1
736 1 42 VAL MG1 1 60 LYS HG3 3.373 . 4.795 3.771 3.583 4.293 . 0 0 "[ . 1 . 2]" 1
737 1 42 VAL MG1 1 64 LEU HB2 2.648 . 3.524 2.906 2.744 3.145 . 0 0 "[ . 1 . 2]" 1
738 1 42 VAL MG2 1 45 TRP HE3 2.961 . 4.057 2.766 2.434 3.206 . 0 0 "[ . 1 . 2]" 1
739 1 42 VAL MG2 1 60 LYS HG2 2.912 . 3.972 1.908 1.628 2.250 0.224 18 0 "[ . 1 . 2]" 1
740 1 43 ILE H 1 43 ILE HB 2.454 . 3.206 2.262 2.231 2.295 . 0 0 "[ . 1 . 2]" 1
741 1 43 ILE H 1 43 ILE MD 3.203 . 4.486 3.566 3.501 3.638 . 0 0 "[ . 1 . 2]" 1
742 1 43 ILE H 1 43 ILE HG12 2.953 . 4.043 3.939 3.860 4.024 . 0 0 "[ . 1 . 2]" 1
743 1 43 ILE H 1 43 ILE HG13 2.494 . 3.271 2.669 2.576 2.779 . 0 0 "[ . 1 . 2]" 1
744 1 43 ILE HA 1 43 ILE HB 2.687 . 3.590 2.975 2.968 2.983 . 0 0 "[ . 1 . 2]" 1
745 1 43 ILE HA 1 43 ILE MD 3.142 . 4.376 3.731 3.722 3.740 . 0 0 "[ . 1 . 2]" 1
746 1 43 ILE HA 1 43 ILE HG12 2.604 . 3.452 2.479 2.438 2.519 . 0 0 "[ . 1 . 2]" 1
747 1 43 ILE HA 1 43 ILE HG13 2.684 . 3.585 2.539 2.502 2.619 . 0 0 "[ . 1 . 2]" 1
748 1 43 ILE HA 1 43 ILE MG 2.528 . 3.327 2.642 2.612 2.674 . 0 0 "[ . 1 . 2]" 1
749 1 43 ILE HA 1 44 SER H 3.084 . 4.273 3.554 3.536 3.570 . 0 0 "[ . 1 . 2]" 1
750 1 43 ILE HA 1 46 LEU HB2 2.541 . 3.348 2.563 2.374 2.719 . 0 0 "[ . 1 . 2]" 1
751 1 43 ILE HA 1 46 LEU HB3 3.000 . 4.125 4.026 3.842 4.135 0.010 2 0 "[ . 1 . 2]" 1
752 1 43 ILE HB 1 43 ILE MD 2.472 . 3.236 2.398 2.364 2.422 . 0 0 "[ . 1 . 2]" 1
753 1 43 ILE HB 1 43 ILE HG12 2.445 . 3.192 3.021 3.014 3.026 . 0 0 "[ . 1 . 2]" 1
754 1 43 ILE HB 1 43 ILE HG13 2.735 . 3.670 2.543 2.518 2.568 . 0 0 "[ . 1 . 2]" 1
755 1 43 ILE HB 1 43 ILE MG 2.155 . 2.735 2.123 2.120 2.126 . 0 0 "[ . 1 . 2]" 1
756 1 43 ILE HB 1 44 SER H 2.792 . 3.767 2.873 2.791 2.927 . 0 0 "[ . 1 . 2]" 1
757 1 43 ILE MD 1 43 ILE HG12 2.264 . 2.905 2.094 2.085 2.101 . 0 0 "[ . 1 . 2]" 1
758 1 43 ILE MD 1 43 ILE HG13 2.375 . 3.080 2.101 2.095 2.106 . 0 0 "[ . 1 . 2]" 1
759 1 43 ILE MD 1 43 ILE MG 2.838 . 3.844 1.983 1.896 2.043 . 0 0 "[ . 1 . 2]" 1
760 1 43 ILE MD 1 46 LEU MD1 3.819 . 5.642 3.829 3.765 3.887 . 0 0 "[ . 1 . 2]" 1
761 1 43 ILE HG12 1 43 ILE MG 2.738 . 3.675 2.321 2.295 2.340 . 0 0 "[ . 1 . 2]" 1
762 1 43 ILE HG12 1 44 SER H 3.587 . 5.196 5.162 5.120 5.202 0.006 3 0 "[ . 1 . 2]" 1
763 1 43 ILE MG 1 44 SER H 2.934 . 4.010 2.975 2.884 3.046 . 0 0 "[ . 1 . 2]" 1
764 1 43 ILE MG 1 44 SER HA 3.175 . 4.435 3.184 3.079 3.273 . 0 0 "[ . 1 . 2]" 1
765 1 43 ILE MG 1 46 LEU HB2 3.359 . 4.769 3.713 3.606 3.811 . 0 0 "[ . 1 . 2]" 1
766 1 43 ILE MG 1 47 ASP HB2 3.858 . 5.718 4.118 3.952 4.415 . 0 0 "[ . 1 . 2]" 1
767 1 43 ILE MG 1 47 ASP HB3 3.815 . 5.634 4.768 4.531 5.009 . 0 0 "[ . 1 . 2]" 1
768 1 44 SER H 1 44 SER HA 2.846 . 3.858 2.847 2.827 2.858 . 0 0 "[ . 1 . 2]" 1
769 1 44 SER H 1 44 SER HB2 2.403 . 3.125 2.794 2.466 3.606 0.481 3 0 "[ . 1 . 2]" 1
770 1 44 SER H 1 45 TRP H 2.782 . 3.749 2.515 2.471 2.585 . 0 0 "[ . 1 . 2]" 1
771 1 44 SER HA 1 44 SER HB3 2.307 . 2.972 2.699 2.371 3.035 0.063 16 0 "[ . 1 . 2]" 1
772 1 44 SER HA 1 45 TRP H 3.494 . 5.020 3.482 3.449 3.505 . 0 0 "[ . 1 . 2]" 1
773 1 44 SER HA 1 47 ASP HB2 3.265 . 4.598 3.663 3.326 4.063 . 0 0 "[ . 1 . 2]" 1
774 1 44 SER HA 1 47 ASP HB3 2.895 . 3.943 2.998 2.515 3.448 . 0 0 "[ . 1 . 2]" 1
775 1 45 TRP H 1 45 TRP HA 2.462 . 3.220 2.843 2.825 2.865 . 0 0 "[ . 1 . 2]" 1
776 1 45 TRP H 1 45 TRP HB2 2.558 . 3.376 2.679 2.615 2.776 . 0 0 "[ . 1 . 2]" 1
777 1 45 TRP H 1 45 TRP HB3 2.414 . 3.142 2.350 2.276 2.404 . 0 0 "[ . 1 . 2]" 1
778 1 45 TRP H 1 45 TRP HE3 3.478 . 4.990 4.352 4.201 4.473 . 0 0 "[ . 1 . 2]" 1
779 1 45 TRP H 1 46 LEU H 1.911 . 2.368 2.464 2.411 2.501 0.133 20 0 "[ . 1 . 2]" 1
780 1 45 TRP H 1 46 LEU HB2 3.499 . 5.029 4.442 4.328 4.556 . 0 0 "[ . 1 . 2]" 1
781 1 45 TRP H 1 46 LEU MD1 4.238 . 6.483 4.676 4.565 4.802 . 0 0 "[ . 1 . 2]" 1
782 1 45 TRP H 1 48 ALA MB 3.388 . 4.823 4.488 4.434 4.594 . 0 0 "[ . 1 . 2]" 1
783 1 45 TRP HA 1 45 TRP HB2 2.463 . 3.221 2.413 2.386 2.433 . 0 0 "[ . 1 . 2]" 1
784 1 45 TRP HA 1 45 TRP HB3 2.631 . 3.496 3.028 3.022 3.031 . 0 0 "[ . 1 . 2]" 1
785 1 45 TRP HA 1 45 TRP HD1 3.155 . 4.399 3.288 3.151 3.398 . 0 0 "[ . 1 . 2]" 1
786 1 45 TRP HA 1 48 ALA H 3.601 . 5.222 3.296 3.152 3.552 . 0 0 "[ . 1 . 2]" 1
787 1 45 TRP HA 1 48 ALA MB 2.520 . 3.314 2.511 2.416 2.650 . 0 0 "[ . 1 . 2]" 1
788 1 45 TRP HA 1 49 ASN H 3.551 . 5.127 3.986 3.702 5.034 . 0 0 "[ . 1 . 2]" 1
789 1 45 TRP HB2 1 45 TRP HD1 3.064 . 4.238 2.666 2.632 2.716 . 0 0 "[ . 1 . 2]" 1
790 1 45 TRP HB2 1 45 TRP HE3 3.270 . 4.607 4.108 4.071 4.137 . 0 0 "[ . 1 . 2]" 1
791 1 45 TRP HB2 1 46 LEU H 3.304 . 4.668 3.938 3.865 4.000 . 0 0 "[ . 1 . 2]" 1
792 1 45 TRP HB3 1 45 TRP HD1 3.462 . 4.960 3.814 3.789 3.845 . 0 0 "[ . 1 . 2]" 1
793 1 45 TRP HB3 1 45 TRP HE3 3.106 . 4.312 2.570 2.518 2.619 . 0 0 "[ . 1 . 2]" 1
794 1 45 TRP HB3 1 46 LEU H 2.496 . 3.274 2.653 2.546 2.731 . 0 0 "[ . 1 . 2]" 1
795 1 45 TRP HB3 1 48 ALA H 3.772 . 5.551 5.326 5.226 5.475 . 0 0 "[ . 1 . 2]" 1
796 1 45 TRP HE3 1 46 LEU H 3.023 . 4.165 2.847 2.661 3.131 . 0 0 "[ . 1 . 2]" 1
797 1 45 TRP HH2 1 52 ALA MB 2.724 . 3.652 2.936 2.694 3.380 . 0 0 "[ . 1 . 2]" 1
798 1 45 TRP HH2 1 56 GLU HB3 3.397 . 4.840 2.374 1.920 3.086 0.034 3 0 "[ . 1 . 2]" 1
799 1 45 TRP HH2 1 57 PHE HA 3.183 . 4.449 2.737 2.495 3.133 . 0 0 "[ . 1 . 2]" 1
800 1 45 TRP HZ2 1 52 ALA MB 2.949 . 4.036 3.135 2.629 3.648 . 0 0 "[ . 1 . 2]" 1
801 1 45 TRP HZ2 1 56 GLU HB2 3.370 . 4.789 3.757 3.022 4.285 . 0 0 "[ . 1 . 2]" 1
802 1 45 TRP HZ2 1 56 GLU HB3 2.945 . 4.029 2.384 1.811 3.751 0.050 17 0 "[ . 1 . 2]" 1
803 1 45 TRP HZ3 1 46 LEU MD2 2.873 . 3.905 2.208 1.973 2.373 . 0 0 "[ . 1 . 2]" 1
804 1 45 TRP HZ3 1 52 ALA MB 3.762 . 5.531 4.224 3.836 4.454 . 0 0 "[ . 1 . 2]" 1
805 1 45 TRP HZ3 1 57 PHE HA 2.850 . 3.865 2.821 2.506 3.192 . 0 0 "[ . 1 . 2]" 1
806 1 46 LEU H 1 46 LEU HB2 2.323 . 2.997 2.361 2.240 2.481 . 0 0 "[ . 1 . 2]" 1
807 1 46 LEU H 1 46 LEU HB3 2.797 . 3.775 3.544 3.507 3.569 . 0 0 "[ . 1 . 2]" 1
808 1 46 LEU H 1 46 LEU MD1 2.940 . 4.021 3.312 3.220 3.401 . 0 0 "[ . 1 . 2]" 1
809 1 46 LEU H 1 46 LEU MD2 3.442 . 4.923 3.700 3.474 3.894 . 0 0 "[ . 1 . 2]" 1
810 1 46 LEU H 1 47 ASP H 2.831 . 3.833 2.717 2.634 2.790 . 0 0 "[ . 1 . 2]" 1
811 1 46 LEU HA 1 46 LEU HB2 2.425 . 3.160 3.001 2.979 3.015 . 0 0 "[ . 1 . 2]" 1
812 1 46 LEU HA 1 46 LEU HB3 2.543 . 3.351 2.530 2.469 2.592 . 0 0 "[ . 1 . 2]" 1
813 1 46 LEU HA 1 46 LEU MD1 3.394 . 4.795 3.838 3.782 3.888 . 0 0 "[ . 1 . 2]" 1
814 1 46 LEU HA 1 46 LEU MD2 2.355 . 3.048 2.272 2.184 2.347 . 0 0 "[ . 1 . 2]" 1
815 1 46 LEU HA 1 46 LEU HG 2.781 . 3.748 2.761 2.609 2.928 . 0 0 "[ . 1 . 2]" 1
816 1 46 LEU HA 1 47 ASP H 3.165 . 4.417 3.526 3.502 3.547 . 0 0 "[ . 1 . 2]" 1
817 1 46 LEU HA 1 49 ASN H 3.322 . 4.701 3.446 3.321 3.563 . 0 0 "[ . 1 . 2]" 1
818 1 46 LEU HA 1 49 ASN HB2 3.071 . 4.250 3.911 3.389 5.150 0.900 5 2 "[ - + 1 . 2]" 1
819 1 46 LEU HA 1 57 PHE QE 2.659 . 3.543 2.992 2.586 3.366 . 0 0 "[ . 1 . 2]" 1
820 1 46 LEU HB2 1 46 LEU MD1 2.534 . 3.337 2.108 2.056 2.138 . 0 0 "[ . 1 . 2]" 1
821 1 46 LEU HB2 1 46 LEU MD2 2.592 . 3.432 3.125 3.108 3.140 . 0 0 "[ . 1 . 2]" 1
822 1 46 LEU HB2 1 47 ASP H 2.606 . 3.455 2.441 2.370 2.511 . 0 0 "[ . 1 . 2]" 1
823 1 46 LEU HB3 1 46 LEU MD1 2.306 . 2.970 2.454 2.424 2.486 . 0 0 "[ . 1 . 2]" 1
824 1 46 LEU HB3 1 46 LEU MD2 1.876 . 2.316 2.112 2.051 2.158 . 0 0 "[ . 1 . 2]" 1
825 1 46 LEU HB3 1 46 LEU HG 2.973 . 4.078 2.993 2.983 3.003 . 0 0 "[ . 1 . 2]" 1
826 1 46 LEU HB3 1 47 ASP H 2.691 . 3.596 3.342 3.174 3.565 . 0 0 "[ . 1 . 2]" 1
827 1 46 LEU MD1 1 46 LEU MD2 2.361 . 3.058 2.001 1.981 2.029 . 0 0 "[ . 1 . 2]" 1
828 1 46 LEU MD1 1 46 LEU HG 2.281 . 2.932 2.087 2.081 2.096 . 0 0 "[ . 1 . 2]" 1
829 1 46 LEU MD1 1 47 ASP H 3.181 . 4.446 4.177 4.106 4.227 . 0 0 "[ . 1 . 2]" 1
830 1 46 LEU MD1 1 57 PHE QE 3.819 . 5.642 4.639 4.536 4.722 . 0 0 "[ . 1 . 2]" 1
831 1 46 LEU MD2 1 46 LEU HG 2.265 . 2.907 2.115 2.110 2.118 . 0 0 "[ . 1 . 2]" 1
832 1 46 LEU MD2 1 57 PHE QE 2.365 . 3.064 2.086 1.911 2.272 . 0 0 "[ . 1 . 2]" 1
833 1 46 LEU HG 1 57 PHE QE 3.186 . 4.455 4.393 4.198 4.579 0.124 5 0 "[ . 1 . 2]" 1
834 1 47 ASP H 1 47 ASP HA 2.732 . 3.665 2.835 2.811 2.853 . 0 0 "[ . 1 . 2]" 1
835 1 47 ASP H 1 47 ASP HB2 2.189 . 2.788 2.529 2.369 2.662 . 0 0 "[ . 1 . 2]" 1
836 1 47 ASP H 1 47 ASP HB3 2.305 . 2.969 2.522 2.340 2.687 . 0 0 "[ . 1 . 2]" 1
837 1 47 ASP H 1 48 ALA H 2.721 . 3.646 2.535 2.505 2.603 . 0 0 "[ . 1 . 2]" 1
838 1 47 ASP H 1 48 ALA MB 3.106 . 4.312 4.105 4.073 4.131 . 0 0 "[ . 1 . 2]" 1
839 1 47 ASP HA 1 47 ASP HB2 2.406 . 3.129 2.473 2.393 2.566 . 0 0 "[ . 1 . 2]" 1
840 1 47 ASP HA 1 47 ASP HB3 2.383 . 3.093 3.028 3.017 3.033 . 0 0 "[ . 1 . 2]" 1
841 1 47 ASP HA 1 50 THR MG 2.654 . 3.534 2.955 2.584 3.452 . 0 0 "[ . 1 . 2]" 1
842 1 47 ASP HB2 1 48 ALA H 3.208 . 4.495 4.007 3.888 4.110 . 0 0 "[ . 1 . 2]" 1
843 1 47 ASP HB2 1 48 ALA MB 3.723 . 5.456 5.096 5.005 5.124 . 0 0 "[ . 1 . 2]" 1
844 1 47 ASP HB3 1 48 ALA H 2.773 . 3.734 2.911 2.716 3.126 . 0 0 "[ . 1 . 2]" 1
845 1 47 ASP HB3 1 48 ALA MB 3.298 . 4.657 3.710 3.662 3.767 . 0 0 "[ . 1 . 2]" 1
846 1 48 ALA H 1 48 ALA HA 2.803 . 3.785 2.892 2.851 2.925 . 0 0 "[ . 1 . 2]" 1
847 1 48 ALA H 1 49 ASN H 2.726 . 3.655 2.333 2.182 2.473 . 0 0 "[ . 1 . 2]" 1
848 1 48 ALA HA 1 48 ALA MB 2.099 . 2.650 2.100 2.082 2.106 . 0 0 "[ . 1 . 2]" 1
849 1 48 ALA HA 1 49 ASN H 3.228 . 4.531 3.484 3.309 3.513 . 0 0 "[ . 1 . 2]" 1
850 1 48 ALA MB 1 49 ASN H 2.853 . 3.871 2.784 2.707 3.271 . 0 0 "[ . 1 . 2]" 1
851 1 49 ASN H 1 49 ASN HB2 2.843 . 3.854 2.678 2.453 3.975 0.121 3 0 "[ . 1 . 2]" 1
852 1 49 ASN H 1 49 ASN HB3 3.042 . 4.199 3.636 2.645 3.790 . 0 0 "[ . 1 . 2]" 1
853 1 49 ASN H 1 50 THR H 2.922 . 3.989 3.083 2.795 3.356 . 0 0 "[ . 1 . 2]" 1
854 1 49 ASN HA 1 49 ASN HB2 2.879 . 3.915 2.950 2.337 3.030 . 0 0 "[ . 1 . 2]" 1
855 1 49 ASN HA 1 49 ASN HB3 2.753 . 3.701 2.547 2.490 2.584 . 0 0 "[ . 1 . 2]" 1
856 1 49 ASN HA 1 52 ALA MB 3.221 . 4.518 3.959 3.689 4.131 . 0 0 "[ . 1 . 2]" 1
857 1 49 ASN HB2 1 52 ALA MB 2.819 . 3.812 3.151 2.142 3.445 . 0 0 "[ . 1 . 2]" 1
858 1 49 ASN HB3 1 52 ALA MB 2.304 . 2.968 2.314 1.939 3.490 0.522 5 1 "[ + 1 . 2]" 1
859 1 50 THR H 1 50 THR HA 2.871 . 3.902 2.828 2.777 2.878 . 0 0 "[ . 1 . 2]" 1
860 1 50 THR H 1 50 THR HB 3.004 . 4.132 3.386 2.938 3.616 . 0 0 "[ . 1 . 2]" 1
861 1 50 THR H 1 50 THR MG 2.755 . 3.704 2.845 2.198 3.496 . 0 0 "[ . 1 . 2]" 1
862 1 50 THR H 1 51 LEU H 2.913 . 3.974 2.522 2.315 2.703 . 0 0 "[ . 1 . 2]" 1
863 1 50 THR H 1 51 LEU MD1 3.628 . 5.273 4.466 4.196 4.913 . 0 0 "[ . 1 . 2]" 1
864 1 50 THR H 1 51 LEU HG 4.032 . 6.064 5.816 5.337 6.112 0.048 3 0 "[ . 1 . 2]" 1
865 1 50 THR HA 1 50 THR HB 2.510 . 3.297 2.697 2.472 2.968 . 0 0 "[ . 1 . 2]" 1
866 1 50 THR HA 1 50 THR MG 2.524 . 3.320 2.215 2.142 2.357 . 0 0 "[ . 1 . 2]" 1
867 1 50 THR HA 1 51 LEU H 3.379 . 4.807 3.383 3.298 3.451 . 0 0 "[ . 1 . 2]" 1
868 1 50 THR HA 1 57 PHE QE 3.335 . 4.725 3.734 3.300 4.643 . 0 0 "[ . 1 . 2]" 1
869 1 50 THR HB 1 50 THR MG 2.308 . 2.974 2.132 2.123 2.135 . 0 0 "[ . 1 . 2]" 1
870 1 50 THR HB 1 51 LEU H 2.976 . 4.083 3.688 3.135 4.108 0.025 8 0 "[ . 1 . 2]" 1
871 1 50 THR HB 1 51 LEU MD1 3.510 . 5.050 3.092 2.408 4.007 . 0 0 "[ . 1 . 2]" 1
872 1 50 THR HB 1 51 LEU MD2 4.082 . 6.165 3.090 2.127 3.778 . 0 0 "[ . 1 . 2]" 1
873 1 50 THR MG 1 51 LEU H 3.631 . 5.279 4.193 3.986 4.396 . 0 0 "[ . 1 . 2]" 1
874 1 50 THR MG 1 51 LEU MD2 3.666 . 5.346 3.790 3.527 4.143 . 0 0 "[ . 1 . 2]" 1
875 1 51 LEU H 1 51 LEU HB2 2.208 . 2.817 2.521 2.427 2.606 . 0 0 "[ . 1 . 2]" 1
876 1 51 LEU H 1 51 LEU HB3 4.334 . 6.682 3.656 3.599 3.740 . 0 0 "[ . 1 . 2]" 1
877 1 51 LEU H 1 51 LEU MD2 3.244 . 4.560 1.984 1.709 2.286 0.219 13 0 "[ . 1 . 2]" 1
878 1 51 LEU H 1 52 ALA H 2.799 . 3.778 2.375 2.221 2.471 . 0 0 "[ . 1 . 2]" 1
879 1 51 LEU H 1 52 ALA MB 3.579 . 5.180 3.957 3.774 4.059 . 0 0 "[ . 1 . 2]" 1
880 1 51 LEU HA 1 51 LEU HB2 2.288 . 2.943 3.011 3.006 3.016 0.073 17 0 "[ . 1 . 2]" 1
881 1 51 LEU HA 1 51 LEU HB3 2.488 . 3.262 2.447 2.412 2.497 . 0 0 "[ . 1 . 2]" 1
882 1 51 LEU HA 1 51 LEU MD1 3.283 . 4.630 2.041 1.917 2.137 0.019 15 0 "[ . 1 . 2]" 1
883 1 51 LEU HA 1 51 LEU MD2 2.842 . 3.852 3.245 3.047 3.379 . 0 0 "[ . 1 . 2]" 1
884 1 51 LEU HA 1 51 LEU HG 3.411 . 4.865 3.709 3.665 3.785 . 0 0 "[ . 1 . 2]" 1
885 1 51 LEU HB2 1 51 LEU MD2 2.893 . 3.939 2.229 2.165 2.314 . 0 0 "[ . 1 . 2]" 1
886 1 51 LEU HB2 1 52 ALA H 2.997 . 4.120 3.638 3.419 3.716 . 0 0 "[ . 1 . 2]" 1
887 1 51 LEU HB3 1 51 LEU MD2 2.810 . 3.797 3.168 3.139 3.202 . 0 0 "[ . 1 . 2]" 1
888 1 51 LEU HB3 1 52 ALA H 3.910 . 5.821 4.332 4.242 4.380 . 0 0 "[ . 1 . 2]" 1
889 1 51 LEU MD1 1 51 LEU MD2 2.570 . 3.396 2.054 2.033 2.089 . 0 0 "[ . 1 . 2]" 1
890 1 51 LEU HG 1 52 ALA H 3.853 . 5.709 5.739 5.574 5.797 0.088 3 0 "[ . 1 . 2]" 1
891 1 52 ALA H 1 52 ALA HA 2.861 . 3.884 2.820 2.745 2.868 . 0 0 "[ . 1 . 2]" 1
892 1 52 ALA H 1 52 ALA MB 2.454 . 3.207 2.100 2.013 2.159 . 0 0 "[ . 1 . 2]" 1
893 1 52 ALA HA 1 52 ALA MB 2.185 . 2.782 2.104 2.084 2.116 . 0 0 "[ . 1 . 2]" 1
894 1 52 ALA HA 1 53 GLU H 2.363 . 3.061 2.303 2.250 2.378 . 0 0 "[ . 1 . 2]" 1
895 1 52 ALA MB 1 53 GLU H 2.597 . 3.440 2.614 2.455 2.774 . 0 0 "[ . 1 . 2]" 1
896 1 52 ALA MB 1 56 GLU H 3.356 . 4.764 3.956 3.814 4.196 . 0 0 "[ . 1 . 2]" 1
897 1 52 ALA MB 1 56 GLU HB2 2.395 . 3.112 2.124 1.836 2.958 . 0 0 "[ . 1 . 2]" 1
898 1 52 ALA MB 1 56 GLU HB3 2.597 . 3.440 2.515 1.728 2.883 0.026 13 0 "[ . 1 . 2]" 1
899 1 52 ALA MB 1 56 GLU HG2 2.929 . 4.001 3.145 1.963 3.951 . 0 0 "[ . 1 . 2]" 1
900 1 52 ALA MB 1 56 GLU HG3 3.027 . 4.173 2.815 2.413 3.757 . 0 0 "[ . 1 . 2]" 1
901 1 52 ALA MB 1 57 PHE HA 3.895 . 5.791 4.727 4.497 4.993 . 0 0 "[ . 1 . 2]" 1
902 1 52 ALA MB 1 57 PHE QE 2.857 . 3.877 2.746 2.567 2.942 . 0 0 "[ . 1 . 2]" 1
903 1 53 GLU H 1 53 GLU HB2 2.629 . 3.493 2.462 2.309 2.749 . 0 0 "[ . 1 . 2]" 1
904 1 53 GLU H 1 53 GLU HB3 2.726 . 3.655 3.621 3.569 3.688 0.033 19 0 "[ . 1 . 2]" 1
905 1 53 GLU HA 1 53 GLU HB2 2.465 . 3.225 3.017 2.996 3.027 . 0 0 "[ . 1 . 2]" 1
906 1 53 GLU HA 1 53 GLU HB3 2.280 . 2.930 2.495 2.375 2.604 . 0 0 "[ . 1 . 2]" 1
907 1 53 GLU HA 1 53 GLU HG3 2.833 . 3.836 3.052 2.450 3.888 0.052 3 0 "[ . 1 . 2]" 1
908 1 53 GLU HA 1 54 LYS H 2.500 . 3.281 2.507 2.231 2.726 . 0 0 "[ . 1 . 2]" 1
909 1 53 GLU HB2 1 54 LYS H 2.629 . 3.493 3.475 3.128 3.676 0.183 3 0 "[ . 1 . 2]" 1
910 1 53 GLU HB2 1 55 ASP H 2.861 . 3.884 3.622 3.372 3.899 0.015 2 0 "[ . 1 . 2]" 1
911 1 53 GLU HB3 1 53 GLU HG3 2.368 . 3.069 2.783 2.363 3.011 . 0 0 "[ . 1 . 2]" 1
912 1 53 GLU HB3 1 54 LYS H 2.354 . 3.047 2.272 1.904 2.861 . 0 0 "[ . 1 . 2]" 1
913 1 54 LYS H 1 54 LYS HA 2.853 . 3.871 2.784 2.768 2.816 . 0 0 "[ . 1 . 2]" 1
914 1 54 LYS H 1 54 LYS QG 2.775 . 3.704 2.038 1.723 2.806 0.089 9 0 "[ . 1 . 2]" 1
915 1 54 LYS HA 1 54 LYS HB2 2.286 . 2.939 2.515 2.303 2.709 . 0 0 "[ . 1 . 2]" 1
916 1 54 LYS HA 1 54 LYS HB3 2.518 . 3.310 2.380 2.247 2.612 . 0 0 "[ . 1 . 2]" 1
917 1 54 LYS HA 1 54 LYS HD3 4.009 . 6.018 4.902 3.611 5.527 . 0 0 "[ . 1 . 2]" 1
918 1 54 LYS HA 1 54 LYS QG 2.874 . 3.906 3.338 3.295 3.497 . 0 0 "[ . 1 . 2]" 1
919 1 54 LYS HA 1 55 ASP H 3.428 . 4.897 3.529 3.472 3.574 . 0 0 "[ . 1 . 2]" 1
920 1 54 LYS HA 1 57 PHE HB2 2.742 . 3.682 3.322 3.088 3.560 . 0 0 "[ . 1 . 2]" 1
921 1 54 LYS HA 1 57 PHE HD2 2.810 . 3.797 2.113 1.776 2.451 0.047 3 0 "[ . 1 . 2]" 1
922 1 54 LYS HB2 1 54 LYS HE3 3.460 . 4.957 4.016 1.925 4.819 0.038 7 0 "[ . 1 . 2]" 1
923 1 54 LYS HB2 1 54 LYS QG 2.262 . 2.901 2.332 2.146 2.459 . 0 0 "[ . 1 . 2]" 1
924 1 54 LYS HB2 1 55 ASP H 2.522 . 3.317 3.498 3.254 3.958 0.641 18 2 "[ . 1 - + 2]" 1
925 1 54 LYS HB3 1 54 LYS QG 2.361 . 3.058 2.330 2.161 2.435 . 0 0 "[ . 1 . 2]" 1
926 1 54 LYS HB3 1 55 ASP H 3.191 . 4.464 3.942 3.585 4.175 . 0 0 "[ . 1 . 2]" 1
927 1 54 LYS HD3 1 54 LYS QG 2.073 . 2.610 2.291 2.138 2.423 . 0 0 "[ . 1 . 2]" 1
928 1 54 LYS HE3 1 54 LYS QG 1.878 . 2.319 2.644 2.285 3.299 0.980 16 6 "[ . -**1** .+ 2]" 1
929 1 54 LYS QG 1 55 ASP H 2.943 . 3.907 2.043 1.799 3.323 0.061 13 0 "[ . 1 . 2]" 1
930 1 55 ASP H 1 55 ASP HA 2.782 . 3.749 2.805 2.776 2.827 . 0 0 "[ . 1 . 2]" 1
931 1 55 ASP H 1 55 ASP HB3 2.808 . 3.794 3.040 2.401 3.635 . 0 0 "[ . 1 . 2]" 1
932 1 55 ASP H 1 56 GLU H 2.631 . 3.496 2.740 2.658 2.816 . 0 0 "[ . 1 . 2]" 1
933 1 55 ASP HA 1 55 ASP HB3 2.110 . 2.667 2.480 2.270 3.014 0.347 17 0 "[ . 1 . 2]" 1
934 1 55 ASP HA 1 56 GLU H 3.092 . 4.287 3.514 3.476 3.545 . 0 0 "[ . 1 . 2]" 1
935 1 55 ASP HA 1 58 GLU H 3.019 . 4.158 2.977 2.742 3.131 . 0 0 "[ . 1 . 2]" 1
936 1 55 ASP HA 1 58 GLU QB . . 1.877 1.824 1.626 1.915 0.182 17 0 "[ . 1 . 2]" 1
937 1 55 ASP HA 1 58 GLU QG 2.371 . 3.073 2.694 2.477 3.040 . 0 0 "[ . 1 . 2]" 1
938 1 55 ASP HB3 1 57 PHE H 4.566 . 7.172 5.843 5.322 6.129 . 0 0 "[ . 1 . 2]" 1
939 1 55 ASP HB3 1 58 GLU QB 2.947 . 4.033 3.815 3.552 4.426 0.393 17 0 "[ . 1 . 2]" 1
940 1 56 GLU H 1 56 GLU HA 2.493 . 3.270 2.822 2.808 2.834 . 0 0 "[ . 1 . 2]" 1
941 1 56 GLU H 1 56 GLU HB2 1.997 . 2.495 2.415 2.205 2.578 0.083 18 0 "[ . 1 . 2]" 1
942 1 56 GLU H 1 57 PHE H 2.569 . 3.394 2.646 2.563 2.721 . 0 0 "[ . 1 . 2]" 1
943 1 56 GLU HA 1 56 GLU HB2 2.584 . 3.419 2.935 2.501 3.035 . 0 0 "[ . 1 . 2]" 1
944 1 56 GLU HA 1 56 GLU HB3 2.230 . 2.851 2.645 2.444 3.028 0.177 4 0 "[ . 1 . 2]" 1
945 1 56 GLU HA 1 56 GLU HG2 2.857 . 3.877 3.162 2.458 3.767 . 0 0 "[ . 1 . 2]" 1
946 1 56 GLU HA 1 56 GLU HG3 2.797 . 3.775 3.415 2.273 3.774 . 0 0 "[ . 1 . 2]" 1
947 1 56 GLU HA 1 57 PHE H 2.993 . 4.113 3.527 3.507 3.546 . 0 0 "[ . 1 . 2]" 1
948 1 56 GLU HA 1 59 HIS QB 2.496 . 3.275 3.123 2.797 3.304 0.029 18 0 "[ . 1 . 2]" 1
949 1 56 GLU HB2 1 57 PHE H 2.606 . 3.455 2.761 2.369 3.704 0.249 4 0 "[ . 1 . 2]" 1
950 1 56 GLU HB3 1 57 PHE H 2.753 . 3.700 3.214 2.344 3.650 . 0 0 "[ . 1 . 2]" 1
951 1 57 PHE H 1 57 PHE HA 2.553 . 3.368 2.834 2.816 2.854 . 0 0 "[ . 1 . 2]" 1
952 1 57 PHE H 1 57 PHE HB2 2.585 . 3.420 2.537 2.491 2.589 . 0 0 "[ . 1 . 2]" 1
953 1 57 PHE H 1 58 GLU H 2.678 . 3.574 2.556 2.474 2.634 . 0 0 "[ . 1 . 2]" 1
954 1 57 PHE HA 1 57 PHE HB2 2.445 . 3.192 3.025 3.021 3.031 . 0 0 "[ . 1 . 2]" 1
955 1 57 PHE HA 1 57 PHE HD1 2.728 . 3.658 2.842 2.735 2.955 . 0 0 "[ . 1 . 2]" 1
956 1 57 PHE HA 1 60 LYS HB2 2.470 . 3.233 2.870 2.582 3.294 0.061 6 0 "[ . 1 . 2]" 1
957 1 57 PHE HA 1 60 LYS HB3 3.375 . 4.798 2.744 2.493 3.128 . 0 0 "[ . 1 . 2]" 1
958 1 57 PHE HB2 1 57 PHE HD1 2.704 . 3.618 3.656 3.641 3.670 0.052 5 0 "[ . 1 . 2]" 1
959 1 57 PHE HB2 1 58 GLU H 2.619 . 3.477 2.589 2.503 2.733 . 0 0 "[ . 1 . 2]" 1
960 1 57 PHE HB2 1 58 GLU QG 2.802 . 3.783 3.439 3.162 3.609 . 0 0 "[ . 1 . 2]" 1
961 1 58 GLU H 1 58 GLU HA 2.547 . 3.358 2.793 2.784 2.826 . 0 0 "[ . 1 . 2]" 1
962 1 58 GLU H 1 58 GLU QG 2.570 . 3.396 2.375 2.193 2.545 . 0 0 "[ . 1 . 2]" 1
963 1 58 GLU H 1 59 HIS H 2.432 . 3.171 2.766 2.719 2.802 . 0 0 "[ . 1 . 2]" 1
964 1 58 GLU HA 1 58 GLU QB 2.329 . 3.007 2.430 2.388 2.465 . 0 0 "[ . 1 . 2]" 1
965 1 58 GLU HA 1 58 GLU QG 2.518 . 3.310 2.659 2.259 2.808 . 0 0 "[ . 1 . 2]" 1
966 1 58 GLU HA 1 59 HIS H 2.717 . 3.640 3.548 3.521 3.581 . 0 0 "[ . 1 . 2]" 1
967 1 58 GLU HA 1 61 ARG H 2.667 . 3.556 3.367 3.195 3.569 0.013 3 0 "[ . 1 . 2]" 1
968 1 58 GLU HA 1 61 ARG HB2 2.602 . 3.448 2.779 2.600 2.991 . 0 0 "[ . 1 . 2]" 1
969 1 58 GLU HA 1 61 ARG QD 2.957 . 4.050 3.853 3.474 4.017 . 0 0 "[ . 1 . 2]" 1
970 1 58 GLU HA 1 61 ARG HE 2.379 . 3.087 2.771 2.506 3.148 0.061 1 0 "[ . 1 . 2]" 1
971 1 58 GLU QB 1 59 HIS H 2.351 . 3.042 2.592 2.472 2.695 . 0 0 "[ . 1 . 2]" 1
972 1 59 HIS H 1 59 HIS QB 2.397 . 3.115 2.320 2.081 2.588 . 0 0 "[ . 1 . 2]" 1
973 1 59 HIS H 1 60 LYS H 2.419 . 3.151 2.600 2.529 2.704 . 0 0 "[ . 1 . 2]" 1
974 1 59 HIS HA 1 59 HIS QB 2.288 . 2.943 2.393 2.165 2.504 . 0 0 "[ . 1 . 2]" 1
975 1 59 HIS HA 1 59 HIS HD2 3.453 . 4.943 3.093 2.323 4.612 . 0 0 "[ . 1 . 2]" 1
976 1 59 HIS HA 1 60 LYS H 3.111 . 4.320 3.534 3.519 3.547 . 0 0 "[ . 1 . 2]" 1
977 1 59 HIS HA 1 62 LYS HB2 2.675 . 3.569 3.097 2.675 3.448 . 0 0 "[ . 1 . 2]" 1
978 1 59 HIS HA 1 62 LYS QD 3.331 . 4.718 4.375 4.128 4.653 . 0 0 "[ . 1 . 2]" 1
979 1 59 HIS QB 1 59 HIS HD2 3.226 . 4.527 2.933 2.629 3.180 . 0 0 "[ . 1 . 2]" 1
980 1 59 HIS QB 1 60 LYS H 2.613 . 3.466 2.623 2.350 3.259 . 0 0 "[ . 1 . 2]" 1
981 1 60 LYS H 1 60 LYS HA 2.843 . 3.854 2.809 2.789 2.828 . 0 0 "[ . 1 . 2]" 1
982 1 60 LYS H 1 60 LYS HB2 2.110 . 2.666 2.244 2.073 2.437 . 0 0 "[ . 1 . 2]" 1
983 1 60 LYS H 1 60 LYS HB3 2.129 . 2.695 2.784 2.601 2.937 0.242 5 0 "[ . 1 . 2]" 1
984 1 60 LYS H 1 60 LYS QD 3.019 . 4.158 4.079 3.877 4.171 0.013 10 0 "[ . 1 . 2]" 1
985 1 60 LYS H 1 60 LYS HG2 3.746 . 5.500 4.565 4.524 4.613 . 0 0 "[ . 1 . 2]" 1
986 1 60 LYS H 1 60 LYS HG3 3.270 . 4.606 4.481 4.327 4.536 . 0 0 "[ . 1 . 2]" 1
987 1 60 LYS H 1 61 ARG H 2.585 . 3.420 2.576 2.478 2.649 . 0 0 "[ . 1 . 2]" 1
988 1 60 LYS HA 1 60 LYS HB2 2.432 . 3.171 2.613 2.501 2.714 . 0 0 "[ . 1 . 2]" 1
989 1 60 LYS HA 1 60 LYS HB3 2.694 . 3.601 2.992 2.933 3.022 . 0 0 "[ . 1 . 2]" 1
990 1 60 LYS HA 1 60 LYS QD 2.898 . 3.399 2.225 1.727 3.349 0.121 11 0 "[ . 1 . 2]" 1
991 1 60 LYS HA 1 60 LYS HE2 2.967 . 4.068 2.898 2.246 4.119 0.051 3 0 "[ . 1 . 2]" 1
992 1 60 LYS HA 1 60 LYS HE3 2.962 . 4.059 3.421 1.776 4.171 0.112 7 0 "[ . 1 . 2]" 1
993 1 60 LYS HA 1 60 LYS HG2 3.106 . 4.312 3.651 3.552 3.716 . 0 0 "[ . 1 . 2]" 1
994 1 60 LYS HA 1 60 LYS HG3 2.869 . 3.898 2.755 2.293 3.129 . 0 0 "[ . 1 . 2]" 1
995 1 60 LYS HA 1 63 GLU H 3.015 . 4.151 3.228 3.004 3.610 . 0 0 "[ . 1 . 2]" 1
996 1 60 LYS HA 1 63 GLU HB2 2.684 . 3.585 2.526 2.215 2.901 . 0 0 "[ . 1 . 2]" 1
997 1 60 LYS HA 1 63 GLU HB3 3.086 . 4.277 4.040 3.763 4.282 0.005 9 0 "[ . 1 . 2]" 1
998 1 60 LYS HA 1 63 GLU HG3 2.810 . 3.797 2.913 2.208 3.646 . 0 0 "[ . 1 . 2]" 1
999 1 60 LYS HA 1 64 LEU H 3.214 . 4.505 3.921 3.657 4.123 . 0 0 "[ . 1 . 2]" 1
1000 1 60 LYS HB2 1 60 LYS QD 3.013 . 3.955 2.708 2.170 2.967 . 0 0 "[ . 1 . 2]" 1
1001 1 60 LYS HB2 1 60 LYS HG2 2.446 . 3.194 2.490 2.390 2.658 . 0 0 "[ . 1 . 2]" 1
1002 1 60 LYS HB2 1 60 LYS HG3 2.256 . 2.892 3.001 2.955 3.015 0.123 14 0 "[ . 1 . 2]" 1
1003 1 60 LYS HB2 1 61 ARG H 2.786 . 3.756 3.619 3.354 3.815 0.059 10 0 "[ . 1 . 2]" 1
1004 1 60 LYS HB3 1 60 LYS QD 3.238 . 4.549 3.424 3.252 3.544 . 0 0 "[ . 1 . 2]" 1
1005 1 60 LYS HB3 1 60 LYS HE2 2.961 . 4.057 3.864 3.391 4.678 0.621 9 2 "[ . +1 . -]" 1
1006 1 60 LYS HB3 1 60 LYS HG2 2.089 . 2.635 2.393 2.264 2.474 . 0 0 "[ . 1 . 2]" 1
1007 1 60 LYS HB3 1 60 LYS HG3 2.204 . 2.811 2.487 2.378 2.666 . 0 0 "[ . 1 . 2]" 1
1008 1 60 LYS HB3 1 61 ARG H 2.095 . 2.644 2.644 2.590 2.700 0.056 3 0 "[ . 1 . 2]" 1
1009 1 60 LYS QD 1 60 LYS HE2 2.265 . 2.907 2.366 2.291 2.452 . 0 0 "[ . 1 . 2]" 1
1010 1 60 LYS QD 1 60 LYS HE3 2.170 . 2.759 2.303 2.159 2.384 . 0 0 "[ . 1 . 2]" 1
1011 1 60 LYS QD 1 60 LYS HG2 2.602 . 3.448 2.299 2.148 2.418 . 0 0 "[ . 1 . 2]" 1
1012 1 60 LYS QD 1 60 LYS HG3 2.465 . 3.101 2.245 2.164 2.490 . 0 0 "[ . 1 . 2]" 1
1013 1 60 LYS HE2 1 60 LYS HG2 3.214 . 4.505 3.134 2.378 3.715 . 0 0 "[ . 1 . 2]" 1
1014 1 60 LYS HE2 1 60 LYS HG3 2.894 . 3.941 3.301 2.333 3.817 . 0 0 "[ . 1 . 2]" 1
1015 1 60 LYS HE3 1 60 LYS HG2 3.189 . 4.460 3.033 2.348 3.835 . 0 0 "[ . 1 . 2]" 1
1016 1 60 LYS HE3 1 60 LYS HG3 2.911 . 3.970 3.546 2.637 4.218 0.248 3 0 "[ . 1 . 2]" 1
1017 1 61 ARG H 1 61 ARG HA 2.466 . 3.226 2.794 2.777 2.810 . 0 0 "[ . 1 . 2]" 1
1018 1 61 ARG H 1 61 ARG HB2 2.426 . 3.162 2.300 2.202 2.378 . 0 0 "[ . 1 . 2]" 1
1019 1 61 ARG H 1 61 ARG HB3 2.310 . 2.977 2.756 2.667 2.962 . 0 0 "[ . 1 . 2]" 1
1020 1 61 ARG H 1 61 ARG QD 3.973 . 5.946 4.474 4.247 4.843 . 0 0 "[ . 1 . 2]" 1
1021 1 61 ARG HA 1 61 ARG HB2 2.391 . 3.106 2.577 2.531 2.672 . 0 0 "[ . 1 . 2]" 1
1022 1 61 ARG HA 1 61 ARG HB3 2.665 . 3.553 3.013 2.988 3.026 . 0 0 "[ . 1 . 2]" 1
1023 1 61 ARG HA 1 61 ARG QD 3.451 . 4.940 3.787 3.484 4.117 . 0 0 "[ . 1 . 2]" 1
1024 1 61 ARG HA 1 61 ARG HG2 2.636 . 3.505 3.198 2.858 3.356 . 0 0 "[ . 1 . 2]" 1
1025 1 61 ARG HA 1 61 ARG HG3 2.427 . 3.163 2.315 2.206 2.396 . 0 0 "[ . 1 . 2]" 1
1026 1 61 ARG HA 1 62 LYS H 3.275 . 4.616 3.539 3.520 3.560 . 0 0 "[ . 1 . 2]" 1
1027 1 61 ARG HA 1 64 LEU HB3 2.875 . 3.908 2.989 2.756 3.162 . 0 0 "[ . 1 . 2]" 1
1028 1 61 ARG HB2 1 61 ARG QD 2.793 . 3.768 2.358 2.236 2.950 . 0 0 "[ . 1 . 2]" 1
1029 1 61 ARG HB2 1 61 ARG HG2 2.710 . 3.628 2.981 2.925 3.010 . 0 0 "[ . 1 . 2]" 1
1030 1 61 ARG HB3 1 61 ARG QD 3.073 . 4.082 3.069 2.636 3.243 . 0 0 "[ . 1 . 2]" 1
1031 1 61 ARG HB3 1 61 ARG HE 3.179 . 4.443 2.693 2.124 3.117 . 0 0 "[ . 1 . 2]" 1
1032 1 61 ARG HB3 1 61 ARG HG2 2.240 . 2.867 2.319 2.242 2.402 . 0 0 "[ . 1 . 2]" 1
1033 1 61 ARG HB3 1 61 ARG HG3 2.329 . 3.007 2.985 2.931 3.007 . 0 0 "[ . 1 . 2]" 1
1034 1 61 ARG HB3 1 62 LYS H 2.310 . 2.977 2.540 2.342 2.700 . 0 0 "[ . 1 . 2]" 1
1035 1 61 ARG QD 1 61 ARG HG2 2.642 . 3.515 2.352 2.165 2.396 . 0 0 "[ . 1 . 2]" 1
1036 1 61 ARG QD 1 61 ARG HG3 2.292 . 2.948 2.186 2.168 2.293 . 0 0 "[ . 1 . 2]" 1
1037 1 61 ARG HE 1 61 ARG HG3 3.030 . 4.178 3.739 2.741 3.994 . 0 0 "[ . 1 . 2]" 1
1038 1 62 LYS H 1 62 LYS HA 2.714 . 3.635 2.807 2.757 2.839 . 0 0 "[ . 1 . 2]" 1
1039 1 62 LYS H 1 62 LYS HB2 2.283 . 2.935 2.628 2.445 2.740 . 0 0 "[ . 1 . 2]" 1
1040 1 62 LYS H 1 62 LYS QD 2.851 . 3.867 2.777 2.442 3.170 . 0 0 "[ . 1 . 2]" 1
1041 1 62 LYS H 1 62 LYS HG2 1.839 . 2.262 2.137 1.945 2.348 0.086 18 0 "[ . 1 . 2]" 1
1042 1 62 LYS HA 1 62 LYS HB2 2.282 . 2.933 3.010 3.000 3.015 0.082 20 0 "[ . 1 . 2]" 1
1043 1 62 LYS HA 1 62 LYS QD 1.980 . 2.470 2.075 1.757 2.268 . 0 0 "[ . 1 . 2]" 1
1044 1 62 LYS HA 1 62 LYS HG2 2.625 . 3.487 3.331 3.166 3.496 0.009 5 0 "[ . 1 . 2]" 1
1045 1 62 LYS HA 1 63 GLU H 2.634 . 3.501 3.523 3.510 3.539 0.038 11 0 "[ . 1 . 2]" 1
1046 1 62 LYS HA 1 65 GLU QB 2.479 . 3.247 2.524 2.078 2.815 . 0 0 "[ . 1 . 2]" 1
1047 1 62 LYS HB2 1 62 LYS HE3 3.250 . 4.571 4.451 3.588 5.463 0.892 20 3 "[ . * 1 - +]" 1
1048 1 62 LYS HB2 1 62 LYS HG2 2.171 . 2.760 2.361 2.304 2.429 . 0 0 "[ . 1 . 2]" 1
1049 1 62 LYS HB2 1 63 GLU H 2.420 . 3.152 2.515 2.381 2.696 . 0 0 "[ . 1 . 2]" 1
1050 1 62 LYS QD 1 62 LYS HE2 1.847 . 2.273 2.289 2.157 2.373 0.100 11 0 "[ . 1 . 2]" 1
1051 1 62 LYS HE2 1 62 LYS HG2 2.793 . 3.768 3.342 2.439 3.761 . 0 0 "[ . 1 . 2]" 1
1052 1 63 GLU H 1 63 GLU HB2 2.436 . 3.178 2.422 2.271 2.588 . 0 0 "[ . 1 . 2]" 1
1053 1 63 GLU H 1 63 GLU HG3 2.503 . 3.286 2.486 2.073 3.685 0.399 18 0 "[ . 1 . 2]" 1
1054 1 63 GLU H 1 64 LEU HB2 3.453 . 4.944 4.909 4.833 4.969 0.025 8 0 "[ . 1 . 2]" 1
1055 1 63 GLU HA 1 63 GLU HB2 2.372 . 3.075 3.010 2.997 3.023 . 0 0 "[ . 1 . 2]" 1
1056 1 63 GLU HA 1 63 GLU HB3 2.252 . 2.886 2.514 2.424 2.598 . 0 0 "[ . 1 . 2]" 1
1057 1 63 GLU HA 1 63 GLU HG2 2.675 . 3.569 2.594 2.488 2.940 . 0 0 "[ . 1 . 2]" 1
1058 1 63 GLU HA 1 63 GLU HG3 2.210 . 2.820 3.124 2.857 3.743 0.923 19 6 "[ * * * 1 . *+-]" 1
1059 1 63 GLU HA 1 64 LEU HB2 3.882 . 5.766 5.669 5.636 5.733 . 0 0 "[ . 1 . 2]" 1
1060 1 63 GLU HB3 1 64 LEU H 2.437 . 3.180 3.239 3.113 3.329 0.149 2 0 "[ . 1 . 2]" 1
1061 1 64 LEU H 1 64 LEU HA 2.810 . 3.797 2.804 2.791 2.834 . 0 0 "[ . 1 . 2]" 1
1062 1 64 LEU H 1 64 LEU HB2 2.548 . 3.359 2.275 2.247 2.323 . 0 0 "[ . 1 . 2]" 1
1063 1 64 LEU H 1 64 LEU HB3 2.683 . 3.583 2.675 2.651 2.711 . 0 0 "[ . 1 . 2]" 1
1064 1 64 LEU H 1 64 LEU MD1 3.452 . 4.941 4.243 4.230 4.256 . 0 0 "[ . 1 . 2]" 1
1065 1 64 LEU H 1 64 LEU HG 3.226 . 4.527 4.506 4.478 4.554 0.027 9 0 "[ . 1 . 2]" 1
1066 1 64 LEU H 1 65 GLU H 2.738 . 3.675 2.687 2.580 2.746 . 0 0 "[ . 1 . 2]" 1
1067 1 64 LEU HA 1 64 LEU HB2 2.143 . 2.717 2.560 2.548 2.575 . 0 0 "[ . 1 . 2]" 1
1068 1 64 LEU HA 1 64 LEU HB3 2.717 . 3.640 3.018 3.013 3.022 . 0 0 "[ . 1 . 2]" 1
1069 1 64 LEU HA 1 64 LEU MD1 2.883 . 3.922 2.926 2.870 2.995 . 0 0 "[ . 1 . 2]" 1
1070 1 64 LEU HA 1 64 LEU MD2 2.210 . 2.821 2.048 1.990 2.095 . 0 0 "[ . 1 . 2]" 1
1071 1 64 LEU HA 1 64 LEU HG 2.738 . 3.675 3.713 3.690 3.735 0.060 9 0 "[ . 1 . 2]" 1
1072 1 64 LEU HA 1 67 VAL H 2.773 . 3.734 3.363 3.280 3.445 . 0 0 "[ . 1 . 2]" 1
1073 1 64 LEU HA 1 67 VAL HB 2.510 . 3.297 3.311 3.175 3.369 0.072 10 0 "[ . 1 . 2]" 1
1074 1 64 LEU HA 1 67 VAL MG1 2.746 . 3.688 2.532 2.383 2.648 . 0 0 "[ . 1 . 2]" 1
1075 1 64 LEU HB2 1 64 LEU MD1 2.887 . 3.929 3.192 3.184 3.205 . 0 0 "[ . 1 . 2]" 1
1076 1 64 LEU HB2 1 64 LEU HG 2.218 . 2.833 2.358 2.341 2.381 . 0 0 "[ . 1 . 2]" 1
1077 1 64 LEU HB2 1 65 GLU H 2.896 . 3.944 3.686 3.637 3.728 . 0 0 "[ . 1 . 2]" 1
1078 1 64 LEU HB3 1 64 LEU MD1 2.539 . 3.345 2.342 2.323 2.367 . 0 0 "[ . 1 . 2]" 1
1079 1 64 LEU HB3 1 64 LEU MD2 2.969 . 4.071 3.202 3.196 3.206 . 0 0 "[ . 1 . 2]" 1
1080 1 64 LEU HB3 1 64 LEU HG 2.244 . 2.873 2.482 2.468 2.498 . 0 0 "[ . 1 . 2]" 1
1081 1 64 LEU HB3 1 65 GLU H 2.397 . 3.115 2.543 2.507 2.597 . 0 0 "[ . 1 . 2]" 1
1082 1 64 LEU MD1 1 64 LEU HG 2.416 . 3.146 2.112 2.110 2.116 . 0 0 "[ . 1 . 2]" 1
1083 1 64 LEU MD1 1 65 GLU H 2.755 . 3.704 3.457 3.403 3.508 . 0 0 "[ . 1 . 2]" 1
1084 1 64 LEU HG 1 65 GLU H 3.491 . 5.015 4.916 4.865 4.973 . 0 0 "[ . 1 . 2]" 1
1085 1 65 GLU H 1 65 GLU HA 2.834 . 3.838 2.783 2.771 2.796 . 0 0 "[ . 1 . 2]" 1
1086 1 65 GLU H 1 65 GLU QB 2.617 . 3.473 2.316 2.182 2.519 . 0 0 "[ . 1 . 2]" 1
1087 1 65 GLU H 1 66 GLN H 2.771 . 3.731 2.807 2.739 2.861 . 0 0 "[ . 1 . 2]" 1
1088 1 65 GLU HA 1 65 GLU QB 2.410 . 3.136 2.378 2.343 2.425 . 0 0 "[ . 1 . 2]" 1
1089 1 65 GLU HA 1 65 GLU HG3 2.302 . 2.965 2.795 2.422 3.254 0.289 9 0 "[ . 1 . 2]" 1
1090 1 65 GLU HA 1 68 CYS H 3.241 . 4.554 3.548 3.395 3.652 . 0 0 "[ . 1 . 2]" 1
1091 1 65 GLU HA 1 68 CYS HB2 3.322 . 4.702 4.766 4.685 4.845 0.143 14 0 "[ . 1 . 2]" 1
1092 1 65 GLU HA 1 68 CYS HB3 3.324 . 4.705 4.517 4.364 4.658 . 0 0 "[ . 1 . 2]" 1
1093 1 65 GLU HA 1 69 ASN H 3.393 . 4.832 3.870 3.715 3.998 . 0 0 "[ . 1 . 2]" 1
1094 1 65 GLU QB 1 66 GLN H 2.254 . 2.889 2.530 2.386 2.711 . 0 0 "[ . 1 . 2]" 1
1095 1 65 GLU QB 1 69 ASN H 3.769 . 5.544 4.869 4.404 5.167 . 0 0 "[ . 1 . 2]" 1
1096 1 66 GLN H 1 66 GLN HA 2.458 . 3.213 2.822 2.795 2.837 . 0 0 "[ . 1 . 2]" 1
1097 1 66 GLN H 1 66 GLN HG2 2.507 . 3.292 3.152 1.993 3.398 0.106 4 0 "[ . 1 . 2]" 1
1098 1 66 GLN H 1 66 GLN HG3 2.441 . 3.186 2.384 2.082 3.411 0.225 9 0 "[ . 1 . 2]" 1
1099 1 66 GLN H 1 67 VAL H 2.452 . 3.203 2.691 2.646 2.753 . 0 0 "[ . 1 . 2]" 1
1100 1 66 GLN HA 1 66 GLN HB2 2.338 . 3.021 3.017 3.010 3.023 0.002 16 0 "[ . 1 . 2]" 1
1101 1 66 GLN HA 1 66 GLN HB3 2.168 . 2.756 2.453 2.424 2.474 . 0 0 "[ . 1 . 2]" 1
1102 1 66 GLN HA 1 66 GLN HG2 2.252 . 2.886 2.578 2.408 2.948 0.062 9 0 "[ . 1 . 2]" 1
1103 1 66 GLN HA 1 66 GLN HG3 2.761 . 3.714 3.208 3.001 3.755 0.041 13 0 "[ . 1 . 2]" 1
1104 1 66 GLN HA 1 69 ASN HB3 3.155 . 4.399 2.644 2.367 2.764 . 0 0 "[ . 1 . 2]" 1
1105 1 66 GLN HA 1 70 PRO QD . . 3.519 3.404 3.203 3.547 0.028 16 0 "[ . 1 . 2]" 1
1106 1 66 GLN HB2 1 66 GLN HG3 2.657 . 3.539 2.412 2.322 2.477 . 0 0 "[ . 1 . 2]" 1
1107 1 66 GLN HB3 1 66 GLN HG3 2.612 . 3.465 2.932 2.484 3.009 . 0 0 "[ . 1 . 2]" 1
1108 1 66 GLN HB3 1 69 ASN HD21 3.401 . 4.846 4.879 4.740 4.949 0.103 10 0 "[ . 1 . 2]" 1
1109 1 66 GLN HG2 1 67 VAL H 3.960 . 5.920 4.991 4.332 5.181 . 0 0 "[ . 1 . 2]" 1
1110 1 67 VAL H 1 67 VAL HA 2.838 . 3.845 2.872 2.863 2.879 . 0 0 "[ . 1 . 2]" 1
1111 1 67 VAL H 1 67 VAL HB 2.412 . 3.139 2.433 2.397 2.469 . 0 0 "[ . 1 . 2]" 1
1112 1 67 VAL H 1 67 VAL MG1 2.877 . 3.911 2.533 2.439 2.600 . 0 0 "[ . 1 . 2]" 1
1113 1 67 VAL H 1 67 VAL MG2 3.333 . 4.722 3.764 3.742 3.784 . 0 0 "[ . 1 . 2]" 1
1114 1 67 VAL H 1 68 CYS H 2.615 . 3.470 2.514 2.444 2.555 . 0 0 "[ . 1 . 2]" 1
1115 1 67 VAL HA 1 67 VAL HB 2.572 . 3.399 2.613 2.593 2.629 . 0 0 "[ . 1 . 2]" 1
1116 1 67 VAL HA 1 67 VAL MG1 3.038 . 4.192 3.185 3.179 3.191 . 0 0 "[ . 1 . 2]" 1
1117 1 67 VAL HA 1 67 VAL MG2 2.785 . 3.754 2.233 2.194 2.252 . 0 0 "[ . 1 . 2]" 1
1118 1 67 VAL HA 1 68 CYS H 3.425 . 4.892 3.529 3.515 3.545 . 0 0 "[ . 1 . 2]" 1
1119 1 67 VAL HA 1 70 PRO QD 2.697 . 3.606 3.367 3.287 3.415 . 0 0 "[ . 1 . 2]" 1
1120 1 67 VAL HB 1 67 VAL MG1 2.168 . 2.755 2.109 2.104 2.113 . 0 0 "[ . 1 . 2]" 1
1121 1 67 VAL HB 1 67 VAL MG2 2.194 . 2.796 2.125 2.120 2.130 . 0 0 "[ . 1 . 2]" 1
1122 1 67 VAL HB 1 68 CYS H 2.834 . 3.838 3.733 3.696 3.768 . 0 0 "[ . 1 . 2]" 1
1123 1 67 VAL MG1 1 67 VAL MG2 2.087 . 2.631 2.074 2.061 2.084 . 0 0 "[ . 1 . 2]" 1
1124 1 67 VAL MG1 1 68 CYS H 3.195 . 4.471 1.982 1.930 2.078 . 0 0 "[ . 1 . 2]" 1
1125 1 67 VAL MG2 1 68 CYS H 3.617 . 5.252 3.975 3.957 4.000 . 0 0 "[ . 1 . 2]" 1
1126 1 67 VAL MG2 1 68 CYS HA 3.170 . 4.426 4.184 4.138 4.210 . 0 0 "[ . 1 . 2]" 1
1127 1 67 VAL MG2 1 68 CYS HB3 3.993 . 5.986 4.951 4.894 4.987 . 0 0 "[ . 1 . 2]" 1
1128 1 68 CYS H 1 68 CYS HA 2.777 . 3.741 2.895 2.891 2.898 . 0 0 "[ . 1 . 2]" 1
1129 1 68 CYS H 1 68 CYS HB2 2.841 . 3.850 3.612 3.589 3.629 . 0 0 "[ . 1 . 2]" 1
1130 1 68 CYS H 1 68 CYS HB3 3.038 . 4.192 2.803 2.744 2.882 . 0 0 "[ . 1 . 2]" 1
1131 1 68 CYS H 1 69 ASN H 2.831 . 3.833 2.397 2.366 2.423 . 0 0 "[ . 1 . 2]" 1
1132 1 68 CYS HA 1 68 CYS HB2 2.651 . 3.529 2.498 2.462 2.538 . 0 0 "[ . 1 . 2]" 1
1133 1 68 CYS HA 1 68 CYS HB3 2.504 . 3.288 2.399 2.368 2.428 . 0 0 "[ . 1 . 2]" 1
1134 1 68 CYS HA 1 69 ASN H 3.106 . 4.312 3.477 3.459 3.499 . 0 0 "[ . 1 . 2]" 1
1135 1 68 CYS HA 1 71 ILE H 3.608 . 5.235 3.537 3.491 3.617 . 0 0 "[ . 1 . 2]" 1
1136 1 68 CYS HA 1 71 ILE HB 3.213 . 4.504 4.534 4.499 4.568 0.064 16 0 "[ . 1 . 2]" 1
1137 1 68 CYS HA 1 71 ILE MD 2.418 . 3.149 1.729 1.627 1.834 0.060 8 0 "[ . 1 . 2]" 1
1138 1 68 CYS HA 1 71 ILE HG12 2.532 . 3.333 3.198 3.099 3.301 . 0 0 "[ . 1 . 2]" 1
1139 1 68 CYS HB2 1 72 ILE HG12 3.440 . 4.919 3.692 3.586 3.824 . 0 0 "[ . 1 . 2]" 1
1140 1 68 CYS HB2 1 72 ILE HG13 3.394 . 4.834 4.608 4.511 4.674 . 0 0 "[ . 1 . 2]" 1
1141 1 68 CYS HB3 1 72 ILE MD 3.489 . 5.011 3.244 3.169 3.274 . 0 0 "[ . 1 . 2]" 1
1142 1 68 CYS HB3 1 72 ILE HG12 3.811 . 5.627 5.352 5.220 5.522 . 0 0 "[ . 1 . 2]" 1
1143 1 68 CYS HB3 1 72 ILE HG13 4.145 . 6.292 6.311 6.221 6.356 0.064 9 0 "[ . 1 . 2]" 1
1144 1 69 ASN H 1 69 ASN HB2 2.599 . 3.443 2.569 2.470 2.665 . 0 0 "[ . 1 . 2]" 1
1145 1 69 ASN H 1 69 ASN HB3 2.585 . 3.420 2.497 2.376 2.601 . 0 0 "[ . 1 . 2]" 1
1146 1 69 ASN H 1 70 PRO QD 2.934 . 4.010 2.581 2.541 2.612 . 0 0 "[ . 1 . 2]" 1
1147 1 69 ASN H 1 70 PRO HG3 3.647 . 5.310 5.130 5.071 5.176 . 0 0 "[ . 1 . 2]" 1
1148 1 69 ASN HA 1 69 ASN HB2 2.645 . 3.519 2.397 2.348 2.450 . 0 0 "[ . 1 . 2]" 1
1149 1 69 ASN HA 1 69 ASN HB3 2.769 . 3.727 3.021 3.008 3.029 . 0 0 "[ . 1 . 2]" 1
1150 1 69 ASN HA 1 72 ILE HB 3.302 . 4.665 2.527 2.430 2.693 . 0 0 "[ . 1 . 2]" 1
1151 1 69 ASN HA 1 72 ILE MG 3.387 . 4.821 3.179 3.124 3.226 . 0 0 "[ . 1 . 2]" 1
1152 1 69 ASN HB2 1 69 ASN HD21 3.331 . 4.718 3.054 2.967 3.379 . 0 0 "[ . 1 . 2]" 1
1153 1 69 ASN HB2 1 69 ASN HD22 3.034 . 4.185 3.842 3.799 4.006 . 0 0 "[ . 1 . 2]" 1
1154 1 69 ASN HB2 1 70 PRO QD 2.738 . 3.675 3.291 3.209 3.386 . 0 0 "[ . 1 . 2]" 1
1155 1 69 ASN HB3 1 69 ASN HD21 3.298 . 4.657 2.156 2.139 2.182 . 0 0 "[ . 1 . 2]" 1
1156 1 69 ASN HB3 1 69 ASN HD22 2.950 . 4.038 3.449 3.434 3.463 . 0 0 "[ . 1 . 2]" 1
1157 1 69 ASN HB3 1 70 PRO QD 2.838 . 3.646 1.722 1.694 1.806 0.138 2 0 "[ . 1 . 2]" 1
1158 1 69 ASN HD21 1 70 PRO HG3 2.767 . 3.724 3.624 2.664 3.789 0.065 2 0 "[ . 1 . 2]" 1
1159 1 69 ASN HD22 1 70 PRO HG3 3.595 . 5.210 4.600 3.911 4.919 . 0 0 "[ . 1 . 2]" 1
1160 1 70 PRO HA 1 70 PRO HB2 2.387 . 3.099 2.968 2.961 2.973 . 0 0 "[ . 1 . 2]" 1
1161 1 70 PRO HA 1 70 PRO HB3 2.675 . 3.569 2.290 2.284 2.296 . 0 0 "[ . 1 . 2]" 1
1162 1 70 PRO HA 1 70 PRO QD 3.079 . 4.264 3.407 3.373 3.424 . 0 0 "[ . 1 . 2]" 1
1163 1 70 PRO HA 1 70 PRO HG2 2.833 . 3.836 3.904 3.890 3.911 0.075 5 0 "[ . 1 . 2]" 1
1164 1 70 PRO HA 1 71 ILE MG 3.459 . 4.954 4.450 4.401 4.500 . 0 0 "[ . 1 . 2]" 1
1165 1 70 PRO HB2 1 70 PRO QD 3.094 . 4.275 2.747 2.713 2.809 . 0 0 "[ . 1 . 2]" 1
1166 1 70 PRO HB2 1 71 ILE HA 3.105 . 4.310 4.033 3.930 4.104 . 0 0 "[ . 1 . 2]" 1
1167 1 70 PRO HB3 1 70 PRO QD 3.017 . 4.155 3.513 3.505 3.530 . 0 0 "[ . 1 . 2]" 1
1168 1 70 PRO HB3 1 70 PRO HG2 2.119 . 2.680 2.632 2.627 2.638 . 0 0 "[ . 1 . 2]" 1
1169 1 70 PRO HB3 1 70 PRO HG3 2.312 . 2.980 2.334 2.326 2.342 . 0 0 "[ . 1 . 2]" 1
1170 1 70 PRO QD 1 70 PRO HG2 2.570 . 3.369 2.194 2.191 2.196 . 0 0 "[ . 1 . 2]" 1
1171 1 70 PRO QD 1 70 PRO HG3 2.552 . 3.262 2.256 2.242 2.264 . 0 0 "[ . 1 . 2]" 1
1172 1 70 PRO QD 1 71 ILE H 2.940 . 4.021 2.611 2.529 2.695 . 0 0 "[ . 1 . 2]" 1
1173 1 70 PRO HG3 1 71 ILE H 3.383 . 4.813 4.559 4.488 4.610 . 0 0 "[ . 1 . 2]" 1
1174 1 71 ILE H 1 71 ILE HA 2.864 . 3.889 2.893 2.876 2.905 . 0 0 "[ . 1 . 2]" 1
1175 1 71 ILE H 1 71 ILE HB 2.624 . 3.484 3.538 3.505 3.570 0.086 20 0 "[ . 1 . 2]" 1
1176 1 71 ILE H 1 71 ILE HG12 2.683 . 3.583 3.021 2.971 3.093 . 0 0 "[ . 1 . 2]" 1
1177 1 71 ILE H 1 71 ILE MG 3.240 . 4.552 1.768 1.723 1.813 0.205 10 0 "[ . 1 . 2]" 1
1178 1 71 ILE H 1 72 ILE H 2.585 . 3.420 2.301 2.226 2.392 . 0 0 "[ . 1 . 2]" 1
1179 1 71 ILE HA 1 71 ILE HB 2.558 . 3.376 2.232 2.227 2.237 . 0 0 "[ . 1 . 2]" 1
1180 1 71 ILE HA 1 71 ILE MD 5.003 . 8.132 4.164 4.155 4.174 . 0 0 "[ . 1 . 2]" 1
1181 1 71 ILE HA 1 71 ILE HG12 2.657 . 3.539 3.589 3.574 3.599 0.060 9 0 "[ . 1 . 2]" 1
1182 1 71 ILE HA 1 71 ILE HG13 2.570 . 3.396 3.500 3.482 3.520 0.124 8 0 "[ . 1 . 2]" 1
1183 1 71 ILE HA 1 71 ILE MG 2.376 . 3.082 2.764 2.729 2.803 . 0 0 "[ . 1 . 2]" 1
1184 1 71 ILE HA 1 72 ILE HB 3.808 . 5.620 5.575 5.512 5.600 . 0 0 "[ . 1 . 2]" 1
1185 1 71 ILE HB 1 71 ILE MD 2.425 . 3.160 2.578 2.557 2.595 . 0 0 "[ . 1 . 2]" 1
1186 1 71 ILE HB 1 71 ILE HG12 2.356 . 3.050 2.995 2.991 3.000 . 0 0 "[ . 1 . 2]" 1
1187 1 71 ILE HB 1 71 ILE MG 2.427 . 3.163 2.123 2.118 2.128 . 0 0 "[ . 1 . 2]" 1
1188 1 71 ILE HB 1 72 ILE H 3.075 . 4.257 4.100 4.080 4.125 . 0 0 "[ . 1 . 2]" 1
1189 1 71 ILE MD 1 71 ILE HG13 4.064 . 6.129 2.106 2.103 2.109 . 0 0 "[ . 1 . 2]" 1
1190 1 71 ILE HG12 1 72 ILE H 3.365 . 4.780 1.993 1.953 2.035 . 0 0 "[ . 1 . 2]" 1
1191 1 71 ILE HG12 1 72 ILE MD 2.582 . 3.415 1.885 1.848 1.925 . 0 0 "[ . 1 . 2]" 1
1192 1 71 ILE HG13 1 71 ILE MG 3.150 . 4.390 3.162 3.157 3.168 . 0 0 "[ . 1 . 2]" 1
1193 1 71 ILE HG13 1 72 ILE MD 3.054 . 4.220 2.525 2.467 2.561 . 0 0 "[ . 1 . 2]" 1
1194 1 72 ILE H 1 72 ILE HA 2.433 . 3.173 2.825 2.812 2.837 . 0 0 "[ . 1 . 2]" 1
1195 1 72 ILE H 1 72 ILE HB 2.418 . 3.149 2.094 2.033 2.128 . 0 0 "[ . 1 . 2]" 1
1196 1 72 ILE H 1 72 ILE HG12 3.058 . 4.227 4.178 4.142 4.232 0.005 7 0 "[ . 1 . 2]" 1
1197 1 72 ILE H 1 72 ILE HG13 2.990 . 4.107 4.123 4.066 4.160 0.053 7 0 "[ . 1 . 2]" 1
1198 1 72 ILE H 1 72 ILE MG 3.181 . 4.445 3.452 3.368 3.504 . 0 0 "[ . 1 . 2]" 1
1199 1 72 ILE HA 1 72 ILE HB 2.496 . 3.275 2.924 2.890 2.942 . 0 0 "[ . 1 . 2]" 1
1200 1 72 ILE HA 1 72 ILE MD 2.735 . 3.670 2.266 2.173 2.345 . 0 0 "[ . 1 . 2]" 1
1201 1 72 ILE HA 1 72 ILE HG12 2.874 . 3.906 3.544 3.515 3.565 . 0 0 "[ . 1 . 2]" 1
1202 1 72 ILE HA 1 72 ILE HG13 1.942 . 2.414 2.326 2.298 2.348 . 0 0 "[ . 1 . 2]" 1
1203 1 72 ILE HA 1 72 ILE MG 2.349 . 3.039 2.847 2.816 2.898 . 0 0 "[ . 1 . 2]" 1
1204 1 72 ILE HA 1 75 LEU HB3 2.746 . 3.688 3.730 3.470 3.810 0.122 10 0 "[ . 1 . 2]" 1
1205 1 72 ILE HA 1 75 LEU QD 2.697 . 3.606 2.274 1.927 2.712 . 0 0 "[ . 1 . 2]" 1
1206 1 72 ILE HA 1 75 LEU HG 2.999 . 4.124 2.982 2.510 4.263 0.139 20 0 "[ . 1 . 2]" 1
1207 1 72 ILE HB 1 72 ILE MD 2.842 . 3.852 2.400 2.366 2.414 . 0 0 "[ . 1 . 2]" 1
1208 1 72 ILE HB 1 72 ILE HG12 2.390 . 3.104 2.491 2.475 2.506 . 0 0 "[ . 1 . 2]" 1
1209 1 72 ILE HB 1 72 ILE HG13 2.516 . 3.307 3.018 3.013 3.023 . 0 0 "[ . 1 . 2]" 1
1210 1 72 ILE HB 1 72 ILE MG 2.285 . 2.938 2.115 2.111 2.118 . 0 0 "[ . 1 . 2]" 1
1211 1 72 ILE MD 1 72 ILE HG12 2.245 . 2.875 2.117 2.114 2.120 . 0 0 "[ . 1 . 2]" 1
1212 1 72 ILE MD 1 72 ILE HG13 2.039 . 2.559 2.118 2.115 2.121 . 0 0 "[ . 1 . 2]" 1
1213 1 72 ILE HG12 1 72 ILE MG 2.628 . 3.491 2.269 2.233 2.288 . 0 0 "[ . 1 . 2]" 1
1214 1 72 ILE HG13 1 72 ILE MG 2.386 . 3.097 2.465 2.448 2.491 . 0 0 "[ . 1 . 2]" 1
1215 1 72 ILE MG 1 73 SER HA 3.354 . 4.761 3.081 2.993 3.167 . 0 0 "[ . 1 . 2]" 1
1216 1 73 SER H 1 73 SER HA 2.940 . 4.021 2.812 2.753 2.845 . 0 0 "[ . 1 . 2]" 1
1217 1 73 SER H 1 73 SER HB3 2.500 . 3.281 2.952 2.480 3.523 0.242 10 0 "[ . 1 . 2]" 1
1218 1 73 SER HA 1 73 SER HB3 2.135 . 2.705 2.612 2.331 3.034 0.329 11 0 "[ . 1 . 2]" 1
1219 1 73 SER HA 1 74 GLY H 2.853 . 3.871 3.427 3.322 3.503 . 0 0 "[ . 1 . 2]" 1
1220 1 74 GLY H 1 74 GLY HA2 2.467 . 3.228 2.949 2.932 2.957 . 0 0 "[ . 1 . 2]" 1
1221 1 74 GLY H 1 75 LEU H 2.705 . 3.620 2.264 2.017 2.530 . 0 0 "[ . 1 . 2]" 1
1222 1 74 GLY H 1 75 LEU QD 3.960 . 5.920 4.084 2.496 4.318 . 0 0 "[ . 1 . 2]" 1
1223 1 74 GLY H 1 75 LEU HG 3.386 . 4.819 3.696 3.411 5.091 0.272 20 0 "[ . 1 . 2]" 1
1224 1 74 GLY HA2 1 75 LEU H 2.570 . 3.396 3.181 2.975 3.345 . 0 0 "[ . 1 . 2]" 1
1225 1 75 LEU H 1 75 LEU HA 2.454 . 3.207 2.930 2.884 2.945 . 0 0 "[ . 1 . 2]" 1
1226 1 75 LEU H 1 75 LEU HB2 2.164 . 2.750 2.437 2.322 2.564 . 0 0 "[ . 1 . 2]" 1
1227 1 75 LEU H 1 75 LEU HB3 2.723 . 3.650 3.643 3.555 3.718 0.068 1 0 "[ . 1 . 2]" 1
1228 1 75 LEU H 1 75 LEU QD 3.149 . 4.389 3.399 2.778 3.591 . 0 0 "[ . 1 . 2]" 1
1229 1 75 LEU HA 1 75 LEU HB2 2.312 . 2.980 3.008 2.983 3.014 0.034 4 0 "[ . 1 . 2]" 1
1230 1 75 LEU HA 1 75 LEU HB3 2.496 . 3.275 2.538 2.504 2.643 . 0 0 "[ . 1 . 2]" 1
1231 1 75 LEU HA 1 75 LEU QD 2.377 . 3.083 1.935 1.872 2.416 . 0 0 "[ . 1 . 2]" 1
1232 1 75 LEU HA 1 75 LEU HG 2.416 . 3.146 3.038 2.485 3.132 . 0 0 "[ . 1 . 2]" 1
1233 1 75 LEU HB2 1 75 LEU QD 2.216 . 2.830 2.298 2.126 2.336 . 0 0 "[ . 1 . 2]" 1
1234 1 75 LEU HB3 1 75 LEU QD 2.335 . 3.017 2.123 2.089 2.293 . 0 0 "[ . 1 . 2]" 1
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