NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
441554 |
2kb6   |
16040 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2kb6
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 1733
_Distance_constraint_stats_list.Viol_count 1987
_Distance_constraint_stats_list.Viol_total 1795.097
_Distance_constraint_stats_list.Viol_max 0.909
_Distance_constraint_stats_list.Viol_rms 0.0441
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0104
_Distance_constraint_stats_list.Viol_average_violations_only 0.0903
_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 1 PCA 2.063 0.180 5 0 "[ . 1]"
1 2 ASP 0.415 0.137 7 0 "[ . 1]"
1 3 TRP 4.600 0.275 4 0 "[ . 1]"
1 4 LEU 3.552 0.268 7 0 "[ . 1]"
1 5 THR 5.001 0.328 4 0 "[ . 1]"
1 6 PHE 5.505 0.376 4 0 "[ . 1]"
1 7 GLN 5.253 0.842 4 2 "[ +- 1]"
1 8 LYS 6.550 0.537 7 1 "[ . + 1]"
1 9 LYS 3.269 0.471 9 0 "[ . 1]"
1 10 HIS 1.321 0.233 7 0 "[ . 1]"
1 11 ILE 3.628 0.376 4 0 "[ . 1]"
1 12 THR 0.346 0.083 5 0 "[ . 1]"
1 13 ASN 0.066 0.038 2 0 "[ . 1]"
1 14 THR 0.081 0.051 1 0 "[ . 1]"
1 15 ARG 0.559 0.107 8 0 "[ . 1]"
1 16 ASP 1.147 0.181 6 0 "[ . 1]"
1 17 VAL 3.353 0.339 1 0 "[ . 1]"
1 18 ASP 2.580 0.754 2 1 "[ + . 1]"
1 19 CYS 1.140 0.271 3 0 "[ . 1]"
1 20 ASP 4.362 0.754 2 1 "[ + . 1]"
1 21 ASN 0.594 0.309 3 0 "[ . 1]"
1 22 ILE 3.547 0.226 2 0 "[ . 1]"
1 23 MET 0.886 0.326 1 0 "[ . 1]"
1 24 SER 3.652 0.279 3 0 "[ . 1]"
1 25 THR 5.908 0.279 3 0 "[ . 1]"
1 26 ASN 0.807 0.169 8 0 "[ . 1]"
1 27 LEU 7.958 0.471 9 0 "[ . 1]"
1 28 PHE 7.134 0.271 3 0 "[ . 1]"
1 29 HIS 1.867 0.231 8 0 "[ . 1]"
1 30 CYS 0.845 0.231 8 0 "[ . 1]"
1 31 LYS 6.084 0.351 2 0 "[ . 1]"
1 32 ASP 2.059 0.321 1 0 "[ . 1]"
1 33 LYS 2.066 0.283 1 0 "[ . 1]"
1 34 ASN 4.008 0.351 2 0 "[ . 1]"
1 35 THR 1.032 0.109 10 0 "[ . 1]"
1 36 PHE 2.812 0.339 1 0 "[ . 1]"
1 37 ILE 4.765 0.909 3 2 "[ +-. 1]"
1 38 TYR 1.871 0.284 6 0 "[ . 1]"
1 39 SER 2.742 0.909 3 2 "[ +-. 1]"
1 40 ARG 1.420 0.225 3 0 "[ . 1]"
1 41 PRO 7.061 0.842 4 2 "[ +- 1]"
1 42 GLU 2.904 0.225 3 0 "[ . 1]"
1 43 PRO 3.253 0.231 4 0 "[ . 1]"
1 44 VAL 3.666 0.209 7 0 "[ . 1]"
1 45 LYS 2.130 0.135 6 0 "[ . 1]"
1 46 ALA 0.179 0.047 5 0 "[ . 1]"
1 47 ILE 4.935 0.287 4 0 "[ . 1]"
1 48 CYS 2.164 0.194 1 0 "[ . 1]"
1 49 LYS 1.000 0.110 7 0 "[ . 1]"
1 50 GLY 2.419 0.682 6 1 "[ .+ 1]"
1 51 ILE 6.505 0.246 10 0 "[ . 1]"
1 52 ILE 5.344 0.204 4 0 "[ . 1]"
1 53 ALA 4.407 0.317 9 0 "[ . 1]"
1 54 SER 0.280 0.073 8 0 "[ . 1]"
1 55 LYS 3.976 0.317 9 0 "[ . 1]"
1 56 ASN 4.511 0.481 3 0 "[ . 1]"
1 57 VAL 4.249 0.360 2 0 "[ . 1]"
1 58 LEU 3.237 0.634 2 2 "[ + . - 1]"
1 59 THR 2.673 0.184 10 0 "[ . 1]"
1 60 THR 2.184 0.287 4 0 "[ . 1]"
1 61 SER 2.419 0.169 8 0 "[ . 1]"
1 62 GLU 6.019 0.508 8 2 "[ . + -]"
1 63 PHE 6.299 0.508 8 2 "[ . + -]"
1 64 TYR 2.080 0.284 6 0 "[ . 1]"
1 65 LEU 8.034 0.421 4 0 "[ . 1]"
1 66 SER 1.534 0.185 1 0 "[ . 1]"
1 67 ASP 1.304 0.112 8 0 "[ . 1]"
1 68 CYS 4.945 0.687 5 2 "[ - + 1]"
1 69 ASN 5.182 0.538 6 1 "[ .+ 1]"
1 70 VAL 5.328 0.403 5 0 "[ . 1]"
1 71 THR 2.674 0.285 6 0 "[ . 1]"
1 72 SER 3.798 0.319 5 0 "[ . 1]"
1 73 ARG 2.417 0.520 4 1 "[ +. 1]"
1 74 PRO 1.616 0.520 4 1 "[ +. 1]"
1 75 CYS 3.572 0.279 3 0 "[ . 1]"
1 76 LYS 5.081 0.416 2 0 "[ . 1]"
1 77 TYR 7.476 0.687 5 2 "[ - + 1]"
1 78 LYS 13.752 0.908 5 6 "[** +-** 1]"
1 79 LEU 4.075 0.452 6 0 "[ . 1]"
1 80 LYS 2.664 0.538 6 1 "[ .+ 1]"
1 81 LYS 1.356 0.254 8 0 "[ . 1]"
1 82 SER 0.782 0.254 8 0 "[ . 1]"
1 83 THR 1.550 0.116 6 0 "[ . 1]"
1 84 ASN 5.830 0.421 4 0 "[ . 1]"
1 85 LYS 5.364 0.464 10 0 "[ . 1]"
1 86 PHE 6.587 0.284 6 0 "[ . 1]"
1 87 ALA 3.477 0.241 1 0 "[ . 1]"
1 88 VAL 2.453 0.160 4 0 "[ . 1]"
1 89 THR 1.988 0.168 9 0 "[ . 1]"
1 90 CYS 8.100 0.246 10 0 "[ . 1]"
1 91 GLU 0.919 0.115 1 0 "[ . 1]"
1 92 ASN 1.651 0.195 1 0 "[ . 1]"
1 93 GLN 8.164 0.682 6 1 "[ .+ 1]"
1 94 ALA 0.957 0.130 3 0 "[ . 1]"
1 95 PRO 1.223 0.118 6 0 "[ . 1]"
1 96 VAL 2.396 0.180 5 0 "[ . 1]"
1 97 HIS 2.469 0.241 8 0 "[ . 1]"
1 98 PHE 3.757 0.284 6 0 "[ . 1]"
1 99 VAL 4.026 0.241 1 0 "[ . 1]"
1 100 GLY 1.366 0.094 5 0 "[ . 1]"
1 101 VAL 4.170 0.137 10 0 "[ . 1]"
1 102 GLY 0.031 0.031 3 0 "[ . 1]"
1 103 SER 2.494 0.634 2 2 "[ + . - 1]"
1 104 ALA 0.116 0.060 2 0 "[ . 1]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 PCA HA 1 1 PCA HB2 2.314 . 2.984 2.243 2.234 2.253 . 0 0 "[ . 1]" 1
2 1 1 PCA HA 1 1 PCA HB3 2.797 . 3.775 2.849 2.785 2.891 . 0 0 "[ . 1]" 1
3 1 1 PCA HA 1 1 PCA HG2 2.380 . 3.088 2.927 2.848 3.044 . 0 0 "[ . 1]" 1
4 1 1 PCA HA 1 1 PCA HG3 2.533 . 3.335 3.435 3.394 3.470 0.135 10 0 "[ . 1]" 1
5 1 1 PCA HA 1 96 VAL QG 2.604 . 3.452 3.422 2.978 3.537 0.085 4 0 "[ . 1]" 1
6 1 1 PCA HA 1 96 VAL QG 2.445 . 3.192 3.241 2.979 3.372 0.180 5 0 "[ . 1]" 1
7 1 1 PCA HB2 1 1 PCA HG2 1.951 . 2.427 2.279 2.267 2.287 . 0 0 "[ . 1]" 1
8 1 1 PCA HB2 1 2 ASP H 3.218 . 4.512 3.526 3.415 3.952 . 0 0 "[ . 1]" 1
9 1 1 PCA HB3 1 1 PCA HG2 2.483 . 3.254 2.876 2.741 2.972 . 0 0 "[ . 1]" 1
10 1 1 PCA HB3 1 2 ASP H 3.032 . 4.181 1.991 1.844 2.623 0.039 1 0 "[ . 1]" 1
11 1 1 PCA HB3 1 6 PHE H 4.020 . 6.040 4.198 3.928 4.469 . 0 0 "[ . 1]" 1
12 1 1 PCA HG2 1 2 ASP H 3.462 . 4.960 3.923 3.588 4.172 . 0 0 "[ . 1]" 1
13 1 1 PCA HG3 1 2 ASP H 3.193 . 4.468 2.763 2.139 3.353 . 0 0 "[ . 1]" 1
14 1 2 ASP H 1 2 ASP HA 2.298 . 2.958 2.925 2.847 2.953 . 0 0 "[ . 1]" 1
15 1 2 ASP H 1 2 ASP QB 2.859 . 3.880 2.830 2.561 3.240 . 0 0 "[ . 1]" 1
16 1 2 ASP H 1 3 TRP H 4.168 . 6.340 4.425 4.330 4.502 . 0 0 "[ . 1]" 1
17 1 2 ASP H 1 5 THR H 2.874 . 3.906 3.176 2.759 3.742 . 0 0 "[ . 1]" 1
18 1 2 ASP H 1 5 THR HB 3.828 . 5.660 2.462 2.101 3.668 . 0 0 "[ . 1]" 1
19 1 2 ASP HA 1 2 ASP QB 2.218 . 2.833 2.276 2.184 2.367 . 0 0 "[ . 1]" 1
20 1 2 ASP HA 1 3 TRP H 2.886 . 3.927 2.522 2.371 2.694 . 0 0 "[ . 1]" 1
21 1 2 ASP HA 1 3 TRP QB 3.901 . 5.803 3.673 2.749 4.028 . 0 0 "[ . 1]" 1
22 1 2 ASP HA 1 4 LEU H 3.669 . 5.351 4.450 4.308 4.723 . 0 0 "[ . 1]" 1
23 1 2 ASP HA 1 96 VAL QG 2.459 . 3.215 2.441 1.881 2.900 . 0 0 "[ . 1]" 1
24 1 2 ASP QB 1 3 TRP H 2.839 . 3.846 2.472 1.994 3.363 . 0 0 "[ . 1]" 1
25 1 2 ASP QB 1 4 LEU H 3.389 . 4.824 3.018 2.570 3.437 . 0 0 "[ . 1]" 1
26 1 2 ASP HB2 1 5 THR H 3.631 . 5.279 3.349 1.846 4.424 0.137 7 0 "[ . 1]" 1
27 1 3 TRP H 1 3 TRP QB 2.997 . 3.616 2.133 2.049 2.221 . 0 0 "[ . 1]" 1
28 1 3 TRP H 1 3 TRP HD1 4.416 . 6.854 4.419 4.039 4.841 . 0 0 "[ . 1]" 1
29 1 3 TRP H 1 4 LEU H 3.058 . 4.227 2.627 2.310 2.916 . 0 0 "[ . 1]" 1
30 1 3 TRP H 1 94 ALA MB 3.770 . 5.547 2.680 1.982 3.553 0.011 5 0 "[ . 1]" 1
31 1 3 TRP HA 1 3 TRP QB 2.458 . 3.213 2.227 2.182 2.266 . 0 0 "[ . 1]" 1
32 1 3 TRP HA 1 3 TRP HD1 4.049 . 6.098 4.725 4.606 4.776 . 0 0 "[ . 1]" 1
33 1 3 TRP HA 1 4 LEU H 3.455 . 4.947 3.524 3.504 3.538 . 0 0 "[ . 1]" 1
34 1 3 TRP HA 1 6 PHE H 3.612 . 5.243 3.566 3.001 4.037 . 0 0 "[ . 1]" 1
35 1 3 TRP HA 1 6 PHE QB 2.519 . 3.312 2.476 1.860 2.966 . 0 0 "[ . 1]" 1
36 1 3 TRP HA 1 6 PHE QB 2.297 . 2.957 2.337 1.843 2.661 . 0 0 "[ . 1]" 1
37 1 3 TRP HA 1 6 PHE QD 2.680 . 3.578 2.846 2.660 3.137 . 0 0 "[ . 1]" 1
38 1 3 TRP HA 1 7 GLN H 3.426 . 4.893 4.602 3.879 4.911 0.018 8 0 "[ . 1]" 1
39 1 3 TRP HA 1 96 VAL H 3.562 . 5.148 4.478 4.310 4.629 . 0 0 "[ . 1]" 1
40 1 3 TRP HA 1 96 VAL QG 2.438 . 3.181 2.802 2.471 3.219 0.038 3 0 "[ . 1]" 1
41 1 3 TRP QB 1 3 TRP HD1 2.419 . 3.150 2.506 2.472 2.552 . 0 0 "[ . 1]" 1
42 1 3 TRP QB 1 4 LEU H 3.110 . 3.812 2.887 2.748 3.047 . 0 0 "[ . 1]" 1
43 1 3 TRP QB 1 4 LEU QB 3.301 . 4.663 4.175 3.996 4.462 . 0 0 "[ . 1]" 1
44 1 3 TRP QB 1 45 LYS QD 3.798 . 5.601 4.591 4.483 4.715 . 0 0 "[ . 1]" 1
45 1 3 TRP QB 1 94 ALA MB 2.540 . 3.347 1.849 1.671 2.170 0.080 2 0 "[ . 1]" 1
46 1 3 TRP HD1 1 4 LEU H 3.601 . 5.222 3.607 3.182 4.215 . 0 0 "[ . 1]" 1
47 1 3 TRP HD1 1 4 LEU HA 3.335 . 4.725 4.075 3.490 4.450 . 0 0 "[ . 1]" 1
48 1 3 TRP HD1 1 4 LEU QD 3.131 . 4.357 3.926 2.645 4.234 . 0 0 "[ . 1]" 1
49 1 3 TRP HD1 1 7 GLN HE21 3.381 . 4.809 4.595 4.127 5.084 0.275 4 0 "[ . 1]" 1
50 1 3 TRP HD1 1 7 GLN HE22 3.516 . 5.062 4.860 4.266 5.125 0.063 6 0 "[ . 1]" 1
51 1 3 TRP HD1 1 45 LYS HD3 3.232 . 4.538 4.414 4.193 4.563 0.025 9 0 "[ . 1]" 1
52 1 3 TRP HE1 1 4 LEU QB 4.540 . 7.116 4.438 3.956 4.751 . 0 0 "[ . 1]" 1
53 1 3 TRP HE1 1 4 LEU QD 3.860 . 5.723 4.599 2.884 4.980 . 0 0 "[ . 1]" 1
54 1 3 TRP HE1 1 7 GLN HE21 2.986 . 4.101 3.746 3.322 4.203 0.102 4 0 "[ . 1]" 1
55 1 3 TRP HE1 1 7 GLN HE22 3.112 . 4.323 3.297 2.552 3.664 . 0 0 "[ . 1]" 1
56 1 3 TRP HE1 1 41 PRO QG 3.963 . 5.926 5.325 4.857 5.938 0.012 4 0 "[ . 1]" 1
57 1 3 TRP HE3 1 45 LYS HB2 2.748 . 3.692 3.371 3.277 3.494 . 0 0 "[ . 1]" 1
58 1 3 TRP HE3 1 11 ILE MD 3.641 . 5.298 5.400 5.328 5.449 0.151 1 0 "[ . 1]" 1
59 1 3 TRP HE3 1 44 VAL HB 3.313 . 4.685 4.817 4.758 4.894 0.209 7 0 "[ . 1]" 1
60 1 3 TRP HE3 1 45 LYS H 3.356 . 4.764 4.716 4.598 4.795 0.031 4 0 "[ . 1]" 1
61 1 3 TRP HE3 1 44 VAL MG1 2.744 . 3.685 3.715 3.623 3.775 0.090 2 0 "[ . 1]" 1
62 1 3 TRP HE3 1 45 LYS HA 3.380 . 4.808 4.516 4.210 4.701 . 0 0 "[ . 1]" 1
63 1 3 TRP HE3 1 95 PRO QB 3.271 . 4.608 4.171 3.184 4.581 . 0 0 "[ . 1]" 1
64 1 3 TRP HH2 1 45 LYS HB2 2.699 . 3.610 2.259 2.139 2.388 . 0 0 "[ . 1]" 1
65 1 3 TRP HH2 1 7 GLN HE21 3.053 . 4.218 3.767 3.286 4.059 . 0 0 "[ . 1]" 1
66 1 3 TRP HH2 1 44 VAL H 3.159 . 4.407 4.092 3.989 4.231 . 0 0 "[ . 1]" 1
67 1 3 TRP HH2 1 45 LYS H 2.815 . 3.805 2.792 2.701 2.861 . 0 0 "[ . 1]" 1
68 1 3 TRP HH2 1 41 PRO QB 2.968 . 4.069 2.209 2.070 2.355 . 0 0 "[ . 1]" 1
69 1 3 TRP HH2 1 41 PRO QG 2.832 . 3.835 3.914 3.813 3.979 0.144 7 0 "[ . 1]" 1
70 1 3 TRP HZ2 1 41 PRO QB 2.728 . 3.658 2.023 1.809 2.463 . 0 0 "[ . 1]" 1
71 1 3 TRP HZ2 1 42 GLU HA 4.137 . 6.276 3.969 3.524 4.846 . 0 0 "[ . 1]" 1
72 1 3 TRP HZ3 1 6 PHE QE 2.394 . 3.110 2.174 2.005 2.395 . 0 0 "[ . 1]" 1
73 1 3 TRP HZ3 1 44 VAL HB 2.652 . 3.531 2.835 2.721 3.037 . 0 0 "[ . 1]" 1
74 1 3 TRP HZ3 1 44 VAL MG1 2.905 . 3.960 3.223 3.064 3.478 . 0 0 "[ . 1]" 1
75 1 3 TRP HZ3 1 46 ALA H 4.071 . 6.142 4.054 3.947 4.122 . 0 0 "[ . 1]" 1
76 1 4 LEU H 1 4 LEU HA 2.579 . 3.410 2.851 2.821 2.881 . 0 0 "[ . 1]" 1
77 1 4 LEU H 1 4 LEU QB 2.333 . 3.014 2.069 1.987 2.230 . 0 0 "[ . 1]" 1
78 1 4 LEU H 1 4 LEU QB 2.450 . 3.200 2.046 1.980 2.159 . 0 0 "[ . 1]" 1
79 1 4 LEU H 1 4 LEU QD 3.441 . 4.921 3.556 3.084 3.699 . 0 0 "[ . 1]" 1
80 1 4 LEU H 1 4 LEU HG 2.737 . 3.674 3.674 2.637 3.942 0.268 7 0 "[ . 1]" 1
81 1 4 LEU H 1 5 THR H 2.519 . 3.312 2.492 2.398 2.571 . 0 0 "[ . 1]" 1
82 1 4 LEU H 1 5 THR HA 3.796 . 5.597 5.131 5.069 5.202 . 0 0 "[ . 1]" 1
83 1 4 LEU H 1 5 THR HB 3.852 . 5.707 4.985 4.720 5.207 . 0 0 "[ . 1]" 1
84 1 4 LEU H 1 7 GLN HE21 4.094 . 6.189 5.091 4.594 5.795 . 0 0 "[ . 1]" 1
85 1 4 LEU H 1 7 GLN HE22 4.053 . 6.106 5.991 5.471 6.151 0.045 6 0 "[ . 1]" 1
86 1 4 LEU HA 1 4 LEU QB 2.521 . 3.315 2.214 2.149 2.440 . 0 0 "[ . 1]" 1
87 1 4 LEU HA 1 4 LEU MD1 2.736 . 3.672 2.808 2.519 3.812 0.140 5 0 "[ . 1]" 1
88 1 4 LEU HA 1 5 THR H 2.784 . 3.753 3.524 3.460 3.560 . 0 0 "[ . 1]" 1
89 1 4 LEU HA 1 6 PHE H 3.833 . 5.669 4.221 4.033 4.377 . 0 0 "[ . 1]" 1
90 1 4 LEU HA 1 7 GLN H 3.168 . 4.423 3.814 3.426 4.143 . 0 0 "[ . 1]" 1
91 1 4 LEU QB 1 4 LEU QD 2.360 . 3.056 1.917 1.879 1.952 . 0 0 "[ . 1]" 1
92 1 4 LEU QB 1 5 THR H 3.035 . 4.186 2.506 2.020 2.833 . 0 0 "[ . 1]" 1
93 1 4 LEU QB 1 5 THR H 2.560 . 3.379 2.884 2.728 3.348 . 0 0 "[ . 1]" 1
94 1 4 LEU QB 1 6 PHE H 4.015 . 6.030 4.690 4.548 4.951 . 0 0 "[ . 1]" 1
95 1 4 LEU QD 1 7 GLN HE22 3.602 . 5.224 4.524 3.137 5.254 0.030 3 0 "[ . 1]" 1
96 1 4 LEU MD1 1 4 LEU HG 2.259 . 2.897 2.131 2.124 2.134 . 0 0 "[ . 1]" 1
97 1 4 LEU MD1 1 6 PHE H 3.824 . 5.652 4.271 4.145 4.501 . 0 0 "[ . 1]" 1
98 1 4 LEU HG 1 5 THR HA 2.556 . 3.372 2.614 1.993 3.080 . 0 0 "[ . 1]" 1
99 1 4 LEU HG 1 5 THR HB 2.730 . 3.661 3.806 3.704 3.895 0.234 5 0 "[ . 1]" 1
100 1 5 THR H 1 5 THR HA 2.458 . 3.213 2.874 2.848 2.906 . 0 0 "[ . 1]" 1
101 1 5 THR H 1 5 THR HB 2.919 . 3.984 2.694 2.589 2.864 . 0 0 "[ . 1]" 1
102 1 5 THR H 1 5 THR MG 2.875 . 3.908 3.769 3.727 3.794 . 0 0 "[ . 1]" 1
103 1 5 THR H 1 6 PHE QE 3.622 . 5.262 5.449 5.376 5.590 0.328 4 0 "[ . 1]" 1
104 1 5 THR H 1 8 LYS H 4.153 . 6.308 3.872 3.688 3.987 . 0 0 "[ . 1]" 1
105 1 5 THR HA 1 5 THR MG 1.958 . 2.437 2.288 2.207 2.338 . 0 0 "[ . 1]" 1
106 1 5 THR HA 1 5 THR MG 2.010 . 2.515 2.109 2.067 2.132 . 0 0 "[ . 1]" 1
107 1 5 THR HA 1 6 PHE H 2.668 . 3.557 3.452 3.436 3.491 . 0 0 "[ . 1]" 1
108 1 5 THR HA 1 7 GLN H 3.774 . 5.554 3.916 3.640 4.576 . 0 0 "[ . 1]" 1
109 1 5 THR HA 1 7 GLN QG 3.254 . 4.578 4.598 4.049 4.777 0.199 1 0 "[ . 1]" 1
110 1 5 THR HB 1 5 THR MG 2.320 . 2.993 2.131 2.121 2.134 . 0 0 "[ . 1]" 1
111 1 5 THR HB 1 7 GLN H 4.258 . 6.524 5.102 4.997 5.336 . 0 0 "[ . 1]" 1
112 1 5 THR HB 1 8 LYS H 3.669 . 5.352 5.258 5.077 5.439 0.087 7 0 "[ . 1]" 1
113 1 5 THR HB 1 9 LYS H 3.888 . 5.777 5.574 5.265 5.780 0.003 8 0 "[ . 1]" 1
114 1 5 THR MG 1 6 PHE H 2.942 . 4.024 4.002 3.811 4.082 0.058 5 0 "[ . 1]" 1
115 1 5 THR MG 1 9 LYS H 3.090 . 4.284 4.109 3.836 4.310 0.026 5 0 "[ . 1]" 1
116 1 6 PHE H 1 6 PHE HA 2.467 . 3.228 2.820 2.810 2.829 . 0 0 "[ . 1]" 1
117 1 6 PHE H 1 6 PHE HA 2.737 . 3.673 2.499 2.469 2.526 . 0 0 "[ . 1]" 1
118 1 6 PHE H 1 6 PHE QB 2.383 . 3.093 2.005 1.985 2.067 . 0 0 "[ . 1]" 1
119 1 6 PHE H 1 6 PHE QD 3.002 . 4.128 3.458 3.360 3.645 . 0 0 "[ . 1]" 1
120 1 6 PHE H 1 6 PHE HZ 5.328 . 8.876 7.325 7.258 7.458 . 0 0 "[ . 1]" 1
121 1 6 PHE H 1 7 GLN H 2.607 . 3.456 2.542 2.468 2.664 . 0 0 "[ . 1]" 1
122 1 6 PHE H 1 7 GLN HE21 3.036 . 4.188 4.048 3.833 4.180 . 0 0 "[ . 1]" 1
123 1 6 PHE H 1 7 GLN HE21 4.012 . 6.024 4.468 4.102 5.181 . 0 0 "[ . 1]" 1
124 1 6 PHE H 1 9 LYS H 4.394 . 6.807 4.757 4.497 5.018 . 0 0 "[ . 1]" 1
125 1 6 PHE HA 1 6 PHE QD 2.585 . 3.420 3.280 3.129 3.397 . 0 0 "[ . 1]" 1
126 1 6 PHE HA 1 7 GLN H 3.127 . 4.350 3.483 3.437 3.582 . 0 0 "[ . 1]" 1
127 1 6 PHE HA 1 8 LYS H 4.198 . 6.401 4.124 3.964 4.340 . 0 0 "[ . 1]" 1
128 1 6 PHE HA 1 9 LYS H 3.213 . 4.503 3.237 2.905 3.434 . 0 0 "[ . 1]" 1
129 1 6 PHE HA 1 10 HIS H 3.116 . 4.330 3.818 3.534 4.198 . 0 0 "[ . 1]" 1
130 1 6 PHE QB 1 6 PHE QD 2.224 . 2.842 2.113 2.098 2.121 . 0 0 "[ . 1]" 1
131 1 6 PHE QB 1 7 GLN H 3.069 . 4.246 3.085 2.842 3.226 . 0 0 "[ . 1]" 1
132 1 6 PHE QB 1 96 VAL QG 2.805 . 3.789 3.297 2.985 3.623 . 0 0 "[ . 1]" 1
133 1 6 PHE QR 1 9 LYS H 3.477 . 4.988 5.005 4.887 5.116 0.128 6 0 "[ . 1]" 1
134 1 6 PHE QR 1 10 HIS H 3.268 . 4.603 4.215 3.899 4.437 . 0 0 "[ . 1]" 1
135 1 6 PHE QR 1 11 ILE H 4.044 . 6.089 4.710 4.437 4.854 . 0 0 "[ . 1]" 1
136 1 6 PHE QR 1 97 HIS H 3.052 . 4.217 4.185 3.846 4.337 0.120 2 0 "[ . 1]" 1
137 1 6 PHE QD 1 7 GLN H 3.094 . 4.290 2.819 2.529 3.063 . 0 0 "[ . 1]" 1
138 1 6 PHE QE 1 10 HIS QB 2.371 . 3.074 2.411 2.233 2.599 . 0 0 "[ . 1]" 1
139 1 6 PHE QE 1 44 VAL MG1 2.354 . 3.046 2.871 2.754 2.937 . 0 0 "[ . 1]" 1
140 1 6 PHE HZ 1 11 ILE MD 2.460 . 3.216 2.125 2.034 2.304 . 0 0 "[ . 1]" 1
141 1 6 PHE HZ 1 11 ILE HG12 3.321 . 4.700 3.554 3.520 3.621 . 0 0 "[ . 1]" 1
142 1 6 PHE HZ 1 11 ILE HG13 2.634 . 3.501 3.707 3.528 3.877 0.376 4 0 "[ . 1]" 1
143 1 6 PHE HZ 1 44 VAL HB 3.025 . 4.168 3.369 3.196 3.535 . 0 0 "[ . 1]" 1
144 1 6 PHE HZ 1 45 LYS HA 3.788 . 5.582 5.660 5.631 5.717 0.135 6 0 "[ . 1]" 1
145 1 6 PHE HZ 1 95 PRO QG 3.136 . 4.365 2.875 2.575 3.186 . 0 0 "[ . 1]" 1
146 1 7 GLN H 1 7 GLN HA 2.188 . 2.787 2.825 2.814 2.832 0.045 10 0 "[ . 1]" 1
147 1 7 GLN H 1 7 GLN QB 2.588 . 3.425 2.588 2.525 2.695 . 0 0 "[ . 1]" 1
148 1 7 GLN H 1 7 GLN HE21 3.290 . 4.643 4.158 3.368 4.597 . 0 0 "[ . 1]" 1
149 1 7 GLN H 1 7 GLN HE22 3.794 . 5.593 5.417 4.762 5.644 0.051 7 0 "[ . 1]" 1
150 1 7 GLN H 1 7 GLN QG 3.207 . 4.492 1.977 1.859 2.052 0.063 3 0 "[ . 1]" 1
151 1 7 GLN H 1 8 LYS H 2.706 . 3.621 2.561 2.511 2.613 . 0 0 "[ . 1]" 1
152 1 7 GLN H 1 10 HIS H 3.274 . 4.614 4.640 4.609 4.667 0.053 1 0 "[ . 1]" 1
153 1 7 GLN HA 1 7 GLN QB 2.210 . 2.821 2.272 2.169 2.320 . 0 0 "[ . 1]" 1
154 1 7 GLN HA 1 7 GLN HE22 4.056 . 6.112 5.915 5.598 6.044 . 0 0 "[ . 1]" 1
155 1 7 GLN HA 1 7 GLN QG 2.522 . 3.317 2.499 2.323 2.710 . 0 0 "[ . 1]" 1
156 1 7 GLN HA 1 8 LYS H 3.245 . 4.561 3.494 3.461 3.532 . 0 0 "[ . 1]" 1
157 1 7 GLN HA 1 9 LYS H 3.945 . 5.891 4.105 3.955 4.226 . 0 0 "[ . 1]" 1
158 1 7 GLN HA 1 10 HIS H 2.901 . 3.953 3.503 3.302 3.749 . 0 0 "[ . 1]" 1
159 1 7 GLN HA 1 11 ILE H 3.065 . 4.239 2.821 2.554 2.950 . 0 0 "[ . 1]" 1
160 1 7 GLN HA 1 11 ILE HG13 2.519 . 3.312 1.955 1.877 2.057 . 0 0 "[ . 1]" 1
161 1 7 GLN HA 1 11 ILE MG 2.568 . 3.392 3.381 3.254 3.458 0.066 1 0 "[ . 1]" 1
162 1 7 GLN QB 1 7 GLN QG 1.834 . 2.255 1.985 1.872 2.059 . 0 0 "[ . 1]" 1
163 1 7 GLN HB2 1 8 LYS H 2.159 . 2.742 2.054 1.954 2.485 . 0 0 "[ . 1]" 1
164 1 7 GLN HB3 1 11 ILE MG 2.199 . 2.803 2.156 2.073 2.232 . 0 0 "[ . 1]" 1
165 1 7 GLN HE22 1 41 PRO HA 3.286 . 4.636 4.868 4.712 5.478 0.842 4 2 "[ +- 1]" 1
166 1 8 LYS H 1 8 LYS HA 2.600 . 3.445 2.846 2.808 2.866 . 0 0 "[ . 1]" 1
167 1 8 LYS H 1 8 LYS HB2 2.380 . 3.088 3.133 3.021 3.625 0.537 7 1 "[ . + 1]" 1
168 1 8 LYS H 1 8 LYS QD 2.484 . 3.255 3.385 3.258 3.476 0.221 5 0 "[ . 1]" 1
169 1 8 LYS H 1 8 LYS QG 2.841 . 3.850 3.691 1.815 3.940 0.090 3 0 "[ . 1]" 1
170 1 8 LYS H 1 9 LYS H 2.288 . 2.942 2.453 2.332 2.605 . 0 0 "[ . 1]" 1
171 1 8 LYS H 1 9 LYS QB 3.291 . 4.645 4.237 4.003 4.544 . 0 0 "[ . 1]" 1
172 1 8 LYS H 1 10 HIS H 3.467 . 4.970 4.065 3.866 4.279 . 0 0 "[ . 1]" 1
173 1 8 LYS H 1 11 ILE MD 3.882 . 5.766 5.308 5.199 5.424 . 0 0 "[ . 1]" 1
174 1 8 LYS HA 1 8 LYS HB2 2.175 . 2.766 2.279 2.237 2.532 . 0 0 "[ . 1]" 1
175 1 8 LYS HA 1 9 LYS H 2.963 . 4.061 3.471 3.436 3.509 . 0 0 "[ . 1]" 1
176 1 8 LYS HA 1 10 HIS H 4.069 . 6.139 4.609 4.478 4.732 . 0 0 "[ . 1]" 1
177 1 8 LYS HA 1 11 ILE H 4.180 . 6.364 4.373 4.268 4.463 . 0 0 "[ . 1]" 1
178 1 8 LYS HB2 1 9 LYS H 2.971 . 4.075 3.857 3.643 3.950 . 0 0 "[ . 1]" 1
179 1 8 LYS HB3 1 9 LYS H 2.832 . 3.835 3.319 3.109 4.283 0.448 7 0 "[ . 1]" 1
180 1 8 LYS HB3 1 10 HIS H 3.716 . 5.442 5.229 5.056 5.675 0.233 7 0 "[ . 1]" 1
181 1 8 LYS QD 1 8 LYS QE 1.889 . 2.335 1.902 1.843 1.973 . 0 0 "[ . 1]" 1
182 1 8 LYS QD 1 8 LYS QZ 2.442 . 3.187 2.306 2.115 2.366 . 0 0 "[ . 1]" 1
183 1 8 LYS QD 1 9 LYS H 2.933 . 4.008 2.677 2.429 3.128 . 0 0 "[ . 1]" 1
184 1 8 LYS QD 1 10 HIS H 3.553 . 5.131 4.708 4.401 5.174 0.043 5 0 "[ . 1]" 1
185 1 8 LYS QD 1 27 LEU MD1 2.584 . 3.419 3.332 3.041 3.682 0.263 5 0 "[ . 1]" 1
186 1 8 LYS QE 1 8 LYS HG3 2.316 . 2.986 2.195 2.048 2.276 . 0 0 "[ . 1]" 1
187 1 8 LYS QE 1 9 LYS H 4.329 . 6.672 4.468 4.210 4.704 . 0 0 "[ . 1]" 1
188 1 8 LYS QE 1 9 LYS QG 3.279 . 4.623 3.612 2.483 4.192 . 0 0 "[ . 1]" 1
189 1 8 LYS QE 1 27 LEU MD2 2.700 . 3.611 2.940 2.267 4.000 0.389 3 0 "[ . 1]" 1
190 1 8 LYS QG 1 9 LYS H 3.480 . 4.994 3.589 2.906 3.849 . 0 0 "[ . 1]" 1
191 1 8 LYS HG2 1 8 LYS QZ 2.662 . 3.548 2.522 2.116 2.768 . 0 0 "[ . 1]" 1
192 1 8 LYS HG3 1 27 LEU MD2 2.429 . 3.166 2.571 1.992 3.389 0.223 5 0 "[ . 1]" 1
193 1 8 LYS QZ 1 27 LEU MD1 3.332 . 4.720 2.911 1.686 3.941 0.258 7 0 "[ . 1]" 1
194 1 9 LYS H 1 9 LYS HA 2.855 . 3.874 2.905 2.855 2.932 . 0 0 "[ . 1]" 1
195 1 9 LYS H 1 9 LYS QB 2.397 . 3.115 2.286 2.194 2.343 . 0 0 "[ . 1]" 1
196 1 9 LYS H 1 9 LYS QG 2.848 . 3.862 3.767 2.719 4.020 0.158 5 0 "[ . 1]" 1
197 1 9 LYS H 1 10 HIS H 2.341 . 3.026 2.348 2.212 2.595 . 0 0 "[ . 1]" 1
198 1 9 LYS H 1 11 ILE H 2.702 . 3.615 3.633 3.575 3.683 0.068 1 0 "[ . 1]" 1
199 1 9 LYS H 1 27 LEU MD1 3.651 . 5.317 4.653 4.066 5.048 . 0 0 "[ . 1]" 1
200 1 9 LYS HA 1 9 LYS QG 2.452 . 3.203 2.541 2.288 2.914 . 0 0 "[ . 1]" 1
201 1 9 LYS HA 1 10 HIS H 2.882 . 3.921 3.532 3.462 3.589 . 0 0 "[ . 1]" 1
202 1 9 LYS HA 1 11 ILE H 5.524 . 9.339 4.788 4.620 5.000 . 0 0 "[ . 1]" 1
203 1 9 LYS HA 1 27 LEU MD1 2.582 . 3.416 3.004 1.701 3.887 0.471 9 0 "[ . 1]" 1
204 1 9 LYS HA 1 27 LEU MD2 2.858 . 3.879 2.202 1.721 3.161 0.116 2 0 "[ . 1]" 1
205 1 9 LYS QB 1 10 HIS H 2.508 . 3.294 2.842 2.491 3.049 . 0 0 "[ . 1]" 1
206 1 9 LYS HB3 1 11 ILE H 3.295 . 4.652 3.865 3.625 4.002 . 0 0 "[ . 1]" 1
207 1 9 LYS QG 1 10 HIS H 3.243 . 4.558 3.979 3.556 4.522 . 0 0 "[ . 1]" 1
208 1 9 LYS QG 1 11 ILE H 4.131 . 6.264 5.515 5.169 5.955 . 0 0 "[ . 1]" 1
209 1 10 HIS H 1 10 HIS HA 2.535 . 3.338 2.948 2.942 2.954 . 0 0 "[ . 1]" 1
210 1 10 HIS H 1 10 HIS QB 2.792 . 3.120 2.593 2.549 2.637 . 0 0 "[ . 1]" 1
211 1 10 HIS H 1 11 ILE H 2.219 . 2.835 1.935 1.859 2.005 . 0 0 "[ . 1]" 1
212 1 10 HIS H 1 11 ILE HA 4.053 . 6.106 4.633 4.571 4.687 . 0 0 "[ . 1]" 1
213 1 10 HIS H 1 11 ILE HB 3.752 . 5.511 4.138 4.089 4.213 . 0 0 "[ . 1]" 1
214 1 10 HIS H 1 11 ILE MD 3.948 . 5.896 4.510 4.285 4.682 . 0 0 "[ . 1]" 1
215 1 10 HIS H 1 11 ILE MG 4.032 . 6.064 5.113 5.061 5.175 . 0 0 "[ . 1]" 1
216 1 10 HIS H 1 34 ASN HD22 5.145 . 8.453 5.164 4.897 5.499 . 0 0 "[ . 1]" 1
217 1 10 HIS HA 1 11 ILE H 3.413 . 4.869 3.324 3.269 3.383 . 0 0 "[ . 1]" 1
218 1 10 HIS HA 1 34 ASN HD22 3.259 . 4.587 3.365 3.018 3.825 . 0 0 "[ . 1]" 1
219 1 10 HIS HA 1 37 ILE H 4.017 . 6.034 4.122 3.750 5.007 . 0 0 "[ . 1]" 1
220 1 10 HIS QB 1 10 HIS HD2 2.368 . 3.069 2.594 2.563 2.671 . 0 0 "[ . 1]" 1
221 1 10 HIS QB 1 11 ILE H 2.583 . 3.417 3.334 3.264 3.400 . 0 0 "[ . 1]" 1
222 1 10 HIS QB 1 11 ILE MD 3.112 . 4.323 3.114 2.972 3.203 . 0 0 "[ . 1]" 1
223 1 10 HIS QB 1 37 ILE H 3.438 . 4.916 3.724 3.265 4.683 . 0 0 "[ . 1]" 1
224 1 10 HIS HE1 1 34 ASN HD22 2.740 . 3.679 3.752 3.632 3.815 0.136 1 0 "[ . 1]" 1
225 1 11 ILE H 1 11 ILE HB 2.752 . 3.698 2.561 2.528 2.628 . 0 0 "[ . 1]" 1
226 1 11 ILE H 1 11 ILE MD 4.402 . 6.824 3.755 3.601 3.887 . 0 0 "[ . 1]" 1
227 1 11 ILE H 1 11 ILE HG12 3.122 . 4.340 2.769 2.552 2.941 . 0 0 "[ . 1]" 1
228 1 11 ILE H 1 11 ILE MG 3.016 . 4.153 3.819 3.807 3.847 . 0 0 "[ . 1]" 1
229 1 11 ILE H 1 37 ILE H 4.678 . 7.414 4.746 4.539 5.172 . 0 0 "[ . 1]" 1
230 1 11 ILE HA 1 11 ILE MD 3.868 . 5.739 2.064 1.975 2.160 0.022 4 0 "[ . 1]" 1
231 1 11 ILE HA 1 11 ILE HG13 2.944 . 4.027 3.737 3.696 3.765 . 0 0 "[ . 1]" 1
232 1 11 ILE HA 1 11 ILE MG 2.439 . 3.183 2.447 2.408 2.478 . 0 0 "[ . 1]" 1
233 1 11 ILE HA 1 12 THR H 2.035 . 2.553 2.189 2.143 2.261 . 0 0 "[ . 1]" 1
234 1 11 ILE HA 1 36 PHE H 4.643 . 7.338 5.121 4.821 5.352 . 0 0 "[ . 1]" 1
235 1 11 ILE HA 1 37 ILE H 2.944 . 4.027 2.832 2.554 3.261 . 0 0 "[ . 1]" 1
236 1 11 ILE HA 1 37 ILE HB 2.863 . 3.888 3.092 2.876 3.401 . 0 0 "[ . 1]" 1
237 1 11 ILE HA 1 39 SER H 4.118 . 6.237 4.607 4.214 5.064 . 0 0 "[ . 1]" 1
238 1 11 ILE HB 1 11 ILE MG 2.263 . 2.903 2.126 2.121 2.128 . 0 0 "[ . 1]" 1
239 1 11 ILE HB 1 12 THR H 3.139 . 4.371 4.179 4.003 4.374 0.003 1 0 "[ . 1]" 1
240 1 11 ILE MD 1 12 THR H 4.062 . 6.124 3.612 3.452 3.859 . 0 0 "[ . 1]" 1
241 1 11 ILE MD 1 37 ILE H 3.121 . 4.338 3.133 2.755 3.791 . 0 0 "[ . 1]" 1
242 1 11 ILE MD 1 37 ILE HA 3.934 . 5.868 4.463 4.270 4.666 . 0 0 "[ . 1]" 1
243 1 11 ILE MD 1 37 ILE HB 2.284 . 2.936 1.951 1.801 2.203 . 0 0 "[ . 1]" 1
244 1 11 ILE HG12 1 12 THR H 3.658 . 5.330 5.022 4.967 5.131 . 0 0 "[ . 1]" 1
245 1 11 ILE HG12 1 37 ILE H 4.097 . 6.196 4.857 4.575 5.192 . 0 0 "[ . 1]" 1
246 1 11 ILE MG 1 13 ASN H 4.001 . 6.002 3.598 3.284 3.732 . 0 0 "[ . 1]" 1
247 1 11 ILE MG 1 41 PRO HD3 3.687 . 5.386 3.770 3.306 4.372 . 0 0 "[ . 1]" 1
248 1 11 ILE MG 1 39 SER H 2.825 . 3.823 3.067 2.956 3.166 . 0 0 "[ . 1]" 1
249 1 12 THR H 1 12 THR HB 3.049 . 4.211 3.198 2.989 3.303 . 0 0 "[ . 1]" 1
250 1 12 THR H 1 12 THR MG 1.996 . 2.494 2.114 1.911 2.190 . 0 0 "[ . 1]" 1
251 1 12 THR H 1 14 THR H 4.432 . 6.887 5.092 4.910 5.209 . 0 0 "[ . 1]" 1
252 1 12 THR H 1 14 THR H 4.303 . 6.618 4.090 4.006 4.138 . 0 0 "[ . 1]" 1
253 1 12 THR H 1 36 PHE HB2 3.896 . 5.794 3.469 3.127 3.776 . 0 0 "[ . 1]" 1
254 1 12 THR H 1 37 ILE H 3.333 . 4.722 3.660 3.468 4.007 . 0 0 "[ . 1]" 1
255 1 12 THR H 1 37 ILE HB 3.536 . 5.099 4.160 3.985 4.498 . 0 0 "[ . 1]" 1
256 1 12 THR H 1 38 TYR HA 3.172 . 4.430 2.949 2.809 3.057 . 0 0 "[ . 1]" 1
257 1 12 THR H 1 39 SER H 3.052 . 4.217 3.682 3.391 3.889 . 0 0 "[ . 1]" 1
258 1 12 THR HA 1 13 ASN H 2.513 . 3.303 2.188 2.104 2.383 . 0 0 "[ . 1]" 1
259 1 12 THR HA 1 14 THR H 3.112 . 4.323 3.651 3.425 4.070 . 0 0 "[ . 1]" 1
260 1 12 THR HB 1 12 THR MG 2.389 . 3.102 2.131 2.128 2.133 . 0 0 "[ . 1]" 1
261 1 12 THR HB 1 13 ASN H 3.557 . 5.139 3.978 3.764 4.150 . 0 0 "[ . 1]" 1
262 1 12 THR HB 1 14 THR H 3.495 . 5.022 4.178 4.117 4.245 . 0 0 "[ . 1]" 1
263 1 12 THR HB 1 17 VAL MG1 2.727 . 3.656 2.630 2.364 2.813 . 0 0 "[ . 1]" 1
264 1 12 THR HB 1 37 ILE H 3.945 . 5.891 5.145 4.744 5.419 . 0 0 "[ . 1]" 1
265 1 12 THR MG 1 14 THR H 2.797 . 3.775 3.244 2.353 3.446 . 0 0 "[ . 1]" 1
266 1 12 THR MG 1 15 ARG H 4.627 . 7.303 5.005 4.680 5.249 . 0 0 "[ . 1]" 1
267 1 12 THR MG 1 16 ASP H 3.878 . 5.757 4.760 4.309 5.226 . 0 0 "[ . 1]" 1
268 1 12 THR MG 1 17 VAL MG1 2.222 . 2.839 2.228 2.107 2.407 . 0 0 "[ . 1]" 1
269 1 12 THR MG 1 36 PHE HB2 2.554 . 3.369 2.345 2.198 2.603 . 0 0 "[ . 1]" 1
270 1 12 THR MG 1 36 PHE QD 1.990 . 2.485 2.273 2.101 2.492 0.007 2 0 "[ . 1]" 1
271 1 12 THR MG 1 37 ILE H 2.607 . 3.456 3.485 3.420 3.539 0.083 5 0 "[ . 1]" 1
272 1 12 THR MG 1 38 TYR HA 2.371 . 3.074 2.253 2.082 2.661 . 0 0 "[ . 1]" 1
273 1 12 THR MG 1 38 TYR HB2 2.265 . 2.906 1.996 1.766 2.472 . 0 0 "[ . 1]" 1
274 1 12 THR MG 1 67 ASP H 4.085 . 6.171 3.499 3.304 3.798 . 0 0 "[ . 1]" 1
275 1 13 ASN H 1 13 ASN HB2 3.775 . 5.557 3.398 2.328 3.669 . 0 0 "[ . 1]" 1
276 1 13 ASN H 1 13 ASN HB3 3.741 . 5.491 2.974 2.696 3.635 . 0 0 "[ . 1]" 1
277 1 13 ASN H 1 13 ASN HD21 2.103 . 2.656 2.375 2.119 2.694 0.038 2 0 "[ . 1]" 1
278 1 13 ASN H 1 14 THR H 2.811 . 3.799 2.330 2.260 2.382 . 0 0 "[ . 1]" 1
279 1 13 ASN H 1 14 THR MG 4.153 . 6.309 3.263 3.135 3.440 . 0 0 "[ . 1]" 1
280 1 13 ASN HA 1 13 ASN HB2 2.421 . 3.154 2.575 2.410 3.024 . 0 0 "[ . 1]" 1
281 1 13 ASN HA 1 13 ASN HB3 2.598 . 3.441 2.463 2.368 2.574 . 0 0 "[ . 1]" 1
282 1 13 ASN HA 1 14 THR H 2.723 . 3.650 3.290 3.255 3.338 . 0 0 "[ . 1]" 1
283 1 13 ASN HA 1 38 TYR QD 2.614 . 3.468 2.990 2.741 3.217 . 0 0 "[ . 1]" 1
284 1 13 ASN HB2 1 13 ASN HD21 3.360 . 4.771 3.110 2.254 3.499 . 0 0 "[ . 1]" 1
285 1 13 ASN HB2 1 14 THR H 3.853 . 5.709 4.112 3.489 4.353 . 0 0 "[ . 1]" 1
286 1 13 ASN HB3 1 13 ASN HD21 3.359 . 4.769 2.751 2.202 3.550 . 0 0 "[ . 1]" 1
287 1 13 ASN HB3 1 14 THR H 3.716 . 5.443 4.309 4.112 4.440 . 0 0 "[ . 1]" 1
288 1 14 THR H 1 14 THR HA 2.675 . 3.569 2.939 2.932 2.944 . 0 0 "[ . 1]" 1
289 1 14 THR H 1 14 THR HB 2.931 . 4.005 3.247 3.107 3.335 . 0 0 "[ . 1]" 1
290 1 14 THR H 1 14 THR MG 2.336 . 3.018 2.148 2.080 2.261 . 0 0 "[ . 1]" 1
291 1 14 THR H 1 17 VAL MG1 3.834 . 5.671 4.476 4.022 5.722 0.051 1 0 "[ . 1]" 1
292 1 14 THR H 1 38 TYR QD 3.073 . 4.253 3.474 3.264 3.934 . 0 0 "[ . 1]" 1
293 1 14 THR H 1 38 TYR QE 3.521 . 5.071 4.590 4.206 5.091 0.020 8 0 "[ . 1]" 1
294 1 14 THR HA 1 14 THR MG 2.840 . 3.848 3.216 3.210 3.222 . 0 0 "[ . 1]" 1
295 1 14 THR HA 1 15 ARG H 2.955 . 4.047 2.140 2.115 2.180 . 0 0 "[ . 1]" 1
296 1 14 THR HA 1 16 ASP H 3.285 . 4.634 3.764 3.570 4.067 . 0 0 "[ . 1]" 1
297 1 14 THR HB 1 14 THR MG 2.179 . 2.773 2.132 2.128 2.137 . 0 0 "[ . 1]" 1
298 1 14 THR HB 1 16 ASP H 4.150 . 6.303 4.511 4.334 4.827 . 0 0 "[ . 1]" 1
299 1 14 THR HB 1 17 VAL H 3.824 . 5.652 4.252 4.055 4.573 . 0 0 "[ . 1]" 1
300 1 14 THR MG 1 16 ASP H 2.915 . 3.977 3.729 3.510 3.987 0.010 3 0 "[ . 1]" 1
301 1 14 THR MG 1 17 VAL H 3.822 . 5.648 3.319 3.098 3.636 . 0 0 "[ . 1]" 1
302 1 14 THR MG 1 17 VAL HA 2.678 . 3.575 2.558 2.125 2.866 . 0 0 "[ . 1]" 1
303 1 14 THR MG 1 18 ASP H 4.008 . 6.016 4.150 3.420 4.478 . 0 0 "[ . 1]" 1
304 1 15 ARG H 1 15 ARG QB 4.151 . 6.305 2.548 2.258 2.706 . 0 0 "[ . 1]" 1
305 1 15 ARG H 1 16 ASP H 4.036 . 6.073 2.463 2.385 2.544 . 0 0 "[ . 1]" 1
306 1 15 ARG HA 1 16 ASP H 3.583 . 5.188 3.479 3.453 3.518 . 0 0 "[ . 1]" 1
307 1 15 ARG HA 1 17 VAL H 4.524 . 7.082 3.899 3.641 4.399 . 0 0 "[ . 1]" 1
308 1 15 ARG QB 1 16 ASP H 3.779 . 5.564 3.124 2.551 3.579 . 0 0 "[ . 1]" 1
309 1 15 ARG QB 1 81 LYS QG 3.975 . 5.950 4.269 3.547 4.890 . 0 0 "[ . 1]" 1
310 1 15 ARG QD 1 38 TYR QD 2.934 . 4.010 3.802 3.082 4.117 0.107 8 0 "[ . 1]" 1
311 1 15 ARG QD 1 64 TYR QD 3.062 . 4.234 4.141 3.208 4.302 0.068 2 0 "[ . 1]" 1
312 1 15 ARG HE 1 15 ARG HG3 2.508 . 3.294 2.531 2.370 2.859 . 0 0 "[ . 1]" 1
313 1 15 ARG HG2 1 38 TYR QE 3.521 . 5.070 3.863 2.851 5.094 0.024 5 0 "[ . 1]" 1
314 1 16 ASP H 1 16 ASP HA 2.778 . 3.743 2.923 2.913 2.948 . 0 0 "[ . 1]" 1
315 1 16 ASP H 1 16 ASP HB2 2.724 . 3.651 2.485 2.356 2.798 . 0 0 "[ . 1]" 1
316 1 16 ASP H 1 16 ASP HB3 2.620 . 3.478 3.383 2.730 3.659 0.181 6 0 "[ . 1]" 1
317 1 16 ASP H 1 17 VAL H 3.420 . 4.882 3.320 3.124 3.696 . 0 0 "[ . 1]" 1
318 1 16 ASP HA 1 16 ASP HB2 2.570 . 3.395 2.899 2.557 3.028 . 0 0 "[ . 1]" 1
319 1 16 ASP HA 1 17 VAL H 2.261 . 2.900 2.568 2.342 2.726 . 0 0 "[ . 1]" 1
320 1 16 ASP HA 1 17 VAL HA 2.950 . 4.038 3.998 3.958 4.037 . 0 0 "[ . 1]" 1
321 1 16 ASP HA 1 17 VAL MG1 3.051 . 4.215 3.640 3.529 3.722 . 0 0 "[ . 1]" 1
322 1 16 ASP HB2 1 17 VAL H 3.559 . 5.142 4.421 4.258 4.639 . 0 0 "[ . 1]" 1
323 1 16 ASP HB3 1 17 VAL H 4.181 . 6.367 4.368 4.298 4.425 . 0 0 "[ . 1]" 1
324 1 17 VAL H 1 17 VAL HB 2.563 . 3.384 2.970 2.714 3.112 . 0 0 "[ . 1]" 1
325 1 17 VAL H 1 17 VAL MG1 2.339 . 3.023 1.690 1.635 1.943 0.020 10 0 "[ . 1]" 1
326 1 17 VAL H 1 17 VAL MG2 3.051 . 4.214 3.673 3.590 3.792 . 0 0 "[ . 1]" 1
327 1 17 VAL H 1 18 ASP H 4.108 . 6.218 4.434 4.353 4.511 . 0 0 "[ . 1]" 1
328 1 17 VAL H 1 79 LEU QD 2.879 . 3.915 3.124 2.472 3.611 . 0 0 "[ . 1]" 1
329 1 17 VAL HA 1 17 VAL HB 2.885 . 3.925 2.327 2.283 2.449 . 0 0 "[ . 1]" 1
330 1 17 VAL HA 1 17 VAL MG1 2.442 . 3.187 3.157 3.114 3.212 0.025 1 0 "[ . 1]" 1
331 1 17 VAL HA 1 17 VAL MG2 2.453 . 3.205 2.597 2.401 2.704 . 0 0 "[ . 1]" 1
332 1 17 VAL HA 1 18 ASP H 2.299 . 2.960 2.135 2.096 2.164 . 0 0 "[ . 1]" 1
333 1 17 VAL HA 1 18 ASP QB 3.225 . 4.525 4.222 4.036 4.400 . 0 0 "[ . 1]" 1
334 1 17 VAL HB 1 17 VAL MG1 2.013 . 2.520 2.121 2.118 2.126 . 0 0 "[ . 1]" 1
335 1 17 VAL HB 1 17 VAL MG2 2.217 . 2.831 2.130 2.127 2.132 . 0 0 "[ . 1]" 1
336 1 17 VAL HB 1 18 ASP H 3.901 . 5.804 4.131 3.966 4.226 . 0 0 "[ . 1]" 1
337 1 17 VAL HB 1 19 CYS H 3.855 . 5.713 5.322 4.761 5.677 . 0 0 "[ . 1]" 1
338 1 17 VAL HB 1 36 PHE HZ 3.378 . 4.804 4.870 4.365 4.938 0.134 6 0 "[ . 1]" 1
339 1 17 VAL MG1 1 17 VAL MG2 2.150 . 2.728 2.085 2.080 2.094 . 0 0 "[ . 1]" 1
340 1 17 VAL MG1 1 18 ASP H 3.585 . 5.192 4.287 3.987 4.353 . 0 0 "[ . 1]" 1
341 1 17 VAL MG1 1 19 CYS H 4.045 . 6.091 3.651 2.453 4.064 . 0 0 "[ . 1]" 1
342 1 17 VAL MG1 1 19 CYS QB 2.906 . 3.962 3.507 2.171 4.206 0.244 10 0 "[ . 1]" 1
343 1 17 VAL MG1 1 81 LYS QE 3.111 . 4.321 4.053 3.749 4.378 0.057 10 0 "[ . 1]" 1
344 1 17 VAL MG1 1 36 PHE HB2 3.124 . 4.344 4.435 4.357 4.683 0.339 1 0 "[ . 1]" 1
345 1 17 VAL MG1 1 36 PHE HZ 3.087 . 4.278 2.719 2.451 3.409 . 0 0 "[ . 1]" 1
346 1 17 VAL MG1 1 66 SER H 4.204 . 6.414 4.806 4.405 5.025 . 0 0 "[ . 1]" 1
347 1 17 VAL MG1 1 66 SER QB 2.602 . 3.448 2.747 2.413 2.897 . 0 0 "[ . 1]" 1
348 1 17 VAL MG2 1 18 ASP H 2.803 . 3.785 2.953 2.695 3.081 . 0 0 "[ . 1]" 1
349 1 17 VAL MG2 1 18 ASP HA 3.522 . 5.073 3.896 3.788 3.989 . 0 0 "[ . 1]" 1
350 1 17 VAL MG2 1 19 CYS H 2.863 . 3.887 2.660 2.493 2.975 . 0 0 "[ . 1]" 1
351 1 17 VAL MG2 1 19 CYS HA 2.598 . 3.442 2.924 2.625 3.199 . 0 0 "[ . 1]" 1
352 1 17 VAL MG2 1 19 CYS QB 3.773 . 5.553 2.714 2.514 3.193 . 0 0 "[ . 1]" 1
353 1 17 VAL MG2 1 22 ILE HB 3.225 . 4.525 3.398 3.280 3.647 . 0 0 "[ . 1]" 1
354 1 17 VAL MG2 1 22 ILE MD 2.483 . 3.253 2.472 2.196 2.733 . 0 0 "[ . 1]" 1
355 1 17 VAL MG2 1 22 ILE MG 2.425 . 3.160 3.108 3.023 3.214 0.054 8 0 "[ . 1]" 1
356 1 17 VAL MG2 1 28 PHE QE 3.028 . 4.174 4.238 4.013 4.325 0.151 4 0 "[ . 1]" 1
357 1 17 VAL MG2 1 28 PHE QE 2.815 . 3.805 3.575 3.449 3.775 . 0 0 "[ . 1]" 1
358 1 17 VAL MG2 1 28 PHE HZ 3.073 . 4.253 3.962 3.716 4.260 0.007 1 0 "[ . 1]" 1
359 1 17 VAL MG2 1 79 LEU QD 3.271 . 4.095 3.549 3.405 3.706 . 0 0 "[ . 1]" 1
360 1 18 ASP H 1 18 ASP HA 2.954 . 4.045 2.880 2.855 2.915 . 0 0 "[ . 1]" 1
361 1 18 ASP H 1 18 ASP QB 3.096 . 3.580 2.347 2.242 2.641 . 0 0 "[ . 1]" 1
362 1 18 ASP H 1 19 CYS H 3.321 . 4.699 3.826 3.597 4.005 . 0 0 "[ . 1]" 1
363 1 18 ASP HA 1 18 ASP QB 3.225 . 3.631 2.398 2.178 2.446 . 0 0 "[ . 1]" 1
364 1 18 ASP HA 1 19 CYS H 2.202 . 2.808 2.344 2.241 2.423 . 0 0 "[ . 1]" 1
365 1 18 ASP HA 1 20 ASP H 3.625 . 5.268 3.317 3.159 3.522 . 0 0 "[ . 1]" 1
366 1 18 ASP HA 1 20 ASP HB3 2.848 . 3.862 4.066 3.919 4.616 0.754 2 1 "[ + . 1]" 1
367 1 18 ASP HA 1 79 LEU QD 2.630 . 3.494 2.682 2.380 2.839 . 0 0 "[ . 1]" 1
368 1 18 ASP HA 1 80 LYS H 4.247 . 6.501 5.722 5.506 5.867 . 0 0 "[ . 1]" 1
369 1 18 ASP HA 1 79 LEU QD 2.306 . 2.971 2.871 2.452 3.093 0.122 1 0 "[ . 1]" 1
370 1 18 ASP QB 1 19 CYS H 3.234 . 4.541 3.939 3.839 4.015 . 0 0 "[ . 1]" 1
371 1 18 ASP QB 1 21 ASN H 3.419 . 4.880 3.105 2.624 3.574 . 0 0 "[ . 1]" 1
372 1 18 ASP QB 1 21 ASN HD21 5.222 . 8.631 3.588 1.504 5.106 0.309 3 0 "[ . 1]" 1
373 1 19 CYS H 1 19 CYS HA 2.602 . 3.449 2.795 2.766 2.815 . 0 0 "[ . 1]" 1
374 1 19 CYS H 1 19 CYS QB 2.767 . 3.724 2.445 2.194 2.923 . 0 0 "[ . 1]" 1
375 1 19 CYS H 1 20 ASP H 2.929 . 4.002 2.646 2.538 2.763 . 0 0 "[ . 1]" 1
376 1 19 CYS H 1 20 ASP HB3 3.566 . 5.156 4.537 4.369 4.851 . 0 0 "[ . 1]" 1
377 1 19 CYS H 1 21 ASN H 4.097 . 6.195 4.389 4.125 4.668 . 0 0 "[ . 1]" 1
378 1 19 CYS H 1 22 ILE MG 3.914 . 5.829 4.112 3.990 4.303 . 0 0 "[ . 1]" 1
379 1 19 CYS H 1 79 LEU QD 4.436 . 5.568 2.895 2.459 3.348 . 0 0 "[ . 1]" 1
380 1 19 CYS HA 1 20 ASP H 3.565 . 5.154 3.481 3.455 3.518 . 0 0 "[ . 1]" 1
381 1 19 CYS HA 1 21 ASN H 5.105 . 8.363 4.165 3.775 4.503 . 0 0 "[ . 1]" 1
382 1 19 CYS HA 1 22 ILE MG 2.335 . 3.017 1.754 1.642 2.040 0.011 10 0 "[ . 1]" 1
383 1 19 CYS HA 1 23 MET H 3.196 . 4.473 3.904 3.665 4.035 . 0 0 "[ . 1]" 1
384 1 19 CYS QB 1 20 ASP H 3.094 . 4.290 3.055 2.647 3.413 . 0 0 "[ . 1]" 1
385 1 19 CYS QB 1 35 THR HA 3.011 . 4.144 3.951 3.768 4.098 . 0 0 "[ . 1]" 1
386 1 19 CYS QB 1 28 PHE QE 2.516 . 3.307 3.317 2.970 3.578 0.271 3 0 "[ . 1]" 1
387 1 19 CYS QB 1 77 TYR H 4.529 . 7.093 6.660 6.124 7.115 0.022 6 0 "[ . 1]" 1
388 1 19 CYS QB 1 68 CYS H 4.585 . 7.213 4.652 3.707 5.240 . 0 0 "[ . 1]" 1
389 1 19 CYS QB 1 79 LEU H 4.248 . 6.504 5.116 4.790 5.738 . 0 0 "[ . 1]" 1
390 1 20 ASP H 1 20 ASP HB2 2.930 . 4.003 2.531 2.407 2.692 . 0 0 "[ . 1]" 1
391 1 20 ASP H 1 20 ASP HB3 2.735 . 3.670 2.470 2.296 2.704 . 0 0 "[ . 1]" 1
392 1 20 ASP H 1 20 ASP HB3 2.608 . 3.458 2.296 1.965 2.519 . 0 0 "[ . 1]" 1
393 1 20 ASP H 1 21 ASN H 2.765 . 3.721 2.860 2.682 3.009 . 0 0 "[ . 1]" 1
394 1 20 ASP H 1 68 CYS HA 4.185 . 6.374 6.466 6.259 6.573 0.199 3 0 "[ . 1]" 1
395 1 20 ASP H 1 79 LEU H 3.983 . 5.966 4.298 4.198 4.374 . 0 0 "[ . 1]" 1
396 1 20 ASP HA 1 21 ASN H 3.403 . 4.850 3.552 3.509 3.593 . 0 0 "[ . 1]" 1
397 1 20 ASP HA 1 23 MET H 3.927 . 5.855 4.238 3.852 4.556 . 0 0 "[ . 1]" 1
398 1 20 ASP HA 1 25 THR H 4.148 . 6.299 6.361 6.312 6.397 0.098 8 0 "[ . 1]" 1
399 1 20 ASP HA 1 77 TYR QD 2.579 . 3.410 2.998 2.195 3.469 0.059 6 0 "[ . 1]" 1
400 1 20 ASP HB2 1 21 ASN H 3.012 . 4.146 3.947 3.752 4.206 0.060 6 0 "[ . 1]" 1
401 1 20 ASP HB2 1 78 LYS H 3.328 . 4.713 4.566 3.870 4.862 0.149 6 0 "[ . 1]" 1
402 1 20 ASP HB3 1 21 ASN H 2.304 . 2.968 2.184 2.027 2.268 . 0 0 "[ . 1]" 1
403 1 20 ASP HB3 1 21 ASN HD21 2.473 . 3.238 2.383 2.150 2.767 . 0 0 "[ . 1]" 1
404 1 20 ASP HB3 1 21 ASN HD22 2.497 . 3.277 3.211 2.982 3.360 0.083 5 0 "[ . 1]" 1
405 1 20 ASP HB3 1 21 ASN HD21 3.030 . 4.178 3.135 2.629 4.204 0.026 9 0 "[ . 1]" 1
406 1 21 ASN H 1 21 ASN HA 2.899 . 3.949 2.909 2.878 2.919 . 0 0 "[ . 1]" 1
407 1 21 ASN H 1 21 ASN HD21 3.711 . 5.433 2.564 2.261 3.423 . 0 0 "[ . 1]" 1
408 1 21 ASN H 1 22 ILE H 2.220 . 2.836 2.324 2.244 2.522 . 0 0 "[ . 1]" 1
409 1 21 ASN H 1 22 ILE HA 4.064 . 6.128 4.712 4.541 4.857 . 0 0 "[ . 1]" 1
410 1 21 ASN H 1 22 ILE HB 3.628 . 5.273 4.242 4.136 4.472 . 0 0 "[ . 1]" 1
411 1 21 ASN H 1 22 ILE MG 3.705 . 5.421 4.294 4.099 4.535 . 0 0 "[ . 1]" 1
412 1 21 ASN H 1 23 MET H 3.326 . 4.709 4.053 3.857 4.233 . 0 0 "[ . 1]" 1
413 1 21 ASN HA 1 21 ASN QB 2.376 . 3.082 2.435 2.377 2.485 . 0 0 "[ . 1]" 1
414 1 21 ASN HA 1 24 SER H 3.449 . 4.936 4.058 3.834 4.504 . 0 0 "[ . 1]" 1
415 1 21 ASN QB 1 22 ILE H 2.750 . 3.695 2.741 2.494 3.030 . 0 0 "[ . 1]" 1
416 1 21 ASN QB 1 22 ILE HG13 4.270 . 6.549 4.715 4.241 4.957 . 0 0 "[ . 1]" 1
417 1 22 ILE H 1 22 ILE HB 2.403 . 3.125 2.220 2.190 2.307 . 0 0 "[ . 1]" 1
418 1 22 ILE H 1 22 ILE HG12 3.560 . 5.144 4.537 4.525 4.545 . 0 0 "[ . 1]" 1
419 1 22 ILE H 1 22 ILE HG13 2.864 . 3.889 4.024 3.977 4.115 0.226 2 0 "[ . 1]" 1
420 1 22 ILE H 1 22 ILE MG 2.964 . 4.062 2.743 2.625 2.854 . 0 0 "[ . 1]" 1
421 1 22 ILE H 1 23 MET H 2.766 . 3.722 2.695 2.488 2.843 . 0 0 "[ . 1]" 1
422 1 22 ILE H 1 24 SER H 3.681 . 5.375 4.385 4.204 4.556 . 0 0 "[ . 1]" 1
423 1 22 ILE HA 1 22 ILE HB 2.114 . 2.673 2.644 2.611 2.685 0.012 4 0 "[ . 1]" 1
424 1 22 ILE HA 1 22 ILE HG12 2.650 . 3.527 2.690 2.599 2.797 . 0 0 "[ . 1]" 1
425 1 22 ILE HA 1 22 ILE HG13 2.838 . 3.844 2.218 2.151 2.252 . 0 0 "[ . 1]" 1
426 1 22 ILE HA 1 22 ILE MG 2.380 . 3.088 3.146 3.122 3.161 0.073 8 0 "[ . 1]" 1
427 1 22 ILE HA 1 23 MET H 3.271 . 4.609 3.468 3.453 3.485 . 0 0 "[ . 1]" 1
428 1 22 ILE HA 1 24 SER H 3.211 . 4.500 3.771 3.652 4.013 . 0 0 "[ . 1]" 1
429 1 22 ILE HA 1 25 THR H 3.458 . 4.953 3.063 2.962 3.378 . 0 0 "[ . 1]" 1
430 1 22 ILE HB 1 22 ILE MG 2.397 . 3.115 2.128 2.125 2.132 . 0 0 "[ . 1]" 1
431 1 22 ILE HB 1 23 MET H 2.895 . 3.943 3.812 3.738 3.861 . 0 0 "[ . 1]" 1
432 1 22 ILE MD 1 28 PHE QE 2.418 . 3.149 2.809 2.308 3.047 . 0 0 "[ . 1]" 1
433 1 22 ILE MD 1 28 PHE HZ 2.936 . 4.013 2.887 2.543 3.150 . 0 0 "[ . 1]" 1
434 1 22 ILE HG12 1 25 THR HB 2.463 . 3.221 3.234 3.097 3.305 0.084 8 0 "[ . 1]" 1
435 1 22 ILE HG12 1 28 PHE H 3.187 . 4.457 4.181 3.116 4.544 0.087 2 0 "[ . 1]" 1
436 1 22 ILE HG12 1 29 HIS H 4.432 . 6.887 5.709 4.981 5.967 . 0 0 "[ . 1]" 1
437 1 22 ILE HG12 1 28 PHE HZ 3.942 . 5.884 4.776 4.265 5.120 . 0 0 "[ . 1]" 1
438 1 22 ILE HG13 1 23 MET H 3.776 . 5.558 5.099 5.036 5.131 . 0 0 "[ . 1]" 1
439 1 22 ILE HG13 1 25 THR H 4.105 . 6.212 5.298 5.041 5.463 . 0 0 "[ . 1]" 1
440 1 22 ILE MG 1 23 MET H 2.465 . 3.224 2.416 2.317 2.472 . 0 0 "[ . 1]" 1
441 1 22 ILE MG 1 23 MET HA 3.156 . 4.401 2.726 2.614 2.775 . 0 0 "[ . 1]" 1
442 1 22 ILE MG 1 23 MET QB 2.705 . 3.620 3.228 3.126 3.574 . 0 0 "[ . 1]" 1
443 1 22 ILE MG 1 24 SER H 4.068 . 6.136 4.262 4.224 4.329 . 0 0 "[ . 1]" 1
444 1 22 ILE MG 1 27 LEU HB3 2.819 . 3.812 3.884 3.768 3.998 0.186 8 0 "[ . 1]" 1
445 1 22 ILE MG 1 28 PHE QD 2.454 . 3.207 2.903 2.796 2.962 . 0 0 "[ . 1]" 1
446 1 22 ILE MG 1 28 PHE QE 2.442 . 3.188 2.829 2.732 2.908 . 0 0 "[ . 1]" 1
447 1 22 ILE MG 1 28 PHE HZ 2.425 . 3.160 3.107 3.000 3.168 0.008 1 0 "[ . 1]" 1
448 1 23 MET H 1 23 MET HA 2.978 . 4.087 2.820 2.815 2.829 . 0 0 "[ . 1]" 1
449 1 23 MET H 1 23 MET HA 2.461 . 3.218 2.538 2.514 2.548 . 0 0 "[ . 1]" 1
450 1 23 MET H 1 23 MET QB 2.730 . 3.662 2.541 2.257 2.692 . 0 0 "[ . 1]" 1
451 1 23 MET H 1 24 SER H 2.765 . 3.720 2.662 2.616 2.723 . 0 0 "[ . 1]" 1
452 1 23 MET H 1 25 THR H 4.115 . 6.232 4.132 4.056 4.224 . 0 0 "[ . 1]" 1
453 1 23 MET HA 1 30 CYS H 3.212 . 4.501 3.251 3.192 3.329 . 0 0 "[ . 1]" 1
454 1 23 MET HA 1 28 PHE H 2.936 . 4.013 3.804 3.552 3.984 . 0 0 "[ . 1]" 1
455 1 23 MET HA 1 28 PHE QD 2.514 . 3.304 3.350 3.214 3.419 0.115 4 0 "[ . 1]" 1
456 1 23 MET HA 1 31 LYS H 3.903 . 5.808 4.053 3.869 4.213 . 0 0 "[ . 1]" 1
457 1 23 MET QB 1 24 SER H 4.295 . 6.600 3.631 3.007 3.725 . 0 0 "[ . 1]" 1
458 1 23 MET QB 1 25 THR H 4.503 . 7.037 4.613 4.415 4.746 . 0 0 "[ . 1]" 1
459 1 23 MET QB 1 30 CYS HA 2.157 . 2.738 2.391 1.976 2.739 0.001 4 0 "[ . 1]" 1
460 1 23 MET QB 1 31 LYS H 3.629 . 5.275 2.901 2.444 3.593 . 0 0 "[ . 1]" 1
461 1 23 MET HG2 1 77 TYR QE 2.594 . 3.435 2.859 1.427 3.437 0.326 1 0 "[ . 1]" 1
462 1 24 SER H 1 24 SER HA 2.866 . 3.893 2.858 2.821 2.896 . 0 0 "[ . 1]" 1
463 1 24 SER H 1 24 SER QB 2.867 . 3.895 2.489 2.317 2.667 . 0 0 "[ . 1]" 1
464 1 24 SER H 1 25 THR H 2.477 . 3.244 2.433 2.326 2.510 . 0 0 "[ . 1]" 1
465 1 24 SER H 1 25 THR HB 3.781 . 5.568 4.491 4.385 4.578 . 0 0 "[ . 1]" 1
466 1 24 SER HA 1 25 THR H 3.174 . 4.434 3.312 3.255 3.351 . 0 0 "[ . 1]" 1
467 1 24 SER HA 1 25 THR HA 3.268 . 4.603 4.086 4.048 4.118 . 0 0 "[ . 1]" 1
468 1 24 SER HA 1 25 THR HB 3.670 . 5.353 5.538 5.498 5.591 0.238 8 0 "[ . 1]" 1
469 1 24 SER HA 1 25 THR MG 2.929 . 4.002 4.183 4.078 4.281 0.279 3 0 "[ . 1]" 1
470 1 25 THR H 1 25 THR HB 2.677 . 3.573 2.324 2.296 2.344 . 0 0 "[ . 1]" 1
471 1 25 THR H 1 25 THR MG 2.690 . 3.594 3.698 3.685 3.706 0.112 3 0 "[ . 1]" 1
472 1 25 THR H 1 28 PHE QB 4.177 . 6.357 3.901 3.784 4.007 . 0 0 "[ . 1]" 1
473 1 25 THR H 1 28 PHE QD 3.510 . 5.050 5.006 4.453 5.115 0.065 1 0 "[ . 1]" 1
474 1 25 THR H 1 29 HIS H 4.557 . 7.153 4.261 4.123 4.384 . 0 0 "[ . 1]" 1
475 1 25 THR H 1 29 HIS HA 5.086 . 8.319 5.117 4.874 5.437 . 0 0 "[ . 1]" 1
476 1 25 THR H 1 30 CYS H 5.386 . 9.012 4.831 4.725 4.964 . 0 0 "[ . 1]" 1
477 1 25 THR HA 1 25 THR MG 2.212 . 2.824 2.462 2.434 2.517 . 0 0 "[ . 1]" 1
478 1 25 THR HA 1 27 LEU H 3.718 . 5.446 3.913 3.831 4.031 . 0 0 "[ . 1]" 1
479 1 25 THR HB 1 25 THR MG 2.433 . 3.173 2.133 2.130 2.136 . 0 0 "[ . 1]" 1
480 1 25 THR HB 1 29 HIS H 3.436 . 4.912 4.201 4.088 4.305 . 0 0 "[ . 1]" 1
481 1 25 THR MG 1 28 PHE QD 2.896 . 3.945 3.877 3.587 3.974 0.029 4 0 "[ . 1]" 1
482 1 26 ASN H 1 29 HIS HA 3.483 . 4.999 4.869 4.735 5.008 0.009 3 0 "[ . 1]" 1
483 1 26 ASN HA 1 28 PHE H 3.637 . 5.290 4.059 3.851 4.201 . 0 0 "[ . 1]" 1
484 1 26 ASN HA 1 29 HIS H 2.686 . 3.588 2.918 2.735 3.051 . 0 0 "[ . 1]" 1
485 1 26 ASN HA 1 29 HIS QB 4.295 . 6.601 2.209 1.960 2.663 0.029 1 0 "[ . 1]" 1
486 1 26 ASN HA 1 30 CYS HB2 4.280 . 6.570 6.613 6.438 6.739 0.169 8 0 "[ . 1]" 1
487 1 26 ASN QB 1 27 LEU H 3.723 . 5.456 3.061 2.930 3.195 . 0 0 "[ . 1]" 1
488 1 26 ASN HD21 1 29 HIS H 3.031 . 4.179 3.855 3.637 3.990 . 0 0 "[ . 1]" 1
489 1 26 ASN HD21 1 30 CYS H 4.178 . 6.360 5.124 4.830 5.326 . 0 0 "[ . 1]" 1
490 1 26 ASN HD21 1 29 HIS QB 2.420 . 3.152 2.638 1.862 3.241 0.089 6 0 "[ . 1]" 1
491 1 26 ASN HD21 1 29 HIS QB 3.010 . 4.143 2.605 1.860 3.169 0.017 2 0 "[ . 1]" 1
492 1 27 LEU H 1 27 LEU MD2 3.233 . 4.540 4.263 4.122 4.314 . 0 0 "[ . 1]" 1
493 1 27 LEU H 1 27 LEU HG 3.006 . 4.135 4.162 4.012 4.263 0.128 4 0 "[ . 1]" 1
494 1 27 LEU H 1 28 PHE H 3.315 . 4.688 2.810 2.618 2.896 . 0 0 "[ . 1]" 1
495 1 27 LEU H 1 29 HIS H 4.138 . 6.279 3.760 3.616 3.968 . 0 0 "[ . 1]" 1
496 1 27 LEU HA 1 27 LEU MD1 2.573 . 3.400 3.476 2.239 3.813 0.413 3 0 "[ . 1]" 1
497 1 27 LEU HA 1 28 PHE H 3.347 . 4.748 3.558 3.538 3.582 . 0 0 "[ . 1]" 1
498 1 27 LEU HA 1 29 HIS H 4.360 . 6.737 4.751 4.630 5.003 . 0 0 "[ . 1]" 1
499 1 27 LEU HB2 1 28 PHE QD 2.595 . 3.437 3.033 2.627 3.316 . 0 0 "[ . 1]" 1
500 1 27 LEU HB3 1 27 LEU MD1 2.594 . 3.435 2.578 2.336 3.208 . 0 0 "[ . 1]" 1
501 1 27 LEU HB3 1 27 LEU MD2 2.010 . 2.515 2.346 2.279 2.428 . 0 0 "[ . 1]" 1
502 1 27 LEU HB3 1 28 PHE H 3.854 . 5.711 2.457 2.342 2.699 . 0 0 "[ . 1]" 1
503 1 27 LEU HB3 1 28 PHE HA 2.547 . 3.358 3.353 3.299 3.428 0.070 4 0 "[ . 1]" 1
504 1 27 LEU MD1 1 27 LEU HG 2.187 . 2.785 2.123 2.118 2.127 . 0 0 "[ . 1]" 1
505 1 27 LEU MD1 1 28 PHE H 4.436 . 6.896 4.385 4.059 4.601 . 0 0 "[ . 1]" 1
506 1 27 LEU MD1 1 28 PHE QE 2.397 . 3.115 2.721 1.939 3.209 0.094 4 0 "[ . 1]" 1
507 1 27 LEU MD2 1 28 PHE H 3.557 . 5.138 3.729 3.571 4.081 . 0 0 "[ . 1]" 1
508 1 27 LEU MD2 1 28 PHE QE 2.509 . 3.296 2.354 1.968 2.722 . 0 0 "[ . 1]" 1
509 1 27 LEU MD2 1 29 HIS H 5.195 . 8.568 5.299 5.034 5.854 . 0 0 "[ . 1]" 1
510 1 28 PHE H 1 28 PHE QB 2.903 . 3.957 2.400 2.366 2.427 . 0 0 "[ . 1]" 1
511 1 28 PHE H 1 28 PHE QD 2.203 . 2.810 2.246 2.156 2.408 . 0 0 "[ . 1]" 1
512 1 28 PHE H 1 29 HIS H 2.117 . 2.677 2.091 2.050 2.162 . 0 0 "[ . 1]" 1
513 1 28 PHE H 1 29 HIS HA 3.054 . 4.220 4.305 4.253 4.333 0.113 10 0 "[ . 1]" 1
514 1 28 PHE H 1 30 CYS H 3.688 . 5.388 4.719 4.410 4.869 . 0 0 "[ . 1]" 1
515 1 28 PHE H 1 31 LYS H 4.397 . 6.814 5.747 5.602 5.953 . 0 0 "[ . 1]" 1
516 1 28 PHE HA 1 28 PHE QD 2.321 . 2.994 3.010 2.896 3.090 0.096 10 0 "[ . 1]" 1
517 1 28 PHE QB 1 31 LYS HB2 2.169 . 2.757 2.893 2.826 2.951 0.194 1 0 "[ . 1]" 1
518 1 28 PHE QB 1 28 PHE QD 2.189 . 2.788 2.152 2.119 2.179 . 0 0 "[ . 1]" 1
519 1 28 PHE QB 1 29 HIS H 2.720 . 3.645 2.691 2.485 2.800 . 0 0 "[ . 1]" 1
520 1 28 PHE QB 1 30 CYS H 3.203 . 4.486 3.281 2.978 3.433 . 0 0 "[ . 1]" 1
521 1 28 PHE QB 1 31 LYS H 3.232 . 4.538 2.818 2.580 2.993 . 0 0 "[ . 1]" 1
522 1 28 PHE QD 1 31 LYS H 4.035 . 6.071 4.325 4.034 4.496 . 0 0 "[ . 1]" 1
523 1 28 PHE QD 1 31 LYS QE 2.050 . 2.575 2.255 1.955 2.543 . 0 0 "[ . 1]" 1
524 1 28 PHE QD 1 31 LYS HG3 2.818 . 3.811 3.259 2.809 3.407 . 0 0 "[ . 1]" 1
525 1 28 PHE QD 1 34 ASN HD22 3.281 . 4.627 4.601 4.402 4.738 0.111 4 0 "[ . 1]" 1
526 1 28 PHE QE 1 31 LYS QG 3.962 . 5.924 4.526 4.310 4.630 . 0 0 "[ . 1]" 1
527 1 28 PHE QE 1 34 ASN HB2 3.228 . 4.530 4.113 3.402 4.543 0.013 4 0 "[ . 1]" 1
528 1 28 PHE QE 1 34 ASN HB3 3.088 . 4.280 2.876 2.089 3.192 . 0 0 "[ . 1]" 1
529 1 28 PHE QE 1 34 ASN HD22 3.447 . 4.932 2.779 2.237 3.802 . 0 0 "[ . 1]" 1
530 1 28 PHE QE 1 35 THR H 4.211 . 6.427 5.278 4.971 5.773 . 0 0 "[ . 1]" 1
531 1 28 PHE QE 1 68 CYS H 3.637 . 5.291 5.069 4.661 5.307 0.016 5 0 "[ . 1]" 1
532 1 28 PHE HZ 1 34 ASN HD21 3.086 . 4.277 3.280 2.826 4.025 . 0 0 "[ . 1]" 1
533 1 28 PHE HZ 1 34 ASN HD22 2.768 . 3.725 3.748 3.514 3.830 0.105 1 0 "[ . 1]" 1
534 1 29 HIS H 1 29 HIS HA 2.262 . 2.901 2.253 2.243 2.259 . 0 0 "[ . 1]" 1
535 1 29 HIS H 1 29 HIS QB 2.977 . 3.662 2.933 2.898 2.991 . 0 0 "[ . 1]" 1
536 1 29 HIS H 1 30 CYS H 2.935 . 4.012 3.016 2.704 3.188 . 0 0 "[ . 1]" 1
537 1 29 HIS H 1 31 LYS QG 4.164 . 6.331 6.393 6.333 6.427 0.096 9 0 "[ . 1]" 1
538 1 29 HIS HA 1 29 HIS QB 2.529 . 2.708 2.223 2.162 2.359 . 0 0 "[ . 1]" 1
539 1 29 HIS HA 1 30 CYS H 2.662 . 3.548 2.547 2.430 2.748 . 0 0 "[ . 1]" 1
540 1 29 HIS HA 1 30 CYS HB2 3.101 . 4.303 4.119 3.812 4.534 0.231 8 0 "[ . 1]" 1
541 1 29 HIS QB 1 29 HIS HD2 3.004 . 4.132 2.765 2.633 2.883 . 0 0 "[ . 1]" 1
542 1 29 HIS QB 1 29 HIS HE1 3.327 . 4.711 4.428 4.389 4.488 . 0 0 "[ . 1]" 1
543 1 29 HIS QB 1 30 CYS H 3.347 . 4.747 3.988 3.942 4.034 . 0 0 "[ . 1]" 1
544 1 29 HIS QB 1 31 LYS H 3.447 . 4.932 4.304 4.131 4.428 . 0 0 "[ . 1]" 1
545 1 29 HIS HD2 1 31 LYS QB 4.165 . 6.333 4.723 3.956 5.665 . 0 0 "[ . 1]" 1
546 1 30 CYS H 1 30 CYS HA 2.570 . 3.395 2.272 2.263 2.280 . 0 0 "[ . 1]" 1
547 1 30 CYS H 1 30 CYS HB2 2.910 . 3.969 3.017 2.955 3.084 . 0 0 "[ . 1]" 1
548 1 30 CYS H 1 30 CYS HB3 3.121 . 4.338 3.664 3.458 4.013 . 0 0 "[ . 1]" 1
549 1 30 CYS H 1 31 LYS H 2.661 . 3.546 2.969 2.865 3.038 . 0 0 "[ . 1]" 1
550 1 30 CYS H 1 31 LYS QG 4.150 . 6.303 5.896 5.793 5.983 . 0 0 "[ . 1]" 1
551 1 30 CYS HA 1 30 CYS HB3 2.526 . 3.324 2.671 2.597 2.691 . 0 0 "[ . 1]" 1
552 1 30 CYS HA 1 31 LYS H 2.638 . 3.508 2.562 2.480 2.666 . 0 0 "[ . 1]" 1
553 1 30 CYS HB3 1 31 LYS H 4.039 . 6.078 4.367 4.281 4.441 . 0 0 "[ . 1]" 1
554 1 31 LYS H 1 31 LYS HA 2.486 . 3.258 2.878 2.855 2.908 . 0 0 "[ . 1]" 1
555 1 31 LYS H 1 31 LYS QB 2.490 . 3.265 2.321 2.249 2.387 . 0 0 "[ . 1]" 1
556 1 31 LYS H 1 31 LYS QD 2.342 . 3.028 1.949 1.707 2.120 . 0 0 "[ . 1]" 1
557 1 31 LYS H 1 31 LYS QG 2.633 . 3.500 3.438 3.303 3.510 0.010 9 0 "[ . 1]" 1
558 1 31 LYS H 1 32 ASP H 3.499 . 5.029 4.616 4.575 4.651 . 0 0 "[ . 1]" 1
559 1 31 LYS HA 1 31 LYS QB 2.333 . 3.013 2.170 2.158 2.182 . 0 0 "[ . 1]" 1
560 1 31 LYS HA 1 32 ASP H 2.308 . 2.974 2.385 2.304 2.483 . 0 0 "[ . 1]" 1
561 1 31 LYS QB 1 32 ASP H 2.696 . 3.605 2.790 2.594 2.887 . 0 0 "[ . 1]" 1
562 1 31 LYS QB 1 33 LYS H 3.503 . 5.037 3.595 3.325 3.718 . 0 0 "[ . 1]" 1
563 1 31 LYS QB 1 34 ASN H 4.446 . 6.916 5.570 5.285 5.703 . 0 0 "[ . 1]" 1
564 1 31 LYS QD 1 31 LYS QE 1.959 . 2.439 2.029 1.993 2.090 . 0 0 "[ . 1]" 1
565 1 31 LYS QD 1 31 LYS QZ 2.284 . 2.936 2.169 2.058 2.248 . 0 0 "[ . 1]" 1
566 1 31 LYS QD 1 32 ASP H 3.042 . 4.199 4.281 4.239 4.366 0.167 8 0 "[ . 1]" 1
567 1 31 LYS QG 1 34 ASN H 2.758 . 3.709 3.623 3.426 3.715 0.006 3 0 "[ . 1]" 1
568 1 31 LYS HG2 1 31 LYS QZ 2.892 . 3.938 2.543 1.804 3.758 0.042 6 0 "[ . 1]" 1
569 1 31 LYS HG2 1 32 ASP H 3.122 . 4.340 3.144 2.988 3.386 . 0 0 "[ . 1]" 1
570 1 31 LYS HG2 1 33 LYS H 2.550 . 3.363 2.655 2.373 2.947 . 0 0 "[ . 1]" 1
571 1 31 LYS HG2 1 33 LYS HA 2.967 . 4.067 3.400 3.159 3.684 . 0 0 "[ . 1]" 1
572 1 31 LYS HG2 1 33 LYS HA 2.765 . 3.721 2.965 2.590 3.158 . 0 0 "[ . 1]" 1
573 1 31 LYS HG2 1 34 ASN H 2.856 . 3.875 3.906 3.836 3.953 0.078 2 0 "[ . 1]" 1
574 1 31 LYS HG3 1 34 ASN HB2 2.889 . 3.932 1.883 1.788 2.120 0.058 3 0 "[ . 1]" 1
575 1 31 LYS QZ 1 32 ASP HB2 3.093 . 4.289 3.489 3.374 3.785 . 0 0 "[ . 1]" 1
576 1 31 LYS QZ 1 34 ASN HB3 2.455 . 3.208 3.069 1.611 3.559 0.351 2 0 "[ . 1]" 1
577 1 32 ASP H 1 32 ASP HA 2.661 . 3.546 2.881 2.828 2.906 . 0 0 "[ . 1]" 1
578 1 32 ASP H 1 32 ASP HB2 2.462 . 3.220 2.593 2.098 3.541 0.321 1 0 "[ . 1]" 1
579 1 32 ASP H 1 33 LYS H 2.309 . 2.975 2.119 2.037 2.202 . 0 0 "[ . 1]" 1
580 1 32 ASP H 1 70 VAL MG1 3.962 . 5.924 4.876 4.585 5.153 . 0 0 "[ . 1]" 1
581 1 32 ASP HA 1 32 ASP QB 2.239 . 2.866 2.353 2.161 2.538 . 0 0 "[ . 1]" 1
582 1 32 ASP HA 1 33 LYS H 2.626 . 3.488 3.091 3.072 3.104 . 0 0 "[ . 1]" 1
583 1 32 ASP HA 1 70 VAL H 3.596 . 5.212 3.911 3.580 4.245 . 0 0 "[ . 1]" 1
584 1 32 ASP HA 1 70 VAL MG1 2.373 . 3.077 2.801 2.325 3.107 0.030 3 0 "[ . 1]" 1
585 1 32 ASP QB 1 33 LYS HA 3.096 . 4.294 4.354 4.235 4.577 0.283 1 0 "[ . 1]" 1
586 1 32 ASP HB2 1 33 LYS H 2.697 . 3.606 2.644 2.412 3.408 . 0 0 "[ . 1]" 1
587 1 32 ASP HB3 1 70 VAL MG2 2.734 . 3.669 3.524 3.203 3.775 0.106 6 0 "[ . 1]" 1
588 1 32 ASP HB3 1 70 VAL H 3.137 . 4.367 3.714 3.062 4.153 . 0 0 "[ . 1]" 1
589 1 32 ASP HB3 1 70 VAL MG1 2.269 . 2.912 2.429 1.984 2.962 0.050 2 0 "[ . 1]" 1
590 1 33 LYS H 1 33 LYS HA 2.822 . 3.817 2.886 2.864 2.924 . 0 0 "[ . 1]" 1
591 1 33 LYS H 1 33 LYS QB 2.753 . 3.700 3.111 2.609 3.308 . 0 0 "[ . 1]" 1
592 1 33 LYS H 1 33 LYS QD 2.827 . 3.826 3.542 2.348 3.936 0.110 9 0 "[ . 1]" 1
593 1 33 LYS H 1 34 ASN HB2 4.955 . 8.025 4.531 4.405 4.648 . 0 0 "[ . 1]" 1
594 1 33 LYS H 1 70 VAL H 3.429 . 4.899 4.892 4.780 4.997 0.098 6 0 "[ . 1]" 1
595 1 33 LYS H 1 70 VAL MG1 3.484 . 5.001 4.704 4.577 4.944 . 0 0 "[ . 1]" 1
596 1 33 LYS HA 1 33 LYS QB 2.317 . 2.988 2.194 2.161 2.280 . 0 0 "[ . 1]" 1
597 1 33 LYS HA 1 33 LYS QD 2.961 . 4.057 3.618 2.512 3.806 . 0 0 "[ . 1]" 1
598 1 33 LYS HA 1 34 ASN H 2.181 . 2.776 2.224 2.190 2.342 . 0 0 "[ . 1]" 1
599 1 33 LYS HA 1 69 ASN HA 2.210 . 2.821 2.840 2.696 2.915 0.094 4 0 "[ . 1]" 1
600 1 33 LYS HA 1 70 VAL H 3.464 . 4.964 3.568 3.320 3.756 . 0 0 "[ . 1]" 1
601 1 33 LYS HA 1 77 TYR QE 4.991 . 8.105 4.582 3.696 5.449 . 0 0 "[ . 1]" 1
602 1 33 LYS QB 1 33 LYS QZ 2.786 . 3.756 3.429 3.122 3.713 . 0 0 "[ . 1]" 1
603 1 33 LYS QB 1 68 CYS H 3.872 . 5.746 4.462 3.720 5.647 . 0 0 "[ . 1]" 1
604 1 33 LYS QB 1 69 ASN H 3.724 . 5.457 4.637 4.127 5.547 0.090 2 0 "[ . 1]" 1
605 1 33 LYS QB 1 69 ASN HA 2.886 . 3.927 2.392 1.937 3.389 . 0 0 "[ . 1]" 1
606 1 33 LYS QB 1 70 VAL H 4.268 . 6.545 3.232 2.760 4.460 . 0 0 "[ . 1]" 1
607 1 33 LYS HB2 1 69 ASN HD21 3.653 . 5.321 3.880 2.910 5.115 . 0 0 "[ . 1]" 1
608 1 33 LYS HB3 1 34 ASN H 2.413 . 3.141 2.880 2.752 2.957 . 0 0 "[ . 1]" 1
609 1 33 LYS QD 1 33 LYS QE 2.006 . 2.509 2.024 1.997 2.092 . 0 0 "[ . 1]" 1
610 1 33 LYS QD 1 33 LYS QZ 2.976 . 4.083 2.195 2.109 2.297 . 0 0 "[ . 1]" 1
611 1 33 LYS QD 1 34 ASN H 3.474 . 4.983 3.746 3.384 4.637 . 0 0 "[ . 1]" 1
612 1 33 LYS QE 1 33 LYS QG 1.953 . 2.430 2.362 2.296 2.556 0.126 5 0 "[ . 1]" 1
613 1 33 LYS QG 1 69 ASN HA 3.003 . 4.130 4.014 3.257 4.242 0.112 3 0 "[ . 1]" 1
614 1 33 LYS QG 1 70 VAL H 5.205 . 8.592 4.634 3.915 5.411 . 0 0 "[ . 1]" 1
615 1 34 ASN H 1 34 ASN HA 2.545 . 3.355 2.905 2.900 2.913 . 0 0 "[ . 1]" 1
616 1 34 ASN H 1 34 ASN HB2 3.043 . 4.201 3.301 3.224 3.432 . 0 0 "[ . 1]" 1
617 1 34 ASN H 1 34 ASN HD21 5.277 . 8.757 5.021 4.483 5.266 . 0 0 "[ . 1]" 1
618 1 34 ASN H 1 67 ASP HA 3.203 . 4.486 4.287 3.887 4.592 0.106 5 0 "[ . 1]" 1
619 1 34 ASN H 1 67 ASP HA 2.835 . 3.840 3.815 3.652 3.938 0.098 5 0 "[ . 1]" 1
620 1 34 ASN H 1 67 ASP QB 4.281 . 6.572 5.140 4.445 5.579 . 0 0 "[ . 1]" 1
621 1 34 ASN H 1 68 CYS H 2.861 . 3.884 2.877 2.498 3.271 . 0 0 "[ . 1]" 1
622 1 34 ASN H 1 68 CYS HB2 3.353 . 4.759 3.603 2.286 4.787 0.028 2 0 "[ . 1]" 1
623 1 34 ASN H 1 68 CYS HB3 3.754 . 5.516 4.691 3.951 5.493 . 0 0 "[ . 1]" 1
624 1 34 ASN H 1 70 VAL H 5.186 . 8.547 5.587 5.257 5.854 . 0 0 "[ . 1]" 1
625 1 34 ASN HA 1 34 ASN HB2 2.723 . 3.650 2.507 2.447 2.552 . 0 0 "[ . 1]" 1
626 1 34 ASN HA 1 35 THR H 1.945 . 2.418 2.138 2.113 2.175 . 0 0 "[ . 1]" 1
627 1 34 ASN HB2 1 34 ASN HD22 3.536 . 5.099 3.866 3.772 4.044 . 0 0 "[ . 1]" 1
628 1 34 ASN HB2 1 35 THR H 3.304 . 4.668 4.376 4.254 4.434 . 0 0 "[ . 1]" 1
629 1 34 ASN HB3 1 34 ASN HD22 2.950 . 4.038 3.493 3.465 3.510 . 0 0 "[ . 1]" 1
630 1 34 ASN HB3 1 35 THR H 3.239 . 4.550 4.245 4.088 4.355 . 0 0 "[ . 1]" 1
631 1 35 THR H 1 35 THR HB 2.299 . 2.959 2.707 2.614 2.807 . 0 0 "[ . 1]" 1
632 1 35 THR H 1 35 THR MG 2.870 . 3.899 3.810 3.766 3.850 . 0 0 "[ . 1]" 1
633 1 35 THR H 1 36 PHE H 3.779 . 5.564 4.285 3.987 4.598 . 0 0 "[ . 1]" 1
634 1 35 THR H 1 67 ASP HA 3.942 . 5.884 4.691 4.367 5.040 . 0 0 "[ . 1]" 1
635 1 35 THR HA 1 35 THR MG 2.345 . 3.032 2.278 2.232 2.334 . 0 0 "[ . 1]" 1
636 1 35 THR HA 1 36 PHE H 2.203 . 2.809 2.191 2.129 2.315 . 0 0 "[ . 1]" 1
637 1 35 THR HA 1 36 PHE QD 2.703 . 3.616 3.506 3.471 3.530 . 0 0 "[ . 1]" 1
638 1 35 THR HA 1 66 SER H 3.759 . 5.525 4.295 4.013 4.493 . 0 0 "[ . 1]" 1
639 1 35 THR HA 1 67 ASP H 3.516 . 5.061 4.757 4.513 5.094 0.033 5 0 "[ . 1]" 1
640 1 35 THR HA 1 67 ASP HA 2.366 . 3.066 2.401 2.046 2.760 . 0 0 "[ . 1]" 1
641 1 35 THR HA 1 68 CYS H 2.907 . 3.963 3.701 3.307 4.006 0.043 4 0 "[ . 1]" 1
642 1 35 THR HB 1 35 THR MG 2.374 . 3.078 2.138 2.133 2.141 . 0 0 "[ . 1]" 1
643 1 35 THR HB 1 36 PHE H 2.790 . 3.763 3.383 3.311 3.412 . 0 0 "[ . 1]" 1
644 1 35 THR MG 1 36 PHE H 2.640 . 3.511 3.023 2.337 3.523 0.012 8 0 "[ . 1]" 1
645 1 35 THR MG 1 37 ILE H 3.084 . 4.273 3.671 3.609 3.778 . 0 0 "[ . 1]" 1
646 1 35 THR MG 1 65 LEU H 4.078 . 6.157 4.681 4.552 4.950 . 0 0 "[ . 1]" 1
647 1 35 THR MG 1 65 LEU HA 2.659 . 3.543 3.617 3.563 3.652 0.109 10 0 "[ . 1]" 1
648 1 35 THR MG 1 66 SER H 3.017 . 4.155 3.496 3.068 3.707 . 0 0 "[ . 1]" 1
649 1 35 THR MG 1 67 ASP H 4.125 . 6.252 4.001 3.743 4.486 . 0 0 "[ . 1]" 1
650 1 35 THR MG 1 67 ASP HA 2.955 . 4.047 3.071 2.808 3.483 . 0 0 "[ . 1]" 1
651 1 35 THR MG 1 68 CYS H 4.396 . 6.812 4.799 4.544 5.174 . 0 0 "[ . 1]" 1
652 1 35 THR MG 1 98 PHE QE 2.719 . 3.643 3.590 3.275 3.721 0.078 4 0 "[ . 1]" 1
653 1 35 THR MG 1 98 PHE HZ 2.374 . 3.078 2.867 2.648 2.996 . 0 0 "[ . 1]" 1
654 1 36 PHE H 1 36 PHE HB3 2.843 . 3.853 3.319 2.955 3.486 . 0 0 "[ . 1]" 1
655 1 36 PHE H 1 36 PHE QD 2.744 . 3.685 2.798 2.666 3.108 . 0 0 "[ . 1]" 1
656 1 36 PHE H 1 37 ILE H 3.203 . 4.485 4.477 4.411 4.541 0.056 2 0 "[ . 1]" 1
657 1 36 PHE H 1 65 LEU HA 4.146 . 6.295 4.871 3.999 5.265 . 0 0 "[ . 1]" 1
658 1 36 PHE H 1 65 LEU MD1 3.992 . 5.984 6.000 5.548 6.081 0.097 4 0 "[ . 1]" 1
659 1 36 PHE H 1 65 LEU MD2 4.310 . 6.632 5.223 4.545 5.413 . 0 0 "[ . 1]" 1
660 1 36 PHE H 1 66 SER H 3.208 . 4.495 3.542 2.682 3.806 . 0 0 "[ . 1]" 1
661 1 36 PHE H 1 66 SER QB 3.495 . 5.022 3.984 3.697 4.135 . 0 0 "[ . 1]" 1
662 1 36 PHE H 1 67 ASP HA 2.968 . 4.069 3.756 3.417 4.086 0.017 5 0 "[ . 1]" 1
663 1 36 PHE H 1 68 CYS H 3.759 . 5.525 4.885 4.572 5.228 . 0 0 "[ . 1]" 1
664 1 36 PHE HA 1 37 ILE H 2.330 . 3.009 2.207 2.151 2.362 . 0 0 "[ . 1]" 1
665 1 36 PHE HB2 1 36 PHE QD 2.482 . 3.252 2.556 2.496 2.589 . 0 0 "[ . 1]" 1
666 1 36 PHE HB2 1 37 ILE H 2.894 . 3.941 2.871 2.517 3.049 . 0 0 "[ . 1]" 1
667 1 36 PHE HB2 1 66 SER H 4.043 . 6.086 4.566 4.356 4.803 . 0 0 "[ . 1]" 1
668 1 36 PHE HB3 1 37 ILE H 3.482 . 4.998 3.616 3.487 3.875 . 0 0 "[ . 1]" 1
669 1 36 PHE QD 1 37 ILE H 3.480 . 4.993 4.185 2.893 4.474 . 0 0 "[ . 1]" 1
670 1 36 PHE QD 1 66 SER QB 2.615 . 3.470 2.516 2.253 2.859 . 0 0 "[ . 1]" 1
671 1 36 PHE HZ 1 66 SER QB 2.791 . 3.765 3.456 2.659 3.631 . 0 0 "[ . 1]" 1
672 1 37 ILE H 1 37 ILE HB 2.457 . 3.211 2.560 2.512 2.733 . 0 0 "[ . 1]" 1
673 1 37 ILE H 1 37 ILE MD 3.188 . 4.458 3.079 1.968 3.864 . 0 0 "[ . 1]" 1
674 1 37 ILE H 1 37 ILE HG12 4.340 . 6.695 3.768 3.553 4.118 . 0 0 "[ . 1]" 1
675 1 37 ILE H 1 38 TYR H 3.411 . 4.866 4.333 4.058 4.393 . 0 0 "[ . 1]" 1
676 1 37 ILE H 1 65 LEU MD2 4.483 . 6.995 4.223 4.105 4.374 . 0 0 "[ . 1]" 1
677 1 37 ILE HA 1 37 ILE MD 3.419 . 4.880 3.777 3.419 3.938 . 0 0 "[ . 1]" 1
678 1 37 ILE HA 1 37 ILE MG 2.451 . 3.202 2.361 2.330 2.414 . 0 0 "[ . 1]" 1
679 1 37 ILE HA 1 38 TYR H 2.249 . 2.881 2.183 2.153 2.217 . 0 0 "[ . 1]" 1
680 1 37 ILE HA 1 65 LEU HA 2.799 . 3.778 2.789 2.642 3.471 . 0 0 "[ . 1]" 1
681 1 37 ILE HA 1 65 LEU MD2 2.385 . 3.096 2.154 1.892 2.326 . 0 0 "[ . 1]" 1
682 1 37 ILE HA 1 66 SER H 3.497 . 5.026 3.956 3.663 4.927 . 0 0 "[ . 1]" 1
683 1 37 ILE HB 1 37 ILE MD 3.191 . 4.464 2.324 2.236 2.396 . 0 0 "[ . 1]" 1
684 1 37 ILE HB 1 38 TYR H 4.132 . 6.266 4.311 4.274 4.342 . 0 0 "[ . 1]" 1
685 1 37 ILE HB 1 39 SER HB2 2.950 . 4.037 4.160 3.827 4.946 0.909 3 2 "[ +-. 1]" 1
686 1 37 ILE MD 1 86 PHE QD 4.225 . 6.456 3.370 3.114 3.509 . 0 0 "[ . 1]" 1
687 1 37 ILE MD 1 86 PHE QE 3.180 . 4.444 2.930 2.682 3.475 . 0 0 "[ . 1]" 1
688 1 37 ILE MD 1 88 VAL MG1 2.178 . 2.771 2.825 2.554 2.931 0.160 4 0 "[ . 1]" 1
689 1 37 ILE MD 1 98 PHE QD 3.071 . 4.250 3.064 2.342 3.618 . 0 0 "[ . 1]" 1
690 1 37 ILE HG12 1 86 PHE HZ 2.402 . 3.123 2.326 1.825 2.728 . 0 0 "[ . 1]" 1
691 1 37 ILE HG12 1 86 PHE QD 2.680 . 3.578 3.370 3.188 3.528 . 0 0 "[ . 1]" 1
692 1 37 ILE HG13 1 38 TYR H 4.375 . 6.768 4.692 4.360 4.865 . 0 0 "[ . 1]" 1
693 1 37 ILE HG13 1 66 SER H 3.389 . 4.825 4.894 4.710 5.010 0.185 1 0 "[ . 1]" 1
694 1 37 ILE MG 1 38 TYR H 2.547 . 3.358 3.046 2.926 3.230 . 0 0 "[ . 1]" 1
695 1 37 ILE MG 1 39 SER H 3.531 . 5.089 3.207 3.073 3.594 . 0 0 "[ . 1]" 1
696 1 37 ILE MG 1 39 SER HA 3.267 . 4.601 4.117 4.011 4.227 . 0 0 "[ . 1]" 1
697 1 37 ILE MG 1 39 SER HB2 2.666 . 3.554 2.231 2.114 2.453 . 0 0 "[ . 1]" 1
698 1 37 ILE MG 1 39 SER HB3 2.595 . 3.437 3.240 2.160 3.514 0.077 7 0 "[ . 1]" 1
699 1 37 ILE MG 1 44 VAL MG2 1.950 . 2.425 2.359 2.211 2.472 0.047 1 0 "[ . 1]" 1
700 1 37 ILE MG 1 63 PHE HB2 2.759 . 3.710 3.190 2.862 3.600 . 0 0 "[ . 1]" 1
701 1 37 ILE MG 1 63 PHE QD 2.430 . 3.168 3.164 2.935 3.240 0.072 1 0 "[ . 1]" 1
702 1 37 ILE MG 1 64 TYR H 3.476 . 4.987 4.073 3.684 4.845 . 0 0 "[ . 1]" 1
703 1 37 ILE MG 1 86 PHE QE 2.540 . 3.347 2.862 2.591 3.075 . 0 0 "[ . 1]" 1
704 1 37 ILE MG 1 86 PHE HZ 2.980 . 4.090 3.089 2.757 3.338 . 0 0 "[ . 1]" 1
705 1 38 TYR H 1 38 TYR HA 2.502 . 3.284 2.910 2.904 2.921 . 0 0 "[ . 1]" 1
706 1 38 TYR H 1 38 TYR HB2 2.633 . 3.500 2.990 2.950 3.024 . 0 0 "[ . 1]" 1
707 1 38 TYR H 1 38 TYR HB3 2.638 . 3.508 2.296 2.240 2.395 . 0 0 "[ . 1]" 1
708 1 38 TYR H 1 39 SER H 3.718 . 5.446 4.047 4.007 4.174 . 0 0 "[ . 1]" 1
709 1 38 TYR H 1 39 SER HA 4.144 . 6.290 5.396 5.295 5.454 . 0 0 "[ . 1]" 1
710 1 38 TYR H 1 63 PHE HB2 4.644 . 7.340 5.861 5.627 6.068 . 0 0 "[ . 1]" 1
711 1 38 TYR H 1 63 PHE HB3 3.489 . 5.011 4.058 3.946 4.179 . 0 0 "[ . 1]" 1
712 1 38 TYR H 1 64 TYR H 4.227 . 6.460 4.639 4.428 4.951 . 0 0 "[ . 1]" 1
713 1 38 TYR H 1 64 TYR HB2 3.160 . 4.408 3.797 3.374 4.351 . 0 0 "[ . 1]" 1
714 1 38 TYR H 1 65 LEU HA 3.092 . 4.287 2.976 2.785 3.390 . 0 0 "[ . 1]" 1
715 1 38 TYR H 1 65 LEU MD1 3.998 . 5.996 5.430 5.139 5.550 . 0 0 "[ . 1]" 1
716 1 38 TYR H 1 65 LEU MD2 3.446 . 4.930 2.976 2.486 3.227 . 0 0 "[ . 1]" 1
717 1 38 TYR H 1 66 SER H 4.219 . 6.444 3.894 3.449 4.947 . 0 0 "[ . 1]" 1
718 1 38 TYR HA 1 38 TYR HB2 2.613 . 3.467 2.354 2.333 2.388 . 0 0 "[ . 1]" 1
719 1 38 TYR HA 1 38 TYR HB3 2.861 . 3.884 3.013 3.003 3.024 . 0 0 "[ . 1]" 1
720 1 38 TYR HA 1 38 TYR QD 2.402 . 3.123 2.612 2.445 2.695 . 0 0 "[ . 1]" 1
721 1 38 TYR HA 1 38 TYR QE 3.403 . 4.850 4.745 4.579 4.810 . 0 0 "[ . 1]" 1
722 1 38 TYR HA 1 39 SER H 2.322 . 2.996 2.143 2.127 2.166 . 0 0 "[ . 1]" 1
723 1 38 TYR HB2 1 38 TYR QD 2.354 . 3.047 2.351 2.318 2.379 . 0 0 "[ . 1]" 1
724 1 38 TYR HB2 1 39 SER H 3.121 . 4.338 4.374 4.361 4.391 0.053 6 0 "[ . 1]" 1
725 1 38 TYR HB3 1 38 TYR QD 2.234 . 2.858 2.260 2.242 2.274 . 0 0 "[ . 1]" 1
726 1 38 TYR HB3 1 64 TYR H 3.531 . 5.089 4.699 4.220 4.973 . 0 0 "[ . 1]" 1
727 1 38 TYR QD 1 39 SER H 3.354 . 4.761 3.739 3.632 3.862 . 0 0 "[ . 1]" 1
728 1 38 TYR QD 1 64 TYR HB2 2.334 . 3.015 2.120 1.640 2.502 0.013 1 0 "[ . 1]" 1
729 1 38 TYR QD 1 64 TYR QD 1.863 . 2.297 2.001 1.772 2.155 . 0 0 "[ . 1]" 1
730 1 38 TYR QE 1 39 SER H 4.959 . 8.033 5.265 5.121 5.352 . 0 0 "[ . 1]" 1
731 1 38 TYR QE 1 64 TYR HB3 2.817 . 3.809 3.938 3.880 4.093 0.284 6 0 "[ . 1]" 1
732 1 38 TYR QE 1 64 TYR QD 3.083 . 4.271 2.590 1.886 3.551 0.009 8 0 "[ . 1]" 1
733 1 39 SER H 1 39 SER HA 2.882 . 3.920 2.874 2.866 2.892 . 0 0 "[ . 1]" 1
734 1 39 SER H 1 39 SER HB2 3.013 . 4.148 3.023 2.907 3.457 . 0 0 "[ . 1]" 1
735 1 39 SER H 1 39 SER HB3 3.321 . 4.699 3.724 2.870 3.942 . 0 0 "[ . 1]" 1
736 1 39 SER H 1 40 ARG H 4.098 . 6.197 4.347 4.337 4.371 . 0 0 "[ . 1]" 1
737 1 39 SER H 1 44 VAL MG2 4.305 . 6.621 4.375 4.290 4.552 . 0 0 "[ . 1]" 1
738 1 39 SER H 1 44 VAL MG2 3.268 . 4.603 4.118 4.060 4.244 . 0 0 "[ . 1]" 1
739 1 39 SER HA 1 39 SER HB2 2.351 . 3.042 2.915 2.416 3.038 . 0 0 "[ . 1]" 1
740 1 39 SER HA 1 40 ARG H 2.561 . 3.381 2.496 2.364 2.555 . 0 0 "[ . 1]" 1
741 1 39 SER HB2 1 40 ARG H 4.312 . 6.636 3.568 3.444 3.805 . 0 0 "[ . 1]" 1
742 1 39 SER HB2 1 44 VAL MG2 2.819 . 3.813 2.724 2.304 3.651 . 0 0 "[ . 1]" 1
743 1 39 SER HB2 1 63 PHE QR 2.855 . 3.874 3.040 1.861 3.611 . 0 0 "[ . 1]" 1
744 1 39 SER HB3 1 40 ARG H 3.950 . 5.900 2.572 2.253 3.695 . 0 0 "[ . 1]" 1
745 1 39 SER HB3 1 44 VAL H 3.609 . 5.237 3.874 3.740 4.062 . 0 0 "[ . 1]" 1
746 1 39 SER HB3 1 63 PHE QD 2.543 . 3.351 3.077 2.642 3.447 0.096 3 0 "[ . 1]" 1
747 1 40 ARG H 1 40 ARG HA 2.752 . 3.699 2.871 2.838 2.904 . 0 0 "[ . 1]" 1
748 1 40 ARG H 1 40 ARG QB 3.214 . 4.506 2.356 2.217 2.480 . 0 0 "[ . 1]" 1
749 1 40 ARG H 1 40 ARG HD2 5.428 . 9.111 3.972 1.965 4.775 . 0 0 "[ . 1]" 1
750 1 40 ARG H 1 40 ARG QG 3.199 . 4.478 2.874 2.099 3.963 . 0 0 "[ . 1]" 1
751 1 40 ARG H 1 43 PRO HD2 4.104 . 6.210 3.676 3.181 3.998 . 0 0 "[ . 1]" 1
752 1 40 ARG H 1 43 PRO QG 4.165 . 6.334 2.780 2.435 3.063 . 0 0 "[ . 1]" 1
753 1 40 ARG HA 1 40 ARG QB 2.518 . 3.310 2.403 2.352 2.474 . 0 0 "[ . 1]" 1
754 1 40 ARG HA 1 40 ARG HD2 4.705 . 7.472 4.102 2.472 4.873 . 0 0 "[ . 1]" 1
755 1 40 ARG HA 1 41 PRO HD3 2.216 . 2.830 2.578 2.448 2.708 . 0 0 "[ . 1]" 1
756 1 40 ARG HA 1 42 GLU H 3.394 . 4.834 4.251 4.000 4.490 . 0 0 "[ . 1]" 1
757 1 40 ARG QB 1 40 ARG HD2 2.525 . 3.322 2.755 2.231 3.495 0.173 8 0 "[ . 1]" 1
758 1 40 ARG QB 1 40 ARG HD3 2.658 . 3.541 2.857 2.344 3.289 . 0 0 "[ . 1]" 1
759 1 40 ARG QB 1 42 GLU H 3.419 . 4.880 2.750 2.452 3.645 . 0 0 "[ . 1]" 1
760 1 40 ARG QB 1 43 PRO HA 3.491 . 5.014 4.825 4.549 5.016 0.002 1 0 "[ . 1]" 1
761 1 40 ARG QB 1 43 PRO HD2 2.711 . 3.630 2.091 1.864 2.207 . 0 0 "[ . 1]" 1
762 1 40 ARG QB 1 44 VAL H 3.437 . 4.914 4.573 4.443 4.706 . 0 0 "[ . 1]" 1
763 1 40 ARG HD3 1 40 ARG HE 2.617 . 3.473 2.793 2.470 2.948 . 0 0 "[ . 1]" 1
764 1 40 ARG HE 1 43 PRO QG 4.293 . 6.596 4.309 2.772 5.698 . 0 0 "[ . 1]" 1
765 1 40 ARG QG 1 42 GLU H 3.193 . 4.467 4.318 1.904 4.692 0.225 3 0 "[ . 1]" 1
766 1 41 PRO HA 1 41 PRO HG2 2.463 . 3.221 3.437 3.426 3.452 0.231 4 0 "[ . 1]" 1
767 1 41 PRO HA 1 41 PRO QB 2.294 . 2.952 2.185 2.181 2.190 . 0 0 "[ . 1]" 1
768 1 41 PRO QB 1 41 PRO HG2 1.771 . 2.163 2.050 2.041 2.055 . 0 0 "[ . 1]" 1
769 1 41 PRO QB 1 42 GLU H 2.482 . 3.252 3.156 2.981 3.314 0.062 5 0 "[ . 1]" 1
770 1 41 PRO HD2 1 42 GLU H 2.751 . 3.697 2.732 2.585 2.911 . 0 0 "[ . 1]" 1
771 1 41 PRO HD2 1 44 VAL H 3.991 . 5.982 6.024 5.950 6.081 0.099 5 0 "[ . 1]" 1
772 1 41 PRO HG2 1 42 GLU H 2.395 . 3.112 2.104 1.870 2.343 . 0 0 "[ . 1]" 1
773 1 41 PRO HG2 1 42 GLU HA 2.761 . 3.714 3.835 3.786 3.878 0.164 1 0 "[ . 1]" 1
774 1 41 PRO HG2 1 44 VAL H 4.214 . 6.433 5.083 4.845 5.254 . 0 0 "[ . 1]" 1
775 1 42 GLU H 1 42 GLU HA 2.603 . 3.450 2.800 2.779 2.833 . 0 0 "[ . 1]" 1
776 1 42 GLU H 1 42 GLU QB 2.785 . 3.755 2.396 2.115 2.566 . 0 0 "[ . 1]" 1
777 1 42 GLU H 1 43 PRO HD2 2.481 . 3.250 2.317 2.117 2.418 . 0 0 "[ . 1]" 1
778 1 42 GLU H 1 43 PRO HD3 2.833 . 3.837 2.988 2.767 3.448 . 0 0 "[ . 1]" 1
779 1 42 GLU H 1 43 PRO QG 3.010 . 4.143 4.156 3.955 4.249 0.106 1 0 "[ . 1]" 1
780 1 42 GLU H 1 44 VAL H 4.211 . 6.427 4.120 4.017 4.278 . 0 0 "[ . 1]" 1
781 1 42 GLU H 1 44 VAL HB 3.807 . 5.618 5.357 5.206 5.503 . 0 0 "[ . 1]" 1
782 1 42 GLU HA 1 42 GLU QB 2.395 . 3.112 2.368 2.318 2.462 . 0 0 "[ . 1]" 1
783 1 42 GLU HA 1 42 GLU QG 2.469 . 3.231 2.719 2.242 2.997 . 0 0 "[ . 1]" 1
784 1 42 GLU HA 1 45 LYS H 3.142 . 4.376 3.503 3.227 3.838 . 0 0 "[ . 1]" 1
785 1 42 GLU HA 1 45 LYS QB 2.346 . 3.034 2.752 2.420 2.998 . 0 0 "[ . 1]" 1
786 1 42 GLU HA 1 45 LYS QD 2.973 . 4.078 3.654 3.181 4.093 0.015 5 0 "[ . 1]" 1
787 1 42 GLU HA 1 46 ALA H 4.117 . 6.235 4.282 4.079 4.604 . 0 0 "[ . 1]" 1
788 1 43 PRO HA 1 43 PRO QB 2.156 . 2.737 2.209 2.159 2.235 . 0 0 "[ . 1]" 1
789 1 43 PRO HA 1 43 PRO QG 2.493 . 3.270 3.048 2.834 3.468 0.198 5 0 "[ . 1]" 1
790 1 43 PRO HA 1 44 VAL H 2.861 . 3.884 3.561 3.542 3.581 . 0 0 "[ . 1]" 1
791 1 43 PRO HA 1 45 LYS H 3.553 . 5.131 4.664 4.559 4.739 . 0 0 "[ . 1]" 1
792 1 43 PRO HA 1 46 ALA H 3.182 . 4.448 3.508 3.302 3.672 . 0 0 "[ . 1]" 1
793 1 43 PRO HA 1 46 ALA MB 2.306 . 2.970 2.521 2.187 2.773 . 0 0 "[ . 1]" 1
794 1 43 PRO QB 1 43 PRO HD2 2.838 . 3.845 3.088 2.881 3.536 . 0 0 "[ . 1]" 1
795 1 43 PRO QB 1 43 PRO HD3 2.919 . 3.984 3.321 2.829 3.521 . 0 0 "[ . 1]" 1
796 1 43 PRO QB 1 44 VAL H 3.342 . 4.738 2.752 2.456 3.189 . 0 0 "[ . 1]" 1
797 1 43 PRO HD2 1 43 PRO QG 2.231 . 2.853 2.211 2.180 2.228 . 0 0 "[ . 1]" 1
798 1 43 PRO HD2 1 44 VAL H 2.928 . 4.000 2.982 2.833 3.181 . 0 0 "[ . 1]" 1
799 1 43 PRO QG 1 44 VAL H 3.184 . 4.451 3.459 2.477 3.864 . 0 0 "[ . 1]" 1
800 1 44 VAL H 1 44 VAL HA 2.585 . 3.420 2.840 2.828 2.859 . 0 0 "[ . 1]" 1
801 1 44 VAL H 1 44 VAL HB 2.312 . 2.980 2.665 2.593 2.710 . 0 0 "[ . 1]" 1
802 1 44 VAL H 1 44 VAL MG1 2.736 . 3.672 3.771 3.765 3.776 0.104 4 0 "[ . 1]" 1
803 1 44 VAL H 1 44 VAL MG2 2.502 . 3.285 1.948 1.907 2.028 . 0 0 "[ . 1]" 1
804 1 44 VAL H 1 45 LYS H 2.407 . 3.131 2.597 2.533 2.665 . 0 0 "[ . 1]" 1
805 1 44 VAL H 1 46 ALA H 3.342 . 4.738 3.804 3.633 3.907 . 0 0 "[ . 1]" 1
806 1 44 VAL HA 1 44 VAL MG1 2.269 . 2.913 2.316 2.279 2.352 . 0 0 "[ . 1]" 1
807 1 44 VAL HA 1 45 LYS H 3.223 . 4.521 3.526 3.512 3.540 . 0 0 "[ . 1]" 1
808 1 44 VAL HA 1 47 ILE H 3.135 . 4.363 3.255 3.177 3.318 . 0 0 "[ . 1]" 1
809 1 44 VAL HB 1 45 LYS H 2.581 . 3.414 2.400 2.354 2.479 . 0 0 "[ . 1]" 1
810 1 44 VAL HB 1 46 ALA H 4.112 . 6.225 4.689 4.625 4.782 . 0 0 "[ . 1]" 1
811 1 44 VAL HB 1 95 PRO QG 2.524 . 3.320 3.360 3.335 3.396 0.076 10 0 "[ . 1]" 1
812 1 44 VAL MG1 1 45 LYS H 3.004 . 4.132 3.346 3.288 3.400 . 0 0 "[ . 1]" 1
813 1 44 VAL MG2 1 45 LYS H 2.959 . 4.053 3.576 3.491 3.691 . 0 0 "[ . 1]" 1
814 1 44 VAL MG2 1 86 PHE QE 3.144 . 4.379 2.992 2.878 3.089 . 0 0 "[ . 1]" 1
815 1 44 VAL MG2 1 86 PHE HZ 2.784 . 3.753 2.975 2.732 3.335 . 0 0 "[ . 1]" 1
816 1 45 LYS H 1 45 LYS QB 2.662 . 3.548 2.189 2.159 2.219 . 0 0 "[ . 1]" 1
817 1 45 LYS H 1 45 LYS QD 2.850 . 3.865 3.850 3.798 3.912 0.047 5 0 "[ . 1]" 1
818 1 45 LYS H 1 46 ALA H 2.719 . 3.643 2.596 2.536 2.664 . 0 0 "[ . 1]" 1
819 1 45 LYS HA 1 46 ALA H 3.498 . 5.027 3.477 3.469 3.495 . 0 0 "[ . 1]" 1
820 1 45 LYS HA 1 48 CYS H 2.957 . 4.050 3.654 3.526 3.752 . 0 0 "[ . 1]" 1
821 1 45 LYS HA 1 48 CYS H 3.141 . 4.374 3.359 3.131 3.432 . 0 0 "[ . 1]" 1
822 1 45 LYS HA 1 94 ALA HA 2.614 . 3.468 3.538 3.498 3.598 0.130 3 0 "[ . 1]" 1
823 1 45 LYS HA 1 94 ALA MB 3.403 . 4.851 4.784 4.700 4.857 0.006 3 0 "[ . 1]" 1
824 1 45 LYS QB 1 47 ILE H 3.656 . 5.327 4.758 4.691 4.820 . 0 0 "[ . 1]" 1
825 1 45 LYS QB 1 48 CYS H 3.443 . 4.925 3.966 2.220 4.558 . 0 0 "[ . 1]" 1
826 1 45 LYS HB3 1 46 ALA H 2.963 . 4.061 2.870 2.827 2.922 . 0 0 "[ . 1]" 1
827 1 45 LYS QG 1 46 ALA H 3.453 . 4.943 3.983 3.857 4.163 . 0 0 "[ . 1]" 1
828 1 45 LYS QG 1 48 CYS H 3.376 . 4.800 3.658 3.548 3.750 . 0 0 "[ . 1]" 1
829 1 46 ALA H 1 46 ALA HA 2.611 . 3.463 2.796 2.765 2.817 . 0 0 "[ . 1]" 1
830 1 46 ALA H 1 46 ALA MB 2.273 . 2.919 2.225 2.206 2.237 . 0 0 "[ . 1]" 1
831 1 46 ALA H 1 47 ILE H 3.142 . 4.376 2.756 2.670 2.839 . 0 0 "[ . 1]" 1
832 1 46 ALA H 1 47 ILE HA 4.009 . 6.018 5.328 5.268 5.407 . 0 0 "[ . 1]" 1
833 1 46 ALA H 1 47 ILE HB 3.729 . 5.467 5.144 4.915 5.326 . 0 0 "[ . 1]" 1
834 1 46 ALA HA 1 46 ALA MB 2.041 . 2.562 2.122 2.119 2.124 . 0 0 "[ . 1]" 1
835 1 46 ALA HA 1 48 CYS H 2.913 . 3.973 3.584 3.497 3.647 . 0 0 "[ . 1]" 1
836 1 46 ALA MB 1 47 ILE H 3.240 . 4.553 2.879 2.786 2.965 . 0 0 "[ . 1]" 1
837 1 46 ALA MB 1 48 CYS H 3.423 . 4.888 4.061 3.657 4.253 . 0 0 "[ . 1]" 1
838 1 47 ILE H 1 47 ILE HB 2.937 . 4.015 2.611 2.501 2.738 . 0 0 "[ . 1]" 1
839 1 47 ILE H 1 47 ILE MD 4.135 . 6.272 3.654 3.531 3.746 . 0 0 "[ . 1]" 1
840 1 47 ILE H 1 47 ILE HG12 2.926 . 3.996 3.272 3.161 3.419 . 0 0 "[ . 1]" 1
841 1 47 ILE H 1 47 ILE MG 2.900 . 3.951 3.785 3.771 3.795 . 0 0 "[ . 1]" 1
842 1 47 ILE H 1 48 CYS H 2.930 . 4.003 2.511 2.466 2.563 . 0 0 "[ . 1]" 1
843 1 47 ILE HA 1 47 ILE HB 2.346 . 3.034 3.028 3.025 3.034 . 0 0 "[ . 1]" 1
844 1 47 ILE HA 1 47 ILE MG 2.548 . 3.359 2.383 2.308 2.448 . 0 0 "[ . 1]" 1
845 1 47 ILE HA 1 48 CYS H 3.109 . 4.317 3.432 3.423 3.443 . 0 0 "[ . 1]" 1
846 1 47 ILE HA 1 49 LYS H 4.668 . 7.392 3.678 3.531 3.786 . 0 0 "[ . 1]" 1
847 1 47 ILE HB 1 47 ILE MG 2.039 . 2.559 2.126 2.125 2.127 . 0 0 "[ . 1]" 1
848 1 47 ILE HB 1 48 CYS H 2.383 . 3.093 2.920 2.852 2.962 . 0 0 "[ . 1]" 1
849 1 47 ILE MD 1 48 CYS H 5.178 . 8.529 4.806 4.661 4.914 . 0 0 "[ . 1]" 1
850 1 47 ILE MD 1 58 LEU H 4.025 . 6.050 5.801 5.688 6.034 . 0 0 "[ . 1]" 1
851 1 47 ILE MD 1 59 THR H 2.440 . 3.184 3.325 3.249 3.368 0.184 10 0 "[ . 1]" 1
852 1 47 ILE MD 1 59 THR HA 2.234 . 2.858 2.323 2.170 2.479 . 0 0 "[ . 1]" 1
853 1 47 ILE MD 1 59 THR HB 2.824 . 3.821 3.636 3.578 3.732 . 0 0 "[ . 1]" 1
854 1 47 ILE MD 1 60 THR H 3.102 . 4.305 3.879 3.688 4.093 . 0 0 "[ . 1]" 1
855 1 47 ILE MD 1 61 SER H 3.177 . 4.439 4.435 4.328 4.483 0.044 3 0 "[ . 1]" 1
856 1 47 ILE MD 1 86 PHE H 2.924 . 3.993 4.064 3.962 4.146 0.153 5 0 "[ . 1]" 1
857 1 47 ILE MD 1 86 PHE QD 2.728 . 3.658 3.677 3.585 3.723 0.065 10 0 "[ . 1]" 1
858 1 47 ILE MD 1 86 PHE QE 2.458 . 3.213 2.476 2.311 2.562 . 0 0 "[ . 1]" 1
859 1 47 ILE MD 1 86 PHE HZ 2.729 . 3.660 2.485 2.376 2.627 . 0 0 "[ . 1]" 1
860 1 47 ILE MD 1 87 ALA HA 3.335 . 4.726 4.757 4.608 4.819 0.093 10 0 "[ . 1]" 1
861 1 47 ILE HG13 1 60 THR H 2.607 . 3.457 3.578 3.132 3.744 0.287 4 0 "[ . 1]" 1
862 1 47 ILE HG13 1 61 SER H 3.057 . 4.225 4.097 3.949 4.276 0.051 8 0 "[ . 1]" 1
863 1 47 ILE MG 1 48 CYS H 2.828 . 3.828 3.746 3.608 3.833 0.005 9 0 "[ . 1]" 1
864 1 47 ILE MG 1 59 THR HA 2.721 . 3.646 2.567 2.231 3.035 . 0 0 "[ . 1]" 1
865 1 47 ILE MG 1 60 THR H 4.228 . 6.463 3.631 3.279 4.261 . 0 0 "[ . 1]" 1
866 1 47 ILE MG 1 61 SER H 4.205 . 6.415 5.241 4.724 5.945 . 0 0 "[ . 1]" 1
867 1 48 CYS H 1 48 CYS HA 2.551 . 3.364 2.906 2.896 2.916 . 0 0 "[ . 1]" 1
868 1 48 CYS H 1 48 CYS HB2 2.320 . 2.993 2.563 2.516 2.653 . 0 0 "[ . 1]" 1
869 1 48 CYS H 1 48 CYS HB3 2.715 . 3.636 3.591 3.578 3.615 . 0 0 "[ . 1]" 1
870 1 48 CYS H 1 49 LYS H 2.213 . 2.825 2.623 2.518 2.757 . 0 0 "[ . 1]" 1
871 1 48 CYS H 1 49 LYS QB 3.077 . 4.261 3.777 3.496 3.941 . 0 0 "[ . 1]" 1
872 1 48 CYS H 1 94 ALA MB 5.085 . 8.317 6.067 5.809 6.200 . 0 0 "[ . 1]" 1
873 1 48 CYS H 1 93 GLN HA 4.201 . 6.407 5.156 4.991 5.305 . 0 0 "[ . 1]" 1
874 1 48 CYS HA 1 51 ILE MG 2.489 . 3.263 3.089 2.923 3.219 . 0 0 "[ . 1]" 1
875 1 48 CYS HA 1 48 CYS HB3 2.954 . 4.045 2.381 2.347 2.395 . 0 0 "[ . 1]" 1
876 1 48 CYS HA 1 49 LYS H 2.775 . 3.737 3.155 3.042 3.224 . 0 0 "[ . 1]" 1
877 1 48 CYS HA 1 51 ILE H 3.758 . 5.524 4.036 3.930 4.143 . 0 0 "[ . 1]" 1
878 1 48 CYS HA 1 57 VAL H 5.186 . 8.547 6.371 6.116 6.751 . 0 0 "[ . 1]" 1
879 1 48 CYS HA 1 90 CYS HB2 2.397 . 3.115 3.195 3.132 3.242 0.127 4 0 "[ . 1]" 1
880 1 48 CYS HB2 1 94 ALA H 3.262 . 4.592 4.002 3.832 4.239 . 0 0 "[ . 1]" 1
881 1 48 CYS HB3 1 49 LYS H 3.747 . 5.502 4.461 4.401 4.527 . 0 0 "[ . 1]" 1
882 1 48 CYS HB3 1 50 GLY H 4.459 . 6.944 4.721 3.997 5.128 . 0 0 "[ . 1]" 1
883 1 48 CYS HB3 1 51 ILE H 3.872 . 5.746 4.301 4.202 4.422 . 0 0 "[ . 1]" 1
884 1 48 CYS HB3 1 90 CYS H 4.357 . 6.730 4.825 4.725 4.985 . 0 0 "[ . 1]" 1
885 1 48 CYS HB3 1 91 GLU H 4.224 . 6.455 4.521 4.325 4.674 . 0 0 "[ . 1]" 1
886 1 48 CYS HB3 1 93 GLN H 3.917 . 5.835 4.024 3.905 4.145 . 0 0 "[ . 1]" 1
887 1 48 CYS HB3 1 93 GLN HA 3.147 . 4.385 2.269 2.207 2.369 . 0 0 "[ . 1]" 1
888 1 48 CYS HB3 1 94 ALA H 3.140 . 4.373 3.376 3.185 3.672 . 0 0 "[ . 1]" 1
889 1 49 LYS H 1 49 LYS HA 2.683 . 3.583 2.817 2.800 2.831 . 0 0 "[ . 1]" 1
890 1 49 LYS H 1 49 LYS QB 2.071 . 2.607 2.231 2.204 2.259 . 0 0 "[ . 1]" 1
891 1 49 LYS H 1 49 LYS QG 2.909 . 3.967 3.983 3.956 4.036 0.069 7 0 "[ . 1]" 1
892 1 49 LYS H 1 50 GLY H 3.397 . 4.840 4.451 4.402 4.503 . 0 0 "[ . 1]" 1
893 1 49 LYS H 1 51 ILE MG 4.189 . 6.382 4.856 4.548 5.154 . 0 0 "[ . 1]" 1
894 1 49 LYS HA 1 49 LYS QB 1.853 . 2.282 2.359 2.329 2.392 0.110 7 0 "[ . 1]" 1
895 1 49 LYS HA 1 50 GLY H 2.092 . 2.639 2.140 2.124 2.155 . 0 0 "[ . 1]" 1
896 1 49 LYS HA 1 51 ILE H 3.118 . 4.333 3.437 3.298 3.565 . 0 0 "[ . 1]" 1
897 1 49 LYS HA 1 93 GLN HG2 2.949 . 4.036 2.612 2.416 2.695 . 0 0 "[ . 1]" 1
898 1 49 LYS QB 1 50 GLY H 2.874 . 3.907 3.660 3.626 3.684 . 0 0 "[ . 1]" 1
899 1 49 LYS QG 1 50 GLY H 2.659 . 3.543 3.136 2.944 3.508 . 0 0 "[ . 1]" 1
900 1 49 LYS QG 1 51 ILE H 3.644 . 5.304 4.763 4.611 5.077 . 0 0 "[ . 1]" 1
901 1 50 GLY H 1 50 GLY HA2 2.344 . 3.031 2.367 2.348 2.381 . 0 0 "[ . 1]" 1
902 1 50 GLY H 1 50 GLY HA3 2.412 . 3.139 2.930 2.916 2.936 . 0 0 "[ . 1]" 1
903 1 50 GLY H 1 51 ILE H 2.685 . 3.586 2.406 2.330 2.470 . 0 0 "[ . 1]" 1
904 1 50 GLY H 1 51 ILE HA 3.463 . 4.962 5.011 4.966 5.043 0.081 9 0 "[ . 1]" 1
905 1 50 GLY H 1 51 ILE MG 4.123 . 6.248 5.335 5.290 5.386 . 0 0 "[ . 1]" 1
906 1 50 GLY H 1 93 GLN QB 2.706 . 3.621 3.502 3.049 3.701 0.080 6 0 "[ . 1]" 1
907 1 50 GLY H 1 93 GLN HG2 3.678 . 5.369 2.377 2.080 2.728 . 0 0 "[ . 1]" 1
908 1 50 GLY H 1 93 GLN HG3 2.694 . 3.601 3.666 2.541 4.283 0.682 6 1 "[ .+ 1]" 1
909 1 50 GLY HA2 1 51 ILE H 3.060 . 4.231 3.305 3.250 3.370 . 0 0 "[ . 1]" 1
910 1 50 GLY HA3 1 51 ILE H 2.968 . 4.069 3.211 3.127 3.280 . 0 0 "[ . 1]" 1
911 1 51 ILE H 1 51 ILE HA 2.656 . 3.538 2.765 2.722 2.793 . 0 0 "[ . 1]" 1
912 1 51 ILE H 1 51 ILE HB 2.424 . 3.159 2.365 2.314 2.417 . 0 0 "[ . 1]" 1
913 1 51 ILE H 1 51 ILE HG13 3.029 . 4.176 3.559 2.654 4.037 . 0 0 "[ . 1]" 1
914 1 51 ILE H 1 51 ILE MG 2.759 . 3.711 3.723 3.702 3.750 0.039 5 0 "[ . 1]" 1
915 1 51 ILE H 1 52 ILE H 3.471 . 4.977 4.288 4.243 4.342 . 0 0 "[ . 1]" 1
916 1 51 ILE H 1 52 ILE HB 4.143 . 6.289 5.675 5.589 5.795 . 0 0 "[ . 1]" 1
917 1 51 ILE H 1 52 ILE MG 3.642 . 5.300 5.357 5.317 5.410 0.110 9 0 "[ . 1]" 1
918 1 51 ILE H 1 92 ASN HA 5.162 . 8.492 6.569 6.447 6.794 . 0 0 "[ . 1]" 1
919 1 51 ILE H 1 93 GLN H 3.973 . 5.946 4.533 4.407 4.677 . 0 0 "[ . 1]" 1
920 1 51 ILE H 1 93 GLN QB 2.916 . 3.979 3.906 3.682 4.016 0.037 2 0 "[ . 1]" 1
921 1 51 ILE H 1 93 GLN HG2 3.593 . 5.207 2.349 2.002 3.329 . 0 0 "[ . 1]" 1
922 1 51 ILE H 1 93 GLN HG3 3.052 . 4.217 3.671 2.181 4.176 . 0 0 "[ . 1]" 1
923 1 51 ILE HA 1 51 ILE HG12 2.597 . 3.440 2.836 2.401 3.073 . 0 0 "[ . 1]" 1
924 1 51 ILE HA 1 51 ILE HG13 2.726 . 3.655 3.448 2.908 3.688 0.033 2 0 "[ . 1]" 1
925 1 51 ILE HA 1 51 ILE MG 2.093 . 2.641 2.518 2.491 2.537 . 0 0 "[ . 1]" 1
926 1 51 ILE HA 1 52 ILE H 2.205 . 2.813 2.194 2.173 2.217 . 0 0 "[ . 1]" 1
927 1 51 ILE HA 1 53 ALA H 3.155 . 4.399 4.096 4.035 4.158 . 0 0 "[ . 1]" 1
928 1 51 ILE HB 1 51 ILE MG 1.847 . 2.273 2.120 2.115 2.126 . 0 0 "[ . 1]" 1
929 1 51 ILE HB 1 51 ILE MG 1.740 . 2.119 1.890 1.887 1.895 . 0 0 "[ . 1]" 1
930 1 51 ILE HB 1 52 ILE H 3.727 . 5.463 4.461 4.428 4.483 . 0 0 "[ . 1]" 1
931 1 51 ILE HB 1 92 ASN H 5.321 . 8.860 5.470 5.314 5.644 . 0 0 "[ . 1]" 1
932 1 51 ILE HB 1 93 GLN H 3.770 . 5.546 3.672 3.553 3.849 . 0 0 "[ . 1]" 1
933 1 51 ILE MD 1 55 LYS QG 2.022 . 2.533 2.511 2.357 2.605 0.072 2 0 "[ . 1]" 1
934 1 51 ILE MD 1 57 VAL H 3.841 . 5.685 4.224 3.795 4.439 . 0 0 "[ . 1]" 1
935 1 51 ILE MD 1 57 VAL MG2 2.109 . 2.665 2.189 1.576 2.522 . 0 0 "[ . 1]" 1
936 1 51 ILE MG 1 52 ILE H 2.669 . 3.560 3.200 3.169 3.219 . 0 0 "[ . 1]" 1
937 1 51 ILE MG 1 53 ALA H 2.832 . 3.835 3.519 3.438 3.565 . 0 0 "[ . 1]" 1
938 1 51 ILE MG 1 92 ASN H 3.381 . 4.810 2.680 2.566 2.797 . 0 0 "[ . 1]" 1
939 1 51 ILE MG 1 53 ALA MB 2.274 . 2.921 3.009 2.929 3.104 0.183 10 0 "[ . 1]" 1
940 1 51 ILE MG 1 54 SER H 4.279 . 6.567 5.010 4.931 5.129 . 0 0 "[ . 1]" 1
941 1 51 ILE MG 1 54 SER HA 3.021 . 4.162 3.760 3.495 3.993 . 0 0 "[ . 1]" 1
942 1 51 ILE MG 1 55 LYS H 2.906 . 3.961 2.916 2.725 3.073 . 0 0 "[ . 1]" 1
943 1 51 ILE MG 1 55 LYS QD 2.165 . 2.751 2.037 1.647 2.799 0.048 5 0 "[ . 1]" 1
944 1 51 ILE MG 1 56 ASN H 3.694 . 5.400 4.951 4.757 5.157 . 0 0 "[ . 1]" 1
945 1 51 ILE MG 1 90 CYS H 2.872 . 3.903 3.119 3.002 3.209 . 0 0 "[ . 1]" 1
946 1 51 ILE MG 1 90 CYS HA 2.743 . 3.684 3.901 3.854 3.930 0.246 10 0 "[ . 1]" 1
947 1 51 ILE MG 1 90 CYS HB2 2.610 . 3.461 1.707 1.682 1.731 0.077 7 0 "[ . 1]" 1
948 1 51 ILE MG 1 90 CYS HB3 2.456 . 3.210 3.043 2.981 3.126 . 0 0 "[ . 1]" 1
949 1 51 ILE MG 1 91 GLU H 3.249 . 4.568 2.988 2.829 3.390 . 0 0 "[ . 1]" 1
950 1 51 ILE MG 1 91 GLU HA 2.149 . 2.726 2.778 2.731 2.841 0.115 1 0 "[ . 1]" 1
951 1 51 ILE MG 1 93 GLN H 3.247 . 4.565 3.042 2.849 3.233 . 0 0 "[ . 1]" 1
952 1 51 ILE MG 1 94 ALA H 3.621 . 5.260 4.173 3.984 4.419 . 0 0 "[ . 1]" 1
953 1 52 ILE H 1 52 ILE HB 2.677 . 3.573 3.011 2.964 3.055 . 0 0 "[ . 1]" 1
954 1 52 ILE H 1 52 ILE HG12 3.399 . 4.844 4.763 4.737 4.791 . 0 0 "[ . 1]" 1
955 1 52 ILE H 1 52 ILE MG 3.170 . 4.426 1.905 1.874 1.954 0.040 7 0 "[ . 1]" 1
956 1 52 ILE H 1 53 ALA HA 3.607 . 5.233 4.609 4.578 4.652 . 0 0 "[ . 1]" 1
957 1 52 ILE H 1 53 ALA MB 2.892 . 3.938 3.976 3.941 4.014 0.076 10 0 "[ . 1]" 1
958 1 52 ILE H 1 55 LYS QD 4.099 . 6.199 4.075 3.807 4.453 . 0 0 "[ . 1]" 1
959 1 52 ILE H 1 92 ASN H 4.556 . 7.151 4.759 4.649 4.871 . 0 0 "[ . 1]" 1
960 1 52 ILE H 1 92 ASN HD21 4.170 . 6.343 6.292 6.196 6.370 0.027 8 0 "[ . 1]" 1
961 1 52 ILE HA 1 52 ILE MD 2.317 . 2.988 2.113 2.080 2.132 . 0 0 "[ . 1]" 1
962 1 52 ILE HA 1 52 ILE MG 2.457 . 3.212 3.197 3.190 3.201 . 0 0 "[ . 1]" 1
963 1 52 ILE HA 1 53 ALA H 3.812 . 5.628 3.532 3.524 3.539 . 0 0 "[ . 1]" 1
964 1 52 ILE HA 1 92 ASN H 2.533 . 3.335 2.481 2.344 2.627 . 0 0 "[ . 1]" 1
965 1 52 ILE HA 1 92 ASN HA 2.587 . 3.423 2.643 2.580 2.717 . 0 0 "[ . 1]" 1
966 1 52 ILE HA 1 93 GLN H 2.660 . 3.544 2.931 2.813 3.114 . 0 0 "[ . 1]" 1
967 1 52 ILE HB 1 52 ILE MG 1.975 . 2.463 2.123 2.121 2.127 . 0 0 "[ . 1]" 1
968 1 52 ILE HB 1 53 ALA HA 3.764 . 5.535 4.505 4.180 4.772 . 0 0 "[ . 1]" 1
969 1 52 ILE HB 1 93 GLN H 4.029 . 6.058 4.422 4.362 4.486 . 0 0 "[ . 1]" 1
970 1 52 ILE MD 1 92 ASN HA 2.391 . 3.106 2.013 1.907 2.226 . 0 0 "[ . 1]" 1
971 1 52 ILE MD 1 93 GLN HE21 3.407 . 4.858 4.171 3.775 4.509 . 0 0 "[ . 1]" 1
972 1 52 ILE HG12 1 92 ASN H 4.354 . 6.724 5.315 5.191 5.484 . 0 0 "[ . 1]" 1
973 1 52 ILE HG13 1 52 ILE MG 2.000 . 2.500 1.834 1.829 1.838 . 0 0 "[ . 1]" 1
974 1 52 ILE HG13 1 53 ALA H 2.392 . 3.107 3.236 3.207 3.311 0.204 4 0 "[ . 1]" 1
975 1 52 ILE MG 1 53 ALA HA 2.596 . 3.438 3.512 3.492 3.553 0.115 9 0 "[ . 1]" 1
976 1 52 ILE MG 1 53 ALA MB 2.004 . 2.506 2.586 2.562 2.613 0.107 8 0 "[ . 1]" 1
977 1 52 ILE MG 1 54 SER H 4.481 . 6.991 5.381 5.350 5.438 . 0 0 "[ . 1]" 1
978 1 52 ILE MG 1 92 ASN H 3.252 . 4.574 4.711 4.650 4.769 0.195 1 0 "[ . 1]" 1
979 1 53 ALA H 1 53 ALA HA 2.595 . 3.437 2.845 2.832 2.872 . 0 0 "[ . 1]" 1
980 1 53 ALA H 1 53 ALA MB 2.121 . 2.683 2.213 2.199 2.241 . 0 0 "[ . 1]" 1
981 1 53 ALA H 1 55 LYS HD2 2.422 . 3.155 2.561 2.260 3.472 0.317 9 0 "[ . 1]" 1
982 1 53 ALA H 1 93 GLN H 4.156 . 6.315 5.672 5.603 5.777 . 0 0 "[ . 1]" 1
983 1 53 ALA HA 1 53 ALA MB 2.047 . 2.571 2.130 2.127 2.133 . 0 0 "[ . 1]" 1
984 1 53 ALA HA 1 54 SER H 2.224 . 2.842 2.419 2.363 2.483 . 0 0 "[ . 1]" 1
985 1 53 ALA HA 1 54 SER HA 3.721 . 5.452 4.312 4.271 4.349 . 0 0 "[ . 1]" 1
986 1 53 ALA HA 1 91 GLU HG2 3.758 . 5.523 4.453 4.010 4.976 . 0 0 "[ . 1]" 1
987 1 53 ALA MB 1 54 SER H 2.366 . 3.066 2.443 2.299 2.667 . 0 0 "[ . 1]" 1
988 1 53 ALA MB 1 93 GLN H 4.398 . 6.816 6.180 6.123 6.272 . 0 0 "[ . 1]" 1
989 1 53 ALA MB 1 92 ASN H 4.420 . 6.863 5.275 5.231 5.403 . 0 0 "[ . 1]" 1
990 1 54 SER H 1 54 SER HA 2.592 . 3.431 2.850 2.808 2.875 . 0 0 "[ . 1]" 1
991 1 54 SER H 1 54 SER QB 2.207 . 2.816 2.733 2.358 2.889 0.073 8 0 "[ . 1]" 1
992 1 54 SER H 1 55 LYS H 3.668 . 5.349 4.302 4.256 4.391 . 0 0 "[ . 1]" 1
993 1 54 SER H 1 89 THR MG 4.391 . 6.801 5.252 4.933 5.481 . 0 0 "[ . 1]" 1
994 1 54 SER H 1 91 GLU QB 4.092 . 6.185 4.060 3.571 4.656 . 0 0 "[ . 1]" 1
995 1 54 SER H 1 91 GLU HG2 3.542 . 5.110 4.948 4.526 5.140 0.030 1 0 "[ . 1]" 1
996 1 54 SER H 1 91 GLU HG3 3.878 . 5.758 3.226 2.769 3.434 . 0 0 "[ . 1]" 1
997 1 54 SER HA 1 55 LYS H 2.042 . 2.563 2.190 2.140 2.224 . 0 0 "[ . 1]" 1
998 1 54 SER HA 1 90 CYS H 4.010 . 6.020 4.418 4.081 4.748 . 0 0 "[ . 1]" 1
999 1 54 SER HA 1 91 GLU HA 2.752 . 3.699 3.142 2.890 3.357 . 0 0 "[ . 1]" 1
1000 1 54 SER HA 1 91 GLU HG3 2.688 . 3.591 3.384 3.118 3.625 0.034 4 0 "[ . 1]" 1
1001 1 54 SER HA 1 92 ASN H 4.260 . 6.528 5.145 4.910 5.371 . 0 0 "[ . 1]" 1
1002 1 54 SER QB 1 55 LYS H 2.840 . 3.848 3.608 3.524 3.646 . 0 0 "[ . 1]" 1
1003 1 55 LYS H 1 55 LYS HA 2.644 . 3.518 2.918 2.889 2.954 . 0 0 "[ . 1]" 1
1004 1 55 LYS H 1 55 LYS QG 3.378 . 4.804 3.381 2.981 4.184 . 0 0 "[ . 1]" 1
1005 1 55 LYS H 1 56 ASN H 3.793 . 5.592 4.350 4.306 4.442 . 0 0 "[ . 1]" 1
1006 1 55 LYS H 1 57 VAL H 4.274 . 6.558 5.951 5.429 6.375 . 0 0 "[ . 1]" 1
1007 1 55 LYS H 1 89 THR MG 2.839 . 3.847 3.113 2.817 3.307 . 0 0 "[ . 1]" 1
1008 1 55 LYS H 1 90 CYS H 3.069 . 4.246 3.205 2.842 3.472 . 0 0 "[ . 1]" 1
1009 1 55 LYS H 1 90 CYS HB2 3.667 . 5.347 4.346 4.024 4.565 . 0 0 "[ . 1]" 1
1010 1 55 LYS H 1 90 CYS HB3 4.051 . 6.102 5.605 5.215 5.907 . 0 0 "[ . 1]" 1
1011 1 55 LYS H 1 91 GLU HA 3.136 . 4.365 4.172 3.876 4.378 0.013 2 0 "[ . 1]" 1
1012 1 55 LYS HA 1 55 LYS QD 2.690 . 3.595 3.541 2.917 3.731 0.136 8 0 "[ . 1]" 1
1013 1 55 LYS HA 1 56 ASN H 2.038 . 2.557 2.204 2.166 2.237 . 0 0 "[ . 1]" 1
1014 1 55 LYS HA 1 89 THR MG 3.381 . 4.810 3.495 2.882 4.250 . 0 0 "[ . 1]" 1
1015 1 55 LYS QB 1 55 LYS QE 2.085 . 2.628 2.074 1.844 2.562 . 0 0 "[ . 1]" 1
1016 1 55 LYS QB 1 56 ASN H 2.840 . 3.848 2.836 2.631 3.578 . 0 0 "[ . 1]" 1
1017 1 55 LYS QB 1 90 CYS H 4.021 . 6.042 4.100 3.193 4.781 . 0 0 "[ . 1]" 1
1018 1 55 LYS QD 1 56 ASN H 3.335 . 4.725 4.794 4.612 4.892 0.167 6 0 "[ . 1]" 1
1019 1 55 LYS QD 1 90 CYS H 4.122 . 6.246 4.744 4.204 6.135 . 0 0 "[ . 1]" 1
1020 1 55 LYS QG 1 56 ASN H 2.611 . 3.463 3.447 2.658 3.600 0.137 6 0 "[ . 1]" 1
1021 1 55 LYS QG 1 90 CYS H 5.282 . 8.769 4.595 3.830 5.715 . 0 0 "[ . 1]" 1
1022 1 56 ASN H 1 56 ASN HB2 2.426 . 3.161 2.969 2.307 3.642 0.481 3 0 "[ . 1]" 1
1023 1 56 ASN H 1 56 ASN HB3 2.652 . 3.531 2.622 2.418 3.569 0.038 5 0 "[ . 1]" 1
1024 1 56 ASN H 1 56 ASN HD21 4.253 . 6.514 4.342 2.601 4.681 . 0 0 "[ . 1]" 1
1025 1 56 ASN H 1 56 ASN HD22 5.316 . 8.849 5.212 4.151 5.807 . 0 0 "[ . 1]" 1
1026 1 56 ASN H 1 57 VAL H 3.611 . 5.241 4.160 4.012 4.306 . 0 0 "[ . 1]" 1
1027 1 56 ASN H 1 89 THR MG 4.008 . 6.016 3.847 3.331 4.588 . 0 0 "[ . 1]" 1
1028 1 56 ASN HA 1 57 VAL H 2.188 . 2.786 2.167 2.101 2.220 . 0 0 "[ . 1]" 1
1029 1 56 ASN HA 1 89 THR H 3.305 . 4.671 4.366 3.915 4.703 0.032 7 0 "[ . 1]" 1
1030 1 56 ASN HA 1 89 THR HA 2.787 . 3.758 2.159 1.770 2.536 0.046 1 0 "[ . 1]" 1
1031 1 56 ASN HA 1 89 THR MG 3.995 . 5.990 3.430 3.046 3.880 . 0 0 "[ . 1]" 1
1032 1 56 ASN HA 1 90 CYS H 2.794 . 3.770 3.516 2.970 3.793 0.023 5 0 "[ . 1]" 1
1033 1 56 ASN HA 1 99 VAL MG2 2.973 . 4.078 3.366 2.873 3.669 . 0 0 "[ . 1]" 1
1034 1 56 ASN HB2 1 56 ASN HD21 2.808 . 3.794 2.718 2.154 2.972 . 0 0 "[ . 1]" 1
1035 1 56 ASN HB2 1 56 ASN HD22 2.808 . 3.794 3.685 3.433 3.799 0.005 10 0 "[ . 1]" 1
1036 1 56 ASN HB2 1 57 VAL H 3.632 . 5.281 3.899 2.866 4.526 . 0 0 "[ . 1]" 1
1037 1 56 ASN HB3 1 56 ASN HD21 2.899 . 3.949 3.035 2.201 3.509 . 0 0 "[ . 1]" 1
1038 1 56 ASN HB3 1 56 ASN HD22 3.081 . 4.268 3.843 3.463 4.067 . 0 0 "[ . 1]" 1
1039 1 56 ASN HB3 1 57 VAL H 3.119 . 4.335 4.165 3.833 4.401 0.066 10 0 "[ . 1]" 1
1040 1 56 ASN HD21 1 57 VAL H 3.306 . 4.672 3.939 2.277 5.032 0.360 2 0 "[ . 1]" 1
1041 1 56 ASN HD21 1 99 VAL MG1 3.623 . 5.263 3.473 2.278 4.864 . 0 0 "[ . 1]" 1
1042 1 56 ASN HD21 1 99 VAL MG2 3.013 . 4.147 3.028 2.230 3.723 . 0 0 "[ . 1]" 1
1043 1 56 ASN HD22 1 99 VAL MG1 3.012 . 4.146 3.173 2.443 4.220 0.074 5 0 "[ . 1]" 1
1044 1 56 ASN HD22 1 99 VAL MG2 3.403 . 4.851 3.244 2.111 4.467 . 0 0 "[ . 1]" 1
1045 1 57 VAL H 1 57 VAL HA 2.880 . 3.917 2.937 2.932 2.945 . 0 0 "[ . 1]" 1
1046 1 57 VAL H 1 57 VAL HB 2.723 . 3.650 2.648 2.583 2.740 . 0 0 "[ . 1]" 1
1047 1 57 VAL H 1 57 VAL MG1 2.795 . 3.772 3.829 3.789 3.879 0.107 1 0 "[ . 1]" 1
1048 1 57 VAL H 1 57 VAL MG2 3.303 . 4.666 2.629 2.341 2.910 . 0 0 "[ . 1]" 1
1049 1 57 VAL H 1 58 LEU H 3.697 . 5.406 4.408 4.346 4.497 . 0 0 "[ . 1]" 1
1050 1 57 VAL H 1 87 ALA MB 3.833 . 5.669 4.058 3.836 4.499 . 0 0 "[ . 1]" 1
1051 1 57 VAL H 1 88 VAL H 2.614 . 3.468 3.003 2.614 3.331 . 0 0 "[ . 1]" 1
1052 1 57 VAL H 1 88 VAL MG2 2.897 . 3.946 3.324 3.153 3.477 . 0 0 "[ . 1]" 1
1053 1 57 VAL H 1 89 THR HA 3.072 . 4.251 3.339 3.069 3.811 . 0 0 "[ . 1]" 1
1054 1 57 VAL HA 1 57 VAL HB 2.293 . 2.950 3.014 3.006 3.020 0.070 1 0 "[ . 1]" 1
1055 1 57 VAL HA 1 57 VAL MG1 2.047 . 2.571 2.411 2.332 2.532 . 0 0 "[ . 1]" 1
1056 1 57 VAL HA 1 58 LEU H 2.139 . 2.711 2.193 2.154 2.260 . 0 0 "[ . 1]" 1
1057 1 57 VAL HB 1 58 LEU H 2.737 . 3.673 3.536 3.398 3.655 . 0 0 "[ . 1]" 1
1058 1 57 VAL HB 1 88 VAL H 3.492 . 5.016 3.961 3.624 4.435 . 0 0 "[ . 1]" 1
1059 1 57 VAL MG1 1 58 LEU H 2.484 . 3.256 2.392 2.245 2.561 . 0 0 "[ . 1]" 1
1060 1 57 VAL MG1 1 59 THR H 3.152 . 4.394 4.209 3.980 4.398 0.004 1 0 "[ . 1]" 1
1061 1 57 VAL MG1 1 60 THR H 4.427 . 6.876 4.872 4.504 5.170 . 0 0 "[ . 1]" 1
1062 1 57 VAL MG1 1 87 ALA HA 3.039 . 4.193 4.379 4.347 4.434 0.241 1 0 "[ . 1]" 1
1063 1 57 VAL MG2 1 58 LEU H 2.811 . 3.799 3.405 3.278 3.483 . 0 0 "[ . 1]" 1
1064 1 57 VAL MG2 1 90 CYS H 3.592 . 5.205 3.313 2.833 3.881 . 0 0 "[ . 1]" 1
1065 1 58 LEU H 1 58 LEU HA 2.677 . 3.573 2.924 2.906 2.938 . 0 0 "[ . 1]" 1
1066 1 58 LEU H 1 58 LEU HB2 2.420 . 3.152 2.216 2.114 2.322 . 0 0 "[ . 1]" 1
1067 1 58 LEU H 1 58 LEU HB3 2.466 . 3.226 3.182 2.996 3.274 0.048 1 0 "[ . 1]" 1
1068 1 58 LEU H 1 58 LEU QD 3.248 . 4.567 3.752 3.666 3.826 . 0 0 "[ . 1]" 1
1069 1 58 LEU H 1 59 THR H 3.738 . 5.484 4.441 4.370 4.506 . 0 0 "[ . 1]" 1
1070 1 58 LEU H 1 87 ALA HA 4.068 . 6.136 4.588 4.422 4.844 . 0 0 "[ . 1]" 1
1071 1 58 LEU HA 1 58 LEU QD 2.916 . 3.005 2.132 1.960 2.285 . 0 0 "[ . 1]" 1
1072 1 58 LEU HA 1 59 THR H 2.240 . 2.867 2.135 2.106 2.166 . 0 0 "[ . 1]" 1
1073 1 58 LEU HA 1 86 PHE QD 3.626 . 5.269 5.280 5.247 5.309 0.040 2 0 "[ . 1]" 1
1074 1 58 LEU HA 1 87 ALA H 4.084 . 6.169 4.591 4.470 4.869 . 0 0 "[ . 1]" 1
1075 1 58 LEU HA 1 87 ALA HA 2.348 . 3.037 2.299 2.183 2.448 . 0 0 "[ . 1]" 1
1076 1 58 LEU HA 1 87 ALA MB 2.425 . 3.160 3.024 2.817 3.164 0.004 1 0 "[ . 1]" 1
1077 1 58 LEU HA 1 88 VAL H 2.901 . 3.953 3.785 3.671 4.020 0.067 3 0 "[ . 1]" 1
1078 1 58 LEU HB3 1 58 LEU QD 2.288 . 2.942 2.111 2.101 2.123 . 0 0 "[ . 1]" 1
1079 1 58 LEU HB3 1 59 THR H 2.706 . 3.621 3.596 3.373 3.695 0.074 9 0 "[ . 1]" 1
1080 1 58 LEU QD 1 59 THR H 2.771 . 3.731 2.328 1.951 2.608 . 0 0 "[ . 1]" 1
1081 1 58 LEU QD 1 59 THR H 4.079 . 6.159 2.297 1.944 2.562 0.055 7 0 "[ . 1]" 1
1082 1 58 LEU QD 1 59 THR HB 2.746 . 3.689 3.606 3.282 3.752 0.063 1 0 "[ . 1]" 1
1083 1 58 LEU QD 1 86 PHE H 2.999 . 4.123 3.190 2.709 3.468 . 0 0 "[ . 1]" 1
1084 1 58 LEU QD 1 87 ALA H 2.885 . 3.926 3.548 3.361 3.879 . 0 0 "[ . 1]" 1
1085 1 58 LEU QD 1 87 ALA HA 2.531 . 3.332 3.120 2.893 3.311 . 0 0 "[ . 1]" 1
1086 1 58 LEU QD 1 102 GLY H 4.061 . 6.123 3.483 2.957 4.184 . 0 0 "[ . 1]" 1
1087 1 58 LEU QD 1 103 SER HA 2.876 . 3.850 2.523 1.726 3.064 0.116 3 0 "[ . 1]" 1
1088 1 58 LEU QD 1 103 SER HB2 2.531 . 2.702 2.671 1.991 3.336 0.634 2 2 "[ + . - 1]" 1
1089 1 58 LEU QD 1 103 SER HB3 2.624 . 3.485 2.490 1.904 3.346 . 0 0 "[ . 1]" 1
1090 1 58 LEU QD 1 104 ALA H 3.426 . 4.894 3.497 2.241 4.252 . 0 0 "[ . 1]" 1
1091 1 59 THR H 1 59 THR HA 2.714 . 3.635 2.760 2.738 2.790 . 0 0 "[ . 1]" 1
1092 1 59 THR H 1 59 THR HB 2.653 . 3.533 2.791 2.737 2.852 . 0 0 "[ . 1]" 1
1093 1 59 THR H 1 59 THR MG 2.885 . 3.925 3.673 3.634 3.690 . 0 0 "[ . 1]" 1
1094 1 59 THR H 1 61 SER H 4.093 . 6.187 5.455 5.309 5.586 . 0 0 "[ . 1]" 1
1095 1 59 THR H 1 85 LYS QG 3.682 . 5.377 4.466 4.079 4.790 . 0 0 "[ . 1]" 1
1096 1 59 THR H 1 86 PHE H 2.855 . 3.874 2.865 2.568 3.151 . 0 0 "[ . 1]" 1
1097 1 59 THR H 1 86 PHE HA 4.200 . 6.405 4.532 4.463 4.729 . 0 0 "[ . 1]" 1
1098 1 59 THR H 1 86 PHE QD 4.465 . 6.958 4.490 4.438 4.571 . 0 0 "[ . 1]" 1
1099 1 59 THR H 1 87 ALA HA 2.896 . 3.944 3.296 3.073 3.611 . 0 0 "[ . 1]" 1
1100 1 59 THR H 1 87 ALA MB 3.262 . 4.592 4.323 4.162 4.490 . 0 0 "[ . 1]" 1
1101 1 59 THR HA 1 60 THR H 2.221 . 2.837 2.172 2.150 2.200 . 0 0 "[ . 1]" 1
1102 1 59 THR HA 1 61 SER H 2.651 . 3.529 3.586 3.533 3.640 0.111 3 0 "[ . 1]" 1
1103 1 59 THR HA 1 86 PHE H 3.470 . 4.975 4.392 4.319 4.500 . 0 0 "[ . 1]" 1
1104 1 59 THR HB 1 59 THR MG 2.403 . 3.125 2.130 2.127 2.135 . 0 0 "[ . 1]" 1
1105 1 59 THR MG 1 63 PHE QR 2.436 . 3.178 1.794 1.758 1.855 . 0 0 "[ . 1]" 1
1106 1 59 THR MG 1 86 PHE QD 2.730 . 3.662 3.680 3.641 3.705 0.043 6 0 "[ . 1]" 1
1107 1 60 THR H 1 60 THR HA 2.960 . 4.055 2.893 2.869 2.917 . 0 0 "[ . 1]" 1
1108 1 60 THR H 1 60 THR HB 3.164 . 4.415 2.836 2.577 3.418 . 0 0 "[ . 1]" 1
1109 1 60 THR H 1 85 LYS HA 4.027 . 6.054 6.000 5.921 6.103 0.049 6 0 "[ . 1]" 1
1110 1 60 THR HA 1 60 THR HB 2.350 . 3.040 2.953 2.720 3.026 . 0 0 "[ . 1]" 1
1111 1 60 THR HA 1 60 THR MG 2.354 . 3.046 2.253 2.152 2.328 . 0 0 "[ . 1]" 1
1112 1 60 THR HA 1 61 SER HA 3.456 . 4.949 4.556 4.519 4.596 . 0 0 "[ . 1]" 1
1113 1 60 THR HB 1 60 THR MG 2.324 . 2.999 2.136 2.134 2.140 . 0 0 "[ . 1]" 1
1114 1 60 THR HB 1 61 SER H 2.657 . 3.539 3.300 3.107 3.633 0.094 8 0 "[ . 1]" 1
1115 1 60 THR MG 1 85 LYS H 4.112 . 6.225 5.881 5.553 6.242 0.017 1 0 "[ . 1]" 1
1116 1 61 SER H 1 61 SER QB 2.457 . 3.212 2.588 2.366 3.050 . 0 0 "[ . 1]" 1
1117 1 61 SER H 1 62 GLU H 3.473 . 4.981 4.480 4.454 4.530 . 0 0 "[ . 1]" 1
1118 1 61 SER H 1 63 PHE QE 2.273 . 2.919 3.030 2.977 3.088 0.169 8 0 "[ . 1]" 1
1119 1 61 SER H 1 85 LYS HA 3.374 . 4.797 4.808 4.698 4.873 0.076 5 0 "[ . 1]" 1
1120 1 61 SER HA 1 62 GLU H 2.332 . 3.012 2.479 2.379 2.563 . 0 0 "[ . 1]" 1
1121 1 61 SER QB 1 62 GLU H 2.626 . 3.488 2.620 2.248 3.332 . 0 0 "[ . 1]" 1
1122 1 62 GLU H 1 62 GLU HB2 2.574 . 3.402 3.107 2.411 3.693 0.291 3 0 "[ . 1]" 1
1123 1 62 GLU H 1 62 GLU HB3 2.919 . 3.984 3.379 2.884 3.772 . 0 0 "[ . 1]" 1
1124 1 62 GLU H 1 62 GLU HG2 2.767 . 3.724 3.037 1.947 4.114 0.390 7 0 "[ . 1]" 1
1125 1 62 GLU H 1 62 GLU HG3 3.377 . 4.803 3.106 2.700 3.797 . 0 0 "[ . 1]" 1
1126 1 62 GLU H 1 84 ASN HA 3.878 . 5.758 5.674 5.280 5.854 0.096 7 0 "[ . 1]" 1
1127 1 62 GLU H 1 85 LYS H 3.787 . 5.580 4.810 4.220 5.388 . 0 0 "[ . 1]" 1
1128 1 62 GLU HA 1 62 GLU HB2 2.514 . 3.304 2.767 2.449 3.025 . 0 0 "[ . 1]" 1
1129 1 62 GLU HA 1 62 GLU HB3 2.455 . 3.209 2.422 2.345 2.501 . 0 0 "[ . 1]" 1
1130 1 62 GLU HA 1 63 PHE H 2.338 . 3.021 2.110 2.063 2.153 . 0 0 "[ . 1]" 1
1131 1 62 GLU HA 1 63 PHE QD 2.602 . 3.448 3.139 3.029 3.325 . 0 0 "[ . 1]" 1
1132 1 62 GLU HA 1 83 THR MG 2.897 . 3.946 3.869 3.662 4.004 0.058 4 0 "[ . 1]" 1
1133 1 62 GLU HA 1 84 ASN H 3.233 . 4.540 3.871 3.659 4.098 . 0 0 "[ . 1]" 1
1134 1 62 GLU HA 1 85 LYS H 4.035 . 6.070 3.549 3.428 3.727 . 0 0 "[ . 1]" 1
1135 1 62 GLU HA 1 85 LYS HA 2.571 . 3.398 2.817 2.619 3.119 . 0 0 "[ . 1]" 1
1136 1 62 GLU HB2 1 63 PHE H 3.361 . 4.773 3.743 3.144 4.325 . 0 0 "[ . 1]" 1
1137 1 62 GLU HB2 1 84 ASN H 3.722 . 5.453 4.072 3.031 5.344 . 0 0 "[ . 1]" 1
1138 1 62 GLU HB3 1 62 GLU HG3 2.651 . 3.530 2.851 2.528 3.009 . 0 0 "[ . 1]" 1
1139 1 62 GLU HB3 1 63 PHE H 2.866 . 3.893 3.720 3.184 4.168 0.275 3 0 "[ . 1]" 1
1140 1 62 GLU HB3 1 84 ASN H 3.136 . 4.365 3.918 3.068 4.548 0.183 3 0 "[ . 1]" 1
1141 1 62 GLU HG2 1 63 PHE H 3.309 . 4.677 4.571 4.282 5.185 0.508 8 2 "[ . + -]" 1
1142 1 62 GLU HG2 1 84 ASN H 4.348 . 6.712 4.975 4.282 5.699 . 0 0 "[ . 1]" 1
1143 1 62 GLU HG3 1 63 PHE H 3.601 . 5.222 5.029 4.626 5.345 0.123 5 0 "[ . 1]" 1
1144 1 62 GLU HG3 1 84 ASN H 4.303 . 6.617 5.609 4.988 6.327 . 0 0 "[ . 1]" 1
1145 1 62 GLU HG3 1 85 LYS H 4.068 . 6.137 5.311 4.141 6.601 0.464 10 0 "[ . 1]" 1
1146 1 63 PHE H 1 63 PHE HA 2.931 . 4.005 2.939 2.932 2.946 . 0 0 "[ . 1]" 1
1147 1 63 PHE H 1 63 PHE HB2 3.310 . 4.679 2.428 2.374 2.507 . 0 0 "[ . 1]" 1
1148 1 63 PHE H 1 63 PHE HB3 2.880 . 3.917 3.647 3.615 3.692 . 0 0 "[ . 1]" 1
1149 1 63 PHE H 1 63 PHE QD 2.809 . 3.795 2.565 2.437 2.780 . 0 0 "[ . 1]" 1
1150 1 63 PHE H 1 64 TYR H 3.887 . 5.775 4.508 4.477 4.537 . 0 0 "[ . 1]" 1
1151 1 63 PHE H 1 65 LEU QB 4.659 . 7.372 5.419 5.310 5.529 . 0 0 "[ . 1]" 1
1152 1 63 PHE H 1 65 LEU MD1 3.031 . 4.179 3.169 2.992 3.221 . 0 0 "[ . 1]" 1
1153 1 63 PHE H 1 65 LEU MD2 4.065 . 6.131 3.710 3.427 4.179 . 0 0 "[ . 1]" 1
1154 1 63 PHE H 1 83 THR HA 3.574 . 5.171 4.265 4.026 4.497 . 0 0 "[ . 1]" 1
1155 1 63 PHE H 1 84 ASN H 2.700 . 3.611 2.907 2.708 3.204 . 0 0 "[ . 1]" 1
1156 1 63 PHE H 1 84 ASN HA 3.794 . 5.594 4.148 3.827 4.370 . 0 0 "[ . 1]" 1
1157 1 63 PHE H 1 84 ASN HD21 5.474 . 9.220 4.796 4.607 4.968 . 0 0 "[ . 1]" 1
1158 1 63 PHE H 1 85 LYS HA 3.195 . 4.471 3.355 3.209 3.691 . 0 0 "[ . 1]" 1
1159 1 63 PHE H 1 85 LYS QB 4.447 . 6.919 4.892 4.578 5.577 . 0 0 "[ . 1]" 1
1160 1 63 PHE H 1 86 PHE QD 4.176 . 6.356 3.759 3.553 4.055 . 0 0 "[ . 1]" 1
1161 1 63 PHE H 1 86 PHE QE 4.250 . 6.508 4.112 3.770 4.616 . 0 0 "[ . 1]" 1
1162 1 63 PHE HA 1 63 PHE QD 2.523 . 3.319 3.093 3.051 3.113 . 0 0 "[ . 1]" 1
1163 1 63 PHE HA 1 63 PHE QR 2.791 . 3.765 3.048 3.006 3.068 . 0 0 "[ . 1]" 1
1164 1 63 PHE HA 1 64 TYR H 2.157 . 2.738 2.406 2.321 2.481 . 0 0 "[ . 1]" 1
1165 1 63 PHE HA 1 65 LEU MD2 2.997 . 4.120 4.270 4.254 4.289 0.169 7 0 "[ . 1]" 1
1166 1 63 PHE HA 1 84 ASN H 4.176 . 6.356 4.726 4.597 4.873 . 0 0 "[ . 1]" 1
1167 1 63 PHE HB2 1 63 PHE QD 2.349 . 3.039 2.526 2.499 2.560 . 0 0 "[ . 1]" 1
1168 1 63 PHE HB2 1 64 TYR H 2.833 . 3.836 3.736 3.617 3.851 0.015 1 0 "[ . 1]" 1
1169 1 63 PHE HB2 1 84 ASN H 5.175 . 8.523 4.412 4.304 4.585 . 0 0 "[ . 1]" 1
1170 1 63 PHE HB2 1 86 PHE QD 3.286 . 4.636 2.863 2.645 2.999 . 0 0 "[ . 1]" 1
1171 1 63 PHE HB2 1 86 PHE QE 2.872 . 3.903 2.182 1.966 2.454 . 0 0 "[ . 1]" 1
1172 1 63 PHE HB3 1 63 PHE QD 2.353 . 3.045 2.283 2.274 2.291 . 0 0 "[ . 1]" 1
1173 1 63 PHE HB3 1 64 TYR H 2.421 . 3.154 2.425 2.295 2.567 . 0 0 "[ . 1]" 1
1174 1 63 PHE HB3 1 65 LEU MD2 3.031 . 4.179 2.598 2.251 2.853 . 0 0 "[ . 1]" 1
1175 1 63 PHE HB3 1 84 ASN H 4.007 . 6.014 4.962 4.876 5.038 . 0 0 "[ . 1]" 1
1176 1 63 PHE HB3 1 86 PHE QE 2.422 . 3.155 3.165 3.117 3.203 0.048 6 0 "[ . 1]" 1
1177 1 63 PHE QR 1 86 PHE HZ 3.261 . 4.590 3.870 3.731 4.063 . 0 0 "[ . 1]" 1
1178 1 63 PHE QR 1 65 LEU H 4.171 . 6.346 6.396 6.375 6.448 0.102 4 0 "[ . 1]" 1
1179 1 63 PHE QD 1 64 TYR H 3.036 . 4.188 3.587 3.363 3.768 . 0 0 "[ . 1]" 1
1180 1 63 PHE QD 1 64 TYR H 2.912 . 3.972 2.822 2.355 3.092 . 0 0 "[ . 1]" 1
1181 1 63 PHE QD 1 84 ASN H 4.004 . 6.008 4.682 4.383 5.012 . 0 0 "[ . 1]" 1
1182 1 63 PHE QD 1 85 LYS HA 3.032 . 4.181 3.555 3.164 3.932 . 0 0 "[ . 1]" 1
1183 1 63 PHE QD 1 86 PHE QD 2.793 . 3.768 3.796 3.696 3.831 0.063 6 0 "[ . 1]" 1
1184 1 63 PHE QD 1 86 PHE QE 2.660 . 3.545 2.894 2.751 3.010 . 0 0 "[ . 1]" 1
1185 1 64 TYR H 1 64 TYR HB2 2.450 . 3.200 2.440 2.275 2.523 . 0 0 "[ . 1]" 1
1186 1 64 TYR H 1 64 TYR QE 3.338 . 4.731 4.614 4.459 4.754 0.023 7 0 "[ . 1]" 1
1187 1 64 TYR H 1 65 LEU H 4.094 . 6.189 4.279 4.267 4.307 . 0 0 "[ . 1]" 1
1188 1 64 TYR H 1 65 LEU MD2 4.138 . 6.278 3.650 3.592 3.725 . 0 0 "[ . 1]" 1
1189 1 64 TYR H 1 83 THR HA 4.378 . 6.774 4.645 4.538 4.720 . 0 0 "[ . 1]" 1
1190 1 64 TYR H 1 83 THR MG 4.053 . 6.107 3.710 3.587 3.788 . 0 0 "[ . 1]" 1
1191 1 64 TYR HA 1 64 TYR QD 2.556 . 3.372 2.224 1.963 2.640 . 0 0 "[ . 1]" 1
1192 1 64 TYR HA 1 65 LEU H 2.250 . 2.883 2.128 2.103 2.146 . 0 0 "[ . 1]" 1
1193 1 64 TYR HA 1 82 SER H 3.355 . 4.762 4.745 4.582 4.826 0.064 3 0 "[ . 1]" 1
1194 1 64 TYR HA 1 83 THR HA 2.392 . 3.107 2.657 2.445 2.817 . 0 0 "[ . 1]" 1
1195 1 64 TYR HA 1 83 THR MG 2.561 . 3.381 2.881 2.719 2.989 . 0 0 "[ . 1]" 1
1196 1 64 TYR HB2 1 64 TYR QD 2.524 . 3.320 2.427 2.261 2.762 . 0 0 "[ . 1]" 1
1197 1 64 TYR HB2 1 65 LEU H 3.212 . 4.501 4.405 4.350 4.490 . 0 0 "[ . 1]" 1
1198 1 64 TYR HB3 1 64 TYR QD 2.574 . 3.402 2.640 2.330 2.771 . 0 0 "[ . 1]" 1
1199 1 64 TYR HB3 1 65 LEU H 3.229 . 4.533 3.745 3.731 3.763 . 0 0 "[ . 1]" 1
1200 1 64 TYR QD 1 65 LEU H 3.393 . 4.832 4.115 3.924 4.477 . 0 0 "[ . 1]" 1
1201 1 64 TYR QD 1 83 THR HA 2.804 . 3.787 3.521 3.175 3.870 0.083 4 0 "[ . 1]" 1
1202 1 64 TYR QD 1 83 THR MG 2.787 . 3.758 2.415 1.793 3.233 0.023 8 0 "[ . 1]" 1
1203 1 64 TYR QE 1 83 THR MG 2.501 . 3.283 2.716 2.303 3.258 . 0 0 "[ . 1]" 1
1204 1 65 LEU H 1 65 LEU HA 2.570 . 3.396 2.940 2.934 2.944 . 0 0 "[ . 1]" 1
1205 1 65 LEU H 1 65 LEU QB 2.353 . 3.045 2.642 2.573 2.746 . 0 0 "[ . 1]" 1
1206 1 65 LEU H 1 65 LEU MD1 2.677 . 3.573 3.644 3.583 3.689 0.116 6 0 "[ . 1]" 1
1207 1 65 LEU H 1 65 LEU MD2 3.228 . 4.530 3.302 3.224 3.509 . 0 0 "[ . 1]" 1
1208 1 65 LEU H 1 65 LEU HG 2.974 . 4.080 2.622 2.531 2.694 . 0 0 "[ . 1]" 1
1209 1 65 LEU H 1 66 SER H 3.073 . 4.253 4.309 4.266 4.362 0.109 8 0 "[ . 1]" 1
1210 1 65 LEU H 1 66 SER QB 4.682 . 7.422 5.073 4.643 5.226 . 0 0 "[ . 1]" 1
1211 1 65 LEU H 1 81 LYS QB 4.141 . 6.284 5.436 4.894 6.176 . 0 0 "[ . 1]" 1
1212 1 65 LEU H 1 82 SER H 2.777 . 3.741 3.362 3.252 3.489 . 0 0 "[ . 1]" 1
1213 1 65 LEU H 1 83 THR HA 2.776 . 3.739 2.828 2.489 2.978 . 0 0 "[ . 1]" 1
1214 1 65 LEU HA 1 65 LEU QB 2.604 . 3.451 2.295 2.281 2.306 . 0 0 "[ . 1]" 1
1215 1 65 LEU HA 1 65 LEU MD2 2.332 . 3.012 2.117 2.054 2.236 . 0 0 "[ . 1]" 1
1216 1 65 LEU HA 1 65 LEU HG 2.475 . 3.241 3.341 3.287 3.370 0.129 8 0 "[ . 1]" 1
1217 1 65 LEU HA 1 66 SER H 2.264 . 2.905 2.151 2.133 2.186 . 0 0 "[ . 1]" 1
1218 1 65 LEU QB 1 65 LEU MD1 2.249 . 2.881 2.088 2.079 2.100 . 0 0 "[ . 1]" 1
1219 1 65 LEU QB 1 65 LEU MD2 2.193 . 2.794 2.395 2.331 2.428 . 0 0 "[ . 1]" 1
1220 1 65 LEU QB 1 65 LEU HG 2.458 . 3.213 2.317 2.298 2.363 . 0 0 "[ . 1]" 1
1221 1 65 LEU QB 1 66 SER H 3.069 . 4.247 3.204 3.037 3.322 . 0 0 "[ . 1]" 1
1222 1 65 LEU QB 1 82 SER H 3.132 . 4.358 3.830 3.556 4.116 . 0 0 "[ . 1]" 1
1223 1 65 LEU QB 1 82 SER QB 2.764 . 3.719 3.112 2.704 3.658 . 0 0 "[ . 1]" 1
1224 1 65 LEU QB 1 83 THR HA 3.048 . 4.209 4.237 4.018 4.319 0.110 9 0 "[ . 1]" 1
1225 1 65 LEU QB 1 84 ASN H 3.123 . 4.342 3.828 3.545 3.937 . 0 0 "[ . 1]" 1
1226 1 65 LEU MD1 1 82 SER HB2 2.934 . 4.010 3.798 3.590 4.005 . 0 0 "[ . 1]" 1
1227 1 65 LEU MD1 1 65 LEU HG 1.857 . 2.288 2.124 2.122 2.128 . 0 0 "[ . 1]" 1
1228 1 65 LEU MD1 1 66 SER H 3.446 . 4.931 4.473 4.297 4.623 . 0 0 "[ . 1]" 1
1229 1 65 LEU MD1 1 82 SER H 3.507 . 5.044 4.693 4.544 4.852 . 0 0 "[ . 1]" 1
1230 1 65 LEU MD1 1 84 ASN H 2.526 . 3.324 2.764 2.629 2.803 . 0 0 "[ . 1]" 1
1231 1 65 LEU MD1 1 85 LYS H 3.092 . 4.287 4.180 3.883 4.323 0.036 2 0 "[ . 1]" 1
1232 1 65 LEU MD1 1 84 ASN HB3 2.752 . 3.698 2.644 2.062 4.119 0.421 4 0 "[ . 1]" 1
1233 1 65 LEU MD1 1 84 ASN HD21 3.618 . 5.254 3.429 2.729 3.950 . 0 0 "[ . 1]" 1
1234 1 65 LEU MD1 1 84 ASN HD22 4.244 . 6.495 4.657 2.173 5.397 . 0 0 "[ . 1]" 1
1235 1 65 LEU MD1 1 86 PHE H 2.961 . 4.057 3.943 3.740 4.062 0.005 10 0 "[ . 1]" 1
1236 1 65 LEU MD1 1 86 PHE HB2 2.584 . 3.419 3.481 3.448 3.545 0.126 6 0 "[ . 1]" 1
1237 1 65 LEU MD1 1 86 PHE QD 2.545 . 3.355 1.870 1.720 2.090 0.015 8 0 "[ . 1]" 1
1238 1 65 LEU MD2 1 66 SER H 2.920 . 3.986 3.897 3.819 3.987 0.001 1 0 "[ . 1]" 1
1239 1 65 LEU MD2 1 84 ASN H 3.696 . 5.404 4.145 3.798 4.551 . 0 0 "[ . 1]" 1
1240 1 65 LEU MD2 1 86 PHE QD 2.427 . 3.163 2.528 2.171 2.833 . 0 0 "[ . 1]" 1
1241 1 65 LEU MD2 1 86 PHE QE 2.497 . 3.277 2.795 2.639 3.012 . 0 0 "[ . 1]" 1
1242 1 65 LEU MD2 1 87 ALA H 3.932 . 5.865 4.712 4.517 4.961 . 0 0 "[ . 1]" 1
1243 1 66 SER H 1 66 SER HA 2.963 . 4.060 2.941 2.933 2.948 . 0 0 "[ . 1]" 1
1244 1 66 SER H 1 66 SER QB 3.050 . 3.879 2.656 2.595 2.734 . 0 0 "[ . 1]" 1
1245 1 66 SER HA 1 66 SER QB 2.983 . 4.096 2.316 2.265 2.472 . 0 0 "[ . 1]" 1
1246 1 66 SER HA 1 67 ASP H 2.100 . 2.651 2.141 2.105 2.184 . 0 0 "[ . 1]" 1
1247 1 66 SER HA 1 79 LEU QD 2.918 . 3.982 3.575 3.231 4.093 0.111 1 0 "[ . 1]" 1
1248 1 66 SER HA 1 80 LYS H 3.493 . 5.018 4.602 4.448 4.825 . 0 0 "[ . 1]" 1
1249 1 66 SER HA 1 81 LYS QG 3.741 . 4.340 3.209 2.809 3.792 . 0 0 "[ . 1]" 1
1250 1 66 SER HA 1 82 SER H 2.626 . 3.488 3.062 2.695 3.230 . 0 0 "[ . 1]" 1
1251 1 66 SER QB 1 67 ASP H 3.119 . 4.335 3.325 3.104 3.431 . 0 0 "[ . 1]" 1
1252 1 66 SER QB 1 79 LEU QD 2.507 . 3.292 2.077 1.696 2.519 0.026 6 0 "[ . 1]" 1
1253 1 66 SER QB 1 80 LYS H 5.288 . 8.783 4.387 4.120 4.586 . 0 0 "[ . 1]" 1
1254 1 66 SER QB 1 81 LYS QG 2.173 . 2.763 2.705 2.604 2.790 0.027 6 0 "[ . 1]" 1
1255 1 67 ASP H 1 67 ASP QB 2.443 . 3.189 2.453 2.244 2.569 . 0 0 "[ . 1]" 1
1256 1 67 ASP H 1 68 CYS H 3.708 . 5.426 4.356 4.155 4.450 . 0 0 "[ . 1]" 1
1257 1 67 ASP H 1 68 CYS HB2 4.141 . 6.285 6.091 5.624 6.361 0.076 2 0 "[ . 1]" 1
1258 1 67 ASP H 1 69 ASN HD22 4.655 . 7.363 5.647 5.302 6.171 . 0 0 "[ . 1]" 1
1259 1 67 ASP H 1 79 LEU HA 4.015 . 6.030 4.959 4.630 5.068 . 0 0 "[ . 1]" 1
1260 1 67 ASP H 1 79 LEU QD 2.881 . 3.919 3.508 3.312 3.815 . 0 0 "[ . 1]" 1
1261 1 67 ASP H 1 79 LEU HG 3.971 . 5.943 5.837 4.637 6.004 0.061 1 0 "[ . 1]" 1
1262 1 67 ASP H 1 80 LYS HB3 3.523 . 5.074 3.131 2.758 3.616 . 0 0 "[ . 1]" 1
1263 1 67 ASP H 1 81 LYS HA 2.768 . 3.726 3.382 3.065 3.811 0.085 1 0 "[ . 1]" 1
1264 1 67 ASP H 1 81 LYS QG 3.773 . 5.552 4.453 4.265 4.863 . 0 0 "[ . 1]" 1
1265 1 67 ASP H 1 82 SER H 3.939 . 5.879 4.292 3.910 4.707 . 0 0 "[ . 1]" 1
1266 1 67 ASP H 1 82 SER QB 3.437 . 4.914 4.905 4.717 5.026 0.112 8 0 "[ . 1]" 1
1267 1 67 ASP HA 1 68 CYS H 2.185 . 2.782 2.147 2.106 2.232 . 0 0 "[ . 1]" 1
1268 1 67 ASP HA 1 80 LYS H 3.460 . 4.956 4.844 4.717 4.943 . 0 0 "[ . 1]" 1
1269 1 67 ASP QB 1 68 CYS H 3.859 . 4.299 3.512 3.220 3.848 . 0 0 "[ . 1]" 1
1270 1 67 ASP QB 1 69 ASN HD21 3.826 . 5.656 3.120 1.937 3.697 0.062 5 0 "[ . 1]" 1
1271 1 67 ASP QB 1 69 ASN HD22 3.747 . 5.110 2.753 1.934 3.884 0.058 5 0 "[ . 1]" 1
1272 1 67 ASP QB 1 80 LYS H 3.417 . 4.877 3.966 3.282 4.340 . 0 0 "[ . 1]" 1
1273 1 68 CYS H 1 68 CYS HA 2.936 . 4.013 2.943 2.921 2.955 . 0 0 "[ . 1]" 1
1274 1 68 CYS H 1 68 CYS HB2 2.812 . 3.801 2.888 2.345 3.678 . 0 0 "[ . 1]" 1
1275 1 68 CYS H 1 68 CYS HB3 2.981 . 4.091 3.549 3.239 3.744 . 0 0 "[ . 1]" 1
1276 1 68 CYS H 1 69 ASN H 3.179 . 4.442 4.111 4.028 4.221 . 0 0 "[ . 1]" 1
1277 1 68 CYS HA 1 68 CYS HB2 2.974 . 4.080 2.886 2.555 3.018 . 0 0 "[ . 1]" 1
1278 1 68 CYS HA 1 69 ASN H 2.219 . 2.834 2.167 2.109 2.238 . 0 0 "[ . 1]" 1
1279 1 68 CYS HA 1 69 ASN HA 3.119 . 4.335 4.404 4.357 4.434 0.099 6 0 "[ . 1]" 1
1280 1 68 CYS HA 1 77 TYR HB2 3.309 . 4.678 3.699 3.200 4.269 . 0 0 "[ . 1]" 1
1281 1 68 CYS HA 1 77 TYR QE 4.214 . 6.434 5.026 4.002 5.670 . 0 0 "[ . 1]" 1
1282 1 68 CYS HA 1 78 LYS H 3.356 . 4.764 4.367 3.945 4.815 0.051 9 0 "[ . 1]" 1
1283 1 68 CYS HA 1 79 LEU H 4.027 . 6.054 5.319 5.090 5.549 . 0 0 "[ . 1]" 1
1284 1 68 CYS HA 1 79 LEU HA 2.488 . 3.262 3.187 2.905 3.315 0.053 8 0 "[ . 1]" 1
1285 1 68 CYS HB2 1 70 VAL HA 3.472 . 4.979 5.082 4.890 5.382 0.403 5 0 "[ . 1]" 1
1286 1 68 CYS HB2 1 77 TYR QE 2.685 . 3.586 3.347 2.433 4.273 0.687 5 2 "[ - + 1]" 1
1287 1 68 CYS HB3 1 69 ASN H 3.329 . 4.714 3.978 3.791 4.318 . 0 0 "[ . 1]" 1
1288 1 68 CYS HB3 1 77 TYR QE 3.074 . 4.255 3.219 1.828 4.373 0.118 4 0 "[ . 1]" 1
1289 1 69 ASN H 1 69 ASN HA 2.954 . 4.045 2.937 2.925 2.951 . 0 0 "[ . 1]" 1
1290 1 69 ASN H 1 69 ASN HB2 2.825 . 3.822 2.568 2.356 3.628 . 0 0 "[ . 1]" 1
1291 1 69 ASN H 1 69 ASN HB3 2.871 . 3.902 3.617 3.223 3.735 . 0 0 "[ . 1]" 1
1292 1 69 ASN H 1 69 ASN HD21 3.730 . 5.469 3.068 2.540 4.193 . 0 0 "[ . 1]" 1
1293 1 69 ASN H 1 69 ASN HD22 4.285 . 6.580 4.214 3.896 4.821 . 0 0 "[ . 1]" 1
1294 1 69 ASN H 1 70 VAL H 3.530 . 5.088 4.347 4.182 4.419 . 0 0 "[ . 1]" 1
1295 1 69 ASN H 1 77 TYR HB2 3.350 . 4.753 3.347 2.686 4.699 . 0 0 "[ . 1]" 1
1296 1 69 ASN H 1 77 TYR HB3 3.194 . 4.470 3.828 2.814 4.477 0.007 9 0 "[ . 1]" 1
1297 1 69 ASN H 1 78 LYS HD2 3.805 . 5.615 5.470 4.513 6.153 0.538 6 1 "[ .+ 1]" 1
1298 1 69 ASN H 1 78 LYS QG 3.738 . 5.485 4.649 3.853 5.221 . 0 0 "[ . 1]" 1
1299 1 69 ASN H 1 79 LEU HA 4.265 . 6.539 4.689 3.876 5.000 . 0 0 "[ . 1]" 1
1300 1 69 ASN HA 1 69 ASN HB2 2.513 . 3.303 2.977 2.591 3.033 . 0 0 "[ . 1]" 1
1301 1 69 ASN HA 1 69 ASN HB3 2.423 . 3.157 2.523 2.317 2.634 . 0 0 "[ . 1]" 1
1302 1 69 ASN HA 1 69 ASN HD21 4.292 . 6.595 3.835 2.436 4.477 . 0 0 "[ . 1]" 1
1303 1 69 ASN HA 1 70 VAL H 2.435 . 3.176 2.120 2.089 2.145 . 0 0 "[ . 1]" 1
1304 1 69 ASN HA 1 70 VAL HB 3.188 . 4.458 4.400 4.273 4.505 0.047 6 0 "[ . 1]" 1
1305 1 69 ASN HA 1 70 VAL MG1 2.997 . 4.120 3.918 3.822 4.008 . 0 0 "[ . 1]" 1
1306 1 69 ASN HA 1 70 VAL MG2 3.685 . 5.382 5.398 5.327 5.456 0.074 6 0 "[ . 1]" 1
1307 1 69 ASN HB2 1 69 ASN HD21 2.758 . 3.709 2.378 2.174 3.025 . 0 0 "[ . 1]" 1
1308 1 69 ASN HB3 1 69 ASN HD21 3.009 . 4.140 3.230 2.126 3.518 . 0 0 "[ . 1]" 1
1309 1 69 ASN HB3 1 70 VAL H 3.563 . 5.150 3.495 3.295 3.916 . 0 0 "[ . 1]" 1
1310 1 69 ASN HD21 1 80 LYS H 5.647 . 9.633 5.327 4.613 6.585 . 0 0 "[ . 1]" 1
1311 1 69 ASN HD21 1 80 LYS HB3 3.175 . 4.435 3.853 3.314 4.665 0.230 10 0 "[ . 1]" 1
1312 1 69 ASN HD21 1 80 LYS QG 4.496 . 7.023 4.864 3.641 6.077 . 0 0 "[ . 1]" 1
1313 1 69 ASN HD22 1 80 LYS H 4.255 . 6.519 6.080 5.828 6.504 . 0 0 "[ . 1]" 1
1314 1 70 VAL H 1 70 VAL HA 2.603 . 3.450 2.790 2.751 2.836 . 0 0 "[ . 1]" 1
1315 1 70 VAL H 1 70 VAL HB 2.468 . 3.230 2.401 2.293 2.455 . 0 0 "[ . 1]" 1
1316 1 70 VAL H 1 70 VAL MG1 2.496 . 3.275 2.249 2.142 2.346 . 0 0 "[ . 1]" 1
1317 1 70 VAL H 1 70 VAL MG2 2.842 . 3.851 3.728 3.682 3.750 . 0 0 "[ . 1]" 1
1318 1 70 VAL H 1 71 THR H 3.685 . 5.383 4.593 4.530 4.657 . 0 0 "[ . 1]" 1
1319 1 70 VAL H 1 77 TYR HB3 4.283 . 6.576 3.686 3.314 4.521 . 0 0 "[ . 1]" 1
1320 1 70 VAL H 1 77 TYR QD 4.104 . 6.209 3.262 2.438 4.041 . 0 0 "[ . 1]" 1
1321 1 70 VAL H 1 77 TYR QE 3.445 . 4.928 4.328 3.431 4.949 0.021 7 0 "[ . 1]" 1
1322 1 70 VAL HA 1 70 VAL HB 2.497 . 3.276 2.499 2.466 2.541 . 0 0 "[ . 1]" 1
1323 1 70 VAL HA 1 70 VAL MG1 2.610 . 3.462 3.213 3.199 3.221 . 0 0 "[ . 1]" 1
1324 1 70 VAL HA 1 70 VAL MG2 2.531 . 3.331 2.306 2.287 2.333 . 0 0 "[ . 1]" 1
1325 1 70 VAL HA 1 71 THR H 2.309 . 2.976 2.169 2.096 2.243 . 0 0 "[ . 1]" 1
1326 1 70 VAL HA 1 73 ARG H 3.690 . 5.392 4.184 4.004 4.272 . 0 0 "[ . 1]" 1
1327 1 70 VAL HA 1 76 LYS H 4.083 . 6.166 4.033 3.852 4.231 . 0 0 "[ . 1]" 1
1328 1 70 VAL HA 1 75 CYS HA 3.428 . 4.897 4.909 4.745 4.962 0.065 8 0 "[ . 1]" 1
1329 1 70 VAL HA 1 77 TYR H 4.266 . 6.541 4.475 4.342 4.671 . 0 0 "[ . 1]" 1
1330 1 70 VAL HA 1 77 TYR QD 4.044 . 6.088 1.905 1.717 2.431 0.283 8 0 "[ . 1]" 1
1331 1 70 VAL HA 1 77 TYR QE 2.934 . 4.010 3.887 3.416 4.093 0.083 9 0 "[ . 1]" 1
1332 1 70 VAL HB 1 70 VAL MG1 2.374 . 3.079 2.121 2.117 2.124 . 0 0 "[ . 1]" 1
1333 1 70 VAL HB 1 70 VAL MG2 2.443 . 3.189 2.119 2.114 2.125 . 0 0 "[ . 1]" 1
1334 1 70 VAL HB 1 71 THR H 3.397 . 4.839 4.151 4.060 4.281 . 0 0 "[ . 1]" 1
1335 1 70 VAL HB 1 76 LYS H 4.427 . 6.877 5.048 4.722 5.536 . 0 0 "[ . 1]" 1
1336 1 70 VAL HB 1 77 TYR QE 4.063 . 6.126 3.002 2.381 3.399 . 0 0 "[ . 1]" 1
1337 1 70 VAL MG1 1 71 THR H 3.204 . 4.487 3.741 3.618 3.822 . 0 0 "[ . 1]" 1
1338 1 70 VAL MG1 1 75 CYS H 3.878 . 5.758 4.200 3.914 4.562 . 0 0 "[ . 1]" 1
1339 1 70 VAL MG2 1 71 THR H 2.433 . 3.173 2.394 2.246 2.621 . 0 0 "[ . 1]" 1
1340 1 70 VAL MG2 1 71 THR HB 2.979 . 4.088 3.967 3.745 4.214 0.126 6 0 "[ . 1]" 1
1341 1 70 VAL MG2 1 73 ARG H 4.375 . 6.768 4.470 3.964 4.989 . 0 0 "[ . 1]" 1
1342 1 70 VAL MG2 1 74 PRO HA 2.683 . 3.583 3.168 2.239 3.676 0.093 1 0 "[ . 1]" 1
1343 1 70 VAL MG2 1 75 CYS H 2.614 . 3.468 2.144 1.819 2.365 . 0 0 "[ . 1]" 1
1344 1 70 VAL MG2 1 76 LYS H 2.423 . 3.157 2.590 2.330 3.048 . 0 0 "[ . 1]" 1
1345 1 70 VAL MG2 1 77 TYR QE 2.444 . 3.190 3.222 2.848 3.324 0.134 1 0 "[ . 1]" 1
1346 1 70 VAL MG2 1 78 LYS H 4.079 . 6.159 5.932 5.388 6.150 . 0 0 "[ . 1]" 1
1347 1 71 THR H 1 71 THR HA 2.671 . 3.563 2.931 2.873 2.944 . 0 0 "[ . 1]" 1
1348 1 71 THR H 1 71 THR HA 3.227 . 4.529 2.586 2.457 2.653 . 0 0 "[ . 1]" 1
1349 1 71 THR H 1 71 THR HB 2.706 . 3.621 3.628 3.593 3.693 0.072 6 0 "[ . 1]" 1
1350 1 71 THR H 1 76 LYS H 4.096 . 6.193 4.078 3.925 4.281 . 0 0 "[ . 1]" 1
1351 1 71 THR H 1 76 LYS QB 3.111 . 4.321 4.371 3.998 4.606 0.285 6 0 "[ . 1]" 1
1352 1 71 THR H 1 77 TYR HB3 3.144 . 4.380 3.127 2.239 4.500 0.120 1 0 "[ . 1]" 1
1353 1 71 THR H 1 77 TYR QE 4.305 . 6.622 5.508 4.980 5.793 . 0 0 "[ . 1]" 1
1354 1 71 THR H 1 78 LYS H 3.456 . 4.949 4.879 4.128 5.065 0.116 8 0 "[ . 1]" 1
1355 1 71 THR HA 1 71 THR MG 2.036 . 2.554 2.227 2.155 2.274 . 0 0 "[ . 1]" 1
1356 1 71 THR HA 1 72 SER H 2.740 . 3.678 2.881 2.669 3.017 . 0 0 "[ . 1]" 1
1357 1 71 THR HB 1 71 THR MG 2.440 . 3.184 2.125 2.119 2.130 . 0 0 "[ . 1]" 1
1358 1 71 THR MG 1 72 SER H 2.411 . 3.138 3.225 3.179 3.294 0.156 5 0 "[ . 1]" 1
1359 1 71 THR MG 1 73 ARG H 3.545 . 5.116 4.395 3.916 4.787 . 0 0 "[ . 1]" 1
1360 1 71 THR MG 1 77 TYR H 3.506 . 5.043 4.164 3.460 4.445 . 0 0 "[ . 1]" 1
1361 1 71 THR MG 1 78 LYS H 2.848 . 3.862 3.414 3.009 3.721 . 0 0 "[ . 1]" 1
1362 1 71 THR MG 1 78 LYS QG 2.972 . 4.076 3.160 1.817 4.089 0.051 4 0 "[ . 1]" 1
1363 1 72 SER H 1 72 SER HB2 2.986 . 4.101 2.620 2.546 2.792 . 0 0 "[ . 1]" 1
1364 1 72 SER HA 1 72 SER HB2 2.129 . 2.696 2.952 2.445 3.015 0.319 5 0 "[ . 1]" 1
1365 1 72 SER HA 1 72 SER HB3 2.257 . 2.894 2.464 2.338 3.014 0.120 4 0 "[ . 1]" 1
1366 1 72 SER HA 1 73 ARG H 2.848 . 3.862 3.497 3.402 3.571 . 0 0 "[ . 1]" 1
1367 1 72 SER HB2 1 73 ARG H 3.663 . 5.340 2.937 2.582 3.970 . 0 0 "[ . 1]" 1
1368 1 72 SER HB3 1 73 ARG H 3.179 . 4.442 3.817 2.732 4.167 . 0 0 "[ . 1]" 1
1369 1 73 ARG H 1 73 ARG HA 2.451 . 3.202 2.875 2.817 2.917 . 0 0 "[ . 1]" 1
1370 1 73 ARG H 1 73 ARG HB3 2.693 . 3.599 3.513 2.803 3.647 0.048 7 0 "[ . 1]" 1
1371 1 73 ARG H 1 73 ARG QD 3.679 . 5.370 4.075 3.404 4.458 . 0 0 "[ . 1]" 1
1372 1 73 ARG H 1 73 ARG QG 2.554 . 3.369 2.333 1.933 2.727 . 0 0 "[ . 1]" 1
1373 1 73 ARG H 1 76 LYS H 4.414 . 6.850 4.909 4.658 5.141 . 0 0 "[ . 1]" 1
1374 1 73 ARG HA 1 73 ARG HB2 2.420 . 3.152 2.966 2.524 3.024 . 0 0 "[ . 1]" 1
1375 1 73 ARG HA 1 74 PRO QD 2.222 . 2.839 1.923 1.860 2.006 . 0 0 "[ . 1]" 1
1376 1 73 ARG HA 1 76 LYS H 4.443 . 6.910 4.928 4.759 5.120 . 0 0 "[ . 1]" 1
1377 1 73 ARG HB2 1 73 ARG QD 2.299 . 2.959 2.733 2.280 3.086 0.127 10 0 "[ . 1]" 1
1378 1 73 ARG HB2 1 74 PRO QD 2.801 . 3.782 3.795 2.728 4.302 0.520 4 1 "[ +. 1]" 1
1379 1 73 ARG HB3 1 76 LYS H 2.414 . 3.142 3.039 2.481 3.248 0.106 3 0 "[ . 1]" 1
1380 1 73 ARG QD 1 73 ARG HG3 2.361 . 3.058 2.125 2.118 2.131 . 0 0 "[ . 1]" 1
1381 1 73 ARG HE 1 76 LYS QB 2.582 . 3.415 2.835 2.175 3.443 0.028 5 0 "[ . 1]" 1
1382 1 74 PRO HA 1 74 PRO QB 2.362 . 3.059 2.191 2.168 2.229 . 0 0 "[ . 1]" 1
1383 1 74 PRO HA 1 75 CYS H 2.165 . 2.751 2.128 2.097 2.167 . 0 0 "[ . 1]" 1
1384 1 74 PRO HA 1 76 LYS H 3.233 . 4.539 3.606 3.372 3.791 . 0 0 "[ . 1]" 1
1385 1 74 PRO QB 1 74 PRO QD 2.595 . 3.437 2.746 2.724 2.780 . 0 0 "[ . 1]" 1
1386 1 74 PRO QB 1 75 CYS H 3.012 . 4.146 3.458 3.128 3.595 . 0 0 "[ . 1]" 1
1387 1 75 CYS H 1 75 CYS QB 2.334 . 3.015 3.073 2.981 3.267 0.252 4 0 "[ . 1]" 1
1388 1 75 CYS H 1 76 LYS H 2.649 . 3.526 2.685 2.564 2.833 . 0 0 "[ . 1]" 1
1389 1 75 CYS HA 1 76 LYS H 4.201 . 6.407 3.173 3.010 3.296 . 0 0 "[ . 1]" 1
1390 1 75 CYS QB 1 76 LYS H 2.618 . 3.475 3.533 3.428 3.666 0.191 1 0 "[ . 1]" 1
1391 1 76 LYS H 1 76 LYS QB 2.526 . 3.324 2.500 2.181 2.652 . 0 0 "[ . 1]" 1
1392 1 76 LYS H 1 76 LYS QG 2.545 . 3.355 3.100 2.728 3.771 0.416 2 0 "[ . 1]" 1
1393 1 76 LYS H 1 77 TYR H 3.826 . 5.655 4.391 4.262 4.503 . 0 0 "[ . 1]" 1
1394 1 76 LYS H 1 77 TYR HB3 4.254 . 6.516 5.490 4.976 6.572 0.056 1 0 "[ . 1]" 1
1395 1 76 LYS HA 1 77 TYR H 2.609 . 3.460 2.140 2.035 2.312 . 0 0 "[ . 1]" 1
1396 1 76 LYS HA 1 77 TYR QE 3.077 . 4.260 4.208 3.801 4.399 0.139 7 0 "[ . 1]" 1
1397 1 76 LYS QB 1 77 TYR H 3.423 . 4.888 3.042 2.673 3.372 . 0 0 "[ . 1]" 1
1398 1 76 LYS QD 1 77 TYR H 3.447 . 4.932 3.869 2.960 4.731 . 0 0 "[ . 1]" 1
1399 1 77 TYR H 1 77 TYR HB2 2.855 . 3.874 3.557 2.748 3.809 . 0 0 "[ . 1]" 1
1400 1 77 TYR H 1 77 TYR HB3 3.201 . 4.482 3.714 3.600 3.887 . 0 0 "[ . 1]" 1
1401 1 77 TYR H 1 77 TYR QD 2.756 . 3.705 2.978 2.567 3.296 . 0 0 "[ . 1]" 1
1402 1 77 TYR H 1 77 TYR QE 4.034 . 6.069 4.267 3.938 4.616 . 0 0 "[ . 1]" 1
1403 1 77 TYR H 1 78 LYS H 3.926 . 5.853 4.334 4.272 4.413 . 0 0 "[ . 1]" 1
1404 1 77 TYR H 1 78 LYS HA 4.215 . 6.435 4.759 4.642 4.958 . 0 0 "[ . 1]" 1
1405 1 77 TYR HA 1 78 LYS QE 2.561 . 3.381 3.437 3.163 3.575 0.194 1 0 "[ . 1]" 1
1406 1 77 TYR HB2 1 77 TYR QD 2.629 . 3.493 2.436 2.287 2.636 . 0 0 "[ . 1]" 1
1407 1 77 TYR HB2 1 78 LYS H 2.456 . 3.210 2.165 1.901 3.178 . 0 0 "[ . 1]" 1
1408 1 77 TYR QE 1 78 LYS H 3.864 . 5.730 5.876 5.646 6.145 0.415 4 0 "[ . 1]" 1
1409 1 78 LYS H 1 78 LYS HA 2.523 . 3.319 2.939 2.932 2.948 . 0 0 "[ . 1]" 1
1410 1 78 LYS H 1 78 LYS HB2 2.749 . 3.694 3.200 2.539 3.824 0.130 3 0 "[ . 1]" 1
1411 1 78 LYS H 1 78 LYS HB3 2.431 . 3.170 2.839 1.662 3.553 0.383 7 0 "[ . 1]" 1
1412 1 78 LYS H 1 78 LYS HG2 2.550 . 3.363 3.124 1.871 4.271 0.908 5 4 "[- + ** 1]" 1
1413 1 78 LYS HA 1 78 LYS HB2 2.251 . 2.884 2.750 2.443 3.028 0.144 7 0 "[ . 1]" 1
1414 1 78 LYS HA 1 79 LEU H 1.966 . 2.449 2.261 2.167 2.324 . 0 0 "[ . 1]" 1
1415 1 78 LYS HA 1 79 LEU HA 4.866 . 7.826 4.298 4.233 4.372 . 0 0 "[ . 1]" 1
1416 1 78 LYS HB2 1 79 LEU H 2.134 . 2.703 2.108 1.994 2.363 . 0 0 "[ . 1]" 1
1417 1 78 LYS HB3 1 79 LEU H 2.831 . 3.833 3.404 2.706 3.958 0.125 3 0 "[ . 1]" 1
1418 1 78 LYS HG2 1 79 LEU H 2.667 . 3.556 3.672 3.430 4.008 0.452 6 0 "[ . 1]" 1
1419 1 79 LEU H 1 79 LEU HA 2.571 . 3.397 2.866 2.819 2.925 . 0 0 "[ . 1]" 1
1420 1 79 LEU H 1 79 LEU HB3 2.381 . 3.090 3.057 2.429 3.432 0.342 1 0 "[ . 1]" 1
1421 1 79 LEU H 1 79 LEU QD 3.330 . 4.679 3.679 3.580 3.752 . 0 0 "[ . 1]" 1
1422 1 79 LEU H 1 80 LYS H 3.237 . 4.547 4.435 4.291 4.505 . 0 0 "[ . 1]" 1
1423 1 79 LEU HA 1 79 LEU HB2 2.545 . 3.355 2.766 2.449 2.920 . 0 0 "[ . 1]" 1
1424 1 79 LEU HA 1 79 LEU HB3 2.506 . 3.291 2.892 2.743 3.021 . 0 0 "[ . 1]" 1
1425 1 79 LEU HA 1 79 LEU QD 2.959 . 3.208 2.283 2.107 2.467 . 0 0 "[ . 1]" 1
1426 1 79 LEU HA 1 79 LEU HG 2.710 . 3.628 2.453 2.278 3.134 . 0 0 "[ . 1]" 1
1427 1 79 LEU HA 1 80 LYS H 2.169 . 2.757 2.116 2.058 2.151 . 0 0 "[ . 1]" 1
1428 1 79 LEU HB3 1 80 LYS H 3.104 . 4.309 3.698 3.496 4.003 . 0 0 "[ . 1]" 1
1429 1 79 LEU QD 1 80 LYS H . . 3.218 2.444 2.113 2.831 . 0 0 "[ . 1]" 1
1430 1 79 LEU HG 1 80 LYS H 2.879 . 3.915 3.949 3.101 4.100 0.185 1 0 "[ . 1]" 1
1431 1 80 LYS H 1 80 LYS HA 2.548 . 3.359 2.946 2.934 2.951 . 0 0 "[ . 1]" 1
1432 1 80 LYS H 1 80 LYS HB2 2.583 . 3.417 3.035 2.919 3.307 . 0 0 "[ . 1]" 1
1433 1 80 LYS H 1 80 LYS HB3 2.463 . 3.221 2.554 2.420 2.743 . 0 0 "[ . 1]" 1
1434 1 80 LYS HA 1 80 LYS HB2 2.798 . 3.777 2.446 2.397 2.523 . 0 0 "[ . 1]" 1
1435 1 80 LYS HA 1 80 LYS HB3 2.437 . 3.179 3.027 3.022 3.031 . 0 0 "[ . 1]" 1
1436 1 80 LYS HA 1 81 LYS H 2.975 . 4.081 2.161 2.136 2.210 . 0 0 "[ . 1]" 1
1437 1 80 LYS QG 1 81 LYS H 4.746 . 7.562 3.186 2.554 3.541 . 0 0 "[ . 1]" 1
1438 1 80 LYS QG 1 81 LYS HA 3.089 . 4.282 4.100 3.887 4.307 0.025 2 0 "[ . 1]" 1
1439 1 80 LYS QG 1 82 SER H 4.021 . 6.042 4.304 3.856 4.685 . 0 0 "[ . 1]" 1
1440 1 81 LYS H 1 81 LYS QB 3.166 . 4.419 2.370 2.157 2.466 . 0 0 "[ . 1]" 1
1441 1 81 LYS H 1 81 LYS QG 4.676 . 7.409 3.039 2.504 4.058 . 0 0 "[ . 1]" 1
1442 1 81 LYS HA 1 81 LYS QB 2.463 . 3.222 2.423 2.365 2.532 . 0 0 "[ . 1]" 1
1443 1 81 LYS HA 1 81 LYS QG 2.640 . 3.511 2.332 2.213 2.438 . 0 0 "[ . 1]" 1
1444 1 81 LYS HA 1 82 SER H 1.985 . 2.478 2.108 2.064 2.156 . 0 0 "[ . 1]" 1
1445 1 81 LYS QB 1 81 LYS QE 2.599 . 3.443 3.375 1.904 3.635 0.192 2 0 "[ . 1]" 1
1446 1 81 LYS QB 1 82 SER H 2.503 . 3.286 3.228 3.011 3.540 0.254 8 0 "[ . 1]" 1
1447 1 81 LYS HD3 1 81 LYS QE 2.236 . 2.861 2.310 2.159 2.387 . 0 0 "[ . 1]" 1
1448 1 81 LYS QG 1 82 SER H 2.973 . 4.078 3.708 2.634 4.026 . 0 0 "[ . 1]" 1
1449 1 82 SER H 1 82 SER QB 2.801 . 3.782 2.747 2.665 2.870 . 0 0 "[ . 1]" 1
1450 1 82 SER H 1 83 THR H 4.003 . 6.006 4.392 4.328 4.452 . 0 0 "[ . 1]" 1
1451 1 82 SER H 1 83 THR HA 3.627 . 5.272 4.732 4.652 4.817 . 0 0 "[ . 1]" 1
1452 1 82 SER QB 1 83 THR H 2.233 . 2.857 2.608 2.226 2.826 . 0 0 "[ . 1]" 1
1453 1 82 SER QB 1 84 ASN HD21 4.269 . 6.548 5.709 5.310 6.210 . 0 0 "[ . 1]" 1
1454 1 83 THR H 1 83 THR HA 2.942 . 4.024 2.944 2.930 2.952 . 0 0 "[ . 1]" 1
1455 1 83 THR H 1 83 THR HB 2.360 . 3.056 2.761 2.682 2.895 . 0 0 "[ . 1]" 1
1456 1 83 THR H 1 83 THR MG 3.019 . 4.158 3.893 3.856 3.956 . 0 0 "[ . 1]" 1
1457 1 83 THR H 1 84 ASN H 3.327 . 4.710 4.111 3.878 4.224 . 0 0 "[ . 1]" 1
1458 1 83 THR HA 1 83 THR HB 2.656 . 3.538 3.026 3.014 3.031 . 0 0 "[ . 1]" 1
1459 1 83 THR HA 1 83 THR MG 2.283 . 2.935 2.301 2.245 2.364 . 0 0 "[ . 1]" 1
1460 1 83 THR HA 1 84 ASN H 2.175 . 2.766 2.172 2.147 2.201 . 0 0 "[ . 1]" 1
1461 1 83 THR HB 1 83 THR MG 2.246 . 2.877 2.137 2.131 2.139 . 0 0 "[ . 1]" 1
1462 1 83 THR HB 1 84 ASN H 3.146 . 4.383 4.296 4.201 4.388 0.005 4 0 "[ . 1]" 1
1463 1 84 ASN H 1 84 ASN HA 2.635 . 3.503 2.898 2.868 2.912 . 0 0 "[ . 1]" 1
1464 1 84 ASN H 1 84 ASN HB2 3.180 . 4.444 3.236 3.055 3.975 . 0 0 "[ . 1]" 1
1465 1 84 ASN H 1 84 ASN HB3 3.019 . 4.158 3.080 2.989 3.467 . 0 0 "[ . 1]" 1
1466 1 84 ASN H 1 85 LYS H 3.086 . 4.277 4.338 4.326 4.354 0.077 6 0 "[ . 1]" 1
1467 1 84 ASN HA 1 84 ASN HD21 3.972 . 5.944 3.759 3.598 3.985 . 0 0 "[ . 1]" 1
1468 1 84 ASN HA 1 84 ASN HD22 4.180 . 6.364 4.310 4.128 5.089 . 0 0 "[ . 1]" 1
1469 1 84 ASN HA 1 85 LYS H 2.521 . 3.315 2.392 2.319 2.586 . 0 0 "[ . 1]" 1
1470 1 84 ASN HA 1 85 LYS QB 3.109 . 4.317 4.368 4.296 4.471 0.154 3 0 "[ . 1]" 1
1471 1 84 ASN HB2 1 84 ASN HD21 2.657 . 3.539 3.358 2.236 3.510 . 0 0 "[ . 1]" 1
1472 1 84 ASN HB2 1 85 LYS H 3.069 . 4.246 3.722 1.923 3.993 . 0 0 "[ . 1]" 1
1473 1 84 ASN HB2 1 102 GLY H 4.042 . 6.085 4.864 4.091 5.359 . 0 0 "[ . 1]" 1
1474 1 84 ASN HB3 1 84 ASN HD21 2.516 . 3.307 2.391 2.214 3.477 0.170 4 0 "[ . 1]" 1
1475 1 84 ASN HB3 1 84 ASN HD22 2.718 . 3.642 3.549 3.470 4.038 0.396 4 0 "[ . 1]" 1
1476 1 84 ASN HB3 1 85 LYS H 2.597 . 3.440 3.360 3.204 3.475 0.035 7 0 "[ . 1]" 1
1477 1 84 ASN HD21 1 85 LYS H 3.565 . 5.154 2.483 2.218 2.852 . 0 0 "[ . 1]" 1
1478 1 84 ASN HD21 1 85 LYS QB 2.855 . 3.874 3.911 3.449 4.213 0.339 4 0 "[ . 1]" 1
1479 1 84 ASN HD21 1 86 PHE HA 2.927 . 3.998 3.958 3.887 4.007 0.009 8 0 "[ . 1]" 1
1480 1 84 ASN HD21 1 101 VAL HB 3.369 . 4.787 3.081 2.739 3.620 . 0 0 "[ . 1]" 1
1481 1 84 ASN HD21 1 101 VAL QG 2.611 . 3.463 3.283 2.816 3.584 0.121 4 0 "[ . 1]" 1
1482 1 84 ASN HD22 1 85 LYS H 3.389 . 4.825 3.063 2.707 4.154 . 0 0 "[ . 1]" 1
1483 1 84 ASN HD22 1 101 VAL HB 3.536 . 5.099 3.726 1.909 4.459 0.064 4 0 "[ . 1]" 1
1484 1 84 ASN HD22 1 101 VAL QG 2.927 . 3.998 3.910 2.419 4.106 0.108 5 0 "[ . 1]" 1
1485 1 84 ASN HD22 1 102 GLY HA3 4.257 . 6.523 4.800 3.552 5.914 . 0 0 "[ . 1]" 1
1486 1 84 ASN HD22 1 103 SER HB2 4.333 . 6.680 5.471 3.620 7.057 0.377 8 0 "[ . 1]" 1
1487 1 85 LYS H 1 85 LYS HA 2.898 . 3.948 2.880 2.837 2.898 . 0 0 "[ . 1]" 1
1488 1 85 LYS H 1 85 LYS QB 2.867 . 3.894 2.472 2.254 2.605 . 0 0 "[ . 1]" 1
1489 1 85 LYS H 1 85 LYS QG 2.420 . 3.152 2.335 1.909 3.287 0.135 7 0 "[ . 1]" 1
1490 1 85 LYS H 1 86 PHE H 3.804 . 5.613 4.599 4.579 4.617 . 0 0 "[ . 1]" 1
1491 1 85 LYS H 1 86 PHE HB3 3.913 . 5.827 5.696 5.560 5.800 . 0 0 "[ . 1]" 1
1492 1 85 LYS H 1 102 GLY HA2 4.610 . 7.266 5.949 4.549 7.297 0.031 3 0 "[ . 1]" 1
1493 1 85 LYS H 1 102 GLY HA3 5.117 . 8.389 5.196 3.216 6.556 . 0 0 "[ . 1]" 1
1494 1 85 LYS HA 1 85 LYS HB2 2.420 . 3.152 2.598 2.396 3.013 . 0 0 "[ . 1]" 1
1495 1 85 LYS HA 1 86 PHE H 2.180 . 2.774 2.368 2.275 2.417 . 0 0 "[ . 1]" 1
1496 1 85 LYS QB 1 86 PHE H 2.497 . 3.276 2.600 2.454 2.818 . 0 0 "[ . 1]" 1
1497 1 85 LYS QG 1 86 PHE H 2.631 . 3.497 3.603 3.517 3.743 0.246 5 0 "[ . 1]" 1
1498 1 86 PHE H 1 86 PHE HA 2.635 . 3.503 2.923 2.909 2.943 . 0 0 "[ . 1]" 1
1499 1 86 PHE H 1 86 PHE HB2 3.370 . 4.789 3.869 3.813 3.938 . 0 0 "[ . 1]" 1
1500 1 86 PHE H 1 86 PHE HB3 3.257 . 4.583 3.345 3.293 3.400 . 0 0 "[ . 1]" 1
1501 1 86 PHE H 1 86 PHE QD 2.719 . 3.643 2.994 2.889 3.126 . 0 0 "[ . 1]" 1
1502 1 86 PHE H 1 86 PHE QE 3.817 . 5.638 4.296 4.196 4.419 . 0 0 "[ . 1]" 1
1503 1 86 PHE H 1 87 ALA H 4.381 . 6.780 4.416 4.386 4.457 . 0 0 "[ . 1]" 1
1504 1 86 PHE H 1 88 VAL MG1 3.768 . 5.543 4.320 3.957 4.616 . 0 0 "[ . 1]" 1
1505 1 86 PHE HA 1 86 PHE HB2 2.548 . 3.360 2.487 2.462 2.509 . 0 0 "[ . 1]" 1
1506 1 86 PHE HA 1 86 PHE HB3 2.571 . 3.397 2.408 2.394 2.424 . 0 0 "[ . 1]" 1
1507 1 86 PHE HA 1 86 PHE QD 2.654 . 3.534 3.511 3.475 3.531 . 0 0 "[ . 1]" 1
1508 1 86 PHE HA 1 86 PHE QE 3.506 . 5.043 4.777 4.730 4.829 . 0 0 "[ . 1]" 1
1509 1 86 PHE HA 1 87 ALA H 2.198 . 2.802 2.405 2.307 2.517 . 0 0 "[ . 1]" 1
1510 1 86 PHE HA 1 87 ALA MB 2.964 . 4.062 3.561 3.547 3.578 . 0 0 "[ . 1]" 1
1511 1 86 PHE HA 1 100 GLY H 3.488 . 5.009 4.105 3.985 4.256 . 0 0 "[ . 1]" 1
1512 1 86 PHE HA 1 101 VAL HA 2.915 . 3.977 2.098 1.794 2.437 0.059 10 0 "[ . 1]" 1
1513 1 86 PHE HA 1 101 VAL QG 2.717 . 3.640 2.855 2.386 3.363 . 0 0 "[ . 1]" 1
1514 1 86 PHE HA 1 102 GLY H 2.885 . 3.926 2.977 2.528 3.501 . 0 0 "[ . 1]" 1
1515 1 86 PHE HB2 1 86 PHE QD 2.189 . 2.788 2.392 2.369 2.412 . 0 0 "[ . 1]" 1
1516 1 86 PHE HB2 1 87 ALA H 2.377 . 3.083 2.399 2.260 2.536 . 0 0 "[ . 1]" 1
1517 1 86 PHE HB2 1 100 GLY H 4.324 . 6.661 4.295 3.972 4.528 . 0 0 "[ . 1]" 1
1518 1 86 PHE HB2 1 101 VAL H 3.382 . 4.811 4.729 4.418 4.900 0.089 3 0 "[ . 1]" 1
1519 1 86 PHE HB2 1 101 VAL QG 2.412 . 3.139 2.695 1.989 3.097 . 0 0 "[ . 1]" 1
1520 1 86 PHE HB3 1 86 PHE QD 2.109 . 2.665 2.393 2.368 2.419 . 0 0 "[ . 1]" 1
1521 1 86 PHE HB3 1 87 ALA H 2.718 . 3.642 3.699 3.645 3.758 0.116 7 0 "[ . 1]" 1
1522 1 86 PHE HB3 1 100 GLY H 5.407 . 9.062 4.842 4.694 4.995 . 0 0 "[ . 1]" 1
1523 1 86 PHE HB3 1 101 VAL MG1 2.640 . 3.511 2.090 1.809 2.360 . 0 0 "[ . 1]" 1
1524 1 86 PHE HB3 1 102 GLY H 4.399 . 6.818 4.731 3.992 5.486 . 0 0 "[ . 1]" 1
1525 1 86 PHE QD 1 87 ALA H 2.655 . 3.536 3.375 3.159 3.541 0.005 6 0 "[ . 1]" 1
1526 1 86 PHE QD 1 88 VAL H 4.238 . 6.483 3.838 3.725 3.907 . 0 0 "[ . 1]" 1
1527 1 86 PHE QD 1 88 VAL MG2 2.603 . 3.450 3.097 2.908 3.316 . 0 0 "[ . 1]" 1
1528 1 86 PHE QE 1 88 VAL MG1 2.075 . 2.613 2.034 1.995 2.093 . 0 0 "[ . 1]" 1
1529 1 86 PHE QE 1 88 VAL MG2 2.504 . 3.287 2.494 2.328 2.692 . 0 0 "[ . 1]" 1
1530 1 86 PHE HZ 1 88 VAL MG1 2.891 . 3.936 4.016 3.980 4.050 0.114 7 0 "[ . 1]" 1
1531 1 87 ALA H 1 87 ALA HA 2.836 . 3.841 2.948 2.946 2.950 . 0 0 "[ . 1]" 1
1532 1 87 ALA H 1 87 ALA MB 2.248 . 2.879 2.429 2.380 2.481 . 0 0 "[ . 1]" 1
1533 1 87 ALA H 1 88 VAL H 3.260 . 4.589 3.962 3.871 4.053 . 0 0 "[ . 1]" 1
1534 1 87 ALA H 1 88 VAL MG1 3.001 . 4.127 3.504 3.281 3.673 . 0 0 "[ . 1]" 1
1535 1 87 ALA H 1 99 VAL H 4.089 . 6.179 4.379 4.101 4.607 . 0 0 "[ . 1]" 1
1536 1 87 ALA H 1 99 VAL HB 3.912 . 5.825 4.023 3.772 4.377 . 0 0 "[ . 1]" 1
1537 1 87 ALA H 1 100 GLY H 2.611 . 3.463 3.130 2.887 3.264 . 0 0 "[ . 1]" 1
1538 1 87 ALA H 1 100 GLY HA2 4.448 . 6.921 4.582 4.448 4.687 . 0 0 "[ . 1]" 1
1539 1 87 ALA H 1 100 GLY HA3 4.371 . 6.759 4.793 4.614 5.086 . 0 0 "[ . 1]" 1
1540 1 87 ALA H 1 101 VAL HA 2.738 . 3.675 2.971 2.584 3.367 . 0 0 "[ . 1]" 1
1541 1 87 ALA H 1 102 GLY H 3.957 . 5.915 4.419 3.863 4.833 . 0 0 "[ . 1]" 1
1542 1 87 ALA HA 1 87 ALA MB 2.218 . 2.833 2.128 2.126 2.130 . 0 0 "[ . 1]" 1
1543 1 87 ALA HA 1 88 VAL H 2.039 . 2.559 2.111 2.083 2.123 . 0 0 "[ . 1]" 1
1544 1 87 ALA HA 1 100 GLY H 5.033 . 8.199 4.948 4.771 5.063 . 0 0 "[ . 1]" 1
1545 1 87 ALA MB 1 88 VAL H 2.343 . 3.029 3.084 3.060 3.109 0.080 6 0 "[ . 1]" 1
1546 1 87 ALA MB 1 99 VAL H 3.144 . 4.380 3.709 3.488 3.954 . 0 0 "[ . 1]" 1
1547 1 87 ALA MB 1 100 GLY H 3.115 . 4.328 2.903 2.627 3.155 . 0 0 "[ . 1]" 1
1548 1 87 ALA MB 1 102 GLY H 4.230 . 6.466 4.726 3.806 5.139 . 0 0 "[ . 1]" 1
1549 1 88 VAL H 1 88 VAL HB 3.418 . 4.878 3.797 3.769 3.815 . 0 0 "[ . 1]" 1
1550 1 88 VAL H 1 88 VAL MG1 2.734 . 3.668 3.121 3.046 3.207 . 0 0 "[ . 1]" 1
1551 1 88 VAL H 1 88 VAL MG2 2.295 . 2.953 2.154 2.086 2.183 . 0 0 "[ . 1]" 1
1552 1 88 VAL H 1 99 VAL H 2.868 . 3.896 3.831 3.748 3.904 0.008 8 0 "[ . 1]" 1
1553 1 88 VAL H 1 99 VAL HB 3.526 . 5.080 4.360 4.126 4.755 . 0 0 "[ . 1]" 1
1554 1 88 VAL H 1 100 GLY H 4.314 . 6.640 5.381 5.282 5.524 . 0 0 "[ . 1]" 1
1555 1 88 VAL HA 1 88 VAL HB 2.442 . 3.187 2.525 2.514 2.554 . 0 0 "[ . 1]" 1
1556 1 88 VAL HA 1 88 VAL MG1 2.337 . 3.020 2.310 2.265 2.329 . 0 0 "[ . 1]" 1
1557 1 88 VAL HA 1 88 VAL MG2 2.406 . 3.130 2.476 2.220 2.737 . 0 0 "[ . 1]" 1
1558 1 88 VAL HA 1 89 THR H 2.315 . 2.985 2.281 2.197 2.353 . 0 0 "[ . 1]" 1
1559 1 88 VAL HA 1 97 HIS H 4.143 . 6.289 4.920 4.748 5.115 . 0 0 "[ . 1]" 1
1560 1 88 VAL HA 1 99 VAL H 2.654 . 3.535 2.533 2.426 2.668 . 0 0 "[ . 1]" 1
1561 1 88 VAL HB 1 88 VAL MG1 2.146 . 2.722 2.128 2.125 2.132 . 0 0 "[ . 1]" 1
1562 1 88 VAL HB 1 89 THR H 2.369 . 3.071 2.695 2.483 2.905 . 0 0 "[ . 1]" 1
1563 1 88 VAL HB 1 96 VAL H 3.844 . 5.691 3.495 3.285 3.633 . 0 0 "[ . 1]" 1
1564 1 88 VAL HB 1 97 HIS H 3.606 . 5.231 3.438 3.307 3.584 . 0 0 "[ . 1]" 1
1565 1 88 VAL HB 1 99 VAL H 3.505 . 5.040 4.842 4.707 5.000 . 0 0 "[ . 1]" 1
1566 1 88 VAL MG1 1 88 VAL MG2 2.142 . 2.715 2.085 2.080 2.092 . 0 0 "[ . 1]" 1
1567 1 88 VAL MG1 1 89 THR H 2.499 . 3.280 3.293 3.252 3.346 0.066 4 0 "[ . 1]" 1
1568 1 88 VAL MG1 1 96 VAL H 3.676 . 5.365 4.180 3.819 4.409 . 0 0 "[ . 1]" 1
1569 1 88 VAL MG1 1 97 HIS H 3.416 . 4.875 4.023 3.812 4.150 . 0 0 "[ . 1]" 1
1570 1 88 VAL MG1 1 99 VAL H 2.920 . 3.986 3.342 3.252 3.465 . 0 0 "[ . 1]" 1
1571 1 88 VAL MG1 1 100 GLY H 3.586 . 5.194 4.014 3.847 4.167 . 0 0 "[ . 1]" 1
1572 1 88 VAL MG2 1 89 THR HA 2.917 . 3.980 3.457 3.253 3.604 . 0 0 "[ . 1]" 1
1573 1 88 VAL MG2 1 90 CYS HA 3.095 . 4.292 3.661 3.395 3.859 . 0 0 "[ . 1]" 1
1574 1 88 VAL MG2 1 90 CYS HB2 3.385 . 4.817 4.754 4.553 4.853 0.036 6 0 "[ . 1]" 1
1575 1 89 THR H 1 89 THR HB 2.372 . 3.075 2.562 2.505 2.610 . 0 0 "[ . 1]" 1
1576 1 89 THR H 1 90 CYS H 3.443 . 4.925 4.371 4.310 4.487 . 0 0 "[ . 1]" 1
1577 1 89 THR H 1 97 HIS H 2.943 . 4.025 3.278 3.090 3.451 . 0 0 "[ . 1]" 1
1578 1 89 THR H 1 97 HIS HA 4.088 . 6.177 4.618 4.546 4.792 . 0 0 "[ . 1]" 1
1579 1 89 THR H 1 97 HIS HB2 3.201 . 4.482 4.513 4.476 4.557 0.075 5 0 "[ . 1]" 1
1580 1 89 THR H 1 97 HIS HB3 3.073 . 4.253 2.871 2.826 2.932 . 0 0 "[ . 1]" 1
1581 1 89 THR H 1 98 PHE HA 2.830 . 3.831 3.409 3.152 3.635 . 0 0 "[ . 1]" 1
1582 1 89 THR H 1 99 VAL MG2 2.241 . 2.869 2.876 2.771 2.931 0.062 7 0 "[ . 1]" 1
1583 1 89 THR HA 1 89 THR HB 2.907 . 3.963 3.024 3.020 3.028 . 0 0 "[ . 1]" 1
1584 1 89 THR HA 1 89 THR MG 2.345 . 3.032 2.370 2.336 2.412 . 0 0 "[ . 1]" 1
1585 1 89 THR HA 1 90 CYS H 2.137 . 2.708 2.173 2.154 2.186 . 0 0 "[ . 1]" 1
1586 1 89 THR HB 1 89 THR MG 2.317 . 2.988 2.132 2.129 2.136 . 0 0 "[ . 1]" 1
1587 1 89 THR HB 1 90 CYS H 4.013 . 6.026 4.266 4.149 4.369 . 0 0 "[ . 1]" 1
1588 1 89 THR HB 1 96 VAL H 3.566 . 5.156 3.837 3.592 4.078 . 0 0 "[ . 1]" 1
1589 1 89 THR HB 1 97 HIS H 2.858 . 3.879 3.339 2.923 3.750 . 0 0 "[ . 1]" 1
1590 1 89 THR HB 1 97 HIS HB2 2.893 . 3.939 2.864 2.702 3.321 . 0 0 "[ . 1]" 1
1591 1 89 THR MG 1 90 CYS H 2.501 . 3.283 2.902 2.714 3.067 . 0 0 "[ . 1]" 1
1592 1 89 THR MG 1 90 CYS HA 2.696 . 3.604 3.718 3.686 3.772 0.168 9 0 "[ . 1]" 1
1593 1 90 CYS H 1 90 CYS HB2 3.102 . 4.305 2.813 2.791 2.861 . 0 0 "[ . 1]" 1
1594 1 90 CYS H 1 90 CYS HB3 2.855 . 3.874 3.778 3.757 3.827 . 0 0 "[ . 1]" 1
1595 1 90 CYS HA 1 90 CYS HB2 2.798 . 3.776 3.012 3.004 3.015 . 0 0 "[ . 1]" 1
1596 1 90 CYS HA 1 91 GLU H 2.292 . 2.948 2.135 2.104 2.172 . 0 0 "[ . 1]" 1
1597 1 90 CYS HA 1 94 ALA H 3.308 . 4.676 3.746 3.562 3.872 . 0 0 "[ . 1]" 1
1598 1 90 CYS HA 1 96 VAL HA 3.021 . 4.162 4.245 4.222 4.280 0.118 6 0 "[ . 1]" 1
1599 1 90 CYS HB2 1 91 GLU H 3.043 . 4.201 3.787 3.686 3.878 . 0 0 "[ . 1]" 1
1600 1 90 CYS HB2 1 93 GLN H 5.314 . 8.843 4.436 4.356 4.582 . 0 0 "[ . 1]" 1
1601 1 90 CYS HB2 1 93 GLN HA 2.711 . 3.630 3.785 3.727 3.809 0.179 1 0 "[ . 1]" 1
1602 1 90 CYS HB2 1 94 ALA H 4.247 . 6.502 4.157 3.974 4.546 . 0 0 "[ . 1]" 1
1603 1 90 CYS HB3 1 91 GLU H 3.565 . 5.153 2.914 2.771 3.023 . 0 0 "[ . 1]" 1
1604 1 90 CYS HB3 1 94 ALA HA 2.938 . 4.017 3.893 3.772 3.981 . 0 0 "[ . 1]" 1
1605 1 91 GLU H 1 91 GLU HA 2.828 . 3.828 2.917 2.908 2.924 . 0 0 "[ . 1]" 1
1606 1 91 GLU H 1 91 GLU HG2 4.161 . 6.326 4.499 4.398 4.607 . 0 0 "[ . 1]" 1
1607 1 91 GLU H 1 91 GLU HG3 4.155 . 6.313 4.773 4.748 4.800 . 0 0 "[ . 1]" 1
1608 1 91 GLU H 1 92 ASN H 4.088 . 6.177 4.233 4.190 4.311 . 0 0 "[ . 1]" 1
1609 1 91 GLU H 1 94 ALA H 2.453 . 3.205 2.569 2.451 2.754 . 0 0 "[ . 1]" 1
1610 1 91 GLU H 1 94 ALA MB 2.819 . 3.813 3.641 3.576 3.745 . 0 0 "[ . 1]" 1
1611 1 91 GLU H 1 96 VAL H 3.879 . 5.760 3.921 3.589 4.165 . 0 0 "[ . 1]" 1
1612 1 91 GLU HA 1 91 GLU QB 2.216 . 2.830 2.391 2.354 2.425 . 0 0 "[ . 1]" 1
1613 1 91 GLU HA 1 91 GLU HG2 2.556 . 3.373 3.065 2.992 3.175 . 0 0 "[ . 1]" 1
1614 1 91 GLU HA 1 92 ASN H 2.336 . 3.018 2.225 2.200 2.254 . 0 0 "[ . 1]" 1
1615 1 91 GLU HA 1 92 ASN HD21 3.697 . 5.406 4.160 3.565 4.985 . 0 0 "[ . 1]" 1
1616 1 91 GLU HA 1 93 GLN H 3.315 . 4.688 3.310 3.204 3.382 . 0 0 "[ . 1]" 1
1617 1 91 GLU HA 1 94 ALA H 3.758 . 5.523 4.149 4.078 4.275 . 0 0 "[ . 1]" 1
1618 1 91 GLU QB 1 91 GLU HG2 1.876 . 2.316 2.342 2.322 2.364 0.048 6 0 "[ . 1]" 1
1619 1 91 GLU QB 1 92 ASN H 2.866 . 3.893 3.700 3.597 3.759 . 0 0 "[ . 1]" 1
1620 1 91 GLU QB 1 96 VAL H 4.422 . 6.866 4.822 4.479 5.146 . 0 0 "[ . 1]" 1
1621 1 91 GLU HG2 1 92 ASN H 3.187 . 4.457 2.889 2.615 3.048 . 0 0 "[ . 1]" 1
1622 1 91 GLU HG2 1 94 ALA H 4.062 . 6.125 4.778 4.652 5.024 . 0 0 "[ . 1]" 1
1623 1 91 GLU HG3 1 92 ASN H 3.215 . 4.507 3.163 2.747 3.353 . 0 0 "[ . 1]" 1
1624 1 91 GLU HG3 1 92 ASN HD21 4.098 . 6.197 3.759 2.861 4.975 . 0 0 "[ . 1]" 1
1625 1 91 GLU HG3 1 92 ASN HD22 4.340 . 6.694 4.215 3.728 4.808 . 0 0 "[ . 1]" 1
1626 1 92 ASN H 1 92 ASN HA 2.294 . 2.952 2.285 2.279 2.289 . 0 0 "[ . 1]" 1
1627 1 92 ASN H 1 92 ASN HB2 3.283 . 4.630 3.563 3.508 3.650 . 0 0 "[ . 1]" 1
1628 1 92 ASN H 1 92 ASN HB3 3.294 . 4.651 4.119 4.069 4.148 . 0 0 "[ . 1]" 1
1629 1 92 ASN H 1 92 ASN HD22 4.113 . 6.227 3.768 3.683 3.879 . 0 0 "[ . 1]" 1
1630 1 92 ASN H 1 93 GLN H 3.017 . 4.155 2.520 2.439 2.566 . 0 0 "[ . 1]" 1
1631 1 92 ASN H 1 93 GLN QB 5.408 . 9.064 5.321 5.241 5.402 . 0 0 "[ . 1]" 1
1632 1 92 ASN H 1 93 GLN HG3 4.240 . 6.487 4.680 4.461 5.327 . 0 0 "[ . 1]" 1
1633 1 92 ASN H 1 94 ALA H 3.918 . 5.837 4.284 4.144 4.429 . 0 0 "[ . 1]" 1
1634 1 92 ASN HA 1 92 ASN HB2 2.836 . 3.841 3.027 3.022 3.034 . 0 0 "[ . 1]" 1
1635 1 92 ASN HA 1 92 ASN HB3 2.705 . 3.620 2.520 2.440 2.572 . 0 0 "[ . 1]" 1
1636 1 92 ASN HA 1 92 ASN HD21 2.993 . 4.113 2.268 1.852 2.589 0.021 10 0 "[ . 1]" 1
1637 1 92 ASN HA 1 93 GLN H 2.597 . 3.440 2.839 2.792 2.864 . 0 0 "[ . 1]" 1
1638 1 92 ASN HB2 1 92 ASN HD21 3.867 . 5.737 3.151 2.885 3.509 . 0 0 "[ . 1]" 1
1639 1 92 ASN HB2 1 93 GLN H 3.824 . 5.652 4.113 4.053 4.160 . 0 0 "[ . 1]" 1
1640 1 92 ASN HB2 1 94 ALA H 4.184 . 6.372 3.999 3.670 4.289 . 0 0 "[ . 1]" 1
1641 1 92 ASN HB3 1 92 ASN HD21 3.298 . 4.657 3.273 2.907 3.519 . 0 0 "[ . 1]" 1
1642 1 92 ASN HB3 1 92 ASN HD22 2.950 . 4.037 3.955 3.778 4.084 0.047 2 0 "[ . 1]" 1
1643 1 92 ASN HB3 1 93 GLN H 4.264 . 6.536 4.407 4.376 4.454 . 0 0 "[ . 1]" 1
1644 1 92 ASN HB3 1 94 ALA H 4.674 . 7.404 4.896 4.610 5.097 . 0 0 "[ . 1]" 1
1645 1 93 GLN H 1 93 GLN HA 2.246 . 2.876 2.243 2.235 2.253 . 0 0 "[ . 1]" 1
1646 1 93 GLN H 1 93 GLN QB 2.756 . 3.705 3.352 3.315 3.394 . 0 0 "[ . 1]" 1
1647 1 93 GLN H 1 93 GLN HG2 3.219 . 4.514 3.477 3.260 4.500 . 0 0 "[ . 1]" 1
1648 1 93 GLN H 1 93 GLN HG3 2.559 . 3.377 2.954 2.898 3.178 . 0 0 "[ . 1]" 1
1649 1 93 GLN H 1 94 ALA H 2.673 . 3.566 2.735 2.648 2.809 . 0 0 "[ . 1]" 1
1650 1 93 GLN H 1 94 ALA MB 3.545 . 5.116 4.553 4.517 4.602 . 0 0 "[ . 1]" 1
1651 1 93 GLN HA 1 93 GLN HG3 2.327 . 3.004 3.101 2.403 3.252 0.248 9 0 "[ . 1]" 1
1652 1 93 GLN HA 1 94 ALA H 2.611 . 3.463 2.819 2.740 2.971 . 0 0 "[ . 1]" 1
1653 1 93 GLN QB 1 93 GLN HE21 3.502 . 5.035 3.477 2.743 3.986 . 0 0 "[ . 1]" 1
1654 1 93 GLN QB 1 93 GLN HG2 2.281 . 2.931 2.334 2.140 2.373 . 0 0 "[ . 1]" 1
1655 1 93 GLN QB 1 93 GLN HG3 2.357 . 3.051 2.336 2.306 2.458 . 0 0 "[ . 1]" 1
1656 1 93 GLN QB 1 94 ALA H 3.701 . 5.413 3.840 3.773 3.881 . 0 0 "[ . 1]" 1
1657 1 93 GLN HE21 1 93 GLN HG2 3.327 . 4.711 3.089 2.902 3.473 . 0 0 "[ . 1]" 1
1658 1 93 GLN HE21 1 93 GLN HG3 2.864 . 3.889 2.239 2.198 2.266 . 0 0 "[ . 1]" 1
1659 1 93 GLN HG3 1 94 ALA H 3.543 . 5.112 4.994 4.828 5.078 . 0 0 "[ . 1]" 1
1660 1 94 ALA H 1 94 ALA HA 2.797 . 3.775 2.927 2.910 2.950 . 0 0 "[ . 1]" 1
1661 1 94 ALA H 1 94 ALA MB 2.374 . 3.079 2.607 2.515 2.681 . 0 0 "[ . 1]" 1
1662 1 94 ALA HA 1 94 ALA MB 2.392 . 3.107 2.134 2.131 2.139 . 0 0 "[ . 1]" 1
1663 1 95 PRO HA 1 96 VAL H 2.956 . 4.048 2.181 2.147 2.221 . 0 0 "[ . 1]" 1
1664 1 95 PRO HA 1 97 HIS H 4.034 . 6.068 3.298 3.177 3.471 . 0 0 "[ . 1]" 1
1665 1 96 VAL H 1 96 VAL HA 2.244 . 2.873 2.928 2.912 2.936 0.063 10 0 "[ . 1]" 1
1666 1 96 VAL H 1 96 VAL HB 3.298 . 4.658 3.616 2.421 3.798 . 0 0 "[ . 1]" 1
1667 1 96 VAL H 1 96 VAL QG 2.741 . 3.473 2.066 1.875 2.716 . 0 0 "[ . 1]" 1
1668 1 96 VAL H 1 97 HIS H 2.306 . 2.970 2.129 1.874 2.342 . 0 0 "[ . 1]" 1
1669 1 96 VAL H 1 97 HIS HB2 4.015 . 6.030 4.388 4.239 4.512 . 0 0 "[ . 1]" 1
1670 1 96 VAL H 1 97 HIS HB3 3.990 . 5.980 4.178 4.003 4.528 . 0 0 "[ . 1]" 1
1671 1 96 VAL HA 1 96 VAL HB 2.358 . 3.053 2.527 2.432 3.016 . 0 0 "[ . 1]" 1
1672 1 96 VAL HA 1 96 VAL QG 2.334 . 3.015 2.235 2.122 2.296 . 0 0 "[ . 1]" 1
1673 1 96 VAL HA 1 97 HIS H 2.665 . 3.553 3.205 3.122 3.384 . 0 0 "[ . 1]" 1
1674 1 96 VAL HB 1 96 VAL QG 2.744 . 3.685 1.896 1.891 1.898 . 0 0 "[ . 1]" 1
1675 1 96 VAL HB 1 97 HIS H 3.821 . 5.646 4.196 3.253 4.369 . 0 0 "[ . 1]" 1
1676 1 96 VAL QG 1 97 HIS H 3.406 . 3.646 3.071 2.621 3.449 . 0 0 "[ . 1]" 1
1677 1 97 HIS H 1 97 HIS HA 2.815 . 3.806 2.910 2.894 2.935 . 0 0 "[ . 1]" 1
1678 1 97 HIS H 1 97 HIS HB2 3.042 . 4.199 3.257 3.166 3.326 . 0 0 "[ . 1]" 1
1679 1 97 HIS H 1 97 HIS HB3 3.387 . 4.821 2.868 2.688 2.954 . 0 0 "[ . 1]" 1
1680 1 97 HIS HA 1 97 HIS HB2 2.600 . 3.445 2.501 2.464 2.555 . 0 0 "[ . 1]" 1
1681 1 97 HIS HA 1 98 PHE H 2.352 . 3.043 2.200 2.117 2.236 . 0 0 "[ . 1]" 1
1682 1 97 HIS HB3 1 98 PHE H 2.759 . 3.711 3.898 3.865 3.952 0.241 8 0 "[ . 1]" 1
1683 1 97 HIS HE1 1 99 VAL H 4.314 . 6.640 5.621 5.335 5.989 . 0 0 "[ . 1]" 1
1684 1 97 HIS HE1 1 99 VAL MG2 2.516 . 3.307 3.109 2.645 3.324 0.017 10 0 "[ . 1]" 1
1685 1 98 PHE H 1 98 PHE HB2 2.933 . 4.008 2.951 2.904 3.073 . 0 0 "[ . 1]" 1
1686 1 98 PHE H 1 98 PHE HB3 3.049 . 4.211 2.591 2.419 2.656 . 0 0 "[ . 1]" 1
1687 1 98 PHE HA 1 98 PHE HB2 2.885 . 3.925 2.479 2.394 2.506 . 0 0 "[ . 1]" 1
1688 1 98 PHE HA 1 99 VAL H 2.310 . 2.977 2.162 2.133 2.198 . 0 0 "[ . 1]" 1
1689 1 98 PHE HA 1 99 VAL MG2 2.610 . 3.461 3.458 3.369 3.489 0.028 9 0 "[ . 1]" 1
1690 1 98 PHE HA 1 100 GLY H 3.504 . 5.039 4.095 3.994 4.228 . 0 0 "[ . 1]" 1
1691 1 98 PHE HB2 1 98 PHE QD 2.592 . 3.432 2.535 2.510 2.564 . 0 0 "[ . 1]" 1
1692 1 98 PHE HB3 1 98 PHE QD 2.364 . 3.063 2.291 2.281 2.306 . 0 0 "[ . 1]" 1
1693 1 98 PHE HZ 1 99 VAL H 4.059 . 6.118 5.449 5.291 5.784 . 0 0 "[ . 1]" 1
1694 1 98 PHE HZ 1 101 VAL HA 2.918 . 3.982 3.990 3.852 4.031 0.049 7 0 "[ . 1]" 1
1695 1 98 PHE HZ 1 101 VAL HB 3.443 . 4.925 4.715 4.375 4.969 0.044 1 0 "[ . 1]" 1
1696 1 98 PHE HZ 1 101 VAL MG1 2.145 . 2.720 1.905 1.544 2.372 0.026 4 0 "[ . 1]" 1
1697 1 99 VAL H 1 99 VAL HA 2.686 . 3.588 2.925 2.909 2.932 . 0 0 "[ . 1]" 1
1698 1 99 VAL H 1 99 VAL HB 2.290 . 2.945 2.470 2.420 2.542 . 0 0 "[ . 1]" 1
1699 1 99 VAL H 1 99 VAL MG1 3.460 . 4.957 3.776 3.751 3.806 . 0 0 "[ . 1]" 1
1700 1 99 VAL H 1 99 VAL MG2 2.390 . 3.104 2.475 2.402 2.553 . 0 0 "[ . 1]" 1
1701 1 99 VAL H 1 100 GLY H 2.293 . 2.950 2.208 2.141 2.277 . 0 0 "[ . 1]" 1
1702 1 99 VAL H 1 101 VAL H 4.075 . 6.151 6.231 6.182 6.253 0.102 5 0 "[ . 1]" 1
1703 1 99 VAL HA 1 99 VAL MG1 2.191 . 2.791 2.442 2.399 2.492 . 0 0 "[ . 1]" 1
1704 1 99 VAL HA 1 99 VAL MG2 2.174 . 2.765 2.356 2.320 2.403 . 0 0 "[ . 1]" 1
1705 1 99 VAL HA 1 100 GLY H 2.614 . 3.468 3.522 3.506 3.535 0.067 8 0 "[ . 1]" 1
1706 1 99 VAL HB 1 99 VAL MG2 2.065 . 2.598 2.127 2.124 2.131 . 0 0 "[ . 1]" 1
1707 1 99 VAL HB 1 100 GLY H 2.761 . 3.714 2.493 2.363 2.599 . 0 0 "[ . 1]" 1
1708 1 99 VAL MG1 1 100 GLY H 2.517 . 3.309 3.319 3.215 3.354 0.045 5 0 "[ . 1]" 1
1709 1 99 VAL MG2 1 100 GLY H 3.286 . 4.636 3.771 3.654 3.845 . 0 0 "[ . 1]" 1
1710 1 100 GLY H 1 100 GLY HA3 2.876 . 3.910 2.910 2.890 2.924 . 0 0 "[ . 1]" 1
1711 1 100 GLY H 1 101 VAL H 2.992 . 4.111 4.172 4.145 4.205 0.094 5 0 "[ . 1]" 1
1712 1 100 GLY HA2 1 101 VAL MG1 2.988 . 4.104 3.163 2.996 3.271 . 0 0 "[ . 1]" 1
1713 1 100 GLY HA2 1 101 VAL H 2.297 . 2.956 2.280 2.236 2.330 . 0 0 "[ . 1]" 1
1714 1 100 GLY HA3 1 101 VAL H 2.459 . 3.215 2.869 2.803 2.939 . 0 0 "[ . 1]" 1
1715 1 100 GLY HA3 1 101 VAL QG 2.960 . 4.055 3.997 3.948 4.073 0.018 7 0 "[ . 1]" 1
1716 1 101 VAL H 1 101 VAL HA 2.690 . 3.595 2.881 2.848 2.911 . 0 0 "[ . 1]" 1
1717 1 101 VAL H 1 101 VAL HB 2.649 . 3.526 3.622 3.560 3.663 0.137 10 0 "[ . 1]" 1
1718 1 101 VAL H 1 101 VAL QG 2.266 . 2.908 1.850 1.712 1.949 . 0 0 "[ . 1]" 1
1719 1 101 VAL HA 1 101 VAL HB 2.316 . 2.986 2.473 2.355 2.632 . 0 0 "[ . 1]" 1
1720 1 101 VAL HA 1 101 VAL QG 2.220 . 2.836 2.280 2.159 2.401 . 0 0 "[ . 1]" 1
1721 1 101 VAL HA 1 102 GLY H 2.562 . 3.383 2.268 2.075 2.435 . 0 0 "[ . 1]" 1
1722 1 101 VAL HB 1 101 VAL QG 2.032 . 2.548 1.891 1.887 1.895 . 0 0 "[ . 1]" 1
1723 1 101 VAL HB 1 102 GLY H 2.968 . 4.069 2.855 2.381 3.546 . 0 0 "[ . 1]" 1
1724 1 101 VAL QG 1 102 GLY H 3.084 . 4.273 3.243 2.910 3.561 . 0 0 "[ . 1]" 1
1725 1 102 GLY H 1 102 GLY HA2 2.780 . 3.746 2.578 2.339 2.865 . 0 0 "[ . 1]" 1
1726 1 102 GLY H 1 102 GLY HA3 2.733 . 3.667 2.888 2.725 2.954 . 0 0 "[ . 1]" 1
1727 1 102 GLY HA3 1 103 SER H 3.466 . 4.967 3.030 2.164 3.516 . 0 0 "[ . 1]" 1
1728 1 103 SER H 1 103 SER HA 3.183 . 4.450 2.202 2.047 2.393 . 0 0 "[ . 1]" 1
1729 1 103 SER HA 1 104 ALA H 2.167 . 2.754 2.293 2.089 2.577 . 0 0 "[ . 1]" 1
1730 1 103 SER HB2 1 104 ALA H 2.872 . 3.903 3.180 2.135 3.963 0.060 2 0 "[ . 1]" 1
1731 1 103 SER HB3 1 104 ALA H 3.211 . 4.500 3.832 3.392 4.273 . 0 0 "[ . 1]" 1
1732 1 104 ALA H 1 104 ALA MB 2.546 . 3.356 2.614 2.325 2.940 . 0 0 "[ . 1]" 1
1733 1 104 ALA HA 1 104 ALA MB 2.206 . 2.815 2.133 2.127 2.138 . 0 0 "[ . 1]" 1
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