NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
529524 |
2lnz   |
18186 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lnz
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 2590
_Distance_constraint_stats_list.Viol_count 2362
_Distance_constraint_stats_list.Viol_total 4373.395
_Distance_constraint_stats_list.Viol_max 1.707
_Distance_constraint_stats_list.Viol_rms 0.0761
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0169
_Distance_constraint_stats_list.Viol_average_violations_only 0.1852
_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 25 GLN 17.904 0.820 2 7 "[*+*** *- 1]"
1 26 GLU 5.951 0.744 5 3 "[* + - 1]"
1 27 LEU 14.592 0.769 7 2 "[ . +* 1]"
1 28 THR 6.586 0.744 5 2 "[- + 1]"
1 29 VAL 4.842 0.909 10 1 "[ . +]"
1 30 PRO 6.392 0.312 7 0 "[ . 1]"
1 31 TRP 23.268 0.907 10 4 "[ * -* +]"
1 32 ASP 2.623 0.312 7 0 "[ . 1]"
1 33 ASP 6.030 0.782 9 3 "[ - . +*]"
1 34 ILE 25.734 1.368 10 2 "[ . -+]"
1 35 GLU 8.106 0.485 9 0 "[ . 1]"
1 36 ALA 11.039 0.782 9 3 "[ - . +*]"
1 37 LEU 18.624 0.450 4 0 "[ . 1]"
1 38 LEU 9.619 0.317 3 0 "[ . 1]"
1 39 LYS 7.149 0.725 7 1 "[ . + 1]"
1 40 ASN 8.649 1.700 8 3 "[ - *+ 1]"
1 41 ASN 12.655 1.700 8 3 "[- * + 1]"
1 42 PHE 10.545 0.574 7 1 "[ . + 1]"
1 43 GLU 19.132 0.849 4 3 "[ +- *1]"
1 44 ASN 20.096 0.820 2 5 "[*+*-. * 1]"
1 45 ASP 12.240 0.849 4 3 "[ +- * 1]"
1 46 GLN 6.114 0.820 2 3 "[ +*-. 1]"
1 47 ALA 11.464 0.802 1 2 "[+ . - 1]"
1 48 ALA 17.291 0.836 2 3 "[ +*-. 1]"
1 49 VAL 13.343 0.323 7 0 "[ . 1]"
1 50 ARG 6.580 0.308 7 0 "[ . 1]"
1 51 GLN 16.162 0.842 2 3 "[ +*-. 1]"
1 52 VAL 15.752 0.502 7 1 "[ . + 1]"
1 53 MET 30.219 1.468 10 5 "[ * . **-+]"
1 54 GLU 4.863 0.377 7 0 "[ . 1]"
1 55 ARG 15.079 1.466 10 6 "[ **-. * *+]"
1 56 LEU 14.908 0.530 8 1 "[ . + 1]"
1 57 GLN 7.215 0.725 6 7 "[ ** *+* -*]"
1 58 LYS 14.509 0.806 5 5 "[ * -+ **1]"
1 59 GLY 0.115 0.056 10 0 "[ . 1]"
1 60 TRP 17.229 1.453 10 2 "[ . - +]"
1 61 SER 6.046 1.083 10 1 "[ . +]"
1 62 LEU 5.807 0.906 6 4 "[ -+ **1]"
1 63 ALA 21.346 0.906 6 5 "[ - *+ **1]"
1 64 LYS 13.031 0.906 6 4 "[ -+ **1]"
2 25 GLN 17.894 0.842 2 7 "[*+*-* ** 1]"
2 26 GLU 5.915 0.742 5 3 "[* + - 1]"
2 27 LEU 14.511 0.769 7 2 "[ . +* 1]"
2 28 THR 6.473 0.742 5 2 "[- + 1]"
2 29 VAL 4.832 0.912 10 1 "[ . +]"
2 30 PRO 6.405 0.313 7 0 "[ . 1]"
2 31 TRP 23.371 0.912 10 4 "[ * -* +]"
2 32 ASP 2.684 0.313 7 0 "[ . 1]"
2 33 ASP 6.061 0.775 9 3 "[ - . +*]"
2 34 ILE 25.788 1.371 10 2 "[ . -+]"
2 35 GLU 8.066 0.482 9 0 "[ . 1]"
2 36 ALA 11.022 0.775 9 3 "[ - . +*]"
2 37 LEU 18.583 0.443 4 0 "[ . 1]"
2 38 LEU 9.605 0.317 8 0 "[ . 1]"
2 39 LYS 7.129 0.719 7 1 "[ . + 1]"
2 40 ASN 8.632 1.707 8 3 "[ - *+ 1]"
2 41 ASN 12.692 1.707 8 3 "[- * + 1]"
2 42 PHE 10.540 0.571 7 1 "[ . + 1]"
2 43 GLU 19.118 0.838 4 3 "[ +- *1]"
2 44 ASN 20.030 0.836 2 5 "[*+*-. * 1]"
2 45 ASP 12.162 0.838 4 3 "[ +- * 1]"
2 46 GLN 6.088 0.836 2 3 "[ +*-. 1]"
2 47 ALA 11.532 0.802 1 2 "[+ . - 1]"
2 48 ALA 17.307 0.820 2 3 "[ +*-. 1]"
2 49 VAL 13.326 0.321 7 0 "[ . 1]"
2 50 ARG 6.584 0.304 7 0 "[ . 1]"
2 51 GLN 16.088 0.820 2 3 "[ +*-. 1]"
2 52 VAL 15.819 0.505 7 1 "[ . + 1]"
2 53 MET 30.279 1.473 10 5 "[ * . **-+]"
2 54 GLU 4.882 0.376 7 0 "[ . 1]"
2 55 ARG 15.203 1.453 10 6 "[ ***. * *+]"
2 56 LEU 14.971 0.516 8 1 "[ . + 1]"
2 57 GLN 7.280 0.731 6 7 "[ ** *+* -*]"
2 58 LYS 14.690 0.813 5 5 "[ * -+ **1]"
2 59 GLY 0.116 0.057 10 0 "[ . 1]"
2 60 TRP 17.169 1.466 10 2 "[ . - +]"
2 61 SER 5.982 1.085 10 1 "[ . +]"
2 62 LEU 5.801 0.902 6 4 "[ -+ **1]"
2 63 ALA 21.087 0.902 6 5 "[ - *+ **1]"
2 64 LYS 12.962 0.902 6 4 "[ -+ **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 29 VAL QG 1 31 TRP HE1 3.047 . 4.082 3.587 3.457 3.679 . 0 0 "[ . 1]" 1
2 2 29 VAL QG 2 31 TRP HE1 3.047 . 4.082 3.586 3.456 3.672 . 0 0 "[ . 1]" 1
3 1 29 VAL QG 1 31 TRP HE3 2.810 . 3.797 3.514 3.421 3.606 . 0 0 "[ . 1]" 1
4 2 29 VAL QG 2 31 TRP HE3 2.810 . 3.797 3.514 3.423 3.602 . 0 0 "[ . 1]" 1
5 1 29 VAL QG 1 30 PRO HD3 2.797 . 3.775 3.324 3.298 3.361 . 0 0 "[ . 1]" 1
6 2 29 VAL QG 2 30 PRO HD3 2.797 . 3.775 3.323 3.298 3.359 . 0 0 "[ . 1]" 1
7 1 29 VAL HB 1 29 VAL QG 2.135 . 2.639 1.893 1.892 1.895 . 0 0 "[ . 1]" 1
8 2 29 VAL HB 2 29 VAL QG 2.135 . 2.639 1.893 1.893 1.894 . 0 0 "[ . 1]" 1
9 1 29 VAL QG 2 38 LEU MD1 2.662 . 3.327 2.460 2.381 2.547 . 0 0 "[ . 1]" 1
10 1 38 LEU MD1 2 29 VAL QG 2.662 . 3.327 2.458 2.382 2.553 . 0 0 "[ . 1]" 1
11 1 29 VAL QG 2 56 LEU MD1 2.655 . 3.168 2.361 2.299 2.415 . 0 0 "[ . 1]" 1
12 1 56 LEU MD1 2 29 VAL QG 2.655 . 3.168 2.361 2.305 2.414 . 0 0 "[ . 1]" 1
13 1 29 VAL QG 2 56 LEU MD2 2.355 . 3.048 2.229 2.121 2.302 . 0 0 "[ . 1]" 1
14 1 56 LEU MD2 2 29 VAL QG 2.355 . 3.048 2.229 2.136 2.300 . 0 0 "[ . 1]" 1
15 1 34 ILE MG 1 35 GLU H 2.685 . 3.586 3.140 2.944 3.317 . 0 0 "[ . 1]" 1
16 2 34 ILE MG 2 35 GLU H 2.685 . 3.586 3.141 2.944 3.311 . 0 0 "[ . 1]" 1
17 1 34 ILE MG 1 38 LEU H 2.793 . 3.768 3.748 3.705 3.830 0.062 9 0 "[ . 1]" 1
18 2 34 ILE MG 2 38 LEU H 2.793 . 3.768 3.748 3.703 3.832 0.064 9 0 "[ . 1]" 1
19 1 31 TRP HE3 1 34 ILE MG 2.885 . 3.925 3.251 2.934 3.493 . 0 0 "[ . 1]" 1
20 2 31 TRP HE3 2 34 ILE MG 2.885 . 3.925 3.254 2.941 3.490 . 0 0 "[ . 1]" 1
21 1 34 ILE HA 1 34 ILE MG 2.372 . 3.075 2.527 2.476 2.587 . 0 0 "[ . 1]" 1
22 2 34 ILE HA 2 34 ILE MG 2.372 . 3.075 2.527 2.476 2.587 . 0 0 "[ . 1]" 1
23 1 35 GLU HA 1 53 MET ME 2.688 . 3.591 3.207 2.854 4.076 0.485 9 0 "[ . 1]" 1
24 2 35 GLU HA 2 53 MET ME 2.688 . 3.591 3.207 2.856 4.073 0.482 9 0 "[ . 1]" 1
25 1 31 TRP HB3 1 53 MET ME 2.341 . 3.026 2.612 1.869 3.250 0.224 3 0 "[ . 1]" 1
26 2 31 TRP HB3 2 53 MET ME 2.341 . 3.026 2.613 1.868 3.254 0.228 3 0 "[ . 1]" 1
27 1 35 GLU H 1 53 MET ME 2.402 . 3.123 2.872 2.652 3.498 0.375 9 0 "[ . 1]" 1
28 2 35 GLU H 2 53 MET ME 2.402 . 3.123 2.872 2.653 3.487 0.364 9 0 "[ . 1]" 1
29 1 31 TRP HE3 1 53 MET ME 2.108 . 2.664 1.993 1.826 2.899 0.235 10 0 "[ . 1]" 1
30 2 31 TRP HE3 2 53 MET ME 2.108 . 2.664 1.993 1.827 2.906 0.242 10 0 "[ . 1]" 1
31 1 31 TRP HZ3 1 53 MET ME 2.820 . 3.814 3.458 2.749 4.721 0.907 10 1 "[ . +]" 1
32 2 31 TRP HZ3 2 53 MET ME 2.820 . 3.814 3.459 2.745 4.726 0.912 10 1 "[ . +]" 1
33 1 53 MET ME 1 57 GLN HE21 2.637 . 3.506 2.574 2.016 3.698 0.192 3 0 "[ . 1]" 1
34 2 53 MET ME 2 57 GLN HE21 2.637 . 3.506 2.573 2.026 3.697 0.191 3 0 "[ . 1]" 1
35 1 48 ALA H 1 48 ALA MB 1.894 . 2.342 2.273 2.257 2.284 . 0 0 "[ . 1]" 1
36 2 48 ALA H 2 48 ALA MB 1.894 . 2.342 2.273 2.258 2.284 . 0 0 "[ . 1]" 1
37 1 36 ALA H 1 36 ALA MB 1.899 . 2.350 2.228 2.220 2.233 . 0 0 "[ . 1]" 1
38 2 36 ALA H 2 36 ALA MB 1.899 . 2.350 2.228 2.224 2.232 . 0 0 "[ . 1]" 1
39 1 36 ALA MB 1 37 LEU H 2.181 . 2.776 2.654 2.633 2.668 . 0 0 "[ . 1]" 1
40 2 36 ALA MB 2 37 LEU H 2.181 . 2.776 2.655 2.632 2.670 . 0 0 "[ . 1]" 1
41 1 47 ALA MB 1 48 ALA H 2.137 . 2.708 2.753 2.686 2.849 0.141 4 0 "[ . 1]" 1
42 2 47 ALA MB 2 48 ALA H 2.137 . 2.708 2.753 2.688 2.855 0.147 4 0 "[ . 1]" 1
43 1 47 ALA H 1 47 ALA MB 1.939 . 2.409 2.246 2.232 2.298 . 0 0 "[ . 1]" 1
44 2 47 ALA H 2 47 ALA MB 1.939 . 2.409 2.246 2.233 2.298 . 0 0 "[ . 1]" 1
45 1 48 ALA MB 1 51 GLN H 3.095 . 4.292 4.491 4.444 4.546 0.254 6 0 "[ . 1]" 1
46 2 48 ALA MB 2 51 GLN H 3.095 . 4.292 4.488 4.448 4.541 0.249 6 0 "[ . 1]" 1
47 1 48 ALA MB 1 50 ARG H 3.082 . 4.270 4.518 4.486 4.578 0.308 7 0 "[ . 1]" 1
48 2 48 ALA MB 2 50 ARG H 3.082 . 4.270 4.518 4.489 4.574 0.304 7 0 "[ . 1]" 1
49 1 47 ALA MB 1 51 GLN QE 3.186 . 4.455 2.888 2.726 3.115 . 0 0 "[ . 1]" 1
50 2 47 ALA MB 2 51 GLN QE 3.186 . 4.455 2.890 2.733 3.142 . 0 0 "[ . 1]" 1
51 1 46 GLN H 1 47 ALA MB 3.025 . 4.169 4.130 4.090 4.171 0.002 7 0 "[ . 1]" 1
52 2 46 GLN H 2 47 ALA MB 3.025 . 4.169 4.130 4.087 4.165 . 0 0 "[ . 1]" 1
53 1 47 ALA MB 1 51 GLN H 3.228 . 4.531 4.584 4.453 4.634 0.103 9 0 "[ . 1]" 1
54 2 47 ALA MB 2 51 GLN H 3.228 . 4.531 4.586 4.457 4.645 0.114 9 0 "[ . 1]" 1
55 1 63 ALA MB 2 59 GLY H 2.366 . 3.066 2.582 2.453 2.649 . 0 0 "[ . 1]" 1
56 1 59 GLY H 2 63 ALA MB 2.366 . 3.066 2.579 2.482 2.631 . 0 0 "[ . 1]" 1
57 1 63 ALA MB 2 58 LYS H 2.943 . 4.025 4.296 4.106 4.404 0.379 9 0 "[ . 1]" 1
58 1 58 LYS H 2 63 ALA MB 2.943 . 4.025 4.293 4.136 4.381 0.356 9 0 "[ . 1]" 1
59 1 63 ALA H 1 63 ALA MB 1.984 . 2.476 2.263 2.233 2.307 . 0 0 "[ . 1]" 1
60 2 63 ALA H 2 63 ALA MB 1.984 . 2.476 2.263 2.229 2.309 . 0 0 "[ . 1]" 1
61 1 63 ALA MB 1 64 LYS H 2.567 . 3.391 3.554 3.353 3.652 0.261 5 0 "[ . 1]" 1
62 2 63 ALA MB 2 64 LYS H 2.567 . 3.391 3.552 3.354 3.647 0.256 5 0 "[ . 1]" 1
63 1 63 ALA MB 2 55 ARG HE 3.056 . 4.223 3.154 2.707 3.541 . 0 0 "[ . 1]" 1
64 1 55 ARG HE 2 63 ALA MB 3.056 . 4.223 3.155 2.721 3.541 . 0 0 "[ . 1]" 1
65 1 28 THR MG 1 29 VAL H 2.292 . 2.948 2.434 2.248 2.572 . 0 0 "[ . 1]" 1
66 2 28 THR MG 2 29 VAL H 2.292 . 2.948 2.433 2.256 2.577 . 0 0 "[ . 1]" 1
67 1 49 VAL MG1 1 50 ARG H 2.550 . 3.363 3.422 3.323 3.482 0.119 8 0 "[ . 1]" 1
68 2 49 VAL MG1 2 50 ARG H 2.550 . 3.363 3.422 3.327 3.484 0.121 8 0 "[ . 1]" 1
69 1 38 LEU MD1 1 42 PHE QE 2.059 . 2.589 1.867 1.847 1.891 . 0 0 "[ . 1]" 1
70 2 38 LEU MD1 2 42 PHE QE 2.059 . 2.589 1.866 1.846 1.894 . 0 0 "[ . 1]" 1
71 1 27 LEU H 1 27 LEU QD 2.558 . 3.376 3.245 2.988 3.596 0.220 5 0 "[ . 1]" 1
72 2 27 LEU H 2 27 LEU QD 2.558 . 3.376 3.247 2.990 3.596 0.220 5 0 "[ . 1]" 1
73 1 52 VAL H 1 52 VAL MG1 2.107 . 2.662 2.334 2.317 2.356 . 0 0 "[ . 1]" 1
74 2 52 VAL H 2 52 VAL MG1 2.107 . 2.662 2.334 2.315 2.358 . 0 0 "[ . 1]" 1
75 1 51 GLN H 1 52 VAL MG1 3.052 . 4.216 4.229 4.165 4.257 0.041 8 0 "[ . 1]" 1
76 2 51 GLN H 2 52 VAL MG1 3.052 . 4.216 4.226 4.165 4.260 0.044 5 0 "[ . 1]" 1
77 1 52 VAL MG1 2 60 TRP HZ3 2.642 . 3.514 3.559 3.488 3.672 0.158 3 0 "[ . 1]" 1
78 1 60 TRP HZ3 2 52 VAL MG1 2.642 . 3.514 3.561 3.485 3.668 0.154 3 0 "[ . 1]" 1
79 1 52 VAL MG1 2 60 TRP HH2 2.407 . 3.131 1.919 1.858 1.956 . 0 0 "[ . 1]" 1
80 1 60 TRP HH2 2 52 VAL MG1 2.407 . 3.131 1.923 1.870 1.965 . 0 0 "[ . 1]" 1
81 1 44 ASN H 1 49 VAL MG2 3.207 . 4.493 4.273 4.174 4.396 . 0 0 "[ . 1]" 1
82 2 44 ASN H 2 49 VAL MG2 3.207 . 4.493 4.273 4.174 4.391 . 0 0 "[ . 1]" 1
83 1 49 VAL H 1 49 VAL MG2 1.991 . 2.486 1.901 1.885 1.923 . 0 0 "[ . 1]" 1
84 2 49 VAL H 2 49 VAL MG2 1.991 . 2.486 1.900 1.881 1.925 . 0 0 "[ . 1]" 1
85 1 42 PHE QD 1 49 VAL MG2 2.261 . 2.900 2.823 2.763 2.896 . 0 0 "[ . 1]" 1
86 2 42 PHE QD 2 49 VAL MG2 2.261 . 2.900 2.825 2.764 2.897 . 0 0 "[ . 1]" 1
87 1 42 PHE H 1 49 VAL MG2 2.801 . 3.782 3.233 3.181 3.280 . 0 0 "[ . 1]" 1
88 2 42 PHE H 2 49 VAL MG2 2.801 . 3.782 3.234 3.179 3.281 . 0 0 "[ . 1]" 1
89 1 47 ALA H 1 49 VAL MG2 3.158 . 4.405 4.493 4.188 4.622 0.217 2 0 "[ . 1]" 1
90 2 47 ALA H 2 49 VAL MG2 3.158 . 4.405 4.494 4.186 4.626 0.221 2 0 "[ . 1]" 1
91 1 52 VAL H 1 52 VAL MG2 2.587 . 3.423 2.085 2.069 2.114 . 0 0 "[ . 1]" 1
92 2 52 VAL H 2 52 VAL MG2 2.587 . 3.423 2.084 2.071 2.111 . 0 0 "[ . 1]" 1
93 1 27 LEU QD 2 52 VAL H 3.313 . 4.199 3.086 2.995 3.368 . 0 0 "[ . 1]" 1
94 1 52 VAL H 2 27 LEU QD 3.313 . 4.199 3.082 2.995 3.371 . 0 0 "[ . 1]" 1
95 1 37 LEU QD 1 41 ASN H 3.080 . 4.266 3.914 3.857 3.958 . 0 0 "[ . 1]" 1
96 2 37 LEU QD 2 41 ASN H 3.080 . 4.266 3.915 3.853 3.957 . 0 0 "[ . 1]" 1
97 1 37 LEU QD 1 40 ASN QD 2.872 . 3.903 2.974 2.606 4.100 0.197 8 0 "[ . 1]" 1
98 2 37 LEU QD 2 40 ASN QD 2.872 . 3.903 2.976 2.607 4.109 0.206 8 0 "[ . 1]" 1
99 1 37 LEU QD 1 40 ASN H 3.504 . 5.039 4.445 4.371 4.542 . 0 0 "[ . 1]" 1
100 2 37 LEU QD 2 40 ASN H 3.504 . 5.039 4.444 4.370 4.540 . 0 0 "[ . 1]" 1
101 1 37 LEU QD 1 41 ASN HD21 2.893 . 3.939 3.785 3.595 3.915 . 0 0 "[ . 1]" 1
102 2 37 LEU QD 2 41 ASN HD21 2.893 . 3.939 3.783 3.594 3.907 . 0 0 "[ . 1]" 1
103 1 59 GLY H 1 62 LEU MD1 3.285 . 4.634 3.997 3.927 4.091 . 0 0 "[ . 1]" 1
104 2 59 GLY H 2 62 LEU MD1 3.285 . 4.634 3.997 3.930 4.094 . 0 0 "[ . 1]" 1
105 1 37 LEU QD 2 35 GLU H 3.405 . 4.854 4.747 4.694 4.842 . 0 0 "[ . 1]" 1
106 1 35 GLU H 2 37 LEU QD 3.405 . 4.854 4.750 4.690 4.842 . 0 0 "[ . 1]" 1
107 1 37 LEU QD 2 34 ILE H 2.677 . 3.573 2.887 2.838 2.953 . 0 0 "[ . 1]" 1
108 1 34 ILE H 2 37 LEU QD 2.677 . 3.573 2.888 2.831 2.949 . 0 0 "[ . 1]" 1
109 1 62 LEU MD1 2 64 LYS H 3.288 . 4.525 4.458 4.255 4.599 0.074 4 0 "[ . 1]" 1
110 1 64 LYS H 2 62 LEU MD1 3.288 . 4.525 4.458 4.258 4.595 0.070 4 0 "[ . 1]" 1
111 1 25 GLN QE 1 27 LEU QD 3.007 . 4.137 3.255 2.635 3.913 . 0 0 "[ . 1]" 1
112 2 25 GLN QE 2 27 LEU QD 3.007 . 4.137 3.255 2.626 3.911 . 0 0 "[ . 1]" 1
113 1 27 LEU QD 1 60 TRP HH2 3.270 . 4.606 2.928 2.716 3.493 . 0 0 "[ . 1]" 1
114 2 27 LEU QD 2 60 TRP HH2 3.270 . 4.606 2.928 2.715 3.496 . 0 0 "[ . 1]" 1
115 1 56 LEU MD2 2 60 TRP HE3 2.489 . 3.264 2.202 2.179 2.235 . 0 0 "[ . 1]" 1
116 1 60 TRP HE3 2 56 LEU MD2 2.489 . 3.264 2.202 2.174 2.241 . 0 0 "[ . 1]" 1
117 1 56 LEU H 1 56 LEU MD1 2.732 . 3.665 3.538 3.514 3.561 . 0 0 "[ . 1]" 1
118 2 56 LEU H 2 56 LEU MD1 2.732 . 3.665 3.538 3.511 3.562 . 0 0 "[ . 1]" 1
119 1 50 ARG HG3 1 51 GLN H 3.132 . 4.359 4.168 4.039 4.297 . 0 0 "[ . 1]" 1
120 2 50 ARG HG3 2 51 GLN H 3.132 . 4.359 4.170 4.041 4.300 . 0 0 "[ . 1]" 1
121 1 50 ARG H 1 50 ARG HG2 2.674 . 3.568 3.348 3.179 3.468 . 0 0 "[ . 1]" 1
122 2 50 ARG H 2 50 ARG HG2 2.674 . 3.568 3.349 3.177 3.470 . 0 0 "[ . 1]" 1
123 1 50 ARG H 1 50 ARG HG3 2.623 . 3.483 2.192 2.084 2.500 . 0 0 "[ . 1]" 1
124 2 50 ARG H 2 50 ARG HG3 2.623 . 3.483 2.193 2.090 2.501 . 0 0 "[ . 1]" 1
125 1 38 LEU H 1 38 LEU MD2 2.651 . 3.530 2.308 2.261 2.333 . 0 0 "[ . 1]" 1
126 2 38 LEU H 2 38 LEU MD2 2.651 . 3.530 2.306 2.266 2.334 . 0 0 "[ . 1]" 1
127 1 37 LEU H 1 38 LEU MD2 3.363 . 4.777 3.882 3.844 3.913 . 0 0 "[ . 1]" 1
128 2 37 LEU H 2 38 LEU MD2 3.363 . 4.777 3.881 3.841 3.915 . 0 0 "[ . 1]" 1
129 1 35 GLU H 1 38 LEU MD2 3.405 . 4.855 4.437 4.379 4.548 . 0 0 "[ . 1]" 1
130 2 35 GLU H 2 38 LEU MD2 3.405 . 4.855 4.437 4.380 4.545 . 0 0 "[ . 1]" 1
131 1 37 LEU QD 1 41 ASN HD22 3.266 . 4.600 4.910 4.705 5.050 0.450 4 0 "[ . 1]" 1
132 2 37 LEU QD 2 41 ASN HD22 3.266 . 4.600 4.909 4.710 5.043 0.443 4 0 "[ . 1]" 1
133 1 29 VAL QG 1 60 TRP HE1 3.076 . 4.259 3.887 3.815 3.939 . 0 0 "[ . 1]" 1
134 2 29 VAL QG 2 60 TRP HE1 3.076 . 4.259 3.885 3.810 3.943 . 0 0 "[ . 1]" 1
135 1 29 VAL H 1 29 VAL QG 2.238 . 2.864 2.613 2.543 2.709 . 0 0 "[ . 1]" 1
136 2 29 VAL H 2 29 VAL QG 2.238 . 2.864 2.613 2.549 2.714 . 0 0 "[ . 1]" 1
137 1 29 VAL QG 1 60 TRP HH2 2.745 . 3.687 2.900 2.756 3.033 . 0 0 "[ . 1]" 1
138 2 29 VAL QG 2 60 TRP HH2 2.745 . 3.687 2.899 2.755 3.030 . 0 0 "[ . 1]" 1
139 1 29 VAL QG 1 31 TRP HZ2 2.730 . 3.661 2.955 2.869 3.036 . 0 0 "[ . 1]" 1
140 2 29 VAL QG 2 31 TRP HZ2 2.730 . 3.661 2.953 2.867 3.035 . 0 0 "[ . 1]" 1
141 1 34 ILE MG 1 37 LEU H 3.208 . 4.494 4.360 4.319 4.405 . 0 0 "[ . 1]" 1
142 2 34 ILE MG 2 37 LEU H 3.208 . 4.494 4.359 4.318 4.406 . 0 0 "[ . 1]" 1
143 1 31 TRP HZ3 1 34 ILE MG 3.184 . 4.452 3.407 3.035 3.672 . 0 0 "[ . 1]" 1
144 2 31 TRP HZ3 2 34 ILE MG 3.184 . 4.452 3.408 3.039 3.672 . 0 0 "[ . 1]" 1
145 1 34 ILE MD 1 35 GLU H 3.171 . 4.428 4.686 4.635 4.727 0.299 1 0 "[ . 1]" 1
146 2 34 ILE MD 2 35 GLU H 3.171 . 4.428 4.685 4.632 4.722 0.294 1 0 "[ . 1]" 1
147 1 34 ILE H 1 34 ILE MD 2.575 . 3.404 3.746 3.670 3.801 0.397 10 0 "[ . 1]" 1
148 2 34 ILE H 2 34 ILE MD 2.575 . 3.404 3.747 3.671 3.801 0.397 10 0 "[ . 1]" 1
149 1 31 TRP HE3 1 34 ILE MD 2.705 . 3.620 3.257 3.102 3.361 . 0 0 "[ . 1]" 1
150 2 31 TRP HE3 2 34 ILE MD 2.705 . 3.620 3.258 3.101 3.360 . 0 0 "[ . 1]" 1
151 1 30 PRO HD2 1 34 ILE MD 2.851 . 3.867 3.025 2.840 3.263 . 0 0 "[ . 1]" 1
152 2 30 PRO HD2 2 34 ILE MD 2.851 . 3.867 3.024 2.837 3.264 . 0 0 "[ . 1]" 1
153 1 29 VAL HA 1 34 ILE MD 2.916 . 3.979 4.211 4.087 4.351 0.372 7 0 "[ . 1]" 1
154 2 29 VAL HA 2 34 ILE MD 2.916 . 3.979 4.211 4.089 4.352 0.373 7 0 "[ . 1]" 1
155 1 34 ILE HB 1 34 ILE MD 2.195 . 2.797 2.439 2.411 2.465 . 0 0 "[ . 1]" 1
156 2 34 ILE HB 2 34 ILE MD 2.195 . 2.797 2.438 2.408 2.462 . 0 0 "[ . 1]" 1
157 1 34 ILE MD 1 34 ILE HG13 2.101 . 2.653 2.113 2.112 2.114 . 0 0 "[ . 1]" 1
158 2 34 ILE MD 2 34 ILE HG13 2.101 . 2.653 2.113 2.112 2.114 . 0 0 "[ . 1]" 1
159 1 34 ILE MD 2 56 LEU MD1 2.538 . 3.343 2.606 2.422 2.678 . 0 0 "[ . 1]" 1
160 1 56 LEU MD1 2 34 ILE MD 2.538 . 3.343 2.607 2.423 2.692 . 0 0 "[ . 1]" 1
161 1 29 VAL QG 1 34 ILE MD 1.984 . 2.476 1.854 1.840 1.877 . 0 0 "[ . 1]" 1
162 2 29 VAL QG 2 34 ILE MD 1.984 . 2.476 1.854 1.840 1.880 . 0 0 "[ . 1]" 1
163 1 63 ALA MB 2 58 LYS HE3 2.885 . 3.926 3.367 2.022 4.561 0.635 5 1 "[ + 1]" 1
164 1 58 LYS HE3 2 63 ALA MB 2.885 . 3.926 3.369 2.057 4.553 0.627 5 1 "[ + 1]" 1
165 1 63 ALA MB 2 55 ARG HD2 2.899 . 3.917 3.933 3.620 4.384 0.467 10 0 "[ . 1]" 1
166 1 55 ARG HD2 2 63 ALA MB 2.899 . 3.917 3.931 3.623 4.367 0.450 10 0 "[ . 1]" 1
167 1 63 ALA MB 2 59 GLY HA2 2.377 . 3.020 2.340 2.231 2.535 . 0 0 "[ . 1]" 1
168 1 59 GLY HA2 2 63 ALA MB 2.377 . 3.020 2.340 2.235 2.541 . 0 0 "[ . 1]" 1
169 1 42 PHE HB3 1 48 ALA MB 3.179 . 4.442 2.697 2.605 2.793 . 0 0 "[ . 1]" 1
170 2 42 PHE HB3 2 48 ALA MB 3.179 . 4.442 2.697 2.601 2.795 . 0 0 "[ . 1]" 1
171 1 48 ALA MB 1 49 VAL HA 2.899 . 3.950 3.933 3.894 3.963 0.013 2 0 "[ . 1]" 1
172 2 48 ALA MB 2 49 VAL HA 2.899 . 3.950 3.933 3.897 3.968 0.018 2 0 "[ . 1]" 1
173 1 45 ASP HB3 1 48 ALA MB 2.597 . 3.440 2.126 1.918 2.333 . 0 0 "[ . 1]" 1
174 2 45 ASP HB3 2 48 ALA MB 2.597 . 3.440 2.125 1.915 2.317 . 0 0 "[ . 1]" 1
175 1 42 PHE HB2 1 48 ALA MB 2.932 . 4.007 3.590 3.496 3.721 . 0 0 "[ . 1]" 1
176 2 42 PHE HB2 2 48 ALA MB 2.932 . 4.007 3.590 3.497 3.725 . 0 0 "[ . 1]" 1
177 1 36 ALA MB 1 39 LYS HE2 2.961 . 4.057 3.521 2.988 4.315 0.258 7 0 "[ . 1]" 1
178 2 36 ALA MB 2 39 LYS HE2 2.961 . 4.057 3.523 2.990 4.314 0.257 7 0 "[ . 1]" 1
179 1 47 ALA MB 1 51 GLN HG3 2.910 . 3.969 3.770 3.686 3.843 . 0 0 "[ . 1]" 1
180 2 47 ALA MB 2 51 GLN HG3 2.910 . 3.969 3.772 3.691 3.841 . 0 0 "[ . 1]" 1
181 1 34 ILE MG 1 35 GLU HA 3.101 . 4.303 3.233 3.091 3.326 . 0 0 "[ . 1]" 1
182 2 34 ILE MG 2 35 GLU HA 3.101 . 4.303 3.233 3.094 3.328 . 0 0 "[ . 1]" 1
183 1 34 ILE MG 1 53 MET ME 2.193 . 2.794 2.656 2.042 3.846 1.052 10 2 "[ . -+]" 1
184 2 34 ILE MG 2 53 MET ME 2.193 . 2.794 2.657 2.042 3.852 1.058 10 2 "[ . -+]" 1
185 1 34 ILE MD 1 53 MET ME 2.670 . 3.561 3.710 3.281 4.929 1.368 10 2 "[ . -+]" 1
186 2 34 ILE MD 2 53 MET ME 2.670 . 3.561 3.710 3.285 4.932 1.371 10 2 "[ . -+]" 1
187 1 53 MET ME 1 57 GLN QG 2.893 . 3.939 3.190 2.635 4.464 0.525 9 1 "[ . +1]" 1
188 2 53 MET ME 2 57 GLN QG 2.893 . 3.939 3.189 2.634 4.470 0.531 9 1 "[ . +1]" 1
189 1 29 VAL QG 1 53 MET ME 3.046 . 4.206 4.314 4.043 5.115 0.909 10 1 "[ . +]" 1
190 2 29 VAL QG 2 53 MET ME 3.046 . 4.206 4.314 4.042 5.118 0.912 10 1 "[ . +]" 1
191 1 34 ILE HB 1 34 ILE MG 2.004 . 2.506 2.127 2.127 2.128 . 0 0 "[ . 1]" 1
192 2 34 ILE HB 2 34 ILE MG 2.004 . 2.506 2.127 2.127 2.129 . 0 0 "[ . 1]" 1
193 1 38 LEU HA 1 38 LEU MD1 2.104 . 2.657 1.958 1.945 1.970 . 0 0 "[ . 1]" 1
194 2 38 LEU HA 2 38 LEU MD1 2.104 . 2.657 1.957 1.944 1.968 . 0 0 "[ . 1]" 1
195 1 38 LEU MD1 2 30 PRO HD3 2.610 . 3.462 2.488 2.434 2.580 . 0 0 "[ . 1]" 1
196 1 30 PRO HD3 2 38 LEU MD1 2.610 . 3.462 2.492 2.440 2.582 . 0 0 "[ . 1]" 1
197 1 38 LEU MD1 1 49 VAL HA 2.949 . 4.036 3.770 3.730 3.848 . 0 0 "[ . 1]" 1
198 2 38 LEU MD1 2 49 VAL HA 2.949 . 4.036 3.770 3.730 3.852 . 0 0 "[ . 1]" 1
199 1 38 LEU MD1 2 30 PRO HD2 2.541 . 3.348 2.073 2.015 2.108 . 0 0 "[ . 1]" 1
200 1 30 PRO HD2 2 38 LEU MD1 2.541 . 3.348 2.075 2.019 2.109 . 0 0 "[ . 1]" 1
201 1 38 LEU HB3 1 38 LEU MD1 2.265 . 2.906 2.331 2.316 2.352 . 0 0 "[ . 1]" 1
202 2 38 LEU HB3 2 38 LEU MD1 2.265 . 2.906 2.331 2.317 2.354 . 0 0 "[ . 1]" 1
203 1 38 LEU MD1 1 38 LEU HG 2.072 . 2.608 2.115 2.114 2.116 . 0 0 "[ . 1]" 1
204 2 38 LEU MD1 2 38 LEU HG 2.072 . 2.608 2.116 2.114 2.117 . 0 0 "[ . 1]" 1
205 1 38 LEU MD1 2 30 PRO HG3 2.367 . 3.067 2.819 2.747 2.895 . 0 0 "[ . 1]" 1
206 1 30 PRO HG3 2 38 LEU MD1 2.367 . 3.067 2.820 2.734 2.889 . 0 0 "[ . 1]" 1
207 1 28 THR HB 1 28 THR MG 1.894 . 2.342 2.136 2.135 2.137 . 0 0 "[ . 1]" 1
208 2 28 THR HB 2 28 THR MG 1.894 . 2.342 2.137 2.136 2.138 . 0 0 "[ . 1]" 1
209 1 62 LEU MD1 2 63 ALA HA 2.028 . 2.542 2.393 2.241 2.665 0.123 3 0 "[ . 1]" 1
210 1 63 ALA HA 2 62 LEU MD1 2.028 . 2.542 2.394 2.249 2.665 0.123 3 0 "[ . 1]" 1
211 1 58 LYS HE3 1 62 LEU MD1 2.708 . 3.625 2.788 2.054 3.291 . 0 0 "[ . 1]" 1
212 2 58 LYS HE3 2 62 LEU MD1 2.708 . 3.625 2.788 2.053 3.301 . 0 0 "[ . 1]" 1
213 1 29 VAL QG 2 52 VAL MG1 2.571 . 3.397 2.994 2.881 3.159 . 0 0 "[ . 1]" 1
214 1 52 VAL MG1 2 29 VAL QG 2.571 . 3.397 2.991 2.881 3.158 . 0 0 "[ . 1]" 1
215 1 29 VAL MG1 1 29 VAL MG2 1.945 . 2.418 2.078 2.075 2.082 . 0 0 "[ . 1]" 1
216 2 29 VAL MG1 2 29 VAL MG2 1.945 . 2.418 2.078 2.074 2.081 . 0 0 "[ . 1]" 1
217 1 58 LYS HA 1 58 LYS QG 2.911 . 3.062 2.487 2.439 2.545 . 0 0 "[ . 1]" 1
218 2 58 LYS HA 2 58 LYS QG 2.911 . 3.062 2.488 2.440 2.545 . 0 0 "[ . 1]" 1
219 1 58 LYS HE3 1 58 LYS QG 2.717 . 3.640 2.416 2.366 2.493 . 0 0 "[ . 1]" 1
220 2 58 LYS HE3 2 58 LYS QG 2.717 . 3.640 2.415 2.364 2.491 . 0 0 "[ . 1]" 1
221 1 64 LYS HA 1 64 LYS QG 2.863 . 3.043 2.993 2.448 3.354 0.311 10 0 "[ . 1]" 1
222 2 64 LYS HA 2 64 LYS QG 2.863 . 3.043 2.993 2.442 3.353 0.310 10 0 "[ . 1]" 1
223 1 64 LYS HE3 1 64 LYS QG 2.712 . 3.631 2.515 2.372 2.947 . 0 0 "[ . 1]" 1
224 2 64 LYS HE3 2 64 LYS QG 2.712 . 3.631 2.516 2.375 2.948 . 0 0 "[ . 1]" 1
225 1 49 VAL HA 1 52 VAL MG1 2.879 . 3.915 3.667 3.571 3.816 . 0 0 "[ . 1]" 1
226 2 49 VAL HA 2 52 VAL MG1 2.879 . 3.915 3.667 3.568 3.811 . 0 0 "[ . 1]" 1
227 1 37 LEU QD 1 40 ASN QB 2.602 . 3.448 3.067 2.958 3.208 . 0 0 "[ . 1]" 1
228 2 37 LEU QD 2 40 ASN QB 2.602 . 3.448 3.067 2.960 3.209 . 0 0 "[ . 1]" 1
229 1 37 LEU QD 2 33 ASP HB2 2.264 . 2.866 2.057 1.947 2.117 . 0 0 "[ . 1]" 1
230 1 33 ASP HB2 2 37 LEU QD 2.264 . 2.866 2.057 1.949 2.126 . 0 0 "[ . 1]" 1
231 1 27 LEU QD 2 48 ALA HA 2.597 . 3.013 2.581 2.236 2.725 . 0 0 "[ . 1]" 1
232 1 48 ALA HA 2 27 LEU QD 2.597 . 3.013 2.574 2.242 2.725 . 0 0 "[ . 1]" 1
233 1 37 LEU QD 2 34 ILE HA 2.309 . 2.976 2.569 2.484 2.674 . 0 0 "[ . 1]" 1
234 1 34 ILE HA 2 37 LEU QD 2.309 . 2.976 2.571 2.496 2.686 . 0 0 "[ . 1]" 1
235 1 37 LEU QD 2 30 PRO HB2 2.419 . 3.150 2.952 2.841 3.016 . 0 0 "[ . 1]" 1
236 1 30 PRO HB2 2 37 LEU QD 2.419 . 3.150 2.953 2.854 3.018 . 0 0 "[ . 1]" 1
237 1 27 LEU QD 2 51 GLN HG3 2.867 . 3.895 3.805 3.678 3.918 0.023 7 0 "[ . 1]" 1
238 1 51 GLN HG3 2 27 LEU QD 2.867 . 3.895 3.800 3.704 3.914 0.019 7 0 "[ . 1]" 1
239 1 56 LEU MD2 1 56 LEU HG 2.191 . 2.791 2.128 2.127 2.129 . 0 0 "[ . 1]" 1
240 2 56 LEU MD2 2 56 LEU HG 2.191 . 2.791 2.128 2.127 2.129 . 0 0 "[ . 1]" 1
241 1 56 LEU MD1 1 56 LEU HG 2.317 . 2.988 2.127 2.126 2.128 . 0 0 "[ . 1]" 1
242 2 56 LEU MD1 2 56 LEU HG 2.317 . 2.988 2.127 2.126 2.129 . 0 0 "[ . 1]" 1
243 1 58 LYS HB2 1 58 LYS QG 2.503 . 3.286 2.350 2.323 2.375 . 0 0 "[ . 1]" 1
244 2 58 LYS HB2 2 58 LYS QG 2.503 . 3.286 2.350 2.321 2.377 . 0 0 "[ . 1]" 1
245 1 58 LYS HB3 1 58 LYS QG 2.390 . 3.104 2.329 2.306 2.355 . 0 0 "[ . 1]" 1
246 2 58 LYS HB3 2 58 LYS QG 2.390 . 3.104 2.328 2.305 2.356 . 0 0 "[ . 1]" 1
247 1 50 ARG HA 1 50 ARG HG3 2.803 . 3.785 3.119 3.037 3.225 . 0 0 "[ . 1]" 1
248 2 50 ARG HA 2 50 ARG HG3 2.803 . 3.785 3.118 3.038 3.229 . 0 0 "[ . 1]" 1
249 1 50 ARG QD 1 50 ARG HG3 2.184 . 2.780 2.207 2.167 2.369 . 0 0 "[ . 1]" 1
250 2 50 ARG QD 2 50 ARG HG3 2.184 . 2.780 2.207 2.167 2.370 . 0 0 "[ . 1]" 1
251 1 39 LYS HE3 1 39 LYS QG 2.893 . 3.939 2.643 2.417 3.528 . 0 0 "[ . 1]" 1
252 2 39 LYS HE3 2 39 LYS QG 2.893 . 3.939 2.644 2.418 3.526 . 0 0 "[ . 1]" 1
253 1 39 LYS HE2 1 39 LYS QG 2.839 . 3.846 3.026 2.855 3.485 . 0 0 "[ . 1]" 1
254 2 39 LYS HE2 2 39 LYS QG 2.839 . 3.846 3.024 2.853 3.482 . 0 0 "[ . 1]" 1
255 1 37 LEU HB2 1 37 LEU QD 2.035 . 2.552 2.118 2.115 2.121 . 0 0 "[ . 1]" 1
256 2 37 LEU HB2 2 37 LEU QD 2.035 . 2.552 2.118 2.115 2.121 . 0 0 "[ . 1]" 1
257 1 37 LEU HB3 1 37 LEU QD 2.137 . 2.708 2.253 2.242 2.266 . 0 0 "[ . 1]" 1
258 2 37 LEU HB3 2 37 LEU QD 2.137 . 2.708 2.253 2.242 2.267 . 0 0 "[ . 1]" 1
259 1 37 LEU QD 2 34 ILE HG13 2.202 . 2.808 2.228 2.170 2.278 . 0 0 "[ . 1]" 1
260 1 34 ILE HG13 2 37 LEU QD 2.202 . 2.808 2.232 2.175 2.266 . 0 0 "[ . 1]" 1
261 1 27 LEU HB3 1 27 LEU QD 2.184 . 2.521 2.104 2.096 2.112 . 0 0 "[ . 1]" 1
262 2 27 LEU HB3 2 27 LEU QD 2.184 . 2.521 2.103 2.096 2.112 . 0 0 "[ . 1]" 1
263 1 62 LEU MD1 2 63 ALA MB 2.133 . 2.702 2.163 2.053 2.385 . 0 0 "[ . 1]" 1
264 1 63 ALA MB 2 62 LEU MD1 2.133 . 2.702 2.161 2.025 2.364 . 0 0 "[ . 1]" 1
265 1 27 LEU QD 2 52 VAL MG1 2.029 . 2.406 1.835 1.792 1.873 . 0 0 "[ . 1]" 1
266 1 52 VAL MG1 2 27 LEU QD 2.029 . 2.406 1.833 1.799 1.877 . 0 0 "[ . 1]" 1
267 1 37 LEU QD 2 34 ILE MD 2.394 . 3.111 3.095 3.004 3.141 0.030 8 0 "[ . 1]" 1
268 1 34 ILE MD 2 37 LEU QD 2.394 . 3.111 3.097 3.037 3.142 0.031 9 0 "[ . 1]" 1
269 1 38 LEU MD2 1 38 LEU HG 2.217 . 2.831 2.125 2.124 2.127 . 0 0 "[ . 1]" 1
270 2 38 LEU MD2 2 38 LEU HG 2.217 . 2.831 2.125 2.124 2.127 . 0 0 "[ . 1]" 1
271 1 35 GLU HA 1 38 LEU MD2 2.760 . 3.712 3.546 3.424 3.760 0.048 10 0 "[ . 1]" 1
272 2 35 GLU HA 2 38 LEU MD2 2.760 . 3.712 3.546 3.423 3.760 0.048 10 0 "[ . 1]" 1
273 1 51 GLN HA 1 54 GLU HB2 2.458 . 3.213 2.917 2.735 3.064 . 0 0 "[ . 1]" 1
274 2 51 GLN HA 2 54 GLU HB2 2.458 . 3.213 2.917 2.730 3.071 . 0 0 "[ . 1]" 1
275 1 51 GLN HA 1 51 GLN HB2 2.593 . 3.434 3.012 3.009 3.015 . 0 0 "[ . 1]" 1
276 2 51 GLN HA 2 51 GLN HB2 2.593 . 3.434 3.011 3.009 3.014 . 0 0 "[ . 1]" 1
277 1 51 GLN HB2 2 27 LEU QD 2.773 . 3.210 2.156 2.034 2.323 . 0 0 "[ . 1]" 1
278 1 27 LEU QD 2 51 GLN HB2 2.773 . 3.210 2.161 2.013 2.325 . 0 0 "[ . 1]" 1
279 1 51 GLN HB2 1 52 VAL MG1 3.135 . 4.363 3.229 3.140 3.330 . 0 0 "[ . 1]" 1
280 2 51 GLN HB2 2 52 VAL MG1 3.135 . 4.363 3.229 3.142 3.329 . 0 0 "[ . 1]" 1
281 1 53 MET QB 1 54 GLU H 2.658 . 3.541 2.657 2.532 2.717 . 0 0 "[ . 1]" 1
282 2 53 MET QB 2 54 GLU H 2.658 . 3.541 2.656 2.531 2.717 . 0 0 "[ . 1]" 1
283 1 54 GLU HB2 1 55 ARG H 2.712 . 3.632 2.992 2.927 3.057 . 0 0 "[ . 1]" 1
284 2 54 GLU HB2 2 55 ARG H 2.712 . 3.632 2.992 2.935 3.056 . 0 0 "[ . 1]" 1
285 1 35 GLU H 1 35 GLU HB3 2.705 . 3.620 2.548 2.484 2.662 . 0 0 "[ . 1]" 1
286 2 35 GLU H 2 35 GLU HB3 2.705 . 3.620 2.551 2.490 2.667 . 0 0 "[ . 1]" 1
287 1 46 GLN H 1 46 GLN HG2 2.570 . 3.396 2.201 2.136 2.300 . 0 0 "[ . 1]" 1
288 2 46 GLN H 2 46 GLN HG2 2.570 . 3.396 2.200 2.140 2.304 . 0 0 "[ . 1]" 1
289 1 46 GLN HG2 1 47 ALA H 3.243 . 4.557 4.205 4.095 4.384 . 0 0 "[ . 1]" 1
290 2 46 GLN HG2 2 47 ALA H 3.243 . 4.557 4.203 4.095 4.384 . 0 0 "[ . 1]" 1
291 1 25 GLN QE 1 25 GLN QG 2.777 . 3.741 2.187 2.127 2.213 . 0 0 "[ . 1]" 1
292 2 25 GLN QE 2 25 GLN QG 2.777 . 3.741 2.189 2.130 2.223 . 0 0 "[ . 1]" 1
293 1 46 GLN HE21 1 46 GLN HG3 3.122 . 4.340 3.409 2.929 3.470 . 0 0 "[ . 1]" 1
294 2 46 GLN HE21 2 46 GLN HG3 3.122 . 4.340 3.410 2.938 3.471 . 0 0 "[ . 1]" 1
295 1 58 LYS HB2 1 59 GLY H 2.848 . 3.862 3.764 3.721 3.800 . 0 0 "[ . 1]" 1
296 2 58 LYS HB2 2 59 GLY H 2.848 . 3.862 3.762 3.724 3.795 . 0 0 "[ . 1]" 1
297 1 58 LYS H 1 58 LYS HB2 2.410 . 3.136 2.543 2.521 2.569 . 0 0 "[ . 1]" 1
298 2 58 LYS H 2 58 LYS HB2 2.410 . 3.136 2.543 2.526 2.561 . 0 0 "[ . 1]" 1
299 1 49 VAL HB 1 50 ARG H 2.484 . 3.255 2.439 2.341 2.488 . 0 0 "[ . 1]" 1
300 2 49 VAL HB 2 50 ARG H 2.484 . 3.255 2.440 2.346 2.488 . 0 0 "[ . 1]" 1
301 1 49 VAL H 1 49 VAL HB 2.359 . 3.055 2.648 2.633 2.667 . 0 0 "[ . 1]" 1
302 2 49 VAL H 2 49 VAL HB 2.359 . 3.055 2.648 2.636 2.668 . 0 0 "[ . 1]" 1
303 1 34 ILE HB 1 35 GLU H 2.727 . 3.657 2.656 2.603 2.716 . 0 0 "[ . 1]" 1
304 2 34 ILE HB 2 35 GLU H 2.727 . 3.657 2.656 2.602 2.713 . 0 0 "[ . 1]" 1
305 1 34 ILE H 1 34 ILE HB 2.475 . 3.241 2.387 2.322 2.443 . 0 0 "[ . 1]" 1
306 2 34 ILE H 2 34 ILE HB 2.475 . 3.241 2.388 2.323 2.442 . 0 0 "[ . 1]" 1
307 1 31 TRP HE3 1 34 ILE HB 3.146 . 4.383 3.298 3.182 3.427 . 0 0 "[ . 1]" 1
308 2 31 TRP HE3 2 34 ILE HB 3.146 . 4.383 3.299 3.178 3.427 . 0 0 "[ . 1]" 1
309 1 42 PHE H 1 43 GLU QG 3.162 . 4.412 4.190 3.922 4.361 . 0 0 "[ . 1]" 1
310 2 42 PHE H 2 43 GLU QG 3.162 . 4.412 4.189 3.929 4.356 . 0 0 "[ . 1]" 1
311 1 43 GLU H 1 43 GLU HG2 2.198 . 2.802 2.507 2.208 3.443 0.641 9 2 "[ - +1]" 1
312 2 43 GLU H 2 43 GLU HG2 2.198 . 2.802 2.507 2.215 3.441 0.639 9 2 "[ - +1]" 1
313 1 54 GLU H 1 54 GLU QG 2.452 . 3.203 2.457 2.381 2.510 . 0 0 "[ . 1]" 1
314 2 54 GLU H 2 54 GLU QG 2.452 . 3.203 2.456 2.380 2.518 . 0 0 "[ . 1]" 1
315 1 42 PHE HB2 1 42 PHE QD 2.867 . 3.894 2.311 2.301 2.337 . 0 0 "[ . 1]" 1
316 2 42 PHE HB2 2 42 PHE QD 2.867 . 3.894 2.312 2.300 2.338 . 0 0 "[ . 1]" 1
317 1 54 GLU QG 1 55 ARG H 3.316 . 4.691 4.231 4.196 4.277 . 0 0 "[ . 1]" 1
318 2 54 GLU QG 2 55 ARG H 3.316 . 4.691 4.231 4.194 4.276 . 0 0 "[ . 1]" 1
319 1 26 GLU H 1 26 GLU QG 2.335 . 3.016 2.642 1.909 3.449 0.433 2 0 "[ . 1]" 1
320 2 26 GLU H 2 26 GLU QG 2.335 . 3.016 2.646 1.903 3.453 0.437 2 0 "[ . 1]" 1
321 1 41 ASN H 1 41 ASN QB 2.186 . 2.728 2.211 2.191 2.232 . 0 0 "[ . 1]" 1
322 2 41 ASN H 2 41 ASN QB 2.186 . 2.728 2.212 2.194 2.231 . 0 0 "[ . 1]" 1
323 1 40 ASN H 1 41 ASN QB 3.275 . 4.616 4.307 4.259 4.351 . 0 0 "[ . 1]" 1
324 2 40 ASN H 2 41 ASN QB 3.275 . 4.616 4.308 4.253 4.365 . 0 0 "[ . 1]" 1
325 1 41 ASN QB 1 41 ASN HD21 2.914 . 3.975 2.203 2.195 2.211 . 0 0 "[ . 1]" 1
326 2 41 ASN QB 2 41 ASN HD21 2.914 . 3.975 2.201 2.193 2.211 . 0 0 "[ . 1]" 1
327 1 41 ASN QB 1 42 PHE QD 2.867 . 3.894 2.875 2.758 2.951 . 0 0 "[ . 1]" 1
328 2 41 ASN QB 2 42 PHE QD 2.867 . 3.894 2.873 2.752 2.950 . 0 0 "[ . 1]" 1
329 1 41 ASN QB 1 41 ASN HD22 2.817 . 3.786 3.283 3.279 3.285 . 0 0 "[ . 1]" 1
330 2 41 ASN QB 2 41 ASN HD22 2.817 . 3.786 3.283 3.280 3.286 . 0 0 "[ . 1]" 1
331 1 41 ASN HA 1 41 ASN QB 2.543 . 2.621 2.397 2.376 2.419 . 0 0 "[ . 1]" 1
332 2 41 ASN HA 2 41 ASN QB 2.543 . 2.621 2.398 2.379 2.417 . 0 0 "[ . 1]" 1
333 1 38 LEU HA 1 41 ASN QB 2.597 . 3.160 2.037 1.960 2.196 . 0 0 "[ . 1]" 1
334 2 38 LEU HA 2 41 ASN QB 2.597 . 3.160 2.039 1.968 2.198 . 0 0 "[ . 1]" 1
335 1 40 ASN HA 1 40 ASN QB . . 2.477 2.314 2.268 2.444 . 0 0 "[ . 1]" 1
336 2 40 ASN HA 2 40 ASN QB . . 2.477 2.314 2.269 2.442 . 0 0 "[ . 1]" 1
337 1 37 LEU QD 1 41 ASN QB 3.066 . 4.241 3.353 3.264 3.421 . 0 0 "[ . 1]" 1
338 2 37 LEU QD 2 41 ASN QB 3.066 . 4.241 3.354 3.266 3.423 . 0 0 "[ . 1]" 1
339 1 38 LEU MD1 1 41 ASN QB 2.810 . 3.165 2.492 2.403 2.677 . 0 0 "[ . 1]" 1
340 2 38 LEU MD1 2 41 ASN QB 2.810 . 3.165 2.492 2.400 2.681 . 0 0 "[ . 1]" 1
341 1 37 LEU HG 1 41 ASN QB 3.116 . 4.330 3.289 3.233 3.354 . 0 0 "[ . 1]" 1
342 2 37 LEU HG 2 41 ASN QB 3.116 . 4.330 3.289 3.237 3.359 . 0 0 "[ . 1]" 1
343 1 41 ASN QB 2 30 PRO HG3 3.282 . 4.344 2.569 2.428 2.666 . 0 0 "[ . 1]" 1
344 1 30 PRO HG3 2 41 ASN QB 3.282 . 4.344 2.573 2.447 2.639 . 0 0 "[ . 1]" 1
345 1 27 LEU H 1 27 LEU HB3 2.573 . 3.401 3.649 3.552 3.814 0.413 5 0 "[ . 1]" 1
346 2 27 LEU H 2 27 LEU HB3 2.573 . 3.401 3.650 3.552 3.816 0.415 5 0 "[ . 1]" 1
347 1 27 LEU HB3 1 28 THR H 2.653 . 3.533 3.070 2.718 3.228 . 0 0 "[ . 1]" 1
348 2 27 LEU HB3 2 28 THR H 2.653 . 3.533 3.070 2.709 3.233 . 0 0 "[ . 1]" 1
349 1 27 LEU HB3 1 60 TRP HZ2 3.291 . 4.645 3.488 3.092 4.181 . 0 0 "[ . 1]" 1
350 2 27 LEU HB3 2 60 TRP HZ2 3.291 . 4.645 3.488 3.092 4.179 . 0 0 "[ . 1]" 1
351 1 27 LEU HB3 2 42 PHE HZ 3.091 . 4.285 3.073 2.743 3.301 . 0 0 "[ . 1]" 1
352 1 42 PHE HZ 2 27 LEU HB3 3.091 . 4.285 3.072 2.763 3.311 . 0 0 "[ . 1]" 1
353 1 27 LEU HB2 1 60 TRP HH2 3.309 . 4.678 2.730 2.584 2.956 . 0 0 "[ . 1]" 1
354 2 27 LEU HB2 2 60 TRP HH2 3.309 . 4.678 2.730 2.585 2.960 . 0 0 "[ . 1]" 1
355 1 27 LEU HB3 1 60 TRP HH2 3.352 . 4.757 3.080 2.798 3.811 . 0 0 "[ . 1]" 1
356 2 27 LEU HB3 2 60 TRP HH2 3.352 . 4.757 3.080 2.802 3.812 . 0 0 "[ . 1]" 1
357 1 37 LEU HB2 1 38 LEU H 2.832 . 3.835 3.886 3.851 3.917 0.082 6 0 "[ . 1]" 1
358 2 37 LEU HB2 2 38 LEU H 2.832 . 3.835 3.886 3.852 3.912 0.077 5 0 "[ . 1]" 1
359 1 37 LEU H 1 37 LEU HB3 2.397 . 3.115 2.380 2.373 2.384 . 0 0 "[ . 1]" 1
360 2 37 LEU H 2 37 LEU HB3 2.397 . 3.115 2.380 2.373 2.383 . 0 0 "[ . 1]" 1
361 1 37 LEU HB3 1 38 LEU H 2.657 . 3.539 2.547 2.493 2.595 . 0 0 "[ . 1]" 1
362 2 37 LEU HB3 2 38 LEU H 2.657 . 3.539 2.546 2.496 2.592 . 0 0 "[ . 1]" 1
363 1 38 LEU H 1 38 LEU HB2 2.755 . 3.704 2.218 2.208 2.234 . 0 0 "[ . 1]" 1
364 2 38 LEU H 2 38 LEU HB2 2.755 . 3.704 2.217 2.210 2.234 . 0 0 "[ . 1]" 1
365 1 38 LEU HB3 1 42 PHE QD 3.048 . 4.209 2.740 2.703 2.794 . 0 0 "[ . 1]" 1
366 2 38 LEU HB3 2 42 PHE QD 3.048 . 4.209 2.740 2.701 2.796 . 0 0 "[ . 1]" 1
367 1 55 ARG HD2 2 25 GLN QE 3.214 . 4.505 2.476 1.952 3.639 . 0 0 "[ . 1]" 1
368 1 25 GLN QE 2 55 ARG HD2 3.214 . 4.505 2.474 1.958 3.669 . 0 0 "[ . 1]" 1
369 1 45 ASP HB2 1 46 GLN H 3.188 . 4.458 4.515 4.477 4.667 0.209 7 0 "[ . 1]" 1
370 2 45 ASP HB2 2 46 GLN H 3.188 . 4.458 4.516 4.474 4.675 0.217 7 0 "[ . 1]" 1
371 1 45 ASP H 1 45 ASP HB2 2.379 . 3.087 2.612 2.480 3.379 0.292 7 0 "[ . 1]" 1
372 2 45 ASP H 2 45 ASP HB2 2.379 . 3.087 2.612 2.474 3.385 0.298 7 0 "[ . 1]" 1
373 1 45 ASP HB3 1 48 ALA H 2.427 . 3.163 2.608 2.337 3.044 . 0 0 "[ . 1]" 1
374 2 45 ASP HB3 2 48 ALA H 2.427 . 3.163 2.609 2.327 3.053 . 0 0 "[ . 1]" 1
375 1 56 LEU HB2 1 57 GLN H 2.906 . 3.962 2.651 2.597 2.696 . 0 0 "[ . 1]" 1
376 2 56 LEU HB2 2 57 GLN H 2.906 . 3.962 2.652 2.599 2.694 . 0 0 "[ . 1]" 1
377 1 56 LEU HB3 1 57 GLN H 3.145 . 4.381 3.495 3.462 3.513 . 0 0 "[ . 1]" 1
378 2 56 LEU HB3 2 57 GLN H 3.145 . 4.381 3.496 3.467 3.513 . 0 0 "[ . 1]" 1
379 1 31 TRP HZ3 1 56 LEU HB2 2.779 . 3.744 2.509 2.283 2.779 . 0 0 "[ . 1]" 1
380 2 31 TRP HZ3 2 56 LEU HB2 2.779 . 3.744 2.510 2.287 2.774 . 0 0 "[ . 1]" 1
381 1 31 TRP HZ3 1 56 LEU HB3 2.798 . 3.777 2.060 1.945 2.257 . 0 0 "[ . 1]" 1
382 2 31 TRP HZ3 2 56 LEU HB3 2.798 . 3.777 2.061 1.944 2.255 . 0 0 "[ . 1]" 1
383 1 40 ASN QB 1 41 ASN H 2.455 . 3.208 2.656 2.596 2.793 . 0 0 "[ . 1]" 1
384 2 40 ASN QB 2 41 ASN H 2.455 . 3.208 2.659 2.597 2.792 . 0 0 "[ . 1]" 1
385 1 40 ASN H 1 40 ASN QB 2.204 . 2.811 2.187 2.135 2.273 . 0 0 "[ . 1]" 1
386 2 40 ASN H 2 40 ASN QB 2.204 . 2.811 2.187 2.138 2.269 . 0 0 "[ . 1]" 1
387 1 40 ASN QB 1 40 ASN QD 2.537 . 3.341 2.156 2.146 2.176 . 0 0 "[ . 1]" 1
388 2 40 ASN QB 2 40 ASN QD 2.537 . 3.341 2.155 2.142 2.181 . 0 0 "[ . 1]" 1
389 1 44 ASN H 1 44 ASN HB2 2.635 . 3.503 3.511 3.400 3.582 0.079 3 0 "[ . 1]" 1
390 2 44 ASN H 2 44 ASN HB2 2.635 . 3.503 3.512 3.397 3.584 0.081 10 0 "[ . 1]" 1
391 1 44 ASN H 1 44 ASN HB3 2.563 . 3.384 3.112 3.016 3.216 . 0 0 "[ . 1]" 1
392 2 44 ASN H 2 44 ASN HB3 2.563 . 3.384 3.112 3.008 3.222 . 0 0 "[ . 1]" 1
393 1 44 ASN HB2 1 44 ASN HD21 2.863 . 3.887 3.275 2.209 3.465 . 0 0 "[ . 1]" 1
394 2 44 ASN HB2 2 44 ASN HD21 2.863 . 3.887 3.276 2.220 3.464 . 0 0 "[ . 1]" 1
395 1 44 ASN HB3 1 44 ASN HD21 2.706 . 3.621 2.295 2.215 2.916 . 0 0 "[ . 1]" 1
396 2 44 ASN HB3 2 44 ASN HD21 2.706 . 3.621 2.294 2.215 2.913 . 0 0 "[ . 1]" 1
397 1 59 GLY H 1 59 GLY HA2 2.528 . 3.327 2.767 2.758 2.776 . 0 0 "[ . 1]" 1
398 2 59 GLY H 2 59 GLY HA2 2.528 . 3.327 2.767 2.757 2.777 . 0 0 "[ . 1]" 1
399 1 59 GLY HA3 1 60 TRP H 2.958 . 4.052 2.811 2.772 2.836 . 0 0 "[ . 1]" 1
400 2 59 GLY HA3 2 60 TRP H 2.958 . 4.052 2.810 2.771 2.839 . 0 0 "[ . 1]" 1
401 1 40 ASN HA 1 43 GLU H 2.820 . 3.814 3.532 3.332 3.633 . 0 0 "[ . 1]" 1
402 2 40 ASN HA 2 43 GLU H 2.820 . 3.814 3.531 3.325 3.638 . 0 0 "[ . 1]" 1
403 1 40 ASN H 1 40 ASN HA 2.222 . 2.839 2.820 2.802 2.837 . 0 0 "[ . 1]" 1
404 2 40 ASN H 2 40 ASN HA 2.222 . 2.839 2.820 2.801 2.840 0.001 8 0 "[ . 1]" 1
405 1 36 ALA HA 1 39 LYS H 2.686 . 3.588 3.346 3.267 3.420 . 0 0 "[ . 1]" 1
406 2 36 ALA HA 2 39 LYS H 2.686 . 3.588 3.348 3.272 3.419 . 0 0 "[ . 1]" 1
407 1 36 ALA H 1 36 ALA HA 2.376 . 3.082 2.837 2.826 2.844 . 0 0 "[ . 1]" 1
408 2 36 ALA H 2 36 ALA HA 2.376 . 3.082 2.836 2.825 2.843 . 0 0 "[ . 1]" 1
409 1 36 ALA HA 1 37 LEU H 2.877 . 3.912 3.503 3.498 3.509 . 0 0 "[ . 1]" 1
410 2 36 ALA HA 2 37 LEU H 2.877 . 3.912 3.504 3.499 3.509 . 0 0 "[ . 1]" 1
411 1 27 LEU H 1 27 LEU HA 2.414 . 3.142 2.877 2.776 2.937 . 0 0 "[ . 1]" 1
412 2 27 LEU H 2 27 LEU HA 2.414 . 3.142 2.877 2.776 2.936 . 0 0 "[ . 1]" 1
413 1 27 LEU HA 1 28 THR H 1.878 . 2.319 2.183 2.142 2.284 . 0 0 "[ . 1]" 1
414 2 27 LEU HA 2 28 THR H 1.878 . 2.319 2.182 2.142 2.283 . 0 0 "[ . 1]" 1
415 1 47 ALA H 1 47 ALA HA 2.303 . 2.966 2.801 2.759 2.908 . 0 0 "[ . 1]" 1
416 2 47 ALA H 2 47 ALA HA 2.303 . 2.966 2.801 2.759 2.908 . 0 0 "[ . 1]" 1
417 1 47 ALA HA 1 50 ARG H 2.642 . 3.515 3.407 3.036 3.510 . 0 0 "[ . 1]" 1
418 2 47 ALA HA 2 50 ARG H 2.642 . 3.515 3.408 3.027 3.512 . 0 0 "[ . 1]" 1
419 1 47 ALA HA 1 48 ALA H 2.664 . 3.551 3.476 3.422 3.500 . 0 0 "[ . 1]" 1
420 2 47 ALA HA 2 48 ALA H 2.664 . 3.551 3.477 3.423 3.501 . 0 0 "[ . 1]" 1
421 1 48 ALA HA 1 52 VAL H 2.964 . 4.062 3.906 3.787 3.961 . 0 0 "[ . 1]" 1
422 2 48 ALA HA 2 52 VAL H 2.964 . 4.062 3.906 3.785 3.964 . 0 0 "[ . 1]" 1
423 1 48 ALA HA 1 51 GLN H 2.610 . 3.461 3.167 3.103 3.258 . 0 0 "[ . 1]" 1
424 2 48 ALA HA 2 51 GLN H 2.610 . 3.461 3.164 3.103 3.253 . 0 0 "[ . 1]" 1
425 1 48 ALA H 1 48 ALA HA 2.271 . 2.916 2.881 2.875 2.887 . 0 0 "[ . 1]" 1
426 2 48 ALA H 2 48 ALA HA 2.271 . 2.916 2.881 2.877 2.887 . 0 0 "[ . 1]" 1
427 1 44 ASN H 1 44 ASN HA 2.083 . 2.626 2.826 2.803 2.869 0.243 5 0 "[ . 1]" 1
428 2 44 ASN H 2 44 ASN HA 2.083 . 2.626 2.826 2.802 2.869 0.243 5 0 "[ . 1]" 1
429 1 42 PHE H 1 42 PHE HA 2.298 . 2.958 2.929 2.927 2.931 . 0 0 "[ . 1]" 1
430 2 42 PHE H 2 42 PHE HA 2.298 . 2.958 2.930 2.928 2.933 . 0 0 "[ . 1]" 1
431 1 42 PHE HA 1 43 GLU H 2.444 . 3.191 2.970 2.945 3.007 . 0 0 "[ . 1]" 1
432 2 42 PHE HA 2 43 GLU H 2.444 . 3.191 2.971 2.946 3.005 . 0 0 "[ . 1]" 1
433 1 42 PHE HA 1 42 PHE QD 2.355 . 3.048 2.642 2.581 2.763 . 0 0 "[ . 1]" 1
434 2 42 PHE HA 2 42 PHE QD 2.355 . 3.048 2.642 2.587 2.762 . 0 0 "[ . 1]" 1
435 1 36 ALA HA 1 40 ASN H 3.300 . 4.662 4.039 3.959 4.105 . 0 0 "[ . 1]" 1
436 2 36 ALA HA 2 40 ASN H 3.300 . 4.662 4.041 3.960 4.113 . 0 0 "[ . 1]" 1
437 1 48 ALA HA 1 51 GLN QE 3.115 . 4.328 2.173 1.916 2.436 0.074 2 0 "[ . 1]" 1
438 2 48 ALA HA 2 51 GLN QE 3.115 . 4.328 2.173 1.924 2.441 0.066 2 0 "[ . 1]" 1
439 1 48 ALA HA 1 50 ARG H 3.305 . 4.670 4.219 4.147 4.308 . 0 0 "[ . 1]" 1
440 2 48 ALA HA 2 50 ARG H 3.305 . 4.670 4.218 4.151 4.302 . 0 0 "[ . 1]" 1
441 1 53 MET HA 1 56 LEU H 2.987 . 4.103 3.539 3.457 3.726 . 0 0 "[ . 1]" 1
442 2 53 MET HA 2 56 LEU H 2.987 . 4.103 3.539 3.460 3.722 . 0 0 "[ . 1]" 1
443 1 62 LEU HA 1 64 LYS H 3.122 . 4.340 3.675 3.622 3.727 . 0 0 "[ . 1]" 1
444 2 62 LEU HA 2 64 LYS H 3.122 . 4.340 3.676 3.618 3.733 . 0 0 "[ . 1]" 1
445 1 31 TRP HZ3 1 53 MET HA 3.466 . 4.968 4.113 3.673 4.573 . 0 0 "[ . 1]" 1
446 2 31 TRP HZ3 2 53 MET HA 3.466 . 4.968 4.115 3.679 4.573 . 0 0 "[ . 1]" 1
447 1 40 ASN HA 1 40 ASN QD 3.416 . 4.338 3.794 3.476 3.903 . 0 0 "[ . 1]" 1
448 2 40 ASN HA 2 40 ASN QD 3.416 . 4.338 3.793 3.477 3.897 . 0 0 "[ . 1]" 1
449 1 40 ASN QD 1 41 ASN HA 3.253 . 4.576 3.411 3.017 6.276 1.700 8 1 "[ . + 1]" 1
450 2 40 ASN QD 2 41 ASN HA 3.253 . 4.576 3.412 3.017 6.283 1.707 8 1 "[ . + 1]" 1
451 1 41 ASN HA 1 41 ASN HD21 3.337 . 4.729 2.887 2.865 2.913 . 0 0 "[ . 1]" 1
452 2 41 ASN HA 2 41 ASN HD21 3.337 . 4.729 2.888 2.873 2.905 . 0 0 "[ . 1]" 1
453 1 47 ALA HA 1 51 GLN H 3.058 . 4.227 4.190 4.041 4.227 0.000 9 0 "[ . 1]" 1
454 2 47 ALA HA 2 51 GLN H 3.058 . 4.227 4.193 4.041 4.243 0.016 9 0 "[ . 1]" 1
455 1 46 GLN H 1 46 GLN HA 2.338 . 3.021 2.839 2.831 2.857 . 0 0 "[ . 1]" 1
456 2 46 GLN H 2 46 GLN HA 2.338 . 3.021 2.839 2.830 2.857 . 0 0 "[ . 1]" 1
457 1 46 GLN HA 1 47 ALA H 2.699 . 3.609 3.450 3.326 3.509 . 0 0 "[ . 1]" 1
458 2 46 GLN HA 2 47 ALA H 2.699 . 3.609 3.450 3.326 3.511 . 0 0 "[ . 1]" 1
459 1 37 LEU HA 1 41 ASN H 3.085 . 4.275 4.133 4.068 4.185 . 0 0 "[ . 1]" 1
460 2 37 LEU HA 2 41 ASN H 3.085 . 4.275 4.134 4.075 4.190 . 0 0 "[ . 1]" 1
461 1 37 LEU H 1 37 LEU HA 2.332 . 3.012 2.846 2.837 2.853 . 0 0 "[ . 1]" 1
462 2 37 LEU H 2 37 LEU HA 2.332 . 3.012 2.846 2.837 2.854 . 0 0 "[ . 1]" 1
463 1 37 LEU HA 1 40 ASN H 2.651 . 3.529 3.499 3.436 3.562 0.033 7 0 "[ . 1]" 1
464 2 37 LEU HA 2 40 ASN H 2.651 . 3.529 3.500 3.436 3.563 0.034 1 0 "[ . 1]" 1
465 1 43 GLU HA 1 44 ASN H 2.301 . 2.963 2.739 2.703 2.772 . 0 0 "[ . 1]" 1
466 2 43 GLU HA 2 44 ASN H 2.301 . 2.963 2.738 2.701 2.767 . 0 0 "[ . 1]" 1
467 1 42 PHE H 1 43 GLU HA 3.045 . 4.204 4.530 4.472 4.678 0.474 7 0 "[ . 1]" 1
468 2 42 PHE H 2 43 GLU HA 3.045 . 4.204 4.529 4.476 4.682 0.478 7 0 "[ . 1]" 1
469 1 43 GLU H 1 43 GLU HA 1.962 . 2.443 2.640 2.595 2.755 0.312 7 0 "[ . 1]" 1
470 2 43 GLU H 2 43 GLU HA 1.962 . 2.443 2.640 2.598 2.755 0.312 7 0 "[ . 1]" 1
471 1 38 LEU HA 1 40 ASN H 3.235 . 4.543 4.340 4.263 4.406 . 0 0 "[ . 1]" 1
472 2 38 LEU HA 2 40 ASN H 3.235 . 4.543 4.338 4.258 4.405 . 0 0 "[ . 1]" 1
473 1 38 LEU HA 1 42 PHE QD 2.806 . 3.790 3.256 3.163 3.313 . 0 0 "[ . 1]" 1
474 2 38 LEU HA 2 42 PHE QD 2.806 . 3.790 3.254 3.159 3.315 . 0 0 "[ . 1]" 1
475 1 38 LEU HA 1 41 ASN H 2.677 . 3.573 2.974 2.897 3.113 . 0 0 "[ . 1]" 1
476 2 38 LEU HA 2 41 ASN H 2.677 . 3.573 2.972 2.891 3.108 . 0 0 "[ . 1]" 1
477 1 33 ASP HA 1 34 ILE H 2.835 . 3.839 3.519 3.507 3.527 . 0 0 "[ . 1]" 1
478 2 33 ASP HA 2 34 ILE H 2.835 . 3.839 3.519 3.508 3.530 . 0 0 "[ . 1]" 1
479 1 32 ASP HA 1 35 GLU H 2.799 . 3.778 3.503 3.379 3.678 . 0 0 "[ . 1]" 1
480 2 32 ASP HA 2 35 GLU H 2.799 . 3.778 3.503 3.380 3.675 . 0 0 "[ . 1]" 1
481 1 32 ASP H 1 32 ASP HA 2.395 . 3.112 2.857 2.840 2.880 . 0 0 "[ . 1]" 1
482 2 32 ASP H 2 32 ASP HA 2.395 . 3.112 2.856 2.839 2.883 . 0 0 "[ . 1]" 1
483 1 63 ALA H 1 63 ALA HA 2.335 . 3.017 2.894 2.863 2.919 . 0 0 "[ . 1]" 1
484 2 63 ALA H 2 63 ALA HA 2.335 . 3.017 2.893 2.862 2.919 . 0 0 "[ . 1]" 1
485 1 63 ALA HA 1 64 LYS H 2.490 . 3.265 3.040 2.925 3.260 . 0 0 "[ . 1]" 1
486 2 63 ALA HA 2 64 LYS H 2.490 . 3.265 3.040 2.924 3.261 . 0 0 "[ . 1]" 1
487 1 51 GLN HA 1 53 MET H 3.348 . 4.749 4.503 4.432 4.550 . 0 0 "[ . 1]" 1
488 2 51 GLN HA 2 53 MET H 3.348 . 4.749 4.504 4.425 4.552 . 0 0 "[ . 1]" 1
489 1 51 GLN HA 1 54 GLU H 2.599 . 3.443 3.613 3.526 3.713 0.270 7 0 "[ . 1]" 1
490 2 51 GLN HA 2 54 GLU H 2.599 . 3.443 3.614 3.525 3.717 0.274 7 0 "[ . 1]" 1
491 1 51 GLN HA 1 52 VAL H 2.744 . 3.685 3.530 3.522 3.540 . 0 0 "[ . 1]" 1
492 2 51 GLN HA 2 52 VAL H 2.744 . 3.685 3.530 3.523 3.542 . 0 0 "[ . 1]" 1
493 1 51 GLN H 1 51 GLN HA 2.264 . 2.905 2.797 2.783 2.810 . 0 0 "[ . 1]" 1
494 2 51 GLN H 2 51 GLN HA 2.264 . 2.905 2.798 2.784 2.815 . 0 0 "[ . 1]" 1
495 1 31 TRP HH2 1 57 GLN HA 2.790 . 3.763 2.700 2.599 2.750 . 0 0 "[ . 1]" 1
496 2 31 TRP HH2 2 57 GLN HA 2.790 . 3.763 2.701 2.601 2.751 . 0 0 "[ . 1]" 1
497 1 31 TRP HZ2 1 57 GLN HA 2.778 . 3.743 3.214 2.982 3.412 . 0 0 "[ . 1]" 1
498 2 31 TRP HZ2 2 57 GLN HA 2.778 . 3.743 3.217 2.984 3.413 . 0 0 "[ . 1]" 1
499 1 50 ARG HA 1 53 MET H 2.997 . 4.120 3.757 3.667 3.835 . 0 0 "[ . 1]" 1
500 2 50 ARG HA 2 53 MET H 2.997 . 4.120 3.756 3.664 3.838 . 0 0 "[ . 1]" 1
501 1 58 LYS HA 1 62 LEU H 3.312 . 4.683 4.485 4.382 4.544 . 0 0 "[ . 1]" 1
502 2 58 LYS HA 2 62 LEU H 3.312 . 4.683 4.486 4.386 4.541 . 0 0 "[ . 1]" 1
503 1 50 ARG H 1 50 ARG HA 2.415 . 3.144 2.806 2.794 2.816 . 0 0 "[ . 1]" 1
504 2 50 ARG H 2 50 ARG HA 2.415 . 3.144 2.806 2.796 2.813 . 0 0 "[ . 1]" 1
505 1 54 GLU H 1 54 GLU HA 2.365 . 3.064 2.867 2.860 2.874 . 0 0 "[ . 1]" 1
506 2 54 GLU H 2 54 GLU HA 2.365 . 3.064 2.867 2.861 2.875 . 0 0 "[ . 1]" 1
507 1 55 ARG H 1 55 ARG HA 2.488 . 3.262 2.890 2.881 2.894 . 0 0 "[ . 1]" 1
508 2 55 ARG H 2 55 ARG HA 2.488 . 3.262 2.890 2.882 2.894 . 0 0 "[ . 1]" 1
509 1 58 LYS HA 1 61 SER H 2.874 . 3.906 3.379 3.279 3.465 . 0 0 "[ . 1]" 1
510 2 58 LYS HA 2 61 SER H 2.874 . 3.906 3.379 3.282 3.464 . 0 0 "[ . 1]" 1
511 1 31 TRP HA 1 32 ASP H 3.151 . 4.392 3.470 3.452 3.507 . 0 0 "[ . 1]" 1
512 2 31 TRP HA 2 32 ASP H 3.151 . 4.392 3.470 3.449 3.510 . 0 0 "[ . 1]" 1
513 1 31 TRP HA 1 35 GLU H 3.213 . 4.504 3.686 3.638 3.718 . 0 0 "[ . 1]" 1
514 2 31 TRP HA 2 35 GLU H 3.213 . 4.504 3.685 3.636 3.718 . 0 0 "[ . 1]" 1
515 1 55 ARG HA 1 56 LEU H 3.065 . 4.239 3.530 3.523 3.540 . 0 0 "[ . 1]" 1
516 2 55 ARG HA 2 56 LEU H 3.065 . 4.239 3.530 3.524 3.539 . 0 0 "[ . 1]" 1
517 1 55 ARG HA 1 59 GLY H 3.013 . 4.147 3.499 3.436 3.568 . 0 0 "[ . 1]" 1
518 2 55 ARG HA 2 59 GLY H 3.013 . 4.147 3.499 3.432 3.566 . 0 0 "[ . 1]" 1
519 1 60 TRP H 1 60 TRP HA 2.443 . 3.189 2.795 2.789 2.802 . 0 0 "[ . 1]" 1
520 2 60 TRP H 2 60 TRP HA 2.443 . 3.189 2.795 2.787 2.802 . 0 0 "[ . 1]" 1
521 1 28 THR HA 1 29 VAL H 1.902 . 2.354 2.173 2.141 2.230 . 0 0 "[ . 1]" 1
522 2 28 THR HA 2 29 VAL H 1.902 . 2.354 2.171 2.141 2.223 . 0 0 "[ . 1]" 1
523 1 28 THR H 1 28 THR HA 2.424 . 3.159 2.938 2.933 2.944 . 0 0 "[ . 1]" 1
524 2 28 THR H 2 28 THR HA 2.424 . 3.159 2.938 2.933 2.942 . 0 0 "[ . 1]" 1
525 1 28 THR HA 1 60 TRP HZ2 3.178 . 4.441 3.961 3.557 4.498 0.057 8 0 "[ . 1]" 1
526 2 28 THR HA 2 60 TRP HZ2 3.178 . 4.441 3.959 3.556 4.487 0.046 8 0 "[ . 1]" 1
527 1 31 TRP HA 1 31 TRP HE3 2.415 . 3.144 2.411 2.383 2.446 . 0 0 "[ . 1]" 1
528 2 31 TRP HA 2 31 TRP HE3 2.415 . 3.144 2.411 2.386 2.447 . 0 0 "[ . 1]" 1
529 1 31 TRP HA 1 31 TRP HZ3 3.452 . 4.942 4.573 4.530 4.611 . 0 0 "[ . 1]" 1
530 2 31 TRP HA 2 31 TRP HZ3 3.452 . 4.942 4.573 4.531 4.613 . 0 0 "[ . 1]" 1
531 1 61 SER QB 1 62 LEU H 2.413 . 3.141 2.923 2.836 2.989 . 0 0 "[ . 1]" 1
532 2 61 SER QB 2 62 LEU H 2.413 . 3.141 2.924 2.833 2.999 . 0 0 "[ . 1]" 1
533 1 61 SER H 1 61 SER QB 2.082 . 2.624 2.346 2.243 2.502 . 0 0 "[ . 1]" 1
534 2 61 SER H 2 61 SER QB 2.082 . 2.624 2.345 2.239 2.503 . 0 0 "[ . 1]" 1
535 1 60 TRP H 1 61 SER QB 3.374 . 4.797 4.571 4.424 4.769 . 0 0 "[ . 1]" 1
536 2 60 TRP H 2 61 SER QB 3.374 . 4.797 4.570 4.415 4.770 . 0 0 "[ . 1]" 1
537 1 34 ILE HA 1 35 GLU H 3.133 . 4.360 3.577 3.565 3.585 . 0 0 "[ . 1]" 1
538 2 34 ILE HA 2 35 GLU H 3.133 . 4.360 3.578 3.564 3.586 . 0 0 "[ . 1]" 1
539 1 34 ILE HA 1 38 LEU H 3.056 . 4.224 4.003 3.876 4.062 . 0 0 "[ . 1]" 1
540 2 34 ILE HA 2 38 LEU H 3.056 . 4.224 4.004 3.879 4.066 . 0 0 "[ . 1]" 1
541 1 34 ILE H 1 34 ILE HA 2.639 . 3.509 2.825 2.821 2.827 . 0 0 "[ . 1]" 1
542 2 34 ILE H 2 34 ILE HA 2.639 . 3.509 2.825 2.821 2.827 . 0 0 "[ . 1]" 1
543 1 34 ILE HA 1 37 LEU H 2.770 . 3.729 3.171 3.135 3.231 . 0 0 "[ . 1]" 1
544 2 34 ILE HA 2 37 LEU H 2.770 . 3.729 3.170 3.129 3.231 . 0 0 "[ . 1]" 1
545 1 49 VAL HA 1 53 MET H 3.231 . 4.536 4.060 4.030 4.110 . 0 0 "[ . 1]" 1
546 2 49 VAL HA 2 53 MET H 3.231 . 4.536 4.060 4.028 4.115 . 0 0 "[ . 1]" 1
547 1 49 VAL HA 1 52 VAL H 2.947 . 4.033 3.728 3.652 3.826 . 0 0 "[ . 1]" 1
548 2 49 VAL HA 2 52 VAL H 2.947 . 4.033 3.729 3.652 3.825 . 0 0 "[ . 1]" 1
549 1 49 VAL HA 1 50 ARG H 2.859 . 3.881 3.530 3.523 3.543 . 0 0 "[ . 1]" 1
550 2 49 VAL HA 2 50 ARG H 2.859 . 3.881 3.530 3.522 3.543 . 0 0 "[ . 1]" 1
551 1 49 VAL HA 1 51 GLN H 3.403 . 4.850 4.718 4.678 4.763 . 0 0 "[ . 1]" 1
552 2 49 VAL HA 2 51 GLN H 3.403 . 4.850 4.716 4.681 4.760 . 0 0 "[ . 1]" 1
553 1 49 VAL H 1 49 VAL HA 2.347 . 3.035 2.777 2.765 2.786 . 0 0 "[ . 1]" 1
554 2 49 VAL H 2 49 VAL HA 2.347 . 3.035 2.777 2.766 2.785 . 0 0 "[ . 1]" 1
555 1 42 PHE QD 1 49 VAL HA 2.614 . 3.468 3.069 2.979 3.179 . 0 0 "[ . 1]" 1
556 2 42 PHE QD 2 49 VAL HA 2.614 . 3.468 3.070 2.982 3.184 . 0 0 "[ . 1]" 1
557 1 52 VAL HA 1 56 LEU H 3.183 . 4.450 3.900 3.812 4.012 . 0 0 "[ . 1]" 1
558 2 52 VAL HA 2 56 LEU H 3.183 . 4.450 3.901 3.814 4.014 . 0 0 "[ . 1]" 1
559 1 52 VAL HA 1 53 MET H 3.115 . 4.328 3.531 3.519 3.546 . 0 0 "[ . 1]" 1
560 2 52 VAL HA 2 53 MET H 3.115 . 4.328 3.531 3.519 3.547 . 0 0 "[ . 1]" 1
561 1 52 VAL HA 1 54 GLU H 3.757 . 5.521 4.307 4.233 4.415 . 0 0 "[ . 1]" 1
562 2 52 VAL HA 2 54 GLU H 3.757 . 5.521 4.307 4.231 4.417 . 0 0 "[ . 1]" 1
563 1 52 VAL H 1 52 VAL HA 2.546 . 3.356 2.874 2.868 2.880 . 0 0 "[ . 1]" 1
564 2 52 VAL H 2 52 VAL HA 2.546 . 3.356 2.874 2.865 2.879 . 0 0 "[ . 1]" 1
565 1 51 GLN H 1 52 VAL HA 3.496 . 5.024 5.309 5.287 5.333 0.309 10 0 "[ . 1]" 1
566 2 51 GLN H 2 52 VAL HA 3.496 . 5.024 5.306 5.277 5.329 0.305 10 0 "[ . 1]" 1
567 1 52 VAL HA 2 60 TRP HZ3 2.481 . 3.250 2.240 2.113 2.362 . 0 0 "[ . 1]" 1
568 1 60 TRP HZ3 2 52 VAL HA 2.481 . 3.250 2.242 2.105 2.374 . 0 0 "[ . 1]" 1
569 1 52 VAL HA 2 60 TRP HH2 2.605 . 3.453 2.288 2.200 2.380 . 0 0 "[ . 1]" 1
570 1 60 TRP HH2 2 52 VAL HA 2.605 . 3.453 2.292 2.187 2.374 . 0 0 "[ . 1]" 1
571 1 28 THR H 1 28 THR HB 2.184 . 2.780 2.626 2.584 2.681 . 0 0 "[ . 1]" 1
572 2 28 THR H 2 28 THR HB 2.184 . 2.780 2.628 2.587 2.687 . 0 0 "[ . 1]" 1
573 1 35 GLU HA 1 36 ALA H 2.984 . 4.097 3.536 3.527 3.545 . 0 0 "[ . 1]" 1
574 2 35 GLU HA 2 36 ALA H 2.984 . 4.097 3.536 3.528 3.545 . 0 0 "[ . 1]" 1
575 1 35 GLU H 1 35 GLU HA 2.445 . 3.192 2.768 2.741 2.792 . 0 0 "[ . 1]" 1
576 2 35 GLU H 2 35 GLU HA 2.445 . 3.192 2.768 2.742 2.792 . 0 0 "[ . 1]" 1
577 1 39 LYS HA 1 40 ASN H 2.914 . 3.975 3.533 3.527 3.540 . 0 0 "[ . 1]" 1
578 2 39 LYS HA 2 40 ASN H 2.914 . 3.975 3.533 3.524 3.542 . 0 0 "[ . 1]" 1
579 1 39 LYS HA 1 42 PHE QD 3.543 . 5.112 4.541 4.426 4.590 . 0 0 "[ . 1]" 1
580 2 39 LYS HA 2 42 PHE QD 3.543 . 5.112 4.542 4.427 4.591 . 0 0 "[ . 1]" 1
581 1 39 LYS H 1 39 LYS HA 2.332 . 3.012 2.828 2.818 2.841 . 0 0 "[ . 1]" 1
582 2 39 LYS H 2 39 LYS HA 2.332 . 3.012 2.828 2.818 2.841 . 0 0 "[ . 1]" 1
583 1 31 TRP HA 1 33 ASP H 3.493 . 5.018 4.518 4.428 4.575 . 0 0 "[ . 1]" 1
584 2 31 TRP HA 2 33 ASP H 3.493 . 5.018 4.517 4.422 4.575 . 0 0 "[ . 1]" 1
585 1 29 VAL H 1 29 VAL HA 2.780 . 3.746 2.938 2.934 2.940 . 0 0 "[ . 1]" 1
586 2 29 VAL H 2 29 VAL HA 2.780 . 3.746 2.938 2.935 2.940 . 0 0 "[ . 1]" 1
587 1 50 ARG H 1 50 ARG QD 2.947 . 4.033 3.787 3.645 4.040 0.007 1 0 "[ . 1]" 1
588 2 50 ARG H 2 50 ARG QD 2.947 . 4.033 3.788 3.647 4.040 0.007 1 0 "[ . 1]" 1
589 1 50 ARG QD 1 51 GLN H 3.354 . 4.760 4.552 4.321 4.674 . 0 0 "[ . 1]" 1
590 2 50 ARG QD 2 51 GLN H 3.354 . 4.760 4.556 4.325 4.679 . 0 0 "[ . 1]" 1
591 1 50 ARG HB2 1 50 ARG QD 2.220 . 2.836 2.438 2.328 2.583 . 0 0 "[ . 1]" 1
592 2 50 ARG HB2 2 50 ARG QD 2.220 . 2.836 2.437 2.329 2.583 . 0 0 "[ . 1]" 1
593 1 47 ALA MB 1 50 ARG QD 2.969 . 4.071 3.599 3.310 3.806 . 0 0 "[ . 1]" 1
594 2 47 ALA MB 2 50 ARG QD 2.969 . 4.071 3.600 3.295 3.812 . 0 0 "[ . 1]" 1
595 1 56 LEU HB2 1 56 LEU MD1 2.633 . 3.499 2.275 2.269 2.286 . 0 0 "[ . 1]" 1
596 2 56 LEU HB2 2 56 LEU MD1 2.633 . 3.499 2.275 2.269 2.287 . 0 0 "[ . 1]" 1
597 1 55 ARG HB3 1 55 ARG HD2 2.873 . 3.905 3.212 2.671 3.380 . 0 0 "[ . 1]" 1
598 2 55 ARG HB3 2 55 ARG HD2 2.873 . 3.905 3.213 2.672 3.385 . 0 0 "[ . 1]" 1
599 1 59 GLY HA2 1 62 LEU MD1 2.719 . 3.643 2.316 2.216 2.457 . 0 0 "[ . 1]" 1
600 2 59 GLY HA2 2 62 LEU MD1 2.719 . 3.643 2.316 2.217 2.457 . 0 0 "[ . 1]" 1
601 1 30 PRO HD3 1 30 PRO HG2 2.917 . 3.981 2.976 2.973 2.982 . 0 0 "[ . 1]" 1
602 2 30 PRO HD3 2 30 PRO HG2 2.917 . 3.981 2.976 2.973 2.982 . 0 0 "[ . 1]" 1
603 1 30 PRO HD2 1 30 PRO HG2 2.838 . 3.845 2.293 2.290 2.298 . 0 0 "[ . 1]" 1
604 2 30 PRO HD2 2 30 PRO HG2 2.838 . 3.845 2.293 2.290 2.298 . 0 0 "[ . 1]" 1
605 1 30 PRO HB3 1 30 PRO HD3 2.987 . 4.102 3.033 3.006 3.051 . 0 0 "[ . 1]" 1
606 2 30 PRO HB3 2 30 PRO HD3 2.987 . 4.102 3.033 3.005 3.050 . 0 0 "[ . 1]" 1
607 1 30 PRO HB3 1 30 PRO HD2 2.888 . 3.931 3.879 3.875 3.886 . 0 0 "[ . 1]" 1
608 2 30 PRO HB3 2 30 PRO HD2 2.888 . 3.931 3.878 3.875 3.885 . 0 0 "[ . 1]" 1
609 1 59 GLY HA3 1 62 LEU MD1 2.946 . 4.031 3.732 3.586 3.890 . 0 0 "[ . 1]" 1
610 2 59 GLY HA3 2 62 LEU MD1 2.946 . 4.031 3.732 3.587 3.890 . 0 0 "[ . 1]" 1
611 1 59 GLY HA3 2 63 ALA MB 2.439 . 3.182 2.682 2.565 2.815 . 0 0 "[ . 1]" 1
612 1 63 ALA MB 2 59 GLY HA3 2.439 . 3.182 2.683 2.591 2.802 . 0 0 "[ . 1]" 1
613 1 63 ALA HA 1 63 ALA MB 1.978 . 2.467 2.128 2.124 2.132 . 0 0 "[ . 1]" 1
614 2 63 ALA HA 2 63 ALA MB 1.978 . 2.467 2.128 2.125 2.132 . 0 0 "[ . 1]" 1
615 1 44 ASN HA 1 44 ASN HB2 2.211 . 2.822 2.464 2.428 2.528 . 0 0 "[ . 1]" 1
616 2 44 ASN HA 2 44 ASN HB2 2.211 . 2.822 2.463 2.428 2.528 . 0 0 "[ . 1]" 1
617 1 44 ASN HA 1 44 ASN HB3 2.374 . 3.078 3.026 3.024 3.028 . 0 0 "[ . 1]" 1
618 2 44 ASN HA 2 44 ASN HB3 2.374 . 3.078 3.026 3.022 3.028 . 0 0 "[ . 1]" 1
619 1 48 ALA HA 1 51 GLN HB2 2.464 . 3.223 2.537 2.378 2.722 . 0 0 "[ . 1]" 1
620 2 48 ALA HA 2 51 GLN HB2 2.464 . 3.223 2.538 2.381 2.721 . 0 0 "[ . 1]" 1
621 1 47 ALA MB 1 48 ALA HA 2.805 . 3.789 3.900 3.855 3.997 0.208 4 0 "[ . 1]" 1
622 2 47 ALA MB 2 48 ALA HA 2.805 . 3.789 3.901 3.855 4.010 0.221 4 0 "[ . 1]" 1
623 1 48 ALA HA 1 52 VAL MG1 2.886 . 3.927 3.531 3.288 3.645 . 0 0 "[ . 1]" 1
624 2 48 ALA HA 2 52 VAL MG1 2.886 . 3.927 3.530 3.285 3.640 . 0 0 "[ . 1]" 1
625 1 48 ALA HA 1 48 ALA MB 1.909 . 2.365 2.129 2.127 2.135 . 0 0 "[ . 1]" 1
626 2 48 ALA HA 2 48 ALA MB 1.909 . 2.365 2.129 2.127 2.136 . 0 0 "[ . 1]" 1
627 1 35 GLU HB3 1 36 ALA HA 2.940 . 4.020 4.282 4.182 4.344 0.324 4 0 "[ . 1]" 1
628 2 35 GLU HB3 2 36 ALA HA 2.940 . 4.020 4.279 4.180 4.341 0.321 4 0 "[ . 1]" 1
629 1 36 ALA HA 1 39 LYS QB 2.319 . 2.991 2.391 2.275 2.489 . 0 0 "[ . 1]" 1
630 2 36 ALA HA 2 39 LYS QB 2.319 . 2.991 2.393 2.277 2.488 . 0 0 "[ . 1]" 1
631 1 36 ALA HA 1 36 ALA MB 1.925 . 2.388 2.129 2.128 2.131 . 0 0 "[ . 1]" 1
632 2 36 ALA HA 2 36 ALA MB 1.925 . 2.388 2.129 2.129 2.131 . 0 0 "[ . 1]" 1
633 1 47 ALA HA 1 50 ARG HB2 2.354 . 3.047 2.880 2.656 2.976 . 0 0 "[ . 1]" 1
634 2 47 ALA HA 2 50 ARG HB2 2.354 . 3.047 2.882 2.655 2.980 . 0 0 "[ . 1]" 1
635 1 47 ALA HA 1 50 ARG HG3 2.677 . 3.573 2.953 2.547 3.272 . 0 0 "[ . 1]" 1
636 2 47 ALA HA 2 50 ARG HG3 2.677 . 3.573 2.954 2.536 3.270 . 0 0 "[ . 1]" 1
637 1 47 ALA HA 1 47 ALA MB 1.819 . 2.232 2.128 2.125 2.132 . 0 0 "[ . 1]" 1
638 2 47 ALA HA 2 47 ALA MB 1.819 . 2.232 2.128 2.125 2.133 . 0 0 "[ . 1]" 1
639 1 27 LEU HA 1 27 LEU QD 1.994 . 2.491 2.114 2.048 2.166 . 0 0 "[ . 1]" 1
640 2 27 LEU HA 2 27 LEU QD 1.994 . 2.491 2.115 2.047 2.165 . 0 0 "[ . 1]" 1
641 1 27 LEU HA 1 27 LEU HB2 2.389 . 3.102 3.016 3.012 3.019 . 0 0 "[ . 1]" 1
642 2 27 LEU HA 2 27 LEU HB2 2.389 . 3.102 3.016 3.013 3.018 . 0 0 "[ . 1]" 1
643 1 27 LEU HA 1 27 LEU HB3 2.241 . 2.869 2.456 2.430 2.473 . 0 0 "[ . 1]" 1
644 2 27 LEU HA 2 27 LEU HB3 2.241 . 2.869 2.456 2.429 2.473 . 0 0 "[ . 1]" 1
645 1 27 LEU HA 2 52 VAL MG1 2.814 . 3.804 3.907 3.714 4.288 0.484 7 0 "[ . 1]" 1
646 1 52 VAL MG1 2 27 LEU HA 2.814 . 3.804 3.904 3.706 4.288 0.484 7 0 "[ . 1]" 1
647 1 42 PHE HA 1 42 PHE HB3 2.669 . 3.560 2.558 2.546 2.573 . 0 0 "[ . 1]" 1
648 2 42 PHE HA 2 42 PHE HB3 2.669 . 3.560 2.558 2.546 2.572 . 0 0 "[ . 1]" 1
649 1 42 PHE HA 1 42 PHE HB2 2.650 . 3.528 3.005 2.996 3.010 . 0 0 "[ . 1]" 1
650 2 42 PHE HA 2 42 PHE HB2 2.650 . 3.528 3.006 2.998 3.010 . 0 0 "[ . 1]" 1
651 1 41 ASN QB 1 42 PHE HA 3.082 . 4.269 4.288 4.231 4.341 0.072 8 0 "[ . 1]" 1
652 2 41 ASN QB 2 42 PHE HA 3.082 . 4.269 4.286 4.224 4.337 0.068 8 0 "[ . 1]" 1
653 1 42 PHE HA 1 43 GLU QG 2.898 . 3.948 3.763 3.536 4.161 0.213 7 0 "[ . 1]" 1
654 2 42 PHE HA 2 43 GLU QG 2.898 . 3.948 3.763 3.557 4.153 0.205 7 0 "[ . 1]" 1
655 1 38 LEU HA 1 38 LEU HB3 2.599 . 3.444 2.635 2.622 2.641 . 0 0 "[ . 1]" 1
656 2 38 LEU HA 2 38 LEU HB3 2.599 . 3.444 2.634 2.623 2.644 . 0 0 "[ . 1]" 1
657 1 38 LEU HA 1 38 LEU HG 2.626 . 3.488 3.662 3.658 3.667 0.179 1 0 "[ . 1]" 1
658 2 38 LEU HA 2 38 LEU HG 2.626 . 3.488 3.663 3.659 3.669 0.181 1 0 "[ . 1]" 1
659 1 37 LEU HG 1 38 LEU HA 2.935 . 4.012 3.489 3.462 3.519 . 0 0 "[ . 1]" 1
660 2 37 LEU HG 2 38 LEU HA 2.935 . 4.012 3.488 3.462 3.517 . 0 0 "[ . 1]" 1
661 1 38 LEU HA 1 38 LEU HB2 2.589 . 3.427 2.980 2.976 2.984 . 0 0 "[ . 1]" 1
662 2 38 LEU HA 2 38 LEU HB2 2.589 . 3.427 2.980 2.978 2.985 . 0 0 "[ . 1]" 1
663 1 38 LEU HA 1 38 LEU MD2 2.575 . 3.404 2.575 2.532 2.648 . 0 0 "[ . 1]" 1
664 2 38 LEU HA 2 38 LEU MD2 2.575 . 3.404 2.574 2.531 2.648 . 0 0 "[ . 1]" 1
665 1 52 VAL MG2 1 53 MET HA 2.348 . 3.037 3.198 3.122 3.227 0.190 2 0 "[ . 1]" 1
666 2 52 VAL MG2 2 53 MET HA 2.348 . 3.037 3.197 3.122 3.228 0.191 2 0 "[ . 1]" 1
667 1 62 LEU HA 1 62 LEU MD2 1.886 . 2.331 2.051 2.036 2.084 . 0 0 "[ . 1]" 1
668 2 62 LEU HA 2 62 LEU MD2 1.886 . 2.331 2.051 2.036 2.082 . 0 0 "[ . 1]" 1
669 1 33 ASP HA 1 36 ALA MB 2.092 . 2.639 2.605 2.487 2.707 0.068 10 0 "[ . 1]" 1
670 2 33 ASP HA 2 36 ALA MB 2.092 . 2.639 2.604 2.488 2.707 0.068 10 0 "[ . 1]" 1
671 1 33 ASP HA 2 37 LEU QD 2.968 . 4.069 3.666 3.591 3.757 . 0 0 "[ . 1]" 1
672 1 37 LEU QD 2 33 ASP HA 2.968 . 4.069 3.665 3.596 3.762 . 0 0 "[ . 1]" 1
673 1 37 LEU HA 1 37 LEU QD 2.280 . 2.930 2.159 2.137 2.170 . 0 0 "[ . 1]" 1
674 2 37 LEU HA 2 37 LEU QD 2.280 . 2.930 2.158 2.133 2.171 . 0 0 "[ . 1]" 1
675 1 37 LEU HA 1 40 ASN QB 2.437 . 3.179 2.750 2.662 2.948 . 0 0 "[ . 1]" 1
676 2 37 LEU HA 2 40 ASN QB 2.437 . 3.179 2.750 2.662 2.945 . 0 0 "[ . 1]" 1
677 1 37 LEU HA 1 37 LEU HB3 2.345 . 3.032 3.012 3.011 3.014 . 0 0 "[ . 1]" 1
678 2 37 LEU HA 2 37 LEU HB3 2.345 . 3.032 3.012 3.010 3.015 . 0 0 "[ . 1]" 1
679 1 37 LEU HA 1 37 LEU HB2 2.153 . 2.732 2.399 2.394 2.401 . 0 0 "[ . 1]" 1
680 2 37 LEU HA 2 37 LEU HB2 2.153 . 2.732 2.399 2.392 2.401 . 0 0 "[ . 1]" 1
681 1 43 GLU HA 1 43 GLU HB2 2.040 . 2.560 2.502 2.462 2.572 0.012 5 0 "[ . 1]" 1
682 2 43 GLU HA 2 43 GLU HB2 2.040 . 2.560 2.502 2.464 2.569 0.009 5 0 "[ . 1]" 1
683 1 62 LEU HA 1 62 LEU HB3 2.274 . 2.920 2.460 2.441 2.473 . 0 0 "[ . 1]" 1
684 2 62 LEU HA 2 62 LEU HB3 2.274 . 2.920 2.459 2.442 2.473 . 0 0 "[ . 1]" 1
685 1 53 MET HA 1 56 LEU HB2 2.633 . 3.500 2.660 2.567 2.847 . 0 0 "[ . 1]" 1
686 2 53 MET HA 2 56 LEU HB2 2.633 . 3.500 2.661 2.566 2.845 . 0 0 "[ . 1]" 1
687 1 53 MET HA 1 53 MET ME 2.410 . 3.136 3.107 2.000 4.604 1.468 10 3 "[ . - *+]" 1
688 2 53 MET HA 2 53 MET ME 2.410 . 3.136 3.109 1.999 4.609 1.473 10 3 "[ . - *+]" 1
689 1 26 GLU HA 1 26 GLU QG 2.371 . 3.074 2.767 2.371 3.344 0.270 9 0 "[ . 1]" 1
690 2 26 GLU HA 2 26 GLU QG 2.371 . 3.074 2.766 2.361 3.345 0.271 8 0 "[ . 1]" 1
691 1 26 GLU HA 1 26 GLU QB 2.266 . 2.908 2.333 2.178 2.390 . 0 0 "[ . 1]" 1
692 2 26 GLU HA 2 26 GLU QB 2.266 . 2.908 2.334 2.181 2.391 . 0 0 "[ . 1]" 1
693 1 25 GLN HA 1 25 GLN QG 2.460 . 3.217 2.489 2.295 3.332 0.115 6 0 "[ . 1]" 1
694 2 25 GLN HA 2 25 GLN QG 2.460 . 3.217 2.488 2.296 3.330 0.113 6 0 "[ . 1]" 1
695 1 25 GLN HA 1 25 GLN HB3 2.161 . 2.745 2.495 2.377 2.616 . 0 0 "[ . 1]" 1
696 2 25 GLN HA 2 25 GLN HB3 2.161 . 2.745 2.495 2.376 2.618 . 0 0 "[ . 1]" 1
697 1 25 GLN HA 1 25 GLN HB2 2.231 . 2.853 2.969 2.525 3.027 0.174 8 0 "[ . 1]" 1
698 2 25 GLN HA 2 25 GLN HB2 2.231 . 2.853 2.969 2.527 3.026 0.173 8 0 "[ . 1]" 1
699 1 58 LYS HA 1 58 LYS HB2 2.106 . 2.660 2.436 2.407 2.453 . 0 0 "[ . 1]" 1
700 2 58 LYS HA 2 58 LYS HB2 2.106 . 2.660 2.437 2.411 2.455 . 0 0 "[ . 1]" 1
701 1 58 LYS HA 1 58 LYS HB3 2.244 . 2.874 3.021 3.017 3.023 0.149 1 0 "[ . 1]" 1
702 2 58 LYS HA 2 58 LYS HB3 2.244 . 2.874 3.022 3.019 3.025 0.151 10 0 "[ . 1]" 1
703 1 57 GLN HA 1 57 GLN QB 2.632 . 3.409 2.396 2.366 2.410 . 0 0 "[ . 1]" 1
704 2 57 GLN HA 2 57 GLN QB 2.632 . 3.409 2.396 2.365 2.411 . 0 0 "[ . 1]" 1
705 1 57 GLN HA 1 57 GLN QG 2.557 . 3.374 2.430 2.350 2.841 . 0 0 "[ . 1]" 1
706 2 57 GLN HA 2 57 GLN QG 2.557 . 3.374 2.430 2.350 2.841 . 0 0 "[ . 1]" 1
707 1 46 GLN HA 1 49 VAL MG2 2.308 . 2.974 2.023 1.959 2.071 . 0 0 "[ . 1]" 1
708 2 46 GLN HA 2 49 VAL MG2 2.308 . 2.974 2.023 1.960 2.073 . 0 0 "[ . 1]" 1
709 1 54 GLU HA 1 54 GLU QG 2.253 . 2.887 2.364 2.336 2.391 . 0 0 "[ . 1]" 1
710 2 54 GLU HA 2 54 GLU QG 2.253 . 2.887 2.363 2.335 2.390 . 0 0 "[ . 1]" 1
711 1 54 GLU HA 1 54 GLU HB3 2.141 . 2.714 2.515 2.495 2.527 . 0 0 "[ . 1]" 1
712 2 54 GLU HA 2 54 GLU HB3 2.141 . 2.714 2.514 2.496 2.527 . 0 0 "[ . 1]" 1
713 1 46 GLN HA 1 46 GLN HG2 2.592 . 3.432 3.159 3.104 3.192 . 0 0 "[ . 1]" 1
714 2 46 GLN HA 2 46 GLN HG2 2.592 . 3.432 3.160 3.102 3.194 . 0 0 "[ . 1]" 1
715 1 51 GLN HA 1 51 GLN HG3 2.356 . 3.050 3.004 2.929 3.075 0.025 9 0 "[ . 1]" 1
716 2 51 GLN HA 2 51 GLN HG3 2.356 . 3.050 3.003 2.931 3.074 0.024 9 0 "[ . 1]" 1
717 1 51 GLN HA 1 51 GLN HG2 2.247 . 2.878 2.524 2.486 2.579 . 0 0 "[ . 1]" 1
718 2 51 GLN HA 2 51 GLN HG2 2.247 . 2.878 2.523 2.488 2.575 . 0 0 "[ . 1]" 1
719 1 54 GLU HA 1 57 GLN QB 2.696 . 3.605 2.501 2.291 2.655 . 0 0 "[ . 1]" 1
720 2 54 GLU HA 2 57 GLN QB 2.696 . 3.605 2.500 2.291 2.654 . 0 0 "[ . 1]" 1
721 1 55 ARG HA 1 55 ARG QG 2.431 . 3.170 2.448 2.308 2.477 . 0 0 "[ . 1]" 1
722 2 55 ARG HA 2 55 ARG QG 2.431 . 3.170 2.448 2.306 2.477 . 0 0 "[ . 1]" 1
723 1 55 ARG HA 2 63 ALA MB 2.483 . 3.254 2.879 2.802 2.971 . 0 0 "[ . 1]" 1
724 1 63 ALA MB 2 55 ARG HA 2.483 . 3.254 2.882 2.785 2.977 . 0 0 "[ . 1]" 1
725 1 60 TRP HA 1 63 ALA MB 2.445 . 3.192 2.987 2.768 3.205 0.013 3 0 "[ . 1]" 1
726 2 60 TRP HA 2 63 ALA MB 2.445 . 3.192 2.987 2.768 3.207 0.015 3 0 "[ . 1]" 1
727 1 31 TRP HA 1 53 MET ME 2.503 . 3.286 2.666 2.339 3.214 . 0 0 "[ . 1]" 1
728 2 31 TRP HA 2 53 MET ME 2.503 . 3.286 2.665 2.343 3.219 . 0 0 "[ . 1]" 1
729 1 31 TRP HA 1 34 ILE HB 2.455 . 3.208 2.394 2.291 2.499 . 0 0 "[ . 1]" 1
730 2 31 TRP HA 2 34 ILE HB 2.455 . 3.208 2.396 2.294 2.502 . 0 0 "[ . 1]" 1
731 1 39 LYS HA 1 39 LYS QB 2.334 . 3.015 2.385 2.354 2.439 . 0 0 "[ . 1]" 1
732 2 39 LYS HA 2 39 LYS QB 2.334 . 3.015 2.385 2.356 2.440 . 0 0 "[ . 1]" 1
733 1 39 LYS HA 1 39 LYS QG 2.461 . 3.218 2.406 2.366 2.456 . 0 0 "[ . 1]" 1
734 2 39 LYS HA 2 39 LYS QG 2.461 . 3.218 2.405 2.364 2.457 . 0 0 "[ . 1]" 1
735 1 32 ASP HA 1 35 GLU HB3 2.422 . 3.155 2.778 2.593 3.053 . 0 0 "[ . 1]" 1
736 2 32 ASP HA 2 35 GLU HB3 2.422 . 3.155 2.779 2.596 3.058 . 0 0 "[ . 1]" 1
737 1 60 TRP HA 2 55 ARG QG 2.761 . 3.714 2.696 2.579 3.332 . 0 0 "[ . 1]" 1
738 1 55 ARG QG 2 60 TRP HA 2.761 . 3.714 2.694 2.578 3.327 . 0 0 "[ . 1]" 1
739 1 28 THR HA 1 28 THR MG 2.201 . 2.806 2.352 2.327 2.369 . 0 0 "[ . 1]" 1
740 2 28 THR HA 2 28 THR MG 2.201 . 2.806 2.353 2.332 2.368 . 0 0 "[ . 1]" 1
741 1 35 GLU HA 1 49 VAL MG1 2.516 . 3.307 3.313 3.225 3.630 0.323 7 0 "[ . 1]" 1
742 2 35 GLU HA 2 49 VAL MG1 2.516 . 3.307 3.314 3.228 3.628 0.321 7 0 "[ . 1]" 1
743 1 31 TRP HA 1 34 ILE MD 2.543 . 3.351 2.954 2.875 3.011 . 0 0 "[ . 1]" 1
744 2 31 TRP HA 2 34 ILE MD 2.543 . 3.351 2.955 2.879 3.006 . 0 0 "[ . 1]" 1
745 1 39 LYS HA 1 49 VAL MG2 2.128 . 2.694 1.858 1.806 1.884 . 0 0 "[ . 1]" 1
746 2 39 LYS HA 2 49 VAL MG2 2.128 . 2.694 1.857 1.807 1.883 . 0 0 "[ . 1]" 1
747 1 31 TRP HA 1 34 ILE MG 2.754 . 3.702 3.704 3.531 3.828 0.126 8 0 "[ . 1]" 1
748 2 31 TRP HA 2 34 ILE MG 2.754 . 3.702 3.706 3.537 3.830 0.128 8 0 "[ . 1]" 1
749 1 29 VAL HA 2 38 LEU MD1 2.901 . 3.953 2.662 2.557 2.754 . 0 0 "[ . 1]" 1
750 1 38 LEU MD1 2 29 VAL HA 2.901 . 3.953 2.658 2.557 2.754 . 0 0 "[ . 1]" 1
751 1 29 VAL HA 1 29 VAL HB 2.709 . 3.626 3.022 3.018 3.026 . 0 0 "[ . 1]" 1
752 2 29 VAL HA 2 29 VAL HB 2.709 . 3.626 3.022 3.019 3.025 . 0 0 "[ . 1]" 1
753 1 29 VAL QG 1 30 PRO HD2 2.593 . 3.433 2.124 2.077 2.201 . 0 0 "[ . 1]" 1
754 2 29 VAL QG 2 30 PRO HD2 2.593 . 3.433 2.123 2.077 2.199 . 0 0 "[ . 1]" 1
755 1 28 THR HA 1 29 VAL QG 2.569 . 3.394 3.489 3.418 3.636 0.242 3 0 "[ . 1]" 1
756 2 28 THR HA 2 29 VAL QG 2.569 . 3.394 3.488 3.424 3.634 0.240 3 0 "[ . 1]" 1
757 1 29 VAL QG 1 31 TRP HA 2.781 . 3.748 3.100 3.028 3.190 . 0 0 "[ . 1]" 1
758 2 29 VAL QG 2 31 TRP HA 2.781 . 3.748 3.100 3.030 3.189 . 0 0 "[ . 1]" 1
759 1 29 VAL HA 1 29 VAL QG 2.382 . 2.858 2.134 2.129 2.137 . 0 0 "[ . 1]" 1
760 2 29 VAL HA 2 29 VAL QG 2.382 . 2.858 2.135 2.129 2.138 . 0 0 "[ . 1]" 1
761 1 34 ILE HA 1 37 LEU HB3 2.406 . 3.130 2.517 2.425 2.582 . 0 0 "[ . 1]" 1
762 2 34 ILE HA 2 37 LEU HB3 2.406 . 3.130 2.516 2.424 2.581 . 0 0 "[ . 1]" 1
763 1 34 ILE HA 1 34 ILE HG13 2.451 . 3.202 2.904 2.856 2.955 . 0 0 "[ . 1]" 1
764 2 34 ILE HA 2 34 ILE HG13 2.451 . 3.202 2.904 2.858 2.953 . 0 0 "[ . 1]" 1
765 1 52 VAL HA 1 52 VAL HB 2.542 . 3.350 2.438 2.429 2.446 . 0 0 "[ . 1]" 1
766 2 52 VAL HA 2 52 VAL HB 2.542 . 3.350 2.438 2.428 2.446 . 0 0 "[ . 1]" 1
767 1 52 VAL HA 1 55 ARG HB3 2.862 . 3.886 2.754 2.634 3.066 . 0 0 "[ . 1]" 1
768 2 52 VAL HA 2 55 ARG HB3 2.862 . 3.886 2.755 2.636 3.070 . 0 0 "[ . 1]" 1
769 1 52 VAL HA 2 27 LEU HB2 2.943 . 4.026 4.391 4.235 4.528 0.502 7 1 "[ . + 1]" 1
770 1 27 LEU HB2 2 52 VAL HA 2.943 . 4.026 4.396 4.212 4.531 0.505 7 1 "[ . + 1]" 1
771 1 52 VAL HA 1 52 VAL MG1 2.160 . 2.743 2.346 2.327 2.369 . 0 0 "[ . 1]" 1
772 2 52 VAL HA 2 52 VAL MG1 2.160 . 2.743 2.347 2.329 2.372 . 0 0 "[ . 1]" 1
773 1 52 VAL HA 2 27 LEU QD 2.813 . 3.802 2.988 2.713 3.690 . 0 0 "[ . 1]" 1
774 1 27 LEU QD 2 52 VAL HA 2.813 . 3.802 2.989 2.702 3.690 . 0 0 "[ . 1]" 1
775 1 40 ASN QB 1 41 ASN QB 3.166 . 4.419 3.950 3.897 3.995 . 0 0 "[ . 1]" 1
776 2 40 ASN QB 2 41 ASN QB 3.166 . 4.419 3.952 3.891 3.998 . 0 0 "[ . 1]" 1
777 1 39 LYS QB 1 40 ASN QB 3.261 . 4.590 3.879 3.719 4.250 . 0 0 "[ . 1]" 1
778 2 39 LYS QB 2 40 ASN QB 3.261 . 4.590 3.878 3.718 4.253 . 0 0 "[ . 1]" 1
779 1 42 PHE HB3 1 45 ASP HB3 3.081 . 4.268 3.702 2.454 4.327 0.059 5 0 "[ . 1]" 1
780 2 42 PHE HB3 2 45 ASP HB3 3.081 . 4.268 3.701 2.459 4.308 0.040 5 0 "[ . 1]" 1
781 1 42 PHE HB3 1 45 ASP HB2 3.176 . 4.437 2.841 2.478 4.235 . 0 0 "[ . 1]" 1
782 2 42 PHE HB3 2 45 ASP HB2 3.176 . 4.437 2.840 2.474 4.225 . 0 0 "[ . 1]" 1
783 1 43 GLU HA 1 44 ASN HB2 3.486 . 5.005 4.958 4.810 5.029 0.024 5 0 "[ . 1]" 1
784 2 43 GLU HA 2 44 ASN HB2 3.486 . 5.005 4.960 4.810 5.026 0.021 5 0 "[ . 1]" 1
785 1 43 GLU HA 1 44 ASN HB3 3.484 . 5.001 5.297 5.229 5.382 0.381 7 0 "[ . 1]" 1
786 2 43 GLU HA 2 44 ASN HB3 3.484 . 5.001 5.298 5.230 5.383 0.382 7 0 "[ . 1]" 1
787 1 54 GLU HB3 1 54 GLU QG 2.303 . 2.966 2.349 2.334 2.366 . 0 0 "[ . 1]" 1
788 2 54 GLU HB3 2 54 GLU QG 2.303 . 2.966 2.348 2.338 2.366 . 0 0 "[ . 1]" 1
789 1 53 MET QB 1 54 GLU QG 2.755 . 3.704 3.158 2.980 3.237 . 0 0 "[ . 1]" 1
790 2 53 MET QB 2 54 GLU QG 2.755 . 3.704 3.157 2.974 3.232 . 0 0 "[ . 1]" 1
791 1 43 GLU HB2 1 44 ASN HB2 3.519 . 5.067 4.693 4.515 4.801 . 0 0 "[ . 1]" 1
792 2 43 GLU HB2 2 44 ASN HB2 3.519 . 5.067 4.693 4.522 4.801 . 0 0 "[ . 1]" 1
793 1 45 ASP HB2 1 48 ALA MB 2.677 . 3.573 2.470 2.177 3.426 . 0 0 "[ . 1]" 1
794 2 45 ASP HB2 2 48 ALA MB 2.677 . 3.573 2.469 2.164 3.427 . 0 0 "[ . 1]" 1
795 1 34 ILE HA 1 37 LEU HB2 2.991 . 4.109 3.348 3.305 3.404 . 0 0 "[ . 1]" 1
796 2 34 ILE HA 2 37 LEU HB2 2.991 . 4.109 3.347 3.303 3.401 . 0 0 "[ . 1]" 1
797 1 38 LEU HB2 1 38 LEU MD1 2.822 . 3.817 3.189 3.186 3.191 . 0 0 "[ . 1]" 1
798 2 38 LEU HB2 2 38 LEU MD1 2.822 . 3.817 3.189 3.187 3.191 . 0 0 "[ . 1]" 1
799 1 38 LEU HB2 1 49 VAL MG1 2.702 . 3.615 2.708 2.665 2.888 . 0 0 "[ . 1]" 1
800 2 38 LEU HB2 2 49 VAL MG1 2.702 . 3.615 2.707 2.662 2.888 . 0 0 "[ . 1]" 1
801 1 38 LEU HB2 1 38 LEU MD2 2.620 . 3.478 2.346 2.337 2.362 . 0 0 "[ . 1]" 1
802 2 38 LEU HB2 2 38 LEU MD2 2.620 . 3.478 2.346 2.335 2.362 . 0 0 "[ . 1]" 1
803 1 38 LEU HB3 1 38 LEU MD2 2.546 . 3.356 3.202 3.200 3.204 . 0 0 "[ . 1]" 1
804 2 38 LEU HB3 2 38 LEU MD2 2.546 . 3.356 3.202 3.200 3.204 . 0 0 "[ . 1]" 1
805 1 35 GLU HA 1 38 LEU HB3 3.346 . 4.745 4.249 4.161 4.405 . 0 0 "[ . 1]" 1
806 2 35 GLU HA 2 38 LEU HB3 3.346 . 4.745 4.250 4.168 4.404 . 0 0 "[ . 1]" 1
807 1 53 MET HA 1 53 MET HG2 2.373 . 3.077 3.117 2.404 3.861 0.784 3 2 "[ + . - 1]" 1
808 2 53 MET HA 2 53 MET HG2 2.373 . 3.077 3.116 2.403 3.859 0.782 3 2 "[ + . - 1]" 1
809 1 46 GLN HA 1 49 VAL HB 2.627 . 3.489 2.718 2.645 2.882 . 0 0 "[ . 1]" 1
810 2 46 GLN HA 2 49 VAL HB 2.627 . 3.489 2.720 2.646 2.879 . 0 0 "[ . 1]" 1
811 1 49 VAL HA 1 49 VAL HB 2.875 . 3.908 3.027 3.026 3.029 . 0 0 "[ . 1]" 1
812 2 49 VAL HA 2 49 VAL HB 2.875 . 3.908 3.027 3.024 3.030 . 0 0 "[ . 1]" 1
813 1 51 GLN HG2 2 27 LEU QD 2.966 . 4.066 3.903 3.723 4.306 0.240 7 0 "[ . 1]" 1
814 1 27 LEU QD 2 51 GLN HG2 2.966 . 4.066 3.907 3.746 4.308 0.242 7 0 "[ . 1]" 1
815 1 25 GLN QG 1 27 LEU QD 2.893 . 3.939 3.379 2.870 3.605 . 0 0 "[ . 1]" 1
816 2 25 GLN QG 2 27 LEU QD 2.893 . 3.939 3.378 2.863 3.604 . 0 0 "[ . 1]" 1
817 1 57 GLN QB 1 57 GLN QG 3.021 . 3.863 2.075 2.009 2.084 . 0 0 "[ . 1]" 1
818 2 57 GLN QB 2 57 GLN QG 3.021 . 3.863 2.076 2.009 2.084 . 0 0 "[ . 1]" 1
819 1 52 VAL HB 1 52 VAL MG1 1.989 . 2.484 2.121 2.119 2.123 . 0 0 "[ . 1]" 1
820 2 52 VAL HB 2 52 VAL MG1 1.989 . 2.484 2.122 2.118 2.124 . 0 0 "[ . 1]" 1
821 1 42 PHE HB3 1 49 VAL MG2 2.653 . 3.533 2.605 2.470 2.667 . 0 0 "[ . 1]" 1
822 2 42 PHE HB3 2 49 VAL MG2 2.653 . 3.533 2.605 2.472 2.665 . 0 0 "[ . 1]" 1
823 1 49 VAL HA 1 49 VAL MG2 2.159 . 2.742 2.450 2.441 2.460 . 0 0 "[ . 1]" 1
824 2 49 VAL HA 2 49 VAL MG2 2.159 . 2.742 2.451 2.443 2.458 . 0 0 "[ . 1]" 1
825 1 42 PHE HB2 1 49 VAL MG2 2.503 . 3.286 1.850 1.817 1.891 . 0 0 "[ . 1]" 1
826 2 42 PHE HB2 2 49 VAL MG2 2.503 . 3.286 1.850 1.818 1.889 . 0 0 "[ . 1]" 1
827 1 49 VAL HB 1 49 VAL MG2 1.949 . 2.424 2.125 2.122 2.126 . 0 0 "[ . 1]" 1
828 2 49 VAL HB 2 49 VAL MG2 1.949 . 2.424 2.125 2.124 2.127 . 0 0 "[ . 1]" 1
829 1 39 LYS QG 1 49 VAL MG2 2.278 . 2.927 2.832 2.655 3.029 0.102 4 0 "[ . 1]" 1
830 2 39 LYS QG 2 49 VAL MG2 2.278 . 2.927 2.831 2.659 3.030 0.103 4 0 "[ . 1]" 1
831 1 52 VAL HA 1 52 VAL MG2 2.496 . 3.275 3.215 3.213 3.216 . 0 0 "[ . 1]" 1
832 2 52 VAL HA 2 52 VAL MG2 2.496 . 3.275 3.214 3.213 3.216 . 0 0 "[ . 1]" 1
833 1 27 LEU QD 1 27 LEU HG 1.904 . 2.357 1.894 1.891 1.895 . 0 0 "[ . 1]" 1
834 2 27 LEU QD 2 27 LEU HG 1.904 . 2.357 1.893 1.890 1.895 . 0 0 "[ . 1]" 1
835 1 49 VAL HB 1 49 VAL MG1 1.869 . 2.306 2.129 2.128 2.132 . 0 0 "[ . 1]" 1
836 2 49 VAL HB 2 49 VAL MG1 1.869 . 2.306 2.129 2.128 2.130 . 0 0 "[ . 1]" 1
837 1 49 VAL HA 1 49 VAL MG1 2.307 . 2.972 2.387 2.377 2.396 . 0 0 "[ . 1]" 1
838 2 49 VAL HA 2 49 VAL MG1 2.307 . 2.972 2.386 2.373 2.395 . 0 0 "[ . 1]" 1
839 1 39 LYS QG 1 49 VAL MG1 2.598 . 3.442 3.215 2.893 3.458 0.016 4 0 "[ . 1]" 1
840 2 39 LYS QG 2 49 VAL MG1 2.598 . 3.442 3.214 2.890 3.458 0.016 4 0 "[ . 1]" 1
841 1 27 LEU QD 2 51 GLN HB3 2.446 . 3.194 2.245 1.994 2.825 . 0 0 "[ . 1]" 1
842 1 51 GLN HB3 2 27 LEU QD 2.446 . 3.194 2.242 1.968 2.822 . 0 0 "[ . 1]" 1
843 1 56 LEU MD1 1 56 LEU MD2 1.906 . 2.360 2.080 2.078 2.082 . 0 0 "[ . 1]" 1
844 2 56 LEU MD1 2 56 LEU MD2 1.906 . 2.360 2.080 2.078 2.082 . 0 0 "[ . 1]" 1
845 1 52 VAL MG1 1 52 VAL MG2 1.770 . 2.161 2.079 2.075 2.082 . 0 0 "[ . 1]" 1
846 2 52 VAL MG1 2 52 VAL MG2 1.770 . 2.161 2.078 2.075 2.082 . 0 0 "[ . 1]" 1
847 1 56 LEU MD2 2 34 ILE MD 2.629 . 3.493 3.240 2.984 3.390 . 0 0 "[ . 1]" 1
848 1 34 ILE MD 2 56 LEU MD2 2.629 . 3.493 3.238 2.975 3.398 . 0 0 "[ . 1]" 1
849 1 64 LYS HA 1 64 LYS QB 2.111 . 2.668 2.248 2.167 2.369 . 0 0 "[ . 1]" 1
850 2 64 LYS HA 2 64 LYS QB 2.111 . 2.668 2.248 2.166 2.367 . 0 0 "[ . 1]" 1
851 1 29 VAL HB 1 31 TRP HE1 2.729 . 3.660 2.837 2.682 2.943 . 0 0 "[ . 1]" 1
852 2 29 VAL HB 2 31 TRP HE1 2.729 . 3.660 2.837 2.681 2.934 . 0 0 "[ . 1]" 1
853 1 29 VAL H 1 29 VAL HB 2.249 . 2.881 2.488 2.465 2.513 . 0 0 "[ . 1]" 1
854 2 29 VAL H 2 29 VAL HB 2.249 . 2.881 2.488 2.464 2.510 . 0 0 "[ . 1]" 1
855 1 29 VAL HB 1 31 TRP HD1 3.273 . 4.612 4.146 3.948 4.284 . 0 0 "[ . 1]" 1
856 2 29 VAL HB 2 31 TRP HD1 3.273 . 4.612 4.148 3.949 4.277 . 0 0 "[ . 1]" 1
857 1 29 VAL HB 1 31 TRP HZ2 3.328 . 4.712 3.089 3.013 3.194 . 0 0 "[ . 1]" 1
858 2 29 VAL HB 2 31 TRP HZ2 3.328 . 4.712 3.088 3.014 3.194 . 0 0 "[ . 1]" 1
859 1 28 THR HA 1 29 VAL HB 3.439 . 4.918 4.464 4.425 4.528 . 0 0 "[ . 1]" 1
860 2 28 THR HA 2 29 VAL HB 3.439 . 4.918 4.460 4.424 4.524 . 0 0 "[ . 1]" 1
861 1 51 GLN QE 1 51 GLN HG3 2.861 . 3.503 2.202 2.192 2.216 . 0 0 "[ . 1]" 1
862 2 51 GLN QE 2 51 GLN HG3 2.861 . 3.503 2.204 2.195 2.220 . 0 0 "[ . 1]" 1
863 1 51 GLN HG3 1 52 VAL H 3.148 . 4.387 4.428 4.377 4.466 0.079 10 0 "[ . 1]" 1
864 2 51 GLN HG3 2 52 VAL H 3.148 . 4.387 4.428 4.376 4.463 0.076 10 0 "[ . 1]" 1
865 1 51 GLN H 1 51 GLN HG3 2.467 . 3.228 2.209 2.123 2.252 . 0 0 "[ . 1]" 1
866 2 51 GLN H 2 51 GLN HG3 2.467 . 3.228 2.211 2.128 2.255 . 0 0 "[ . 1]" 1
867 1 50 ARG H 1 51 GLN HG3 3.441 . 4.921 4.488 4.398 4.581 . 0 0 "[ . 1]" 1
868 2 50 ARG H 2 51 GLN HG3 3.441 . 4.921 4.489 4.403 4.582 . 0 0 "[ . 1]" 1
869 1 51 GLN H 1 51 GLN HG2 2.585 . 3.421 3.439 3.357 3.523 0.102 10 0 "[ . 1]" 1
870 2 51 GLN H 2 51 GLN HG2 2.585 . 3.421 3.441 3.364 3.521 0.100 10 0 "[ . 1]" 1
871 1 51 GLN QE 1 51 GLN HG2 3.077 . 3.874 3.271 3.266 3.278 . 0 0 "[ . 1]" 1
872 2 51 GLN QE 2 51 GLN HG2 3.077 . 3.874 3.272 3.267 3.282 . 0 0 "[ . 1]" 1
873 1 49 VAL HB 1 51 GLN H 3.427 . 4.895 5.059 5.012 5.139 0.244 1 0 "[ . 1]" 1
874 2 49 VAL HB 2 51 GLN H 3.427 . 4.895 5.058 5.017 5.135 0.240 1 0 "[ . 1]" 1
875 1 31 TRP HB3 1 31 TRP HD1 3.050 . 4.213 3.669 3.661 3.683 . 0 0 "[ . 1]" 1
876 2 31 TRP HB3 2 31 TRP HD1 3.050 . 4.213 3.671 3.663 3.683 . 0 0 "[ . 1]" 1
877 1 31 TRP HB2 1 31 TRP HD1 2.932 . 4.006 2.566 2.560 2.573 . 0 0 "[ . 1]" 1
878 2 31 TRP HB2 2 31 TRP HD1 2.932 . 4.006 2.569 2.565 2.578 . 0 0 "[ . 1]" 1
879 1 60 TRP H 1 60 TRP HB2 2.702 . 3.615 2.499 2.448 2.548 . 0 0 "[ . 1]" 1
880 2 60 TRP H 2 60 TRP HB2 2.702 . 3.615 2.499 2.450 2.549 . 0 0 "[ . 1]" 1
881 1 60 TRP HB2 1 60 TRP HE3 2.586 . 3.422 2.662 2.628 2.711 . 0 0 "[ . 1]" 1
882 2 60 TRP HB2 2 60 TRP HE3 2.586 . 3.422 2.664 2.630 2.712 . 0 0 "[ . 1]" 1
883 1 31 TRP HH2 1 60 TRP HB2 3.099 . 4.299 2.383 2.256 2.783 . 0 0 "[ . 1]" 1
884 2 31 TRP HH2 2 60 TRP HB2 3.099 . 4.299 2.382 2.256 2.783 . 0 0 "[ . 1]" 1
885 1 31 TRP HH2 1 60 TRP HB3 3.179 . 4.443 3.331 3.070 3.682 . 0 0 "[ . 1]" 1
886 2 31 TRP HH2 2 60 TRP HB3 3.179 . 4.443 3.332 3.070 3.684 . 0 0 "[ . 1]" 1
887 1 31 TRP HZ2 1 60 TRP HB2 3.205 . 4.489 2.908 2.832 3.026 . 0 0 "[ . 1]" 1
888 2 31 TRP HZ2 2 60 TRP HB2 3.205 . 4.489 2.910 2.834 3.024 . 0 0 "[ . 1]" 1
889 1 31 TRP HZ2 1 60 TRP HB3 3.196 . 4.473 2.942 2.802 3.061 . 0 0 "[ . 1]" 1
890 2 31 TRP HZ2 2 60 TRP HB3 3.196 . 4.473 2.944 2.805 3.067 . 0 0 "[ . 1]" 1
891 1 60 TRP HB2 1 60 TRP HE1 3.570 . 5.163 5.217 5.200 5.227 0.064 9 0 "[ . 1]" 1
892 2 60 TRP HB2 2 60 TRP HE1 3.570 . 5.163 5.214 5.196 5.222 0.059 9 0 "[ . 1]" 1
893 1 60 TRP HB2 2 56 LEU MD2 3.850 . 5.703 2.594 2.524 2.706 . 0 0 "[ . 1]" 1
894 1 56 LEU MD2 2 60 TRP HB2 3.850 . 5.703 2.592 2.500 2.720 . 0 0 "[ . 1]" 1
895 1 30 PRO HB2 2 38 LEU MD1 3.369 . 4.788 4.897 4.817 4.955 0.167 3 0 "[ . 1]" 1
896 1 38 LEU MD1 2 30 PRO HB2 3.369 . 4.788 4.896 4.814 4.967 0.179 4 0 "[ . 1]" 1
897 1 30 PRO HB2 1 34 ILE MD 3.585 . 5.191 4.582 4.442 4.749 . 0 0 "[ . 1]" 1
898 2 30 PRO HB2 2 34 ILE MD 3.585 . 5.191 4.582 4.451 4.749 . 0 0 "[ . 1]" 1
899 1 29 VAL QG 1 30 PRO HB2 3.766 . 5.538 4.478 4.439 4.575 . 0 0 "[ . 1]" 1
900 2 29 VAL QG 2 30 PRO HB2 3.766 . 5.538 4.478 4.440 4.573 . 0 0 "[ . 1]" 1
901 1 30 PRO HB2 1 30 PRO HG2 2.391 . 3.106 2.313 2.310 2.316 . 0 0 "[ . 1]" 1
902 2 30 PRO HB2 2 30 PRO HG2 2.391 . 3.106 2.314 2.310 2.317 . 0 0 "[ . 1]" 1
903 1 30 PRO HG2 1 34 ILE MD 3.133 . 4.360 3.160 3.006 3.362 . 0 0 "[ . 1]" 1
904 2 30 PRO HG2 2 34 ILE MD 3.133 . 4.360 3.160 3.014 3.366 . 0 0 "[ . 1]" 1
905 1 37 LEU HG 2 34 ILE MD 3.482 . 4.998 4.549 4.411 4.702 . 0 0 "[ . 1]" 1
906 1 34 ILE MD 2 37 LEU HG 3.482 . 4.998 4.551 4.448 4.694 . 0 0 "[ . 1]" 1
907 1 64 LYS QB 1 64 LYS HE3 3.008 . 4.139 3.217 1.962 3.947 . 0 0 "[ . 1]" 1
908 2 64 LYS QB 2 64 LYS HE3 3.008 . 4.139 3.219 1.968 3.949 . 0 0 "[ . 1]" 1
909 1 46 GLN HA 1 46 GLN HG3 2.801 . 3.782 3.760 3.743 3.784 0.002 5 0 "[ . 1]" 1
910 2 46 GLN HA 2 46 GLN HG3 2.801 . 3.782 3.760 3.741 3.785 0.003 5 0 "[ . 1]" 1
911 1 42 PHE HB3 1 42 PHE QD 2.916 . 3.979 2.490 2.444 2.512 . 0 0 "[ . 1]" 1
912 2 42 PHE HB3 2 42 PHE QD 2.916 . 3.979 2.490 2.444 2.512 . 0 0 "[ . 1]" 1
913 1 38 LEU HB2 1 38 LEU HG 2.949 . 4.036 2.465 2.453 2.480 . 0 0 "[ . 1]" 1
914 2 38 LEU HB2 2 38 LEU HG 2.949 . 4.036 2.465 2.456 2.479 . 0 0 "[ . 1]" 1
915 1 41 ASN QB 1 43 GLU H 3.703 . 5.117 4.566 4.509 4.664 . 0 0 "[ . 1]" 1
916 2 41 ASN QB 2 43 GLU H 3.703 . 5.117 4.566 4.509 4.660 . 0 0 "[ . 1]" 1
917 1 42 PHE QD 1 45 ASP HB3 3.597 . 5.215 3.837 2.580 4.600 . 0 0 "[ . 1]" 1
918 2 42 PHE QD 2 45 ASP HB3 3.597 . 5.215 3.833 2.574 4.579 . 0 0 "[ . 1]" 1
919 1 55 ARG HE 1 55 ARG QG 3.405 . 4.565 2.244 2.214 2.278 . 0 0 "[ . 1]" 1
920 2 55 ARG HE 2 55 ARG QG 3.405 . 4.565 2.243 2.209 2.275 . 0 0 "[ . 1]" 1
921 1 27 LEU QD 2 53 MET H 3.572 . 5.167 4.854 4.731 5.193 0.026 7 0 "[ . 1]" 1
922 1 53 MET H 2 27 LEU QD 3.572 . 5.167 4.850 4.727 5.195 0.028 7 0 "[ . 1]" 1
923 1 39 LYS QG 1 44 ASN H 3.859 . 5.436 5.579 5.367 6.161 0.725 7 1 "[ . + 1]" 1
924 2 39 LYS QG 2 44 ASN H 3.859 . 5.436 5.580 5.372 6.155 0.719 7 1 "[ . + 1]" 1
925 1 39 LYS QG 1 40 ASN H 3.834 . 4.392 3.657 3.485 3.844 . 0 0 "[ . 1]" 1
926 2 39 LYS QG 2 40 ASN H 3.834 . 4.392 3.657 3.491 3.841 . 0 0 "[ . 1]" 1
927 1 58 LYS QG 1 59 GLY H 3.458 . 4.603 3.362 3.269 3.502 . 0 0 "[ . 1]" 1
928 2 58 LYS QG 2 59 GLY H 3.458 . 4.603 3.360 3.271 3.495 . 0 0 "[ . 1]" 1
929 1 58 LYS H 1 58 LYS QG 3.109 . 4.317 3.956 3.949 3.965 . 0 0 "[ . 1]" 1
930 2 58 LYS H 2 58 LYS QG 3.109 . 4.317 3.955 3.947 3.964 . 0 0 "[ . 1]" 1
931 1 50 ARG H 1 51 GLN HB2 3.389 . 4.825 4.875 4.796 4.949 0.124 7 0 "[ . 1]" 1
932 2 50 ARG H 2 51 GLN HB2 3.389 . 4.825 4.875 4.797 4.941 0.116 9 0 "[ . 1]" 1
933 1 56 LEU H 1 56 LEU HG 3.102 . 4.304 2.481 2.452 2.510 . 0 0 "[ . 1]" 1
934 2 56 LEU H 2 56 LEU HG 3.102 . 4.304 2.481 2.448 2.507 . 0 0 "[ . 1]" 1
935 1 52 VAL MG1 2 28 THR H 3.229 . 4.533 3.884 3.781 4.079 . 0 0 "[ . 1]" 1
936 1 28 THR H 2 52 VAL MG1 3.229 . 4.533 3.888 3.772 4.088 . 0 0 "[ . 1]" 1
937 1 42 PHE HB2 1 43 GLU H 3.540 . 5.106 4.024 4.007 4.089 . 0 0 "[ . 1]" 1
938 2 42 PHE HB2 2 43 GLU H 3.540 . 5.106 4.022 4.005 4.091 . 0 0 "[ . 1]" 1
939 1 51 GLN HG2 2 25 GLN QE 3.519 . 5.067 4.700 3.083 5.909 0.842 2 3 "[ +*-. 1]" 1
940 1 25 GLN QE 2 51 GLN HG2 3.519 . 5.067 4.705 3.057 5.887 0.820 2 3 "[ +*-. 1]" 1
941 1 43 GLU H 1 43 GLU HB3 2.578 . 3.409 2.530 2.445 2.672 . 0 0 "[ . 1]" 1
942 2 43 GLU H 2 43 GLU HB3 2.578 . 3.409 2.530 2.449 2.672 . 0 0 "[ . 1]" 1
943 1 37 LEU HG 1 38 LEU H 3.006 . 4.135 3.515 3.467 3.576 . 0 0 "[ . 1]" 1
944 2 37 LEU HG 2 38 LEU H 3.006 . 4.135 3.514 3.468 3.572 . 0 0 "[ . 1]" 1
945 1 27 LEU H 1 27 LEU HG 2.466 . 3.226 2.557 2.101 3.174 . 0 0 "[ . 1]" 1
946 2 27 LEU H 2 27 LEU HG 2.466 . 3.226 2.562 2.105 3.175 . 0 0 "[ . 1]" 1
947 1 57 GLN H 1 57 GLN QB 2.831 . 3.544 2.367 2.234 2.406 . 0 0 "[ . 1]" 1
948 2 57 GLN H 2 57 GLN QB 2.831 . 3.544 2.367 2.237 2.399 . 0 0 "[ . 1]" 1
949 1 38 LEU MD1 1 41 ASN HD22 3.400 . 4.845 4.458 4.326 4.787 . 0 0 "[ . 1]" 1
950 2 38 LEU MD1 2 41 ASN HD22 3.400 . 4.845 4.460 4.328 4.782 . 0 0 "[ . 1]" 1
951 1 28 THR MG 1 31 TRP HE1 3.286 . 4.636 4.502 4.103 4.769 0.133 8 0 "[ . 1]" 1
952 2 28 THR MG 2 31 TRP HE1 3.286 . 4.636 4.499 4.103 4.773 0.137 8 0 "[ . 1]" 1
953 1 28 THR MG 1 31 TRP HD1 3.262 . 4.592 4.440 4.039 4.719 0.127 3 0 "[ . 1]" 1
954 2 28 THR MG 2 31 TRP HD1 3.262 . 4.592 4.437 4.037 4.710 0.118 3 0 "[ . 1]" 1
955 1 42 PHE QD 1 49 VAL MG1 3.000 . 4.125 3.949 3.923 4.000 . 0 0 "[ . 1]" 1
956 2 42 PHE QD 2 49 VAL MG1 3.000 . 4.125 3.948 3.922 4.003 . 0 0 "[ . 1]" 1
957 1 49 VAL MG1 1 53 MET H 3.191 . 4.464 4.175 4.136 4.233 . 0 0 "[ . 1]" 1
958 2 49 VAL MG1 2 53 MET H 3.191 . 4.464 4.175 4.134 4.235 . 0 0 "[ . 1]" 1
959 1 39 LYS H 1 49 VAL MG1 2.726 . 3.655 3.010 2.909 3.070 . 0 0 "[ . 1]" 1
960 2 39 LYS H 2 49 VAL MG1 2.726 . 3.655 3.006 2.902 3.070 . 0 0 "[ . 1]" 1
961 1 49 VAL MG1 1 52 VAL H 3.469 . 4.974 4.864 4.816 4.933 . 0 0 "[ . 1]" 1
962 2 49 VAL MG1 2 52 VAL H 3.469 . 4.974 4.864 4.817 4.934 . 0 0 "[ . 1]" 1
963 1 27 LEU QD 2 51 GLN H 3.734 . 5.167 3.912 3.748 3.981 . 0 0 "[ . 1]" 1
964 1 51 GLN H 2 27 LEU QD 3.734 . 5.167 3.909 3.767 3.975 . 0 0 "[ . 1]" 1
965 1 34 ILE H 1 36 ALA MB 3.202 . 4.484 4.726 4.670 4.796 0.312 10 0 "[ . 1]" 1
966 2 34 ILE H 2 36 ALA MB 3.202 . 4.484 4.726 4.668 4.797 0.313 10 0 "[ . 1]" 1
967 1 63 ALA MB 2 56 LEU H 3.389 . 4.824 4.957 4.857 5.019 0.195 4 0 "[ . 1]" 1
968 1 56 LEU H 2 63 ALA MB 3.389 . 4.824 4.954 4.895 5.021 0.197 2 0 "[ . 1]" 1
969 1 27 LEU QD 2 51 GLN QE 3.623 . 4.776 2.819 2.689 2.959 . 0 0 "[ . 1]" 1
970 1 51 GLN QE 2 27 LEU QD 3.623 . 4.776 2.815 2.702 2.959 . 0 0 "[ . 1]" 1
971 1 29 VAL H 1 30 PRO HD3 3.733 . 5.475 4.738 4.683 4.800 . 0 0 "[ . 1]" 1
972 2 29 VAL H 2 30 PRO HD3 3.733 . 5.475 4.738 4.688 4.799 . 0 0 "[ . 1]" 1
973 1 53 MET HA 1 55 ARG H 3.368 . 4.786 4.188 4.114 4.278 . 0 0 "[ . 1]" 1
974 2 53 MET HA 2 55 ARG H 3.368 . 4.786 4.189 4.118 4.274 . 0 0 "[ . 1]" 1
975 1 53 MET H 1 53 MET HA 2.394 . 3.111 2.827 2.806 2.836 . 0 0 "[ . 1]" 1
976 2 53 MET H 2 53 MET HA 2.394 . 3.111 2.826 2.806 2.835 . 0 0 "[ . 1]" 1
977 1 53 MET HA 1 54 GLU H 2.795 . 3.772 3.520 3.507 3.535 . 0 0 "[ . 1]" 1
978 2 53 MET HA 2 54 GLU H 2.795 . 3.772 3.520 3.507 3.533 . 0 0 "[ . 1]" 1
979 1 58 LYS H 1 58 LYS HA 2.359 . 3.055 2.799 2.791 2.808 . 0 0 "[ . 1]" 1
980 2 58 LYS H 2 58 LYS HA 2.359 . 3.055 2.800 2.788 2.808 . 0 0 "[ . 1]" 1
981 1 31 TRP H 1 31 TRP HA 2.436 . 3.178 2.833 2.826 2.839 . 0 0 "[ . 1]" 1
982 2 31 TRP H 2 31 TRP HA 2.436 . 3.178 2.832 2.825 2.839 . 0 0 "[ . 1]" 1
983 1 42 PHE HA 1 44 ASN H 3.452 . 4.942 3.745 3.191 3.948 . 0 0 "[ . 1]" 1
984 2 42 PHE HA 2 44 ASN H 3.452 . 4.942 3.745 3.198 3.952 . 0 0 "[ . 1]" 1
985 1 42 PHE HA 1 45 ASP H 3.128 . 4.351 3.724 3.494 4.925 0.574 7 1 "[ . + 1]" 1
986 2 42 PHE HA 2 45 ASP H 3.128 . 4.351 3.723 3.493 4.922 0.571 7 1 "[ . + 1]" 1
987 1 63 ALA HA 2 58 LYS HE3 3.060 . 4.230 3.601 2.484 4.907 0.677 5 1 "[ + 1]" 1
988 1 58 LYS HE3 2 63 ALA HA 3.060 . 4.230 3.594 2.461 4.893 0.663 5 1 "[ + 1]" 1
989 1 30 PRO HD3 1 34 ILE MD 3.255 . 4.580 4.520 4.354 4.733 0.153 7 0 "[ . 1]" 1
990 2 30 PRO HD3 2 34 ILE MD 3.255 . 4.580 4.519 4.350 4.734 0.154 7 0 "[ . 1]" 1
991 1 30 PRO HB2 1 30 PRO HD2 3.405 . 4.855 4.017 4.010 4.027 . 0 0 "[ . 1]" 1
992 2 30 PRO HB2 2 30 PRO HD2 3.405 . 4.855 4.017 4.009 4.028 . 0 0 "[ . 1]" 1
993 1 47 ALA HA 1 50 ARG QD 3.072 . 4.252 2.418 2.197 2.720 . 0 0 "[ . 1]" 1
994 2 47 ALA HA 2 50 ARG QD 3.072 . 4.252 2.419 2.200 2.727 . 0 0 "[ . 1]" 1
995 1 47 ALA HA 1 51 GLN HG3 3.281 . 4.626 4.211 4.106 4.314 . 0 0 "[ . 1]" 1
996 2 47 ALA HA 2 51 GLN HG3 3.281 . 4.626 4.214 4.112 4.322 . 0 0 "[ . 1]" 1
997 1 36 ALA HA 1 39 LYS HE2 3.259 . 4.587 2.692 2.183 4.016 . 0 0 "[ . 1]" 1
998 2 36 ALA HA 2 39 LYS HE2 3.259 . 4.587 2.693 2.190 4.014 . 0 0 "[ . 1]" 1
999 1 48 ALA HA 1 51 GLN HG3 3.019 . 4.158 3.354 3.155 3.518 . 0 0 "[ . 1]" 1
1000 2 48 ALA HA 2 51 GLN HG3 3.019 . 4.158 3.356 3.163 3.519 . 0 0 "[ . 1]" 1
1001 1 39 LYS HA 1 42 PHE HB2 3.122 . 4.340 3.453 3.309 3.526 . 0 0 "[ . 1]" 1
1002 2 39 LYS HA 2 42 PHE HB2 3.122 . 4.340 3.452 3.308 3.527 . 0 0 "[ . 1]" 1
1003 1 31 TRP HA 1 31 TRP HB3 2.964 . 4.062 2.495 2.476 2.523 . 0 0 "[ . 1]" 1
1004 2 31 TRP HA 2 31 TRP HB3 2.964 . 4.062 2.495 2.479 2.524 . 0 0 "[ . 1]" 1
1005 1 31 TRP HA 1 31 TRP HB2 2.872 . 3.903 3.015 3.007 3.020 . 0 0 "[ . 1]" 1
1006 2 31 TRP HA 2 31 TRP HB2 2.872 . 3.903 3.015 3.007 3.020 . 0 0 "[ . 1]" 1
1007 1 35 GLU HA 1 38 LEU HB2 3.033 . 4.183 2.744 2.658 2.933 . 0 0 "[ . 1]" 1
1008 2 35 GLU HA 2 38 LEU HB2 3.033 . 4.183 2.745 2.663 2.932 . 0 0 "[ . 1]" 1
1009 1 58 LYS QG 1 61 SER QB 3.071 . 4.250 3.629 3.365 3.809 . 0 0 "[ . 1]" 1
1010 2 58 LYS QG 2 61 SER QB 3.071 . 4.250 3.630 3.360 3.821 . 0 0 "[ . 1]" 1
1011 1 61 SER QB 1 62 LEU MD2 2.936 . 4.013 3.490 3.341 3.699 . 0 0 "[ . 1]" 1
1012 2 61 SER QB 2 62 LEU MD2 2.936 . 4.013 3.493 3.350 3.699 . 0 0 "[ . 1]" 1
1013 1 55 ARG HA 1 55 ARG HD2 3.103 . 4.307 4.276 4.216 4.407 0.100 10 0 "[ . 1]" 1
1014 2 55 ARG HA 2 55 ARG HD2 3.103 . 4.307 4.276 4.219 4.406 0.099 10 0 "[ . 1]" 1
1015 1 33 ASP HB2 1 34 ILE HA 3.299 . 4.659 4.405 4.339 4.516 . 0 0 "[ . 1]" 1
1016 2 33 ASP HB2 2 34 ILE HA 3.299 . 4.659 4.405 4.335 4.524 . 0 0 "[ . 1]" 1
1017 1 52 VAL HA 2 29 VAL QG 3.277 . 4.619 3.939 3.860 4.085 . 0 0 "[ . 1]" 1
1018 1 29 VAL QG 2 52 VAL HA 3.277 . 4.619 3.942 3.863 4.079 . 0 0 "[ . 1]" 1
1019 1 60 TRP HA 2 55 ARG HE 2.987 . 4.102 3.129 2.750 5.555 1.453 10 1 "[ . +]" 1
1020 1 55 ARG HE 2 60 TRP HA 2.987 . 4.102 3.130 2.742 5.568 1.466 10 1 "[ . +]" 1
1021 1 51 GLN HA 1 52 VAL MG1 3.353 . 4.758 4.937 4.911 4.984 0.226 6 0 "[ . 1]" 1
1022 2 51 GLN HA 2 52 VAL MG1 3.353 . 4.758 4.938 4.912 4.984 0.226 6 0 "[ . 1]" 1
1023 1 51 GLN HA 2 27 LEU QD 3.228 . 4.531 4.013 3.809 4.521 . 0 0 "[ . 1]" 1
1024 1 27 LEU QD 2 51 GLN HA 3.228 . 4.531 4.017 3.836 4.525 . 0 0 "[ . 1]" 1
1025 1 27 LEU HA 2 48 ALA MB 3.317 . 4.692 4.523 4.350 4.701 0.009 5 0 "[ . 1]" 1
1026 1 48 ALA MB 2 27 LEU HA 3.317 . 4.692 4.516 4.352 4.675 . 0 0 "[ . 1]" 1
1027 1 41 ASN HA 1 41 ASN HD22 3.230 . 4.534 3.836 3.813 3.862 . 0 0 "[ . 1]" 1
1028 2 41 ASN HA 2 41 ASN HD22 3.230 . 4.534 3.837 3.809 3.878 . 0 0 "[ . 1]" 1
1029 1 40 ASN HA 1 43 GLU HA 3.038 . 4.192 4.080 3.829 4.608 0.416 7 0 "[ . 1]" 1
1030 2 40 ASN HA 2 43 GLU HA 3.038 . 4.192 4.079 3.828 4.613 0.421 7 0 "[ . 1]" 1
1031 1 40 ASN HA 1 43 GLU QG 3.136 . 4.365 4.193 3.706 4.704 0.339 1 0 "[ . 1]" 1
1032 2 40 ASN HA 2 43 GLU QG 3.136 . 4.365 4.193 3.713 4.693 0.328 1 0 "[ . 1]" 1
1033 1 39 LYS QB 1 40 ASN HA 3.207 . 4.492 4.161 4.023 4.245 . 0 0 "[ . 1]" 1
1034 2 39 LYS QB 2 40 ASN HA 3.207 . 4.492 4.160 4.020 4.246 . 0 0 "[ . 1]" 1
1035 1 40 ASN HA 1 43 GLU HB3 3.178 . 4.441 2.944 2.661 3.128 . 0 0 "[ . 1]" 1
1036 2 40 ASN HA 2 43 GLU HB3 3.178 . 4.441 2.944 2.660 3.119 . 0 0 "[ . 1]" 1
1037 1 48 ALA HA 1 49 VAL HA 3.445 . 4.928 4.873 4.856 4.886 . 0 0 "[ . 1]" 1
1038 2 48 ALA HA 2 49 VAL HA 3.445 . 4.928 4.873 4.857 4.887 . 0 0 "[ . 1]" 1
1039 1 55 ARG HD2 2 64 LYS HA 3.368 . 4.786 3.561 3.152 5.032 0.246 10 0 "[ . 1]" 1
1040 1 64 LYS HA 2 55 ARG HD2 3.368 . 4.786 3.565 3.163 5.066 0.280 10 0 "[ . 1]" 1
1041 1 29 VAL QG 1 34 ILE HB 3.368 . 4.786 3.802 3.738 3.899 . 0 0 "[ . 1]" 1
1042 2 29 VAL QG 2 34 ILE HB 3.368 . 4.786 3.802 3.737 3.897 . 0 0 "[ . 1]" 1
1043 1 27 LEU HB2 1 29 VAL QG 3.616 . 5.250 4.210 4.019 4.514 . 0 0 "[ . 1]" 1
1044 2 27 LEU HB2 2 29 VAL QG 3.616 . 5.250 4.209 4.018 4.514 . 0 0 "[ . 1]" 1
1045 1 27 LEU HB3 1 29 VAL QG 3.652 . 5.319 4.019 3.891 4.411 . 0 0 "[ . 1]" 1
1046 2 27 LEU HB3 2 29 VAL QG 3.652 . 5.319 4.019 3.891 4.412 . 0 0 "[ . 1]" 1
1047 1 27 LEU HB2 1 27 LEU QD 2.105 . 2.659 2.218 2.179 2.258 . 0 0 "[ . 1]" 1
1048 2 27 LEU HB2 2 27 LEU QD 2.105 . 2.659 2.217 2.176 2.257 . 0 0 "[ . 1]" 1
1049 1 56 LEU HB3 1 56 LEU MD1 2.647 . 3.523 2.445 2.433 2.453 . 0 0 "[ . 1]" 1
1050 2 56 LEU HB3 2 56 LEU MD1 2.647 . 3.523 2.445 2.435 2.453 . 0 0 "[ . 1]" 1
1051 1 27 LEU HB2 2 52 VAL MG1 2.756 . 3.705 2.685 2.428 2.804 . 0 0 "[ . 1]" 1
1052 1 52 VAL MG1 2 27 LEU HB2 2.756 . 3.705 2.680 2.433 2.793 . 0 0 "[ . 1]" 1
1053 1 38 LEU MD2 2 34 ILE MD 2.828 . 3.828 2.113 1.976 2.302 . 0 0 "[ . 1]" 1
1054 1 34 ILE MD 2 38 LEU MD2 2.828 . 3.828 2.114 1.982 2.313 . 0 0 "[ . 1]" 1
1055 1 31 TRP HB2 1 53 MET ME 2.846 . 3.858 3.940 3.251 4.597 0.739 3 1 "[ + . 1]" 1
1056 2 31 TRP HB2 2 53 MET ME 2.846 . 3.858 3.940 3.250 4.600 0.742 3 1 "[ + . 1]" 1
1057 1 37 LEU QD 2 29 VAL QG 3.237 . 4.547 4.174 4.082 4.336 . 0 0 "[ . 1]" 1
1058 1 29 VAL QG 2 37 LEU QD 3.237 . 4.547 4.175 4.094 4.307 . 0 0 "[ . 1]" 1
1059 1 38 LEU MD2 2 29 VAL QG 3.387 . 4.821 2.803 2.657 2.865 . 0 0 "[ . 1]" 1
1060 1 29 VAL QG 2 38 LEU MD2 3.387 . 4.821 2.807 2.686 2.885 . 0 0 "[ . 1]" 1
1061 1 34 ILE HB 1 34 ILE HG13 2.761 . 3.714 2.439 2.423 2.461 . 0 0 "[ . 1]" 1
1062 2 34 ILE HB 2 34 ILE HG13 2.761 . 3.714 2.440 2.423 2.459 . 0 0 "[ . 1]" 1
1063 1 34 ILE HB 1 34 ILE HG12 2.645 . 3.519 3.021 3.019 3.023 . 0 0 "[ . 1]" 1
1064 2 34 ILE HB 2 34 ILE HG12 2.645 . 3.519 3.022 3.020 3.023 . 0 0 "[ . 1]" 1
1065 1 64 LYS HA 2 55 ARG HE 3.434 . 4.908 3.149 2.458 3.746 . 0 0 "[ . 1]" 1
1066 1 55 ARG HE 2 64 LYS HA 3.434 . 4.908 3.147 2.473 3.750 . 0 0 "[ . 1]" 1
1067 1 55 ARG HA 1 55 ARG HE 3.814 . 5.632 5.129 4.791 5.276 . 0 0 "[ . 1]" 1
1068 2 55 ARG HA 2 55 ARG HE 3.814 . 5.632 5.128 4.790 5.276 . 0 0 "[ . 1]" 1
1069 1 34 ILE HG12 1 35 GLU H 3.659 . 5.332 5.018 4.981 5.050 . 0 0 "[ . 1]" 1
1070 2 34 ILE HG12 2 35 GLU H 3.659 . 5.332 5.019 4.982 5.048 . 0 0 "[ . 1]" 1
1071 1 34 ILE H 1 34 ILE HG12 2.841 . 3.850 3.609 3.533 3.687 . 0 0 "[ . 1]" 1
1072 2 34 ILE H 2 34 ILE HG12 2.841 . 3.850 3.611 3.534 3.689 . 0 0 "[ . 1]" 1
1073 1 34 ILE HG13 1 35 GLU H 3.595 . 5.210 4.468 4.384 4.539 . 0 0 "[ . 1]" 1
1074 2 34 ILE HG13 2 35 GLU H 3.595 . 5.210 4.468 4.380 4.541 . 0 0 "[ . 1]" 1
1075 1 34 ILE HA 1 34 ILE HG12 2.740 . 3.679 2.377 2.317 2.443 . 0 0 "[ . 1]" 1
1076 2 34 ILE HA 2 34 ILE HG12 2.740 . 3.679 2.377 2.319 2.442 . 0 0 "[ . 1]" 1
1077 1 29 VAL QG 1 34 ILE HG12 3.464 . 4.964 4.056 4.004 4.117 . 0 0 "[ . 1]" 1
1078 2 29 VAL QG 2 34 ILE HG12 3.464 . 4.964 4.057 4.004 4.120 . 0 0 "[ . 1]" 1
1079 1 27 LEU QD 1 29 VAL QG 3.512 . 5.054 4.284 4.163 4.575 . 0 0 "[ . 1]" 1
1080 2 27 LEU QD 2 29 VAL QG 3.512 . 5.054 4.284 4.162 4.576 . 0 0 "[ . 1]" 1
1081 1 29 VAL HA 1 30 PRO HD2 2.533 . 3.335 2.174 2.157 2.190 . 0 0 "[ . 1]" 1
1082 2 29 VAL HA 2 30 PRO HD2 2.533 . 3.335 2.174 2.158 2.188 . 0 0 "[ . 1]" 1
1083 1 29 VAL QG 1 30 PRO HG3 3.678 . 5.369 4.238 4.194 4.327 . 0 0 "[ . 1]" 1
1084 2 29 VAL QG 2 30 PRO HG3 3.678 . 5.369 4.238 4.196 4.324 . 0 0 "[ . 1]" 1
1085 1 29 VAL QG 1 30 PRO HG2 3.360 . 4.771 3.392 3.317 3.506 . 0 0 "[ . 1]" 1
1086 2 29 VAL QG 2 30 PRO HG2 3.360 . 4.771 3.393 3.319 3.505 . 0 0 "[ . 1]" 1
1087 1 25 GLN HB2 1 27 LEU QD 3.200 . 4.480 3.196 2.651 4.380 . 0 0 "[ . 1]" 1
1088 2 25 GLN HB2 2 27 LEU QD 3.200 . 4.480 3.196 2.649 4.375 . 0 0 "[ . 1]" 1
1089 1 28 THR MG 1 29 VAL QG 3.006 . 4.135 3.968 3.888 4.025 . 0 0 "[ . 1]" 1
1090 2 28 THR MG 2 29 VAL QG 3.006 . 4.135 3.968 3.885 4.024 . 0 0 "[ . 1]" 1
1091 1 28 THR MG 1 29 VAL HB 3.233 . 4.540 4.337 4.163 4.473 . 0 0 "[ . 1]" 1
1092 2 28 THR MG 2 29 VAL HB 3.233 . 4.540 4.335 4.156 4.469 . 0 0 "[ . 1]" 1
1093 1 29 VAL QG 1 34 ILE HG13 3.431 . 4.902 3.370 3.268 3.493 . 0 0 "[ . 1]" 1
1094 2 29 VAL QG 2 34 ILE HG13 3.431 . 4.902 3.371 3.269 3.497 . 0 0 "[ . 1]" 1
1095 1 27 LEU HA 1 27 LEU HG 3.206 . 4.491 3.018 2.927 3.065 . 0 0 "[ . 1]" 1
1096 2 27 LEU HA 2 27 LEU HG 3.206 . 4.491 3.017 2.923 3.066 . 0 0 "[ . 1]" 1
1097 1 56 LEU H 1 56 LEU HB2 2.630 . 3.495 2.384 2.372 2.396 . 0 0 "[ . 1]" 1
1098 2 56 LEU H 2 56 LEU HB2 2.630 . 3.495 2.385 2.374 2.394 . 0 0 "[ . 1]" 1
1099 1 55 ARG HB3 1 56 LEU H 2.843 . 3.853 2.667 2.595 2.733 . 0 0 "[ . 1]" 1
1100 2 55 ARG HB3 2 56 LEU H 2.843 . 3.853 2.667 2.593 2.728 . 0 0 "[ . 1]" 1
1101 1 56 LEU H 1 56 LEU HB3 2.750 . 3.695 3.576 3.570 3.580 . 0 0 "[ . 1]" 1
1102 2 56 LEU H 2 56 LEU HB3 2.750 . 3.695 3.577 3.569 3.581 . 0 0 "[ . 1]" 1
1103 1 39 LYS H 1 49 VAL HA 4.367 . 6.751 5.305 5.174 5.405 . 0 0 "[ . 1]" 1
1104 2 39 LYS H 2 49 VAL HA 4.367 . 6.751 5.302 5.168 5.404 . 0 0 "[ . 1]" 1
1105 1 37 LEU HA 1 39 LYS H 3.835 . 5.673 4.201 4.149 4.274 . 0 0 "[ . 1]" 1
1106 2 37 LEU HA 2 39 LYS H 3.835 . 5.673 4.205 4.153 4.283 . 0 0 "[ . 1]" 1
1107 1 38 LEU HB3 1 39 LYS H 2.951 . 4.039 3.592 3.556 3.622 . 0 0 "[ . 1]" 1
1108 2 38 LEU HB3 2 39 LYS H 2.951 . 4.039 3.591 3.550 3.617 . 0 0 "[ . 1]" 1
1109 1 39 LYS H 1 39 LYS QB 2.478 . 3.245 2.253 2.194 2.279 . 0 0 "[ . 1]" 1
1110 2 39 LYS H 2 39 LYS QB 2.478 . 3.245 2.252 2.189 2.279 . 0 0 "[ . 1]" 1
1111 1 38 LEU HB2 1 39 LYS H 3.191 . 4.464 3.014 2.958 3.042 . 0 0 "[ . 1]" 1
1112 2 38 LEU HB2 2 39 LYS H 3.191 . 4.464 3.012 2.951 3.046 . 0 0 "[ . 1]" 1
1113 1 38 LEU MD1 1 39 LYS H 3.655 . 5.325 4.686 4.669 4.703 . 0 0 "[ . 1]" 1
1114 2 38 LEU MD1 2 39 LYS H 3.655 . 5.325 4.687 4.669 4.703 . 0 0 "[ . 1]" 1
1115 1 43 GLU H 1 44 ASN HB2 3.886 . 5.774 5.507 5.157 5.640 . 0 0 "[ . 1]" 1
1116 2 43 GLU H 2 44 ASN HB2 3.886 . 5.774 5.508 5.147 5.638 . 0 0 "[ . 1]" 1
1117 1 43 GLU H 1 45 ASP HB2 4.258 . 6.525 6.428 6.204 7.374 0.849 4 1 "[ +. 1]" 1
1118 2 43 GLU H 2 45 ASP HB2 4.258 . 6.525 6.425 6.199 7.363 0.838 4 1 "[ +. 1]" 1
1119 1 43 GLU H 1 43 GLU QG 2.387 . 3.099 2.182 1.902 2.303 . 0 0 "[ . 1]" 1
1120 2 43 GLU H 2 43 GLU QG 2.387 . 3.099 2.182 1.911 2.304 . 0 0 "[ . 1]" 1
1121 1 35 GLU HB3 1 36 ALA H 2.653 . 3.533 2.688 2.618 2.731 . 0 0 "[ . 1]" 1
1122 2 35 GLU HB3 2 36 ALA H 2.653 . 3.533 2.689 2.622 2.730 . 0 0 "[ . 1]" 1
1123 1 39 LYS QG 1 43 GLU H 4.055 . 6.111 5.056 4.929 5.363 . 0 0 "[ . 1]" 1
1124 2 39 LYS QG 2 43 GLU H 4.055 . 6.111 5.056 4.927 5.366 . 0 0 "[ . 1]" 1
1125 1 38 LEU HB2 1 41 ASN H 3.999 . 5.998 5.318 5.274 5.420 . 0 0 "[ . 1]" 1
1126 2 38 LEU HB2 2 41 ASN H 3.999 . 5.998 5.317 5.269 5.417 . 0 0 "[ . 1]" 1
1127 1 36 ALA H 1 38 LEU HB2 4.066 . 6.132 5.190 5.125 5.246 . 0 0 "[ . 1]" 1
1128 2 36 ALA H 2 38 LEU HB2 4.066 . 6.132 5.192 5.132 5.245 . 0 0 "[ . 1]" 1
1129 1 38 LEU MD1 1 41 ASN H 3.625 . 5.268 4.302 4.219 4.419 . 0 0 "[ . 1]" 1
1130 2 38 LEU MD1 2 41 ASN H 3.625 . 5.268 4.301 4.217 4.415 . 0 0 "[ . 1]" 1
1131 1 41 ASN HA 1 43 GLU H 3.016 . 4.153 3.988 3.905 4.041 . 0 0 "[ . 1]" 1
1132 2 41 ASN HA 2 43 GLU H 3.016 . 4.153 3.990 3.906 4.046 . 0 0 "[ . 1]" 1
1133 1 39 LYS HA 1 43 GLU H 3.613 . 5.244 4.735 4.623 4.904 . 0 0 "[ . 1]" 1
1134 2 39 LYS HA 2 43 GLU H 3.613 . 5.244 4.735 4.623 4.902 . 0 0 "[ . 1]" 1
1135 1 42 PHE HB3 1 43 GLU H 3.333 . 4.722 4.352 4.331 4.372 . 0 0 "[ . 1]" 1
1136 2 42 PHE HB3 2 43 GLU H 3.333 . 4.722 4.351 4.330 4.371 . 0 0 "[ . 1]" 1
1137 1 34 ILE HA 1 36 ALA H 3.880 . 5.762 4.177 4.131 4.209 . 0 0 "[ . 1]" 1
1138 2 34 ILE HA 2 36 ALA H 3.880 . 5.762 4.177 4.129 4.213 . 0 0 "[ . 1]" 1
1139 1 56 LEU H 1 57 GLN H 2.780 . 3.746 2.728 2.683 2.745 . 0 0 "[ . 1]" 1
1140 2 56 LEU H 2 57 GLN H 2.780 . 3.746 2.727 2.678 2.741 . 0 0 "[ . 1]" 1
1141 1 55 ARG H 1 56 LEU H 2.638 . 3.508 2.401 2.376 2.439 . 0 0 "[ . 1]" 1
1142 2 55 ARG H 2 56 LEU H 2.638 . 3.508 2.401 2.376 2.437 . 0 0 "[ . 1]" 1
1143 1 56 LEU H 2 60 TRP HH2 3.841 . 5.685 5.187 4.990 5.428 . 0 0 "[ . 1]" 1
1144 1 60 TRP HH2 2 56 LEU H 3.841 . 5.685 5.189 4.983 5.436 . 0 0 "[ . 1]" 1
1145 1 31 TRP HE3 1 56 LEU H 4.250 . 6.508 6.462 6.321 6.677 0.169 7 0 "[ . 1]" 1
1146 2 31 TRP HE3 2 56 LEU H 4.250 . 6.508 6.463 6.318 6.680 0.172 7 0 "[ . 1]" 1
1147 1 39 LYS H 1 40 ASN H 2.712 . 3.632 2.604 2.555 2.637 . 0 0 "[ . 1]" 1
1148 2 39 LYS H 2 40 ASN H 2.712 . 3.632 2.605 2.555 2.640 . 0 0 "[ . 1]" 1
1149 1 40 ASN H 1 40 ASN QD 3.765 . 5.537 3.938 2.309 4.187 . 0 0 "[ . 1]" 1
1150 2 40 ASN H 2 40 ASN QD 3.765 . 5.537 3.938 2.318 4.181 . 0 0 "[ . 1]" 1
1151 1 46 GLN H 1 49 VAL H 3.892 . 5.785 4.667 4.630 4.719 . 0 0 "[ . 1]" 1
1152 2 46 GLN H 2 49 VAL H 3.892 . 5.785 4.669 4.628 4.723 . 0 0 "[ . 1]" 1
1153 1 47 ALA H 1 49 VAL H 3.464 . 4.964 4.074 3.661 4.244 . 0 0 "[ . 1]" 1
1154 2 47 ALA H 2 49 VAL H 3.464 . 4.964 4.077 3.661 4.242 . 0 0 "[ . 1]" 1
1155 1 40 ASN H 1 42 PHE H 3.421 . 4.884 4.041 3.997 4.072 . 0 0 "[ . 1]" 1
1156 2 40 ASN H 2 42 PHE H 3.421 . 4.884 4.040 3.988 4.081 . 0 0 "[ . 1]" 1
1157 1 42 PHE H 1 42 PHE QD 3.038 . 4.191 3.246 3.141 3.297 . 0 0 "[ . 1]" 1
1158 2 42 PHE H 2 42 PHE QD 3.038 . 4.191 3.247 3.141 3.291 . 0 0 "[ . 1]" 1
1159 1 39 LYS QB 1 40 ASN H 2.704 . 3.618 2.426 2.339 2.544 . 0 0 "[ . 1]" 1
1160 2 39 LYS QB 2 40 ASN H 2.704 . 3.618 2.425 2.332 2.546 . 0 0 "[ . 1]" 1
1161 1 38 LEU HB2 1 40 ASN H 4.295 . 6.601 5.342 5.296 5.387 . 0 0 "[ . 1]" 1
1162 2 38 LEU HB2 2 40 ASN H 4.295 . 6.601 5.340 5.290 5.381 . 0 0 "[ . 1]" 1
1163 1 38 LEU MD1 1 40 ASN H 4.208 . 6.422 5.690 5.622 5.727 . 0 0 "[ . 1]" 1
1164 2 38 LEU MD1 2 40 ASN H 4.208 . 6.422 5.688 5.619 5.730 . 0 0 "[ . 1]" 1
1165 1 47 ALA HA 1 49 VAL H 3.729 . 5.467 4.447 4.253 4.541 . 0 0 "[ . 1]" 1
1166 2 47 ALA HA 2 49 VAL H 3.729 . 5.467 4.448 4.252 4.547 . 0 0 "[ . 1]" 1
1167 1 46 GLN HA 1 49 VAL H 2.782 . 3.750 2.961 2.896 3.027 . 0 0 "[ . 1]" 1
1168 2 46 GLN HA 2 49 VAL H 2.782 . 3.750 2.962 2.893 3.024 . 0 0 "[ . 1]" 1
1169 1 42 PHE HB3 1 49 VAL H 3.981 . 5.962 3.469 3.322 3.539 . 0 0 "[ . 1]" 1
1170 2 42 PHE HB3 2 49 VAL H 3.981 . 5.962 3.469 3.324 3.532 . 0 0 "[ . 1]" 1
1171 1 45 ASP HB3 1 49 VAL H 3.849 . 5.701 4.153 3.643 4.289 . 0 0 "[ . 1]" 1
1172 2 45 ASP HB3 2 49 VAL H 3.849 . 5.701 4.154 3.654 4.280 . 0 0 "[ . 1]" 1
1173 1 42 PHE HB2 1 49 VAL H 3.888 . 5.777 3.537 3.461 3.606 . 0 0 "[ . 1]" 1
1174 2 42 PHE HB2 2 49 VAL H 3.888 . 5.777 3.537 3.462 3.610 . 0 0 "[ . 1]" 1
1175 1 45 ASP HB2 1 49 VAL H 3.877 . 5.756 4.539 4.239 5.682 . 0 0 "[ . 1]" 1
1176 2 45 ASP HB2 2 49 VAL H 3.877 . 5.756 4.539 4.232 5.682 . 0 0 "[ . 1]" 1
1177 1 47 ALA MB 1 49 VAL H 3.398 . 4.841 4.571 4.543 4.621 . 0 0 "[ . 1]" 1
1178 2 47 ALA MB 2 49 VAL H 3.398 . 4.841 4.572 4.545 4.616 . 0 0 "[ . 1]" 1
1179 1 38 LEU MD1 1 42 PHE H 3.773 . 5.553 4.455 4.365 4.555 . 0 0 "[ . 1]" 1
1180 2 38 LEU MD1 2 42 PHE H 3.773 . 5.553 4.455 4.367 4.557 . 0 0 "[ . 1]" 1
1181 1 41 ASN HA 1 42 PHE H 2.978 . 4.086 3.479 3.469 3.488 . 0 0 "[ . 1]" 1
1182 2 41 ASN HA 2 42 PHE H 2.978 . 4.086 3.479 3.468 3.491 . 0 0 "[ . 1]" 1
1183 1 42 PHE H 1 42 PHE HB3 2.741 . 3.680 3.667 3.639 3.688 0.008 3 0 "[ . 1]" 1
1184 2 42 PHE H 2 42 PHE HB3 2.741 . 3.680 3.668 3.637 3.687 0.007 6 0 "[ . 1]" 1
1185 1 42 PHE H 1 49 VAL HA 4.378 . 6.773 5.448 5.334 5.556 . 0 0 "[ . 1]" 1
1186 2 42 PHE H 2 49 VAL HA 4.378 . 6.773 5.449 5.329 5.556 . 0 0 "[ . 1]" 1
1187 1 42 PHE H 1 42 PHE HB2 2.635 . 3.503 2.476 2.436 2.509 . 0 0 "[ . 1]" 1
1188 2 42 PHE H 2 42 PHE HB2 2.635 . 3.503 2.476 2.432 2.506 . 0 0 "[ . 1]" 1
1189 1 41 ASN QB 1 42 PHE H 2.730 . 3.661 2.689 2.648 2.742 . 0 0 "[ . 1]" 1
1190 2 41 ASN QB 2 42 PHE H 2.730 . 3.661 2.689 2.646 2.739 . 0 0 "[ . 1]" 1
1191 1 38 LEU MD1 1 49 VAL H 4.462 . 6.951 5.719 5.682 5.802 . 0 0 "[ . 1]" 1
1192 2 38 LEU MD1 2 49 VAL H 4.462 . 6.951 5.719 5.675 5.799 . 0 0 "[ . 1]" 1
1193 1 28 THR H 1 29 VAL QG 3.619 . 5.256 4.461 4.403 4.518 . 0 0 "[ . 1]" 1
1194 2 28 THR H 2 29 VAL QG 3.619 . 5.256 4.462 4.403 4.514 . 0 0 "[ . 1]" 1
1195 1 29 VAL QG 1 32 ASP H 4.206 . 6.417 5.161 5.066 5.290 . 0 0 "[ . 1]" 1
1196 2 29 VAL QG 2 32 ASP H 4.206 . 6.417 5.161 5.068 5.295 . 0 0 "[ . 1]" 1
1197 1 32 ASP H 1 34 ILE MD 4.399 . 6.818 5.515 5.436 5.614 . 0 0 "[ . 1]" 1
1198 2 32 ASP H 2 34 ILE MD 4.399 . 6.818 5.515 5.428 5.619 . 0 0 "[ . 1]" 1
1199 1 32 ASP H 1 35 GLU HA 4.478 . 6.984 7.066 6.961 7.208 0.224 7 0 "[ . 1]" 1
1200 2 32 ASP H 2 35 GLU HA 4.478 . 6.984 7.066 6.956 7.213 0.229 7 0 "[ . 1]" 1
1201 1 31 TRP HB3 1 32 ASP H 3.007 . 4.137 3.886 3.800 3.954 . 0 0 "[ . 1]" 1
1202 2 31 TRP HB3 2 32 ASP H 3.007 . 4.137 3.887 3.803 3.959 . 0 0 "[ . 1]" 1
1203 1 31 TRP HB2 1 32 ASP H 2.883 . 3.922 2.994 2.918 3.085 . 0 0 "[ . 1]" 1
1204 2 31 TRP HB2 2 32 ASP H 2.883 . 3.922 2.994 2.921 3.092 . 0 0 "[ . 1]" 1
1205 1 32 ASP H 1 32 ASP HB2 2.332 . 3.012 2.606 2.464 2.780 . 0 0 "[ . 1]" 1
1206 2 32 ASP H 2 32 ASP HB2 2.332 . 3.012 2.608 2.458 2.778 . 0 0 "[ . 1]" 1
1207 1 50 ARG HA 1 51 GLN H 2.776 . 3.739 3.554 3.544 3.562 . 0 0 "[ . 1]" 1
1208 2 50 ARG HA 2 51 GLN H 2.776 . 3.739 3.554 3.545 3.562 . 0 0 "[ . 1]" 1
1209 1 50 ARG H 1 50 ARG HB2 2.377 . 3.083 2.502 2.391 2.575 . 0 0 "[ . 1]" 1
1210 2 50 ARG H 2 50 ARG HB2 2.377 . 3.083 2.503 2.391 2.577 . 0 0 "[ . 1]" 1
1211 1 47 ALA MB 1 50 ARG H 3.380 . 4.808 4.584 4.371 4.666 . 0 0 "[ . 1]" 1
1212 2 47 ALA MB 2 50 ARG H 3.380 . 4.808 4.584 4.368 4.662 . 0 0 "[ . 1]" 1
1213 1 27 LEU QD 1 28 THR H 2.673 . 3.566 3.497 3.354 3.646 0.080 2 0 "[ . 1]" 1
1214 2 27 LEU QD 2 28 THR H 2.673 . 3.566 3.496 3.350 3.649 0.083 2 0 "[ . 1]" 1
1215 1 27 LEU HB2 1 28 THR H 2.939 . 4.019 4.046 3.823 4.139 0.120 9 0 "[ . 1]" 1
1216 2 27 LEU HB2 2 28 THR H 2.939 . 4.019 4.046 3.817 4.143 0.124 9 0 "[ . 1]" 1
1217 1 54 GLU H 1 54 GLU HB2 2.373 . 3.077 2.387 2.358 2.413 . 0 0 "[ . 1]" 1
1218 2 54 GLU H 2 54 GLU HB2 2.373 . 3.077 2.386 2.359 2.416 . 0 0 "[ . 1]" 1
1219 1 52 VAL MG1 1 54 GLU H 3.984 . 5.968 5.374 5.308 5.435 . 0 0 "[ . 1]" 1
1220 2 52 VAL MG1 2 54 GLU H 3.984 . 5.968 5.375 5.306 5.438 . 0 0 "[ . 1]" 1
1221 1 63 ALA H 1 64 LYS H 2.494 . 3.272 2.848 2.671 3.055 . 0 0 "[ . 1]" 1
1222 2 63 ALA H 2 64 LYS H 2.494 . 3.272 2.846 2.672 3.045 . 0 0 "[ . 1]" 1
1223 1 64 LYS H 2 55 ARG HE 3.663 . 5.340 4.113 3.794 4.574 . 0 0 "[ . 1]" 1
1224 1 55 ARG HE 2 64 LYS H 3.663 . 5.340 4.107 3.808 4.619 . 0 0 "[ . 1]" 1
1225 1 64 LYS H 1 64 LYS HE3 4.035 . 6.071 4.663 3.874 5.520 . 0 0 "[ . 1]" 1
1226 2 64 LYS H 2 64 LYS HE3 4.035 . 6.071 4.666 3.875 5.522 . 0 0 "[ . 1]" 1
1227 1 64 LYS H 2 55 ARG HD2 4.153 . 6.309 5.519 5.184 6.563 0.254 10 0 "[ . 1]" 1
1228 1 55 ARG HD2 2 64 LYS H 4.153 . 6.309 5.514 5.170 6.529 0.220 10 0 "[ . 1]" 1
1229 1 64 LYS H 1 64 LYS QB 2.039 . 2.559 2.492 2.216 2.678 0.119 1 0 "[ . 1]" 1
1230 2 64 LYS H 2 64 LYS QB 2.039 . 2.559 2.493 2.216 2.665 0.106 1 0 "[ . 1]" 1
1231 1 64 LYS H 1 64 LYS QG 2.461 . 3.218 2.418 1.899 3.965 0.747 6 2 "[ .+ -1]" 1
1232 2 64 LYS H 2 64 LYS QG 2.461 . 3.218 2.418 1.899 3.964 0.746 6 2 "[ .+ -1]" 1
1233 1 62 LEU H 1 62 LEU HB2 2.273 . 2.919 2.487 2.463 2.525 . 0 0 "[ . 1]" 1
1234 2 62 LEU H 2 62 LEU HB2 2.273 . 2.919 2.487 2.464 2.527 . 0 0 "[ . 1]" 1
1235 1 62 LEU HB2 1 63 ALA H 2.526 . 3.323 2.747 2.714 2.784 . 0 0 "[ . 1]" 1
1236 2 62 LEU HB2 2 63 ALA H 2.526 . 3.323 2.749 2.714 2.788 . 0 0 "[ . 1]" 1
1237 1 63 ALA H 2 62 LEU MD1 2.726 . 3.655 3.180 3.060 3.271 . 0 0 "[ . 1]" 1
1238 1 62 LEU MD1 2 63 ALA H 2.726 . 3.655 3.180 3.044 3.294 . 0 0 "[ . 1]" 1
1239 1 33 ASP H 1 34 ILE HB 3.299 . 4.659 4.653 4.558 4.732 0.073 1 0 "[ . 1]" 1
1240 2 33 ASP H 2 34 ILE HB 3.299 . 4.659 4.653 4.554 4.736 0.077 1 0 "[ . 1]" 1
1241 1 33 ASP H 1 34 ILE MD 3.797 . 5.599 5.452 5.378 5.522 . 0 0 "[ . 1]" 1
1242 2 33 ASP H 2 34 ILE MD 3.797 . 5.599 5.452 5.387 5.521 . 0 0 "[ . 1]" 1
1243 1 37 LEU H 1 37 LEU HB2 2.443 . 3.189 2.686 2.670 2.707 . 0 0 "[ . 1]" 1
1244 2 37 LEU H 2 37 LEU HB2 2.443 . 3.189 2.686 2.671 2.704 . 0 0 "[ . 1]" 1
1245 1 30 PRO HB2 1 33 ASP H 3.049 . 4.211 2.856 2.732 2.982 . 0 0 "[ . 1]" 1
1246 2 30 PRO HB2 2 33 ASP H 3.049 . 4.211 2.856 2.735 2.982 . 0 0 "[ . 1]" 1
1247 1 63 ALA H 2 58 LYS HE3 4.321 . 6.655 6.137 4.944 7.468 0.813 5 3 "[ - + * 1]" 1
1248 1 58 LYS HE3 2 63 ALA H 4.321 . 6.655 6.134 4.925 7.461 0.806 5 3 "[ - + * 1]" 1
1249 1 60 TRP HB2 1 63 ALA H 3.934 . 5.868 5.770 5.715 5.815 . 0 0 "[ . 1]" 1
1250 2 60 TRP HB2 2 63 ALA H 3.934 . 5.868 5.769 5.711 5.812 . 0 0 "[ . 1]" 1
1251 1 60 TRP HB3 1 62 LEU H 3.669 . 5.351 4.835 4.770 4.893 . 0 0 "[ . 1]" 1
1252 2 60 TRP HB3 2 62 LEU H 3.669 . 5.351 4.832 4.769 4.889 . 0 0 "[ . 1]" 1
1253 1 59 GLY HA2 1 62 LEU H 2.968 . 4.069 3.076 3.025 3.128 . 0 0 "[ . 1]" 1
1254 2 59 GLY HA2 2 62 LEU H 2.968 . 4.069 3.075 3.022 3.128 . 0 0 "[ . 1]" 1
1255 1 63 ALA H 2 55 ARG HE 3.586 . 5.194 4.078 3.785 5.584 0.390 10 0 "[ . 1]" 1
1256 1 55 ARG HE 2 63 ALA H 3.586 . 5.194 4.075 3.762 5.573 0.379 10 0 "[ . 1]" 1
1257 1 59 GLY H 1 62 LEU H 3.818 . 5.640 4.619 4.597 4.658 . 0 0 "[ . 1]" 1
1258 2 59 GLY H 2 62 LEU H 3.818 . 5.640 4.619 4.596 4.653 . 0 0 "[ . 1]" 1
1259 1 63 ALA H 2 59 GLY H 3.755 . 5.518 4.977 4.819 5.118 . 0 0 "[ . 1]" 1
1260 1 59 GLY H 2 63 ALA H 3.755 . 5.518 4.973 4.848 5.097 . 0 0 "[ . 1]" 1
1261 1 60 TRP H 1 62 LEU H 3.824 . 5.652 3.910 3.863 3.957 . 0 0 "[ . 1]" 1
1262 2 60 TRP H 2 62 LEU H 3.824 . 5.652 3.908 3.862 3.955 . 0 0 "[ . 1]" 1
1263 1 60 TRP H 1 63 ALA H 4.089 . 6.179 4.703 4.674 4.740 . 0 0 "[ . 1]" 1
1264 2 60 TRP H 2 63 ALA H 4.089 . 6.179 4.703 4.673 4.738 . 0 0 "[ . 1]" 1
1265 1 60 TRP HE1 1 61 SER H 4.354 . 6.723 6.295 6.164 6.391 . 0 0 "[ . 1]" 1
1266 2 60 TRP HE1 2 61 SER H 4.354 . 6.723 6.295 6.163 6.389 . 0 0 "[ . 1]" 1
1267 1 59 GLY H 1 61 SER H 3.588 . 5.197 4.132 4.097 4.169 . 0 0 "[ . 1]" 1
1268 2 59 GLY H 2 61 SER H 3.588 . 5.197 4.131 4.101 4.163 . 0 0 "[ . 1]" 1
1269 1 61 SER H 1 62 LEU H 2.591 . 3.430 2.493 2.449 2.527 . 0 0 "[ . 1]" 1
1270 2 61 SER H 2 62 LEU H 2.591 . 3.430 2.492 2.451 2.523 . 0 0 "[ . 1]" 1
1271 1 61 SER H 2 55 ARG HE 4.394 . 6.808 5.309 4.937 7.891 1.083 10 1 "[ . +]" 1
1272 1 55 ARG HE 2 61 SER H 4.394 . 6.808 5.308 4.941 7.893 1.085 10 1 "[ . +]" 1
1273 1 60 TRP HB3 1 61 SER H 2.674 . 3.568 2.643 2.577 2.699 . 0 0 "[ . 1]" 1
1274 2 60 TRP HB3 2 61 SER H 2.674 . 3.568 2.643 2.579 2.697 . 0 0 "[ . 1]" 1
1275 1 59 GLY HA2 1 61 SER H 3.441 . 4.921 4.171 4.140 4.222 . 0 0 "[ . 1]" 1
1276 2 59 GLY HA2 2 61 SER H 3.441 . 4.921 4.170 4.141 4.214 . 0 0 "[ . 1]" 1
1277 1 31 TRP HZ2 1 60 TRP HE1 3.464 . 4.964 4.327 4.158 4.712 . 0 0 "[ . 1]" 1
1278 2 31 TRP HZ2 2 60 TRP HE1 3.464 . 4.964 4.323 4.148 4.700 . 0 0 "[ . 1]" 1
1279 1 60 TRP HE1 2 55 ARG HE 4.008 . 6.016 4.780 4.333 6.302 0.286 10 0 "[ . 1]" 1
1280 1 55 ARG HE 2 60 TRP HE1 4.008 . 6.016 4.780 4.308 6.329 0.313 10 0 "[ . 1]" 1
1281 1 29 VAL H 1 60 TRP HE1 4.430 . 6.883 4.885 4.644 5.094 . 0 0 "[ . 1]" 1
1282 2 29 VAL H 2 60 TRP HE1 4.430 . 6.883 4.884 4.643 5.089 . 0 0 "[ . 1]" 1
1283 1 60 TRP HE1 2 55 ARG HD2 4.451 . 6.927 5.884 5.335 6.074 . 0 0 "[ . 1]" 1
1284 1 55 ARG HD2 2 60 TRP HE1 4.451 . 6.927 5.879 5.338 6.053 . 0 0 "[ . 1]" 1
1285 1 29 VAL HB 1 60 TRP HE1 4.389 . 6.797 5.123 4.853 5.272 . 0 0 "[ . 1]" 1
1286 2 29 VAL HB 2 60 TRP HE1 4.389 . 6.797 5.119 4.842 5.266 . 0 0 "[ . 1]" 1
1287 1 31 TRP HE1 1 53 MET ME 4.208 . 6.422 6.056 5.569 6.264 . 0 0 "[ . 1]" 1
1288 2 31 TRP HE1 2 53 MET ME 4.208 . 6.422 6.058 5.578 6.270 . 0 0 "[ . 1]" 1
1289 1 31 TRP HE1 1 57 GLN QB 4.127 . 6.256 5.537 5.351 6.046 . 0 0 "[ . 1]" 1
1290 2 31 TRP HE1 2 57 GLN QB 4.127 . 6.256 5.540 5.357 6.055 . 0 0 "[ . 1]" 1
1291 1 31 TRP HE1 1 57 GLN QG 3.726 . 5.462 4.392 4.084 5.771 0.309 9 0 "[ . 1]" 1
1292 2 31 TRP HE1 2 57 GLN QG 3.726 . 5.462 4.395 4.089 5.778 0.316 9 0 "[ . 1]" 1
1293 1 31 TRP HE1 1 34 ILE MD 4.437 . 6.898 5.788 5.609 5.976 . 0 0 "[ . 1]" 1
1294 2 31 TRP HE1 2 34 ILE MD 4.437 . 6.898 5.789 5.610 5.969 . 0 0 "[ . 1]" 1
1295 1 28 THR HA 1 31 TRP HE1 3.690 . 5.392 5.058 4.848 5.200 . 0 0 "[ . 1]" 1
1296 2 28 THR HA 2 31 TRP HE1 3.690 . 5.392 5.055 4.845 5.195 . 0 0 "[ . 1]" 1
1297 1 31 TRP HA 1 31 TRP HE1 4.046 . 6.092 5.530 5.451 5.574 . 0 0 "[ . 1]" 1
1298 2 31 TRP HA 2 31 TRP HE1 4.046 . 6.092 5.531 5.453 5.577 . 0 0 "[ . 1]" 1
1299 1 29 VAL HA 1 31 TRP HE1 4.043 . 6.086 5.543 5.450 5.654 . 0 0 "[ . 1]" 1
1300 2 29 VAL HA 2 31 TRP HE1 4.043 . 6.086 5.543 5.450 5.656 . 0 0 "[ . 1]" 1
1301 1 31 TRP HB2 1 31 TRP HE1 3.595 . 5.211 4.760 4.755 4.764 . 0 0 "[ . 1]" 1
1302 2 31 TRP HB2 2 31 TRP HE1 3.595 . 5.211 4.763 4.758 4.769 . 0 0 "[ . 1]" 1
1303 1 31 TRP HE1 1 32 ASP H 4.539 . 7.115 7.114 7.033 7.213 0.098 10 0 "[ . 1]" 1
1304 2 31 TRP HE1 2 32 ASP H 4.539 . 7.115 7.116 7.036 7.220 0.105 10 0 "[ . 1]" 1
1305 1 29 VAL H 1 31 TRP HE1 3.164 . 4.416 3.549 3.364 3.698 . 0 0 "[ . 1]" 1
1306 2 29 VAL H 2 31 TRP HE1 3.164 . 4.416 3.548 3.363 3.694 . 0 0 "[ . 1]" 1
1307 1 57 GLN QG 1 60 TRP H 4.371 . 6.759 5.295 5.146 5.357 . 0 0 "[ . 1]" 1
1308 2 57 GLN QG 2 60 TRP H 4.371 . 6.759 5.296 5.146 5.358 . 0 0 "[ . 1]" 1
1309 1 56 LEU HB2 1 60 TRP H 4.138 . 6.278 5.704 5.679 5.737 . 0 0 "[ . 1]" 1
1310 2 56 LEU HB2 2 60 TRP H 4.138 . 6.278 5.704 5.679 5.740 . 0 0 "[ . 1]" 1
1311 1 60 TRP H 1 60 TRP HB3 2.383 . 3.093 2.549 2.508 2.582 . 0 0 "[ . 1]" 1
1312 2 60 TRP H 2 60 TRP HB3 2.383 . 3.093 2.549 2.511 2.583 . 0 0 "[ . 1]" 1
1313 1 59 GLY HA2 1 60 TRP H 2.923 . 3.991 3.539 3.523 3.546 . 0 0 "[ . 1]" 1
1314 2 59 GLY HA2 2 60 TRP H 2.923 . 3.991 3.538 3.523 3.546 . 0 0 "[ . 1]" 1
1315 1 60 TRP H 1 61 SER H 2.563 . 3.384 2.673 2.657 2.687 . 0 0 "[ . 1]" 1
1316 2 60 TRP H 2 61 SER H 2.563 . 3.384 2.672 2.655 2.684 . 0 0 "[ . 1]" 1
1317 1 31 TRP HH2 1 60 TRP H 3.294 . 4.650 3.956 3.793 4.117 . 0 0 "[ . 1]" 1
1318 2 31 TRP HH2 2 60 TRP H 3.294 . 4.650 3.957 3.796 4.116 . 0 0 "[ . 1]" 1
1319 1 59 GLY H 1 60 TRP H 2.604 . 3.452 2.820 2.768 2.865 . 0 0 "[ . 1]" 1
1320 2 59 GLY H 2 60 TRP H 2.604 . 3.452 2.819 2.766 2.870 . 0 0 "[ . 1]" 1
1321 1 55 ARG HE 1 59 GLY H 4.482 . 6.994 6.180 5.953 7.050 0.056 10 0 "[ . 1]" 1
1322 2 55 ARG HE 2 59 GLY H 4.482 . 6.994 6.181 5.958 7.051 0.057 10 0 "[ . 1]" 1
1323 1 56 LEU HA 1 59 GLY H 3.587 . 5.195 3.800 3.736 3.863 . 0 0 "[ . 1]" 1
1324 2 56 LEU HA 2 59 GLY H 3.587 . 5.195 3.801 3.735 3.865 . 0 0 "[ . 1]" 1
1325 1 59 GLY H 1 59 GLY HA3 2.408 . 3.133 2.280 2.277 2.284 . 0 0 "[ . 1]" 1
1326 2 59 GLY H 2 59 GLY HA3 2.408 . 3.133 2.280 2.276 2.285 . 0 0 "[ . 1]" 1
1327 1 58 LYS HE3 1 59 GLY H 4.470 . 6.967 5.589 4.505 6.393 . 0 0 "[ . 1]" 1
1328 2 58 LYS HE3 2 59 GLY H 4.470 . 6.967 5.586 4.506 6.382 . 0 0 "[ . 1]" 1
1329 1 56 LEU HB2 1 59 GLY H 4.228 . 6.463 5.755 5.689 5.810 . 0 0 "[ . 1]" 1
1330 2 56 LEU HB2 2 59 GLY H 4.228 . 6.463 5.756 5.689 5.808 . 0 0 "[ . 1]" 1
1331 1 58 LYS HB3 1 59 GLY H 2.681 . 3.580 2.378 2.304 2.452 . 0 0 "[ . 1]" 1
1332 2 58 LYS HB3 2 59 GLY H 2.681 . 3.580 2.377 2.309 2.448 . 0 0 "[ . 1]" 1
1333 1 58 LYS H 1 59 GLY H 2.709 . 3.626 2.730 2.694 2.756 . 0 0 "[ . 1]" 1
1334 2 58 LYS H 2 59 GLY H 2.709 . 3.626 2.729 2.693 2.755 . 0 0 "[ . 1]" 1
1335 1 56 LEU HA 1 58 LYS H 4.236 . 6.479 4.785 4.716 4.840 . 0 0 "[ . 1]" 1
1336 2 56 LEU HA 2 58 LYS H 4.236 . 6.479 4.785 4.722 4.840 . 0 0 "[ . 1]" 1
1337 1 57 GLN HA 1 58 LYS H 3.085 . 4.274 3.551 3.544 3.564 . 0 0 "[ . 1]" 1
1338 2 57 GLN HA 2 58 LYS H 3.085 . 4.274 3.551 3.543 3.564 . 0 0 "[ . 1]" 1
1339 1 58 LYS H 1 59 GLY HA2 3.735 . 5.478 5.305 5.276 5.328 . 0 0 "[ . 1]" 1
1340 2 58 LYS H 2 59 GLY HA2 3.735 . 5.478 5.304 5.274 5.327 . 0 0 "[ . 1]" 1
1341 1 58 LYS H 1 58 LYS HE3 4.221 . 6.448 6.272 5.458 6.650 0.202 2 0 "[ . 1]" 1
1342 2 58 LYS H 2 58 LYS HE3 4.221 . 6.448 6.270 5.447 6.653 0.205 2 0 "[ . 1]" 1
1343 1 58 LYS H 1 58 LYS HB3 2.416 . 3.146 2.469 2.409 2.511 . 0 0 "[ . 1]" 1
1344 2 58 LYS H 2 58 LYS HB3 2.416 . 3.146 2.468 2.409 2.510 . 0 0 "[ . 1]" 1
1345 1 57 GLN QB 1 58 LYS H 2.736 . 3.671 2.393 2.216 2.478 . 0 0 "[ . 1]" 1
1346 2 57 GLN QB 2 58 LYS H 2.736 . 3.671 2.393 2.218 2.472 . 0 0 "[ . 1]" 1
1347 1 57 GLN QG 1 58 LYS H 3.707 . 5.425 4.005 3.314 4.122 . 0 0 "[ . 1]" 1
1348 2 57 GLN QG 2 58 LYS H 3.707 . 5.425 4.006 3.316 4.123 . 0 0 "[ . 1]" 1
1349 1 25 GLN QE 2 51 GLN HB2 3.963 . 5.926 4.843 3.574 6.148 0.222 2 0 "[ . 1]" 1
1350 1 51 GLN HB2 2 25 GLN QE 3.963 . 5.926 4.839 3.622 6.177 0.251 2 0 "[ . 1]" 1
1351 1 25 GLN QE 2 55 ARG HB2 4.418 . 6.857 2.792 2.188 3.623 . 0 0 "[ . 1]" 1
1352 1 55 ARG HB2 2 25 GLN QE 4.418 . 6.857 2.792 2.190 3.618 . 0 0 "[ . 1]" 1
1353 1 25 GLN QE 1 27 LEU HB2 4.185 . 6.374 5.102 4.160 5.785 . 0 0 "[ . 1]" 1
1354 2 25 GLN QE 2 27 LEU HB2 4.185 . 6.374 5.101 4.151 5.785 . 0 0 "[ . 1]" 1
1355 1 25 GLN QE 2 55 ARG HB3 4.179 . 6.258 4.033 3.465 4.602 . 0 0 "[ . 1]" 1
1356 1 55 ARG HB3 2 25 GLN QE 4.179 . 6.258 4.032 3.461 4.611 . 0 0 "[ . 1]" 1
1357 1 25 GLN QE 2 52 VAL MG1 4.422 . 6.866 5.150 4.238 5.937 . 0 0 "[ . 1]" 1
1358 1 52 VAL MG1 2 25 GLN QE 4.422 . 6.866 5.148 4.190 5.950 . 0 0 "[ . 1]" 1
1359 1 25 GLN QE 2 51 GLN HB3 4.418 . 6.858 3.365 2.201 4.665 . 0 0 "[ . 1]" 1
1360 1 51 GLN HB3 2 25 GLN QE 4.418 . 6.858 3.362 2.249 4.694 . 0 0 "[ . 1]" 1
1361 1 25 GLN QE 1 27 LEU HB3 4.526 . 7.086 6.186 5.242 6.929 . 0 0 "[ . 1]" 1
1362 2 25 GLN QE 2 27 LEU HB3 4.526 . 7.086 6.186 5.232 6.930 . 0 0 "[ . 1]" 1
1363 1 44 ASN HB2 1 44 ASN HD22 3.049 . 4.211 3.955 3.466 4.043 . 0 0 "[ . 1]" 1
1364 2 44 ASN HB2 2 44 ASN HD22 3.049 . 4.211 3.955 3.473 4.045 . 0 0 "[ . 1]" 1
1365 1 44 ASN HB3 1 44 ASN HD22 2.678 . 3.575 3.508 3.472 3.776 0.201 1 0 "[ . 1]" 1
1366 2 44 ASN HB3 2 44 ASN HD22 2.678 . 3.575 3.507 3.469 3.776 0.201 1 0 "[ . 1]" 1
1367 1 40 ASN QD 1 41 ASN QB 4.246 . 6.499 3.637 3.183 5.514 . 0 0 "[ . 1]" 1
1368 2 40 ASN QD 2 41 ASN QB 4.246 . 6.499 3.641 3.191 5.525 . 0 0 "[ . 1]" 1
1369 1 44 ASN HD21 1 45 ASP HA 4.257 . 6.522 4.308 3.563 6.808 0.286 7 0 "[ . 1]" 1
1370 2 44 ASN HD21 2 45 ASP HA 4.257 . 6.522 4.304 3.569 6.800 0.278 7 0 "[ . 1]" 1
1371 1 37 LEU HA 1 40 ASN QD 3.309 . 4.677 3.856 3.008 4.163 . 0 0 "[ . 1]" 1
1372 2 37 LEU HA 2 40 ASN QD 3.309 . 4.677 3.856 3.017 4.167 . 0 0 "[ . 1]" 1
1373 1 44 ASN HA 1 44 ASN HD22 3.835 . 5.674 4.487 4.392 4.692 . 0 0 "[ . 1]" 1
1374 2 44 ASN HA 2 44 ASN HD22 3.835 . 5.674 4.486 4.387 4.688 . 0 0 "[ . 1]" 1
1375 1 25 GLN QE 2 52 VAL HA 4.152 . 6.307 4.790 3.879 5.606 . 0 0 "[ . 1]" 1
1376 1 52 VAL HA 2 25 GLN QE 4.152 . 6.307 4.788 3.841 5.642 . 0 0 "[ . 1]" 1
1377 1 25 GLN QE 1 64 LYS HA 4.440 . 6.904 4.172 3.157 5.770 . 0 0 "[ . 1]" 1
1378 2 25 GLN QE 2 64 LYS HA 4.440 . 6.904 4.172 3.157 5.753 . 0 0 "[ . 1]" 1
1379 1 25 GLN HA 1 25 GLN QE 4.130 . 6.262 4.786 4.574 4.927 . 0 0 "[ . 1]" 1
1380 2 25 GLN HA 2 25 GLN QE 4.130 . 6.262 4.787 4.573 4.934 . 0 0 "[ . 1]" 1
1381 1 54 GLU H 1 57 GLN QG 4.197 . 6.399 5.063 4.830 6.241 . 0 0 "[ . 1]" 1
1382 2 54 GLU H 2 57 GLN QG 4.197 . 6.399 5.061 4.832 6.244 . 0 0 "[ . 1]" 1
1383 1 57 GLN H 1 57 GLN QG 2.933 . 4.008 2.543 2.291 4.015 0.007 9 0 "[ . 1]" 1
1384 2 57 GLN H 2 57 GLN QG 2.933 . 4.008 2.544 2.291 4.018 0.010 9 0 "[ . 1]" 1
1385 1 53 MET HA 1 57 GLN H 3.501 . 5.034 4.096 4.042 4.214 . 0 0 "[ . 1]" 1
1386 2 53 MET HA 2 57 GLN H 3.501 . 5.034 4.097 4.042 4.208 . 0 0 "[ . 1]" 1
1387 1 54 GLU H 1 56 LEU HA 4.490 . 7.010 6.758 6.700 6.802 . 0 0 "[ . 1]" 1
1388 2 54 GLU H 2 56 LEU HA 4.490 . 7.010 6.758 6.702 6.800 . 0 0 "[ . 1]" 1
1389 1 56 LEU HA 1 57 GLN H 3.525 . 5.078 3.537 3.526 3.548 . 0 0 "[ . 1]" 1
1390 2 56 LEU HA 2 57 GLN H 3.525 . 5.078 3.537 3.527 3.546 . 0 0 "[ . 1]" 1
1391 1 57 GLN H 1 57 GLN HA 2.681 . 3.579 2.841 2.804 2.855 . 0 0 "[ . 1]" 1
1392 2 57 GLN H 2 57 GLN HA 2.681 . 3.579 2.841 2.806 2.856 . 0 0 "[ . 1]" 1
1393 1 54 GLU H 1 57 GLN HE21 4.541 . 7.118 6.080 5.194 6.972 . 0 0 "[ . 1]" 1
1394 2 54 GLU H 2 57 GLN HE21 4.541 . 7.118 6.076 5.186 6.965 . 0 0 "[ . 1]" 1
1395 1 57 GLN H 1 57 GLN HE21 4.403 . 6.826 4.761 3.946 5.317 . 0 0 "[ . 1]" 1
1396 2 57 GLN H 2 57 GLN HE21 4.403 . 6.826 4.762 3.962 5.322 . 0 0 "[ . 1]" 1
1397 1 55 ARG H 1 57 GLN H 3.402 . 4.849 3.819 3.748 3.868 . 0 0 "[ . 1]" 1
1398 2 55 ARG H 2 57 GLN H 3.402 . 4.849 3.819 3.741 3.869 . 0 0 "[ . 1]" 1
1399 1 54 GLU H 1 56 LEU H 3.608 . 5.235 4.032 3.979 4.093 . 0 0 "[ . 1]" 1
1400 2 54 GLU H 2 56 LEU H 3.608 . 5.235 4.032 3.981 4.089 . 0 0 "[ . 1]" 1
1401 1 31 TRP HE3 1 57 GLN H 4.238 . 6.483 5.129 5.039 5.232 . 0 0 "[ . 1]" 1
1402 2 31 TRP HE3 2 57 GLN H 4.238 . 6.483 5.130 5.046 5.233 . 0 0 "[ . 1]" 1
1403 1 56 LEU H 1 57 GLN QG 4.104 . 6.209 4.689 4.442 6.272 0.063 9 0 "[ . 1]" 1
1404 2 56 LEU H 2 57 GLN QG 4.104 . 6.209 4.688 4.434 6.272 0.063 9 0 "[ . 1]" 1
1405 1 56 LEU H 2 29 VAL QG 4.290 . 6.591 4.787 4.695 4.901 . 0 0 "[ . 1]" 1
1406 1 29 VAL QG 2 56 LEU H 4.290 . 6.591 4.787 4.671 4.917 . 0 0 "[ . 1]" 1
1407 1 38 LEU MD2 1 39 LYS H 3.299 . 4.659 4.173 4.157 4.196 . 0 0 "[ . 1]" 1
1408 2 38 LEU MD2 2 39 LYS H 3.299 . 4.659 4.173 4.157 4.195 . 0 0 "[ . 1]" 1
1409 1 35 GLU HA 1 37 LEU H 3.676 . 5.365 4.266 4.223 4.351 . 0 0 "[ . 1]" 1
1410 2 35 GLU HA 2 37 LEU H 3.676 . 5.365 4.265 4.223 4.350 . 0 0 "[ . 1]" 1
1411 1 37 LEU H 1 38 LEU HA 3.615 . 5.249 5.184 5.161 5.204 . 0 0 "[ . 1]" 1
1412 2 37 LEU H 2 38 LEU HA 3.615 . 5.249 5.186 5.164 5.203 . 0 0 "[ . 1]" 1
1413 1 55 ARG H 1 57 GLN QG 4.637 . 7.324 5.349 5.120 6.355 . 0 0 "[ . 1]" 1
1414 2 55 ARG H 2 57 GLN QG 4.637 . 7.324 5.348 5.121 6.353 . 0 0 "[ . 1]" 1
1415 1 55 ARG H 1 56 LEU HA 3.950 . 5.900 5.052 5.033 5.080 . 0 0 "[ . 1]" 1
1416 2 55 ARG H 2 56 LEU HA 3.950 . 5.900 5.053 5.035 5.081 . 0 0 "[ . 1]" 1
1417 1 54 GLU H 1 55 ARG H 2.723 . 3.650 2.422 2.405 2.443 . 0 0 "[ . 1]" 1
1418 2 54 GLU H 2 55 ARG H 2.723 . 3.650 2.423 2.410 2.447 . 0 0 "[ . 1]" 1
1419 1 55 ARG H 2 60 TRP HH2 3.939 . 5.878 5.278 5.159 5.405 . 0 0 "[ . 1]" 1
1420 1 60 TRP HH2 2 55 ARG H 3.939 . 5.878 5.280 5.157 5.412 . 0 0 "[ . 1]" 1
1421 1 31 TRP HZ3 1 55 ARG H 4.234 . 6.475 6.636 6.379 6.850 0.375 7 0 "[ . 1]" 1
1422 2 31 TRP HZ3 2 55 ARG H 4.234 . 6.475 6.638 6.380 6.851 0.376 7 0 "[ . 1]" 1
1423 1 52 VAL H 1 55 ARG H 4.070 . 6.140 4.614 4.568 4.655 . 0 0 "[ . 1]" 1
1424 2 52 VAL H 2 55 ARG H 4.070 . 6.140 4.614 4.569 4.651 . 0 0 "[ . 1]" 1
1425 1 51 GLN H 1 54 GLU H 3.755 . 5.517 4.784 4.719 4.815 . 0 0 "[ . 1]" 1
1426 2 51 GLN H 2 54 GLU H 3.755 . 5.517 4.784 4.714 4.818 . 0 0 "[ . 1]" 1
1427 1 52 VAL H 1 53 MET H 2.557 . 3.375 2.431 2.376 2.474 . 0 0 "[ . 1]" 1
1428 2 52 VAL H 2 53 MET H 2.557 . 3.375 2.431 2.378 2.471 . 0 0 "[ . 1]" 1
1429 1 51 GLN H 1 53 MET H 3.405 . 4.855 4.235 4.164 4.293 . 0 0 "[ . 1]" 1
1430 2 51 GLN H 2 53 MET H 3.405 . 4.855 4.234 4.159 4.293 . 0 0 "[ . 1]" 1
1431 1 53 MET H 1 55 ARG H 3.650 . 5.315 3.923 3.812 3.973 . 0 0 "[ . 1]" 1
1432 2 53 MET H 2 55 ARG H 3.650 . 5.315 3.922 3.813 3.975 . 0 0 "[ . 1]" 1
1433 1 53 MET H 2 60 TRP HH2 4.687 . 7.433 5.633 5.506 5.710 . 0 0 "[ . 1]" 1
1434 1 60 TRP HH2 2 53 MET H 4.687 . 7.433 5.639 5.482 5.719 . 0 0 "[ . 1]" 1
1435 1 38 LEU HA 1 53 MET H 4.672 . 7.400 7.426 7.238 7.565 0.165 3 0 "[ . 1]" 1
1436 2 38 LEU HA 2 53 MET H 4.672 . 7.400 7.426 7.236 7.566 0.166 3 0 "[ . 1]" 1
1437 1 53 MET H 2 27 LEU HB3 4.268 . 6.545 6.908 6.766 7.314 0.769 7 2 "[ . +- 1]" 1
1438 1 27 LEU HB3 2 53 MET H 4.268 . 6.545 6.914 6.776 7.314 0.769 7 2 "[ . +- 1]" 1
1439 1 52 VAL MG1 1 53 MET H 3.047 . 4.208 3.907 3.897 3.924 . 0 0 "[ . 1]" 1
1440 2 52 VAL MG1 2 53 MET H 3.047 . 4.208 3.908 3.896 3.926 . 0 0 "[ . 1]" 1
1441 1 52 VAL MG2 1 53 MET H 2.779 . 3.744 2.167 2.129 2.216 . 0 0 "[ . 1]" 1
1442 2 52 VAL MG2 2 53 MET H 2.779 . 3.744 2.166 2.128 2.216 . 0 0 "[ . 1]" 1
1443 1 38 LEU MD1 1 53 MET H 4.222 . 6.450 5.134 5.026 5.248 . 0 0 "[ . 1]" 1
1444 2 38 LEU MD1 2 53 MET H 4.222 . 6.450 5.135 5.027 5.250 . 0 0 "[ . 1]" 1
1445 1 44 ASN H 1 45 ASP H 2.667 . 3.556 2.015 1.937 2.244 . 0 0 "[ . 1]" 1
1446 2 44 ASN H 2 45 ASP H 2.667 . 3.556 2.014 1.940 2.234 . 0 0 "[ . 1]" 1
1447 1 53 MET H 1 56 LEU H 4.328 . 6.669 4.677 4.621 4.725 . 0 0 "[ . 1]" 1
1448 2 53 MET H 2 56 LEU H 4.328 . 6.669 4.677 4.622 4.724 . 0 0 "[ . 1]" 1
1449 1 51 GLN HB2 1 52 VAL H 2.299 . 2.960 2.794 2.729 2.835 . 0 0 "[ . 1]" 1
1450 2 51 GLN HB2 2 52 VAL H 2.299 . 2.960 2.794 2.728 2.835 . 0 0 "[ . 1]" 1
1451 1 38 LEU MD1 1 52 VAL H 4.091 . 6.183 5.194 5.157 5.237 . 0 0 "[ . 1]" 1
1452 2 38 LEU MD1 2 52 VAL H 4.091 . 6.183 5.194 5.161 5.234 . 0 0 "[ . 1]" 1
1453 1 52 VAL H 2 29 VAL QG 4.375 . 6.768 5.456 5.373 5.599 . 0 0 "[ . 1]" 1
1454 1 29 VAL QG 2 52 VAL H 4.375 . 6.768 5.458 5.374 5.600 . 0 0 "[ . 1]" 1
1455 1 51 GLN H 1 52 VAL H 2.670 . 3.561 2.742 2.707 2.771 . 0 0 "[ . 1]" 1
1456 2 51 GLN H 2 52 VAL H 2.670 . 3.561 2.740 2.694 2.768 . 0 0 "[ . 1]" 1
1457 1 52 VAL H 2 60 TRP HH2 3.882 . 5.765 4.655 4.571 4.726 . 0 0 "[ . 1]" 1
1458 1 60 TRP HH2 2 52 VAL H 3.882 . 5.765 4.659 4.545 4.748 . 0 0 "[ . 1]" 1
1459 1 51 GLN QE 1 52 VAL H 4.486 . 7.002 4.994 4.905 5.053 . 0 0 "[ . 1]" 1
1460 2 51 GLN QE 2 52 VAL H 4.486 . 7.002 4.995 4.906 5.057 . 0 0 "[ . 1]" 1
1461 1 52 VAL H 1 54 GLU H 3.590 . 5.201 3.914 3.831 3.967 . 0 0 "[ . 1]" 1
1462 2 52 VAL H 2 54 GLU H 3.590 . 5.201 3.914 3.827 3.964 . 0 0 "[ . 1]" 1
1463 1 51 GLN H 1 51 GLN QE 4.379 . 6.776 3.451 3.265 3.537 . 0 0 "[ . 1]" 1
1464 2 51 GLN H 2 51 GLN QE 4.379 . 6.776 3.452 3.275 3.541 . 0 0 "[ . 1]" 1
1465 1 41 ASN HD21 2 30 PRO HD3 3.668 . 5.350 3.680 3.465 3.993 . 0 0 "[ . 1]" 1
1466 1 30 PRO HD3 2 41 ASN HD21 3.668 . 5.350 3.682 3.495 3.990 . 0 0 "[ . 1]" 1
1467 1 50 ARG QD 1 51 GLN QE 4.562 . 7.163 5.466 5.205 5.683 . 0 0 "[ . 1]" 1
1468 2 50 ARG QD 2 51 GLN QE 4.562 . 7.163 5.469 5.208 5.696 . 0 0 "[ . 1]" 1
1469 1 51 GLN QE 1 52 VAL MG1 4.252 . 6.512 4.778 4.641 4.867 . 0 0 "[ . 1]" 1
1470 2 51 GLN QE 2 52 VAL MG1 4.252 . 6.512 4.778 4.642 4.859 . 0 0 "[ . 1]" 1
1471 1 48 ALA MB 1 51 GLN QE 3.912 . 5.825 3.289 3.018 3.528 . 0 0 "[ . 1]" 1
1472 2 48 ALA MB 2 51 GLN QE 3.912 . 5.825 3.289 3.023 3.533 . 0 0 "[ . 1]" 1
1473 1 51 GLN HB2 1 51 GLN QE 3.458 . 4.953 2.778 2.748 2.794 . 0 0 "[ . 1]" 1
1474 2 51 GLN HB2 2 51 GLN QE 3.458 . 4.953 2.778 2.750 2.790 . 0 0 "[ . 1]" 1
1475 1 41 ASN HD21 2 30 PRO HD2 3.841 . 5.685 4.902 4.720 5.156 . 0 0 "[ . 1]" 1
1476 1 30 PRO HD2 2 41 ASN HD21 3.841 . 5.685 4.902 4.725 5.154 . 0 0 "[ . 1]" 1
1477 1 41 ASN HD21 2 33 ASP HB2 3.450 . 4.938 4.920 4.713 5.215 0.277 4 0 "[ . 1]" 1
1478 1 33 ASP HB2 2 41 ASN HD21 3.450 . 4.938 4.919 4.693 5.221 0.283 4 0 "[ . 1]" 1
1479 1 41 ASN HD21 2 28 THR MG 4.248 . 6.504 6.241 5.890 6.819 0.315 7 0 "[ . 1]" 1
1480 1 28 THR MG 2 41 ASN HD21 4.248 . 6.504 6.244 5.863 6.813 0.309 7 0 "[ . 1]" 1
1481 1 38 LEU MD1 1 41 ASN HD21 3.769 . 5.545 4.274 4.170 4.567 . 0 0 "[ . 1]" 1
1482 2 38 LEU MD1 2 41 ASN HD21 3.769 . 5.545 4.272 4.166 4.568 . 0 0 "[ . 1]" 1
1483 1 41 ASN HD21 2 34 ILE MD 4.688 . 7.435 6.596 6.403 6.896 . 0 0 "[ . 1]" 1
1484 1 34 ILE MD 2 41 ASN HD21 4.688 . 7.435 6.595 6.429 6.892 . 0 0 "[ . 1]" 1
1485 1 51 GLN QE 2 27 LEU HG 4.065 . 6.131 4.745 4.542 5.003 . 0 0 "[ . 1]" 1
1486 1 27 LEU HG 2 51 GLN QE 4.065 . 6.131 4.752 4.514 4.977 . 0 0 "[ . 1]" 1
1487 1 38 LEU HA 1 41 ASN HD22 4.416 . 6.854 5.523 5.442 5.719 . 0 0 "[ . 1]" 1
1488 2 38 LEU HA 2 41 ASN HD22 4.416 . 6.854 5.525 5.455 5.713 . 0 0 "[ . 1]" 1
1489 1 41 ASN HD22 2 30 PRO HD3 4.506 . 7.044 3.135 2.967 3.441 . 0 0 "[ . 1]" 1
1490 1 30 PRO HD3 2 41 ASN HD22 4.506 . 7.044 3.137 2.970 3.429 . 0 0 "[ . 1]" 1
1491 1 51 GLN H 1 53 MET HA 4.536 . 7.108 7.015 6.921 7.072 . 0 0 "[ . 1]" 1
1492 2 51 GLN H 2 53 MET HA 4.536 . 7.108 7.013 6.917 7.071 . 0 0 "[ . 1]" 1
1493 1 50 ARG H 1 53 MET H 4.170 . 6.343 4.795 4.717 4.835 . 0 0 "[ . 1]" 1
1494 2 50 ARG H 2 53 MET H 4.170 . 6.343 4.795 4.718 4.834 . 0 0 "[ . 1]" 1
1495 1 49 VAL H 1 50 ARG H 2.750 . 3.695 2.770 2.743 2.835 . 0 0 "[ . 1]" 1
1496 2 49 VAL H 2 50 ARG H 2.750 . 3.695 2.770 2.744 2.829 . 0 0 "[ . 1]" 1
1497 1 42 PHE HB3 1 48 ALA H 4.121 . 6.244 4.251 4.155 4.324 . 0 0 "[ . 1]" 1
1498 2 42 PHE HB3 2 48 ALA H 4.121 . 6.244 4.251 4.154 4.326 . 0 0 "[ . 1]" 1
1499 1 48 ALA H 1 49 VAL HA 3.498 . 5.028 5.016 4.976 5.041 0.013 9 0 "[ . 1]" 1
1500 2 48 ALA H 2 49 VAL HA 3.498 . 5.028 5.017 4.979 5.042 0.014 9 0 "[ . 1]" 1
1501 1 42 PHE HB2 1 48 ALA H 4.077 . 6.155 5.158 5.042 5.239 . 0 0 "[ . 1]" 1
1502 2 42 PHE HB2 2 48 ALA H 4.077 . 6.155 5.158 5.042 5.241 . 0 0 "[ . 1]" 1
1503 1 45 ASP HB2 1 48 ALA H 3.619 . 5.256 3.688 3.235 4.468 . 0 0 "[ . 1]" 1
1504 2 45 ASP HB2 2 48 ALA H 3.619 . 5.256 3.688 3.249 4.473 . 0 0 "[ . 1]" 1
1505 1 48 ALA H 1 50 ARG HB2 3.797 . 5.599 5.009 4.847 5.082 . 0 0 "[ . 1]" 1
1506 2 48 ALA H 2 50 ARG HB2 3.797 . 5.599 5.011 4.849 5.082 . 0 0 "[ . 1]" 1
1507 1 48 ALA H 1 50 ARG HG3 3.845 . 5.693 5.029 4.770 5.255 . 0 0 "[ . 1]" 1
1508 2 48 ALA H 2 50 ARG HG3 3.845 . 5.693 5.030 4.768 5.264 . 0 0 "[ . 1]" 1
1509 1 46 GLN H 1 48 ALA H 3.552 . 5.129 3.906 3.798 3.983 . 0 0 "[ . 1]" 1
1510 2 46 GLN H 2 48 ALA H 3.552 . 5.129 3.906 3.801 3.988 . 0 0 "[ . 1]" 1
1511 1 48 ALA H 1 50 ARG H 3.400 . 4.845 3.878 3.798 3.966 . 0 0 "[ . 1]" 1
1512 2 48 ALA H 2 50 ARG H 3.400 . 4.845 3.878 3.800 3.963 . 0 0 "[ . 1]" 1
1513 1 47 ALA H 1 48 ALA H 2.418 . 3.149 2.622 2.163 2.782 . 0 0 "[ . 1]" 1
1514 2 47 ALA H 2 48 ALA H 2.418 . 3.149 2.626 2.162 2.785 . 0 0 "[ . 1]" 1
1515 1 42 PHE HB3 1 47 ALA H 4.528 . 7.091 5.746 5.326 6.004 . 0 0 "[ . 1]" 1
1516 2 42 PHE HB3 2 47 ALA H 4.528 . 7.091 5.749 5.323 6.009 . 0 0 "[ . 1]" 1
1517 1 47 ALA H 1 50 ARG QD 4.137 . 6.276 4.661 4.425 4.980 . 0 0 "[ . 1]" 1
1518 2 47 ALA H 2 50 ARG QD 4.137 . 6.276 4.661 4.435 4.989 . 0 0 "[ . 1]" 1
1519 1 45 ASP HB3 1 47 ALA H 3.936 . 5.873 3.997 3.636 4.284 . 0 0 "[ . 1]" 1
1520 2 45 ASP HB3 2 47 ALA H 3.936 . 5.873 4.003 3.647 4.301 . 0 0 "[ . 1]" 1
1521 1 46 GLN HG3 1 47 ALA H 3.484 . 5.001 5.008 4.807 5.339 0.338 4 0 "[ . 1]" 1
1522 2 46 GLN HG3 2 47 ALA H 3.484 . 5.001 5.005 4.806 5.343 0.342 4 0 "[ . 1]" 1
1523 1 46 GLN HB2 1 47 ALA H 2.602 . 3.448 2.759 2.487 3.255 . 0 0 "[ . 1]" 1
1524 2 46 GLN HB2 2 47 ALA H 2.602 . 3.448 2.755 2.485 3.259 . 0 0 "[ . 1]" 1
1525 1 29 VAL QG 1 60 TRP H 4.511 . 7.055 5.782 5.702 5.888 . 0 0 "[ . 1]" 1
1526 2 29 VAL QG 2 60 TRP H 4.511 . 7.055 5.782 5.700 5.889 . 0 0 "[ . 1]" 1
1527 1 39 LYS QG 1 46 GLN HE21 4.032 . 6.064 4.063 3.650 4.231 . 0 0 "[ . 1]" 1
1528 2 39 LYS QG 2 46 GLN HE21 4.032 . 6.064 4.065 3.658 4.239 . 0 0 "[ . 1]" 1
1529 1 46 GLN HE21 1 46 GLN HG2 3.145 . 4.382 2.235 2.225 2.246 . 0 0 "[ . 1]" 1
1530 2 46 GLN HE21 2 46 GLN HG2 3.145 . 4.382 2.235 2.223 2.249 . 0 0 "[ . 1]" 1
1531 1 46 GLN HB2 1 46 GLN HE21 3.654 . 5.323 4.085 4.016 4.517 . 0 0 "[ . 1]" 1
1532 2 46 GLN HB2 2 46 GLN HE21 3.654 . 5.323 4.085 4.022 4.518 . 0 0 "[ . 1]" 1
1533 1 46 GLN HE21 1 49 VAL MG2 3.758 . 5.523 3.253 3.079 4.099 . 0 0 "[ . 1]" 1
1534 2 46 GLN HE21 2 49 VAL MG2 3.758 . 5.523 3.255 3.082 4.099 . 0 0 "[ . 1]" 1
1535 1 46 GLN HE22 1 46 GLN HG2 3.457 . 4.950 3.482 3.477 3.488 . 0 0 "[ . 1]" 1
1536 2 46 GLN HE22 2 46 GLN HG2 3.457 . 4.950 3.482 3.476 3.488 . 0 0 "[ . 1]" 1
1537 1 39 LYS QB 1 46 GLN HE22 3.995 . 5.990 4.449 4.247 4.638 . 0 0 "[ . 1]" 1
1538 2 39 LYS QB 2 46 GLN HE22 3.995 . 5.990 4.451 4.253 4.644 . 0 0 "[ . 1]" 1
1539 1 39 LYS QG 1 46 GLN HE22 3.774 . 5.554 2.644 2.199 2.800 . 0 0 "[ . 1]" 1
1540 2 39 LYS QG 2 46 GLN HE22 3.774 . 5.554 2.647 2.204 2.813 . 0 0 "[ . 1]" 1
1541 1 46 GLN HE22 1 49 VAL MG2 3.717 . 5.444 2.809 2.610 3.316 . 0 0 "[ . 1]" 1
1542 2 46 GLN HE22 2 49 VAL MG2 3.717 . 5.444 2.812 2.615 3.321 . 0 0 "[ . 1]" 1
1543 1 44 ASN HB3 1 46 GLN HE21 4.102 . 6.205 5.632 5.368 6.217 0.012 7 0 "[ . 1]" 1
1544 2 44 ASN HB3 2 46 GLN HE21 4.102 . 6.205 5.629 5.367 6.207 0.002 7 0 "[ . 1]" 1
1545 1 44 ASN HA 1 46 GLN HE22 4.297 . 6.605 5.444 5.221 5.995 . 0 0 "[ . 1]" 1
1546 2 44 ASN HA 2 46 GLN HE22 4.297 . 6.605 5.441 5.214 5.979 . 0 0 "[ . 1]" 1
1547 1 39 LYS HA 1 46 GLN HE22 4.102 . 6.205 3.318 3.095 3.574 . 0 0 "[ . 1]" 1
1548 2 39 LYS HA 2 46 GLN HE22 4.102 . 6.205 3.320 3.094 3.579 . 0 0 "[ . 1]" 1
1549 1 46 GLN HA 1 46 GLN HE21 3.767 . 5.541 2.818 2.649 4.040 . 0 0 "[ . 1]" 1
1550 2 46 GLN HA 2 46 GLN HE21 3.767 . 5.541 2.818 2.646 4.033 . 0 0 "[ . 1]" 1
1551 1 39 LYS HA 1 46 GLN HE21 4.204 . 6.413 4.645 4.424 5.064 . 0 0 "[ . 1]" 1
1552 2 39 LYS HA 2 46 GLN HE21 4.204 . 6.413 4.645 4.430 5.064 . 0 0 "[ . 1]" 1
1553 1 27 LEU H 1 27 LEU HB2 2.276 . 2.923 2.540 2.402 2.720 . 0 0 "[ . 1]" 1
1554 2 27 LEU H 2 27 LEU HB2 2.276 . 2.923 2.541 2.406 2.720 . 0 0 "[ . 1]" 1
1555 1 27 LEU H 2 52 VAL MG1 3.483 . 5.000 4.781 4.524 5.056 0.056 5 0 "[ . 1]" 1
1556 1 52 VAL MG1 2 27 LEU H 3.483 . 5.000 4.778 4.530 5.044 0.044 5 0 "[ . 1]" 1
1557 1 45 ASP HB3 1 46 GLN H 3.288 . 4.640 4.139 3.969 4.348 . 0 0 "[ . 1]" 1
1558 2 45 ASP HB3 2 46 GLN H 3.288 . 4.640 4.140 3.967 4.354 . 0 0 "[ . 1]" 1
1559 1 46 GLN H 1 47 ALA HA 3.702 . 5.415 5.130 5.051 5.176 . 0 0 "[ . 1]" 1
1560 2 46 GLN H 2 47 ALA HA 3.702 . 5.415 5.131 5.056 5.181 . 0 0 "[ . 1]" 1
1561 1 42 PHE HB3 1 46 GLN H 4.234 . 6.475 4.874 4.735 5.029 . 0 0 "[ . 1]" 1
1562 2 42 PHE HB3 2 46 GLN H 4.234 . 6.475 4.874 4.733 5.024 . 0 0 "[ . 1]" 1
1563 1 45 ASP HA 1 46 GLN H 2.763 . 3.717 2.311 2.225 2.491 . 0 0 "[ . 1]" 1
1564 2 45 ASP HA 2 46 GLN H 2.763 . 3.717 2.313 2.228 2.491 . 0 0 "[ . 1]" 1
1565 1 27 LEU H 1 29 VAL QG 4.160 . 6.323 5.744 5.450 6.113 . 0 0 "[ . 1]" 1
1566 2 27 LEU H 2 29 VAL QG 4.160 . 6.323 5.742 5.451 6.115 . 0 0 "[ . 1]" 1
1567 1 27 LEU H 1 60 TRP HH2 3.978 . 5.956 5.125 4.945 5.318 . 0 0 "[ . 1]" 1
1568 2 27 LEU H 2 60 TRP HH2 3.978 . 5.956 5.126 4.948 5.320 . 0 0 "[ . 1]" 1
1569 1 46 GLN H 1 46 GLN HE22 4.337 . 6.688 4.534 4.401 5.011 . 0 0 "[ . 1]" 1
1570 2 46 GLN H 2 46 GLN HE22 4.337 . 6.688 4.533 4.407 4.996 . 0 0 "[ . 1]" 1
1571 1 29 VAL QG 1 31 TRP H 3.856 . 4.135 3.411 3.311 3.513 . 0 0 "[ . 1]" 1
1572 2 29 VAL QG 2 31 TRP H 3.856 . 4.135 3.411 3.309 3.515 . 0 0 "[ . 1]" 1
1573 1 40 ASN HA 1 45 ASP H 4.766 . 7.606 7.947 7.735 8.250 0.644 7 2 "[ - + 1]" 1
1574 2 40 ASN HA 2 45 ASP H 4.766 . 7.606 7.945 7.732 8.250 0.644 7 2 "[ - + 1]" 1
1575 1 44 ASN HA 1 45 ASP H 2.741 . 3.680 3.438 2.698 3.542 . 0 0 "[ . 1]" 1
1576 2 44 ASN HA 2 45 ASP H 2.741 . 3.680 3.440 2.709 3.543 . 0 0 "[ . 1]" 1
1577 1 42 PHE HB3 1 45 ASP H 3.070 . 4.248 2.909 2.764 3.948 . 0 0 "[ . 1]" 1
1578 2 42 PHE HB3 2 45 ASP H 3.070 . 4.248 2.909 2.767 3.942 . 0 0 "[ . 1]" 1
1579 1 44 ASN HB3 1 45 ASP H 2.925 . 3.995 2.686 2.426 4.270 0.275 7 0 "[ . 1]" 1
1580 2 44 ASN HB3 2 45 ASP H 2.925 . 3.995 2.686 2.425 4.266 0.271 7 0 "[ . 1]" 1
1581 1 45 ASP H 1 46 GLN H 3.184 . 4.451 3.704 2.524 3.921 . 0 0 "[ . 1]" 1
1582 2 45 ASP H 2 46 GLN H 3.184 . 4.451 3.705 2.525 3.922 . 0 0 "[ . 1]" 1
1583 1 45 ASP H 1 47 ALA H 4.169 . 6.341 5.438 4.590 5.827 . 0 0 "[ . 1]" 1
1584 2 45 ASP H 2 47 ALA H 4.169 . 6.341 5.441 4.591 5.832 . 0 0 "[ . 1]" 1
1585 1 42 PHE HB3 1 44 ASN H 3.811 . 5.627 3.565 3.388 3.634 . 0 0 "[ . 1]" 1
1586 2 42 PHE HB3 2 44 ASN H 3.811 . 5.627 3.565 3.387 3.631 . 0 0 "[ . 1]" 1
1587 1 44 ASN H 1 45 ASP HA 4.140 . 6.283 4.329 4.275 4.448 . 0 0 "[ . 1]" 1
1588 2 44 ASN H 2 45 ASP HA 4.140 . 6.283 4.328 4.273 4.441 . 0 0 "[ . 1]" 1
1589 1 44 ASN H 1 45 ASP HB2 3.801 . 5.607 4.333 3.636 4.740 . 0 0 "[ . 1]" 1
1590 2 44 ASN H 2 45 ASP HB2 3.801 . 5.607 4.333 3.644 4.735 . 0 0 "[ . 1]" 1
1591 1 43 GLU HB2 1 44 ASN H 2.977 . 4.085 4.345 4.306 4.372 0.287 1 0 "[ . 1]" 1
1592 2 43 GLU HB2 2 44 ASN H 2.977 . 4.085 4.343 4.307 4.372 0.287 1 0 "[ . 1]" 1
1593 1 44 ASN H 1 46 GLN HG2 4.379 . 6.776 4.474 4.106 4.864 . 0 0 "[ . 1]" 1
1594 2 44 ASN H 2 46 GLN HG2 4.379 . 6.776 4.474 4.115 4.855 . 0 0 "[ . 1]" 1
1595 1 43 GLU H 1 44 ASN H 2.811 . 3.799 3.515 3.300 3.583 . 0 0 "[ . 1]" 1
1596 2 43 GLU H 2 44 ASN H 2.811 . 3.799 3.513 3.300 3.587 . 0 0 "[ . 1]" 1
1597 1 44 ASN H 1 44 ASN HD21 4.100 . 6.201 4.783 4.589 5.568 . 0 0 "[ . 1]" 1
1598 2 44 ASN H 2 44 ASN HD21 4.100 . 6.201 4.783 4.588 5.576 . 0 0 "[ . 1]" 1
1599 1 42 PHE H 1 44 ASN H 3.563 . 5.150 4.840 4.750 4.887 . 0 0 "[ . 1]" 1
1600 2 42 PHE H 2 44 ASN H 3.563 . 5.150 4.840 4.753 4.886 . 0 0 "[ . 1]" 1
1601 1 42 PHE H 1 43 GLU H 2.552 . 3.366 2.462 2.398 2.606 . 0 0 "[ . 1]" 1
1602 2 42 PHE H 2 43 GLU H 2.552 . 3.366 2.461 2.401 2.608 . 0 0 "[ . 1]" 1
1603 1 40 ASN HA 1 42 PHE H 3.628 . 5.273 4.188 4.103 4.242 . 0 0 "[ . 1]" 1
1604 2 40 ASN HA 2 42 PHE H 3.628 . 5.273 4.186 4.094 4.236 . 0 0 "[ . 1]" 1
1605 1 41 ASN HD22 1 42 PHE H 4.182 . 6.368 6.191 6.126 6.264 . 0 0 "[ . 1]" 1
1606 2 41 ASN HD22 2 42 PHE H 4.182 . 6.368 6.193 6.130 6.262 . 0 0 "[ . 1]" 1
1607 1 41 ASN H 1 42 PHE HA 3.736 . 5.481 5.204 5.128 5.232 . 0 0 "[ . 1]" 1
1608 2 41 ASN H 2 42 PHE HA 3.736 . 5.481 5.203 5.126 5.235 . 0 0 "[ . 1]" 1
1609 1 40 ASN HA 1 41 ASN H 3.035 . 4.187 3.505 3.474 3.514 . 0 0 "[ . 1]" 1
1610 2 40 ASN HA 2 41 ASN H 3.035 . 4.187 3.505 3.476 3.517 . 0 0 "[ . 1]" 1
1611 1 41 ASN H 1 41 ASN HA 2.570 . 3.396 2.823 2.811 2.854 . 0 0 "[ . 1]" 1
1612 2 41 ASN H 2 41 ASN HA 2.570 . 3.396 2.824 2.808 2.856 . 0 0 "[ . 1]" 1
1613 1 52 VAL H 1 53 MET HA 3.644 . 5.304 5.066 5.012 5.101 . 0 0 "[ . 1]" 1
1614 2 52 VAL H 2 53 MET HA 3.644 . 5.304 5.065 5.013 5.097 . 0 0 "[ . 1]" 1
1615 1 38 LEU HA 1 40 ASN QD 4.764 . 7.297 5.344 4.935 5.926 . 0 0 "[ . 1]" 1
1616 2 38 LEU HA 2 40 ASN QD 4.764 . 7.297 5.345 4.934 5.934 . 0 0 "[ . 1]" 1
1617 1 37 LEU H 1 39 LYS H 3.456 . 4.949 3.749 3.693 3.807 . 0 0 "[ . 1]" 1
1618 2 37 LEU H 2 39 LYS H 3.456 . 4.949 3.751 3.695 3.813 . 0 0 "[ . 1]" 1
1619 1 34 ILE H 1 38 LEU H 4.377 . 6.772 6.019 5.964 6.067 . 0 0 "[ . 1]" 1
1620 2 34 ILE H 2 38 LEU H 4.377 . 6.772 6.019 5.964 6.072 . 0 0 "[ . 1]" 1
1621 1 37 LEU H 1 38 LEU H 2.678 . 3.574 2.556 2.526 2.582 . 0 0 "[ . 1]" 1
1622 2 37 LEU H 2 38 LEU H 2.678 . 3.574 2.557 2.529 2.581 . 0 0 "[ . 1]" 1
1623 1 38 LEU H 1 40 ASN H 3.606 . 5.231 4.162 4.119 4.216 . 0 0 "[ . 1]" 1
1624 2 38 LEU H 2 40 ASN H 3.606 . 5.231 4.161 4.115 4.210 . 0 0 "[ . 1]" 1
1625 1 35 GLU H 1 38 LEU H 4.086 . 6.173 4.757 4.727 4.795 . 0 0 "[ . 1]" 1
1626 2 35 GLU H 2 38 LEU H 4.086 . 6.173 4.759 4.726 4.798 . 0 0 "[ . 1]" 1
1627 1 37 LEU HA 1 38 LEU H 3.245 . 4.561 3.527 3.522 3.531 . 0 0 "[ . 1]" 1
1628 2 37 LEU HA 2 38 LEU H 3.245 . 4.561 3.527 3.523 3.531 . 0 0 "[ . 1]" 1
1629 1 36 ALA HA 1 38 LEU H 3.865 . 5.732 4.496 4.467 4.551 . 0 0 "[ . 1]" 1
1630 2 36 ALA HA 2 38 LEU H 3.865 . 5.732 4.498 4.463 4.548 . 0 0 "[ . 1]" 1
1631 1 35 GLU HA 1 38 LEU H 3.280 . 4.625 3.482 3.412 3.656 . 0 0 "[ . 1]" 1
1632 2 35 GLU HA 2 38 LEU H 3.280 . 4.625 3.482 3.414 3.655 . 0 0 "[ . 1]" 1
1633 1 38 LEU H 1 38 LEU HA 2.825 . 3.822 2.842 2.836 2.846 . 0 0 "[ . 1]" 1
1634 2 38 LEU H 2 38 LEU HA 2.825 . 3.822 2.842 2.836 2.845 . 0 0 "[ . 1]" 1
1635 1 38 LEU H 1 49 VAL HA 4.351 . 6.717 5.997 5.885 6.039 . 0 0 "[ . 1]" 1
1636 2 38 LEU H 2 49 VAL HA 4.351 . 6.717 5.996 5.885 6.037 . 0 0 "[ . 1]" 1
1637 1 39 LYS H 1 40 ASN HA 3.915 . 5.831 5.222 5.186 5.251 . 0 0 "[ . 1]" 1
1638 2 39 LYS H 2 40 ASN HA 3.915 . 5.831 5.223 5.187 5.252 . 0 0 "[ . 1]" 1
1639 1 38 LEU H 1 38 LEU HB3 2.768 . 3.726 3.509 3.503 3.521 . 0 0 "[ . 1]" 1
1640 2 38 LEU H 2 38 LEU HB3 2.768 . 3.726 3.508 3.502 3.518 . 0 0 "[ . 1]" 1
1641 1 38 LEU H 1 38 LEU MD1 2.961 . 4.057 3.777 3.710 3.814 . 0 0 "[ . 1]" 1
1642 2 38 LEU H 2 38 LEU MD1 2.961 . 4.057 3.777 3.715 3.813 . 0 0 "[ . 1]" 1
1643 1 35 GLU H 1 37 LEU H 3.826 . 5.656 4.101 4.061 4.140 . 0 0 "[ . 1]" 1
1644 2 35 GLU H 2 37 LEU H 3.826 . 5.656 4.102 4.060 4.139 . 0 0 "[ . 1]" 1
1645 1 36 ALA H 1 49 VAL MG1 3.714 . 5.438 5.354 5.268 5.616 0.178 7 0 "[ . 1]" 1
1646 2 36 ALA H 2 49 VAL MG1 3.714 . 5.438 5.355 5.270 5.615 0.177 7 0 "[ . 1]" 1
1647 1 29 VAL QG 1 34 ILE H 4.007 . 6.014 4.658 4.592 4.738 . 0 0 "[ . 1]" 1
1648 2 29 VAL QG 2 34 ILE H 4.007 . 6.014 4.659 4.595 4.740 . 0 0 "[ . 1]" 1
1649 1 35 GLU H 1 36 ALA HA 3.814 . 5.632 5.329 5.278 5.397 . 0 0 "[ . 1]" 1
1650 2 35 GLU H 2 36 ALA HA 3.814 . 5.632 5.329 5.280 5.397 . 0 0 "[ . 1]" 1
1651 1 31 TRP HB3 1 35 GLU H 4.160 . 6.323 4.693 4.654 4.744 . 0 0 "[ . 1]" 1
1652 2 31 TRP HB3 2 35 GLU H 4.160 . 6.323 4.693 4.651 4.744 . 0 0 "[ . 1]" 1
1653 1 31 TRP HB2 1 35 GLU H 4.190 . 6.385 5.545 5.515 5.611 . 0 0 "[ . 1]" 1
1654 2 31 TRP HB2 2 35 GLU H 4.190 . 6.385 5.544 5.509 5.611 . 0 0 "[ . 1]" 1
1655 1 34 ILE H 1 35 GLU H 2.698 . 3.608 2.685 2.653 2.719 . 0 0 "[ . 1]" 1
1656 2 34 ILE H 2 35 GLU H 2.698 . 3.608 2.683 2.657 2.715 . 0 0 "[ . 1]" 1
1657 1 35 GLU H 1 36 ALA H 2.785 . 3.754 2.747 2.681 2.830 . 0 0 "[ . 1]" 1
1658 2 35 GLU H 2 36 ALA H 2.785 . 3.754 2.748 2.685 2.830 . 0 0 "[ . 1]" 1
1659 1 31 TRP HE3 1 35 GLU H 3.833 . 5.670 4.729 4.533 4.866 . 0 0 "[ . 1]" 1
1660 2 31 TRP HE3 2 35 GLU H 3.833 . 5.670 4.728 4.532 4.859 . 0 0 "[ . 1]" 1
1661 1 31 TRP HE3 1 34 ILE H 3.715 . 5.440 5.313 5.175 5.432 . 0 0 "[ . 1]" 1
1662 2 31 TRP HE3 2 34 ILE H 3.715 . 5.440 5.314 5.169 5.434 . 0 0 "[ . 1]" 1
1663 1 32 ASP H 1 34 ILE H 3.737 . 5.483 3.864 3.768 3.956 . 0 0 "[ . 1]" 1
1664 2 32 ASP H 2 34 ILE H 3.737 . 5.483 3.865 3.760 3.957 . 0 0 "[ . 1]" 1
1665 1 34 ILE H 1 35 GLU HA 3.734 . 5.477 5.256 5.240 5.285 . 0 0 "[ . 1]" 1
1666 2 34 ILE H 2 35 GLU HA 3.734 . 5.477 5.254 5.241 5.282 . 0 0 "[ . 1]" 1
1667 1 31 TRP HB3 1 34 ILE H 4.225 . 6.456 5.437 5.339 5.517 . 0 0 "[ . 1]" 1
1668 2 31 TRP HB3 2 34 ILE H 4.225 . 6.456 5.438 5.331 5.520 . 0 0 "[ . 1]" 1
1669 1 33 ASP HB2 1 34 ILE H 2.747 . 3.690 2.699 2.631 2.777 . 0 0 "[ . 1]" 1
1670 2 33 ASP HB2 2 34 ILE H 2.747 . 3.690 2.698 2.626 2.774 . 0 0 "[ . 1]" 1
1671 1 30 PRO HB2 1 34 ILE H 3.476 . 4.986 3.410 3.348 3.534 . 0 0 "[ . 1]" 1
1672 2 30 PRO HB2 2 34 ILE H 3.476 . 4.986 3.411 3.351 3.542 . 0 0 "[ . 1]" 1
1673 1 34 ILE H 1 34 ILE HG13 2.697 . 3.606 2.442 2.334 2.547 . 0 0 "[ . 1]" 1
1674 2 34 ILE H 2 34 ILE HG13 2.697 . 3.606 2.443 2.334 2.549 . 0 0 "[ . 1]" 1
1675 1 33 ASP H 1 35 GLU H 3.355 . 4.762 4.120 4.044 4.201 . 0 0 "[ . 1]" 1
1676 2 33 ASP H 2 35 GLU H 3.355 . 4.762 4.118 4.052 4.202 . 0 0 "[ . 1]" 1
1677 1 30 PRO HA 1 33 ASP H 4.161 . 6.325 4.063 4.021 4.090 . 0 0 "[ . 1]" 1
1678 2 30 PRO HA 2 33 ASP H 4.161 . 6.325 4.064 4.025 4.089 . 0 0 "[ . 1]" 1
1679 1 33 ASP H 1 35 GLU HA 4.428 . 6.879 6.806 6.754 6.891 0.012 7 0 "[ . 1]" 1
1680 2 33 ASP H 2 35 GLU HA 4.428 . 6.879 6.804 6.757 6.893 0.014 7 0 "[ . 1]" 1
1681 1 33 ASP H 1 34 ILE HA 3.717 . 5.444 5.184 5.158 5.214 . 0 0 "[ . 1]" 1
1682 2 33 ASP H 2 34 ILE HA 3.717 . 5.444 5.184 5.154 5.218 . 0 0 "[ . 1]" 1
1683 1 31 TRP HB2 1 33 ASP H 3.967 . 5.934 5.372 5.277 5.439 . 0 0 "[ . 1]" 1
1684 2 31 TRP HB2 2 33 ASP H 3.967 . 5.934 5.372 5.272 5.432 . 0 0 "[ . 1]" 1
1685 1 28 THR MG 1 32 ASP H 4.791 . 7.660 6.478 6.379 6.624 . 0 0 "[ . 1]" 1
1686 2 28 THR MG 2 32 ASP H 4.791 . 7.660 6.478 6.384 6.628 . 0 0 "[ . 1]" 1
1687 1 31 TRP H 1 32 ASP H 2.866 . 3.892 2.596 2.549 2.639 . 0 0 "[ . 1]" 1
1688 2 31 TRP H 2 32 ASP H 2.866 . 3.892 2.598 2.544 2.642 . 0 0 "[ . 1]" 1
1689 1 32 ASP H 1 33 ASP H 2.638 . 3.508 2.555 2.458 2.631 . 0 0 "[ . 1]" 1
1690 2 32 ASP H 2 33 ASP H 2.638 . 3.508 2.555 2.450 2.640 . 0 0 "[ . 1]" 1
1691 1 31 TRP HD1 1 32 ASP H 3.469 . 4.973 4.940 4.853 5.074 0.101 10 0 "[ . 1]" 1
1692 2 31 TRP HD1 2 32 ASP H 3.469 . 4.973 4.942 4.858 5.083 0.110 10 0 "[ . 1]" 1
1693 1 31 TRP H 1 31 TRP HD1 2.749 . 3.693 3.015 2.956 3.067 . 0 0 "[ . 1]" 1
1694 2 31 TRP H 2 31 TRP HD1 2.749 . 3.693 3.015 2.954 3.069 . 0 0 "[ . 1]" 1
1695 1 31 TRP H 1 31 TRP HZ3 4.311 . 6.634 6.728 6.629 6.835 0.201 9 0 "[ . 1]" 1
1696 2 31 TRP H 2 31 TRP HZ3 4.311 . 6.634 6.726 6.622 6.830 0.196 9 0 "[ . 1]" 1
1697 1 31 TRP H 1 57 GLN HE21 4.559 . 7.156 6.225 5.624 6.744 . 0 0 "[ . 1]" 1
1698 2 31 TRP H 2 57 GLN HE21 4.559 . 7.156 6.227 5.620 6.742 . 0 0 "[ . 1]" 1
1699 1 31 TRP H 1 31 TRP HE1 3.797 . 5.599 4.796 4.712 4.904 . 0 0 "[ . 1]" 1
1700 2 31 TRP H 2 31 TRP HE1 3.797 . 5.599 4.795 4.709 4.901 . 0 0 "[ . 1]" 1
1701 1 30 PRO HA 1 31 TRP H 2.740 . 3.679 2.259 2.247 2.272 . 0 0 "[ . 1]" 1
1702 2 30 PRO HA 2 31 TRP H 2.740 . 3.679 2.261 2.249 2.279 . 0 0 "[ . 1]" 1
1703 1 31 TRP H 1 32 ASP HA 3.728 . 5.465 5.202 5.160 5.234 . 0 0 "[ . 1]" 1
1704 2 31 TRP H 2 32 ASP HA 3.728 . 5.465 5.202 5.158 5.235 . 0 0 "[ . 1]" 1
1705 1 29 VAL HA 1 31 TRP H 3.845 . 5.693 5.101 5.033 5.143 . 0 0 "[ . 1]" 1
1706 2 29 VAL HA 2 31 TRP H 3.845 . 5.693 5.102 5.029 5.142 . 0 0 "[ . 1]" 1
1707 1 30 PRO HD3 1 31 TRP H 3.785 . 5.575 5.195 5.156 5.223 . 0 0 "[ . 1]" 1
1708 2 30 PRO HD3 2 31 TRP H 3.785 . 5.575 5.197 5.157 5.223 . 0 0 "[ . 1]" 1
1709 1 31 TRP H 1 31 TRP HB3 2.804 . 3.787 3.601 3.576 3.613 . 0 0 "[ . 1]" 1
1710 2 31 TRP H 2 31 TRP HB3 2.804 . 3.787 3.599 3.574 3.610 . 0 0 "[ . 1]" 1
1711 1 31 TRP H 1 31 TRP HB2 2.693 . 3.599 2.449 2.368 2.491 . 0 0 "[ . 1]" 1
1712 2 31 TRP H 2 31 TRP HB2 2.693 . 3.599 2.448 2.368 2.490 . 0 0 "[ . 1]" 1
1713 1 30 PRO HB2 1 31 TRP H 3.406 . 4.857 4.133 4.119 4.147 . 0 0 "[ . 1]" 1
1714 2 30 PRO HB2 2 31 TRP H 3.406 . 4.857 4.135 4.122 4.148 . 0 0 "[ . 1]" 1
1715 1 31 TRP H 1 53 MET ME 3.303 . 4.666 4.868 4.519 5.243 0.577 3 1 "[ + . 1]" 1
1716 2 31 TRP H 2 53 MET ME 3.303 . 4.666 4.867 4.520 5.245 0.579 3 1 "[ + . 1]" 1
1717 1 28 THR MG 1 31 TRP H 3.702 . 5.415 4.688 4.493 4.818 . 0 0 "[ . 1]" 1
1718 2 28 THR MG 2 31 TRP H 3.702 . 5.415 4.687 4.496 4.816 . 0 0 "[ . 1]" 1
1719 1 31 TRP H 2 38 LEU MD1 4.326 . 6.665 6.220 6.184 6.266 . 0 0 "[ . 1]" 1
1720 1 38 LEU MD1 2 31 TRP H 4.326 . 6.665 6.218 6.177 6.262 . 0 0 "[ . 1]" 1
1721 1 31 TRP H 1 34 ILE MD 3.492 . 5.016 4.487 4.388 4.565 . 0 0 "[ . 1]" 1
1722 2 31 TRP H 2 34 ILE MD 3.492 . 5.016 4.488 4.391 4.565 . 0 0 "[ . 1]" 1
1723 1 29 VAL HB 1 31 TRP H 3.578 . 5.179 4.499 4.397 4.573 . 0 0 "[ . 1]" 1
1724 2 29 VAL HB 2 31 TRP H 3.578 . 5.179 4.498 4.391 4.569 . 0 0 "[ . 1]" 1
1725 1 27 LEU HB3 1 29 VAL H 4.479 . 6.986 5.683 5.535 5.832 . 0 0 "[ . 1]" 1
1726 2 27 LEU HB3 2 29 VAL H 4.479 . 6.986 5.682 5.532 5.831 . 0 0 "[ . 1]" 1
1727 1 29 VAL H 2 38 LEU MD1 4.325 . 6.664 5.130 5.025 5.227 . 0 0 "[ . 1]" 1
1728 1 38 LEU MD1 2 29 VAL H 4.325 . 6.664 5.125 5.029 5.219 . 0 0 "[ . 1]" 1
1729 1 29 VAL H 1 34 ILE MD 4.210 . 6.426 5.785 5.771 5.807 . 0 0 "[ . 1]" 1
1730 2 29 VAL H 2 34 ILE MD 4.210 . 6.426 5.785 5.772 5.806 . 0 0 "[ . 1]" 1
1731 1 29 VAL H 1 30 PRO HD2 3.801 . 5.607 4.892 4.878 4.907 . 0 0 "[ . 1]" 1
1732 2 29 VAL H 2 30 PRO HD2 3.801 . 5.607 4.893 4.879 4.905 . 0 0 "[ . 1]" 1
1733 1 29 VAL H 1 31 TRP HD1 3.934 . 5.868 4.505 4.337 4.639 . 0 0 "[ . 1]" 1
1734 2 29 VAL H 2 31 TRP HD1 3.934 . 5.868 4.506 4.332 4.646 . 0 0 "[ . 1]" 1
1735 1 29 VAL H 1 60 TRP HZ2 3.701 . 5.413 4.594 4.371 4.870 . 0 0 "[ . 1]" 1
1736 2 29 VAL H 2 60 TRP HZ2 3.701 . 5.413 4.593 4.375 4.862 . 0 0 "[ . 1]" 1
1737 1 29 VAL H 1 60 TRP HH2 4.453 . 6.931 5.694 5.602 5.941 . 0 0 "[ . 1]" 1
1738 2 29 VAL H 2 60 TRP HH2 4.453 . 6.931 5.693 5.588 5.934 . 0 0 "[ . 1]" 1
1739 1 29 VAL H 1 31 TRP HZ2 4.063 . 6.127 4.907 4.737 5.054 . 0 0 "[ . 1]" 1
1740 2 29 VAL H 2 31 TRP HZ2 4.063 . 6.127 4.906 4.738 5.057 . 0 0 "[ . 1]" 1
1741 1 28 THR H 1 60 TRP HZ2 3.794 . 5.593 4.778 4.425 5.102 . 0 0 "[ . 1]" 1
1742 2 28 THR H 2 60 TRP HZ2 3.794 . 5.593 4.778 4.424 5.098 . 0 0 "[ . 1]" 1
1743 1 28 THR H 2 42 PHE HZ 3.135 . 4.364 2.332 2.235 2.465 . 0 0 "[ . 1]" 1
1744 1 42 PHE HZ 2 28 THR H 3.135 . 4.364 2.325 2.203 2.465 . 0 0 "[ . 1]" 1
1745 1 28 THR H 1 60 TRP HH2 4.256 . 6.520 5.456 5.305 5.794 . 0 0 "[ . 1]" 1
1746 2 28 THR H 2 60 TRP HH2 4.256 . 6.520 5.455 5.300 5.785 . 0 0 "[ . 1]" 1
1747 1 28 THR H 1 29 VAL HA 3.845 . 5.693 4.987 4.930 5.060 . 0 0 "[ . 1]" 1
1748 2 28 THR H 2 29 VAL HA 3.845 . 5.693 4.988 4.937 5.063 . 0 0 "[ . 1]" 1
1749 1 26 GLU H 1 26 GLU QB 2.211 . 2.822 2.574 2.388 3.333 0.511 8 1 "[ . + 1]" 1
1750 2 26 GLU H 2 26 GLU QB 2.211 . 2.822 2.573 2.385 3.334 0.512 8 1 "[ . + 1]" 1
1751 1 26 GLU H 2 52 VAL MG1 4.230 . 6.467 6.396 5.664 6.652 0.185 3 0 "[ . 1]" 1
1752 1 52 VAL MG1 2 26 GLU H 4.230 . 6.467 6.391 5.690 6.665 0.198 3 0 "[ . 1]" 1
1753 1 41 ASN H 1 41 ASN HD22 3.957 . 5.914 5.636 5.585 5.709 . 0 0 "[ . 1]" 1
1754 2 41 ASN H 2 41 ASN HD22 3.957 . 5.914 5.638 5.584 5.716 . 0 0 "[ . 1]" 1
1755 1 41 ASN HD22 1 43 GLU H 4.593 . 7.230 7.388 7.294 7.494 0.264 3 0 "[ . 1]" 1
1756 2 41 ASN HD22 2 43 GLU H 4.593 . 7.230 7.390 7.295 7.493 0.263 3 0 "[ . 1]" 1
1757 1 40 ASN QD 1 41 ASN H 4.230 . 6.467 3.210 2.908 4.228 . 0 0 "[ . 1]" 1
1758 2 40 ASN QD 2 41 ASN H 4.230 . 6.467 3.213 2.921 4.238 . 0 0 "[ . 1]" 1
1759 1 55 ARG HE 1 56 LEU H 4.661 . 7.377 6.180 5.992 6.941 . 0 0 "[ . 1]" 1
1760 2 55 ARG HE 2 56 LEU H 4.661 . 7.377 6.179 5.984 6.937 . 0 0 "[ . 1]" 1
1761 1 38 LEU MD1 1 43 GLU H 4.594 . 7.233 6.478 6.379 6.677 . 0 0 "[ . 1]" 1
1762 2 38 LEU MD1 2 43 GLU H 4.594 . 7.233 6.478 6.381 6.676 . 0 0 "[ . 1]" 1
1763 1 40 ASN QD 1 43 GLU H 4.260 . 6.528 5.369 5.120 6.210 . 0 0 "[ . 1]" 1
1764 2 40 ASN QD 2 43 GLU H 4.260 . 6.528 5.370 5.118 6.208 . 0 0 "[ . 1]" 1
1765 1 57 GLN HE21 1 57 GLN QG 3.248 . 4.566 2.228 2.160 2.755 . 0 0 "[ . 1]" 1
1766 2 57 GLN HE21 2 57 GLN QG 3.248 . 4.566 2.227 2.163 2.751 . 0 0 "[ . 1]" 1
1767 1 31 TRP HB3 1 57 GLN HE21 3.687 . 5.386 2.937 2.520 3.819 . 0 0 "[ . 1]" 1
1768 2 31 TRP HB3 2 57 GLN HE21 3.687 . 5.386 2.941 2.518 3.815 . 0 0 "[ . 1]" 1
1769 1 31 TRP HB2 1 57 GLN HE21 3.733 . 5.475 4.328 3.641 5.072 . 0 0 "[ . 1]" 1
1770 2 31 TRP HB2 2 57 GLN HE21 3.733 . 5.475 4.332 3.640 5.070 . 0 0 "[ . 1]" 1
1771 1 57 GLN QB 1 57 GLN HE21 3.720 . 5.449 3.547 1.701 3.768 0.290 9 0 "[ . 1]" 1
1772 2 57 GLN QB 2 57 GLN HE21 3.720 . 5.449 3.546 1.707 3.766 0.284 9 0 "[ . 1]" 1
1773 1 31 TRP HA 1 57 GLN HE21 4.161 . 6.325 4.753 4.553 5.303 . 0 0 "[ . 1]" 1
1774 2 31 TRP HA 2 57 GLN HE21 4.161 . 6.325 4.756 4.551 5.305 . 0 0 "[ . 1]" 1
1775 1 54 GLU HA 1 57 GLN HE21 4.126 . 6.254 4.701 4.135 5.344 . 0 0 "[ . 1]" 1
1776 2 54 GLU HA 2 57 GLN HE21 4.126 . 6.254 4.698 4.131 5.339 . 0 0 "[ . 1]" 1
1777 1 57 GLN HA 1 57 GLN HE21 4.090 . 6.181 4.730 3.019 5.041 . 0 0 "[ . 1]" 1
1778 2 57 GLN HA 2 57 GLN HE21 4.090 . 6.181 4.733 3.034 5.038 . 0 0 "[ . 1]" 1
1779 1 31 TRP HD1 1 57 GLN HE21 3.611 . 5.241 5.186 4.306 5.966 0.725 6 2 "[ -+ 1]" 1
1780 2 31 TRP HD1 2 57 GLN HE21 3.611 . 5.241 5.192 4.315 5.972 0.731 6 2 "[ -+ 1]" 1
1781 1 31 TRP HE1 1 57 GLN HE21 4.188 . 6.381 5.699 4.871 6.528 0.147 6 0 "[ . 1]" 1
1782 2 31 TRP HE1 2 57 GLN HE21 4.188 . 6.381 5.706 4.891 6.534 0.153 6 0 "[ . 1]" 1
1783 1 41 ASN HD21 2 29 VAL QG 4.735 . 7.537 5.911 5.737 6.097 . 0 0 "[ . 1]" 1
1784 1 29 VAL QG 2 41 ASN HD21 4.735 . 7.537 5.912 5.743 6.094 . 0 0 "[ . 1]" 1
1785 1 41 ASN HD22 2 33 ASP HB2 4.482 . 6.992 5.743 5.467 6.138 . 0 0 "[ . 1]" 1
1786 1 33 ASP HB2 2 41 ASN HD22 4.482 . 6.992 5.743 5.451 6.124 . 0 0 "[ . 1]" 1
1787 1 61 SER H 2 55 ARG HD2 4.812 . 7.706 7.843 7.722 8.209 0.503 10 1 "[ . +]" 1
1788 1 55 ARG HD2 2 61 SER H 4.812 . 7.706 7.840 7.712 8.194 0.488 10 0 "[ . 1]" 1
1789 1 29 VAL QG 1 57 GLN HE21 4.889 . 7.877 5.663 5.406 5.868 . 0 0 "[ . 1]" 1
1790 2 29 VAL QG 2 57 GLN HE21 4.889 . 7.877 5.666 5.407 5.868 . 0 0 "[ . 1]" 1
1791 1 38 LEU MD1 1 56 LEU H 4.785 . 7.647 6.765 6.598 6.915 . 0 0 "[ . 1]" 1
1792 2 38 LEU MD1 2 56 LEU H 4.785 . 7.647 6.765 6.603 6.914 . 0 0 "[ . 1]" 1
1793 1 53 MET H 2 29 VAL QG 4.947 . 8.006 5.448 5.383 5.519 . 0 0 "[ . 1]" 1
1794 1 29 VAL QG 2 53 MET H 4.947 . 8.006 5.450 5.372 5.521 . 0 0 "[ . 1]" 1
1795 1 29 VAL QG 1 33 ASP H 4.551 . 7.139 5.655 5.570 5.746 . 0 0 "[ . 1]" 1
1796 2 29 VAL QG 2 33 ASP H 4.551 . 7.139 5.656 5.568 5.753 . 0 0 "[ . 1]" 1
1797 1 55 ARG H 2 29 VAL QG 4.675 . 7.407 5.841 5.765 5.926 . 0 0 "[ . 1]" 1
1798 1 29 VAL QG 2 55 ARG H 4.675 . 7.407 5.842 5.737 5.943 . 0 0 "[ . 1]" 1
1799 1 55 ARG H 1 57 GLN HE21 4.610 . 7.267 7.146 6.456 7.990 0.723 10 4 "[ *- . * +]" 1
1800 2 55 ARG H 2 57 GLN HE21 4.610 . 7.267 7.145 6.452 7.987 0.720 10 4 "[ *- . * +]" 1
1801 1 57 GLN QG 1 59 GLY H 4.811 . 7.704 5.754 5.288 5.852 . 0 0 "[ . 1]" 1
1802 2 57 GLN QG 2 59 GLY H 4.811 . 7.704 5.753 5.288 5.853 . 0 0 "[ . 1]" 1
1803 1 40 ASN H 1 41 ASN H 2.615 . 3.470 2.590 2.543 2.632 . 0 0 "[ . 1]" 1
1804 2 40 ASN H 2 41 ASN H 2.615 . 3.470 2.590 2.537 2.639 . 0 0 "[ . 1]" 1
1805 1 33 ASP H 1 34 ILE H 2.601 . 3.447 2.562 2.527 2.596 . 0 0 "[ . 1]" 1
1806 2 33 ASP H 2 34 ILE H 2.601 . 3.447 2.562 2.522 2.603 . 0 0 "[ . 1]" 1
1807 1 46 GLN H 1 47 ALA H 2.601 . 3.447 2.490 2.442 2.554 . 0 0 "[ . 1]" 1
1808 2 46 GLN H 2 47 ALA H 2.601 . 3.447 2.490 2.456 2.560 . 0 0 "[ . 1]" 1
1809 1 53 MET H 1 54 GLU H 2.826 . 3.825 2.574 2.511 2.637 . 0 0 "[ . 1]" 1
1810 2 53 MET H 2 54 GLU H 2.826 . 3.825 2.574 2.512 2.636 . 0 0 "[ . 1]" 1
1811 1 44 ASN H 1 44 ASN HD22 4.031 . 6.062 5.996 5.879 6.439 0.377 1 0 "[ . 1]" 1
1812 2 44 ASN H 2 44 ASN HD22 4.031 . 6.062 5.994 5.878 6.443 0.381 1 0 "[ . 1]" 1
1813 1 51 GLN H 1 51 GLN HB2 2.370 . 3.072 2.454 2.432 2.478 . 0 0 "[ . 1]" 1
1814 2 51 GLN H 2 51 GLN HB2 2.370 . 3.072 2.452 2.431 2.475 . 0 0 "[ . 1]" 1
1815 1 50 ARG HB2 1 51 GLN H 2.618 . 3.475 2.353 2.275 2.394 . 0 0 "[ . 1]" 1
1816 2 50 ARG HB2 2 51 GLN H 2.618 . 3.475 2.358 2.277 2.400 . 0 0 "[ . 1]" 1
1817 1 29 VAL H 1 29 VAL QG 2.523 . 3.319 2.533 2.483 2.593 . 0 0 "[ . 1]" 1
1818 2 29 VAL H 2 29 VAL QG 2.523 . 3.319 2.533 2.484 2.596 . 0 0 "[ . 1]" 1
1819 1 29 VAL QG 1 31 TRP HH2 2.851 . 3.867 2.958 2.868 3.081 . 0 0 "[ . 1]" 1
1820 2 29 VAL QG 2 31 TRP HH2 2.851 . 3.867 2.957 2.868 3.079 . 0 0 "[ . 1]" 1
1821 1 29 VAL QG 1 34 ILE HG12 2.839 . 3.846 3.664 3.606 3.746 . 0 0 "[ . 1]" 1
1822 1 37 LEU QD 2 29 VAL QG 2.839 . 3.846 3.663 3.602 3.758 . 0 0 "[ . 1]" 1
1823 1 29 VAL QG 1 34 ILE MG 2.591 . 3.430 2.733 2.629 2.800 . 0 0 "[ . 1]" 1
1824 1 38 LEU MD2 2 29 VAL QG 2.591 . 3.430 2.730 2.604 2.789 . 0 0 "[ . 1]" 1
1825 1 33 ASP H 1 53 MET ME 3.033 . 4.183 4.625 4.492 4.965 0.782 9 3 "[ - . +*]" 1
1826 2 33 ASP H 2 53 MET ME 3.033 . 4.183 4.625 4.492 4.958 0.775 9 3 "[ - . +*]" 1
1827 1 42 PHE QR 1 48 ALA MB 2.467 . 3.228 2.569 2.447 2.645 . 0 0 "[ . 1]" 1
1828 2 42 PHE QR 2 48 ALA MB 2.467 . 3.228 2.567 2.445 2.641 . 0 0 "[ . 1]" 1
1829 1 42 PHE H 1 48 ALA MB 3.236 . 4.545 4.442 4.360 4.505 . 0 0 "[ . 1]" 1
1830 1 27 LEU H 2 48 ALA MB 3.236 . 4.545 4.443 4.367 4.508 . 0 0 "[ . 1]" 1
1831 1 60 TRP H 1 63 ALA MB 2.917 . 3.981 4.039 3.992 4.097 0.116 3 0 "[ . 1]" 1
1832 1 57 GLN H 2 63 ALA MB 2.917 . 3.981 4.038 3.991 4.106 0.125 3 0 "[ . 1]" 1
1833 1 60 TRP HE3 1 63 ALA MB 2.926 . 3.996 4.009 3.942 4.086 0.090 2 0 "[ . 1]" 1
1834 1 61 SER H 2 63 ALA MB 2.926 . 3.996 4.008 3.941 4.089 0.093 2 0 "[ . 1]" 1
1835 1 62 LEU H 1 62 LEU MD1 2.298 . 2.958 3.014 2.913 3.093 0.135 4 0 "[ . 1]" 1
1836 1 63 ALA H 2 62 LEU MD1 2.298 . 2.958 3.014 2.925 3.079 0.121 4 0 "[ . 1]" 1
1837 1 38 LEU MD1 1 41 ASN H 3.039 . 4.193 3.896 3.833 3.981 . 0 0 "[ . 1]" 1
1838 2 38 LEU MD1 2 41 ASN H 3.039 . 4.193 3.896 3.830 3.978 . 0 0 "[ . 1]" 1
1839 1 25 GLN QE 1 27 LEU QD 3.013 . 4.148 2.967 2.587 3.415 . 0 0 "[ . 1]" 1
1840 1 48 ALA H 2 27 LEU QD 3.013 . 4.148 2.967 2.579 3.416 . 0 0 "[ . 1]" 1
1841 1 27 LEU QD 2 42 PHE QE 2.417 . 3.147 2.779 2.549 3.086 . 0 0 "[ . 1]" 1
1842 1 42 PHE QE 2 27 LEU QD 2.417 . 3.147 2.780 2.577 3.085 . 0 0 "[ . 1]" 1
1843 1 42 PHE QE 1 52 VAL MG1 2.209 . 2.819 2.094 2.014 2.258 . 0 0 "[ . 1]" 1
1844 2 42 PHE QE 2 52 VAL MG1 2.209 . 2.819 2.094 2.017 2.255 . 0 0 "[ . 1]" 1
1845 1 42 PHE QR 1 52 VAL MG2 2.470 . 3.233 2.364 2.232 2.518 . 0 0 "[ . 1]" 1
1846 2 42 PHE QR 2 52 VAL MG2 2.470 . 3.233 2.364 2.230 2.521 . 0 0 "[ . 1]" 1
1847 1 38 LEU H 1 52 VAL MG2 3.207 . 4.493 4.044 3.978 4.095 . 0 0 "[ . 1]" 1
1848 2 38 LEU H 2 52 VAL MG2 3.207 . 4.493 4.043 3.977 4.094 . 0 0 "[ . 1]" 1
1849 1 43 GLU H 1 49 VAL MG2 3.222 . 4.520 4.291 4.234 4.360 . 0 0 "[ . 1]" 1
1850 2 43 GLU H 2 49 VAL MG2 3.222 . 4.520 4.290 4.234 4.359 . 0 0 "[ . 1]" 1
1851 1 37 LEU QD 2 33 ASP H 2.858 . 3.879 3.734 3.678 3.775 . 0 0 "[ . 1]" 1
1852 1 33 ASP H 2 37 LEU QD 2.858 . 3.879 3.735 3.674 3.776 . 0 0 "[ . 1]" 1
1853 1 27 LEU QD 2 42 PHE HZ 2.759 . 3.710 2.634 2.528 2.771 . 0 0 "[ . 1]" 1
1854 1 42 PHE HZ 2 27 LEU QD 2.759 . 3.710 2.632 2.532 2.781 . 0 0 "[ . 1]" 1
1855 1 56 LEU MD2 1 57 GLN H 3.000 . 4.125 3.657 3.613 3.696 . 0 0 "[ . 1]" 1
1856 1 57 GLN H 2 56 LEU MD2 3.000 . 4.125 3.658 3.605 3.689 . 0 0 "[ . 1]" 1
1857 1 56 LEU MD2 2 31 TRP HH2 2.487 . 3.260 2.157 2.065 2.278 . 0 0 "[ . 1]" 1
1858 1 31 TRP HH2 2 56 LEU MD2 2.487 . 3.260 2.158 2.064 2.284 . 0 0 "[ . 1]" 1
1859 1 31 TRP HZ3 1 56 LEU MD1 2.272 . 2.917 2.938 2.769 3.224 0.307 7 0 "[ . 1]" 1
1860 1 31 TRP HH2 2 56 LEU MD1 2.272 . 2.917 2.939 2.774 3.222 0.305 7 0 "[ . 1]" 1
1861 1 31 TRP HE3 1 56 LEU MD2 3.084 . 4.273 4.468 4.366 4.664 0.391 10 0 "[ . 1]" 1
1862 1 31 TRP HE3 2 56 LEU MD2 3.084 . 4.273 4.467 4.353 4.656 0.383 10 0 "[ . 1]" 1
1863 1 29 VAL QG 1 60 TRP HE3 2.501 . 3.283 2.777 2.731 2.857 . 0 0 "[ . 1]" 1
1864 2 29 VAL QG 2 60 TRP HE3 2.501 . 3.283 2.778 2.734 2.857 . 0 0 "[ . 1]" 1
1865 1 29 VAL QG 2 42 PHE QE 2.963 . 4.060 3.555 3.474 3.658 . 0 0 "[ . 1]" 1
1866 1 42 PHE QE 2 29 VAL QG 2.963 . 4.060 3.552 3.486 3.645 . 0 0 "[ . 1]" 1
1867 1 33 ASP H 1 34 ILE MG 3.199 . 4.478 4.549 4.474 4.607 0.129 1 0 "[ . 1]" 1
1868 2 33 ASP H 2 34 ILE MG 3.199 . 4.478 4.549 4.473 4.608 0.130 1 0 "[ . 1]" 1
1869 1 31 TRP HH2 1 34 ILE MD 3.013 . 4.148 3.357 3.197 3.498 . 0 0 "[ . 1]" 1
1870 2 31 TRP HH2 2 34 ILE MD 3.013 . 4.148 3.356 3.197 3.499 . 0 0 "[ . 1]" 1
1871 1 30 PRO HB2 1 34 ILE MD 3.000 . 4.125 4.166 4.119 4.213 0.088 10 0 "[ . 1]" 1
1872 1 56 LEU HG 2 34 ILE MD 3.000 . 4.125 4.167 4.122 4.221 0.096 10 0 "[ . 1]" 1
1873 1 30 PRO HD3 1 34 ILE MD 2.516 . 3.308 3.573 3.559 3.601 0.293 7 0 "[ . 1]" 1
1874 2 30 PRO HD3 2 34 ILE MD 2.516 . 3.308 3.572 3.558 3.601 0.293 7 0 "[ . 1]" 1
1875 1 29 VAL QG 1 34 ILE MG 2.755 . 3.704 3.440 3.361 3.508 . 0 0 "[ . 1]" 1
1876 1 29 VAL QG 2 34 ILE MG 2.755 . 3.704 3.441 3.368 3.513 . 0 0 "[ . 1]" 1
1877 1 34 ILE HG13 1 34 ILE MG 2.301 . 2.963 3.102 3.072 3.136 0.173 9 0 "[ . 1]" 1
1878 1 34 ILE HG13 2 34 ILE MG 2.301 . 2.963 3.102 3.069 3.137 0.174 9 0 "[ . 1]" 1
1879 1 37 LEU HG 1 38 LEU MD1 2.292 . 2.949 3.009 2.897 3.087 0.138 4 0 "[ . 1]" 1
1880 1 30 PRO HG2 2 38 LEU MD1 2.292 . 2.949 3.010 2.899 3.077 0.128 3 0 "[ . 1]" 1
1881 1 37 LEU QD 1 41 ASN QB 2.527 . 3.325 2.768 2.701 2.828 . 0 0 "[ . 1]" 1
1882 1 30 PRO HB2 2 37 LEU QD 2.527 . 3.325 2.770 2.698 2.823 . 0 0 "[ . 1]" 1
1883 1 37 LEU HA 1 37 LEU QD 2.892 . 3.938 2.157 2.135 2.168 . 0 0 "[ . 1]" 1
1884 1 31 TRP HA 2 37 LEU QD 2.892 . 3.938 2.156 2.131 2.168 . 0 0 "[ . 1]" 1
1885 1 37 LEU HG 1 41 ASN QB 2.691 . 3.596 3.181 3.141 3.236 . 0 0 "[ . 1]" 1
1886 1 30 PRO HB2 2 37 LEU HG 2.691 . 3.596 3.182 3.145 3.244 . 0 0 "[ . 1]" 1
1887 1 39 LYS QG 1 43 GLU HA 2.751 . 3.697 2.527 2.405 2.591 . 0 0 "[ . 1]" 1
1888 2 39 LYS QG 2 43 GLU HA 2.751 . 3.697 2.527 2.403 2.589 . 0 0 "[ . 1]" 1
1889 1 36 ALA HA 1 39 LYS HD3 2.682 . 3.581 3.473 3.305 3.704 0.123 1 0 "[ . 1]" 1
1890 2 36 ALA HA 2 39 LYS HD3 2.682 . 3.581 3.474 3.309 3.703 0.122 1 0 "[ . 1]" 1
1891 1 55 ARG HA 1 58 LYS HD3 2.642 . 3.515 3.673 3.389 4.046 0.531 9 2 "[ -. +1]" 1
1892 2 55 ARG HA 2 58 LYS HD3 2.642 . 3.515 3.672 3.391 4.044 0.529 9 2 "[ -. +1]" 1
1893 1 52 VAL HA 1 55 ARG HB3 2.381 . 3.090 2.327 2.279 2.401 . 0 0 "[ . 1]" 1
1894 2 52 VAL HA 2 55 ARG HB3 2.381 . 3.090 2.327 2.280 2.403 . 0 0 "[ . 1]" 1
1895 1 35 GLU HA 1 35 GLU HB3 2.694 . 3.601 2.411 2.295 2.535 . 0 0 "[ . 1]" 1
1896 2 35 GLU HA 2 35 GLU HB3 2.694 . 3.601 2.412 2.298 2.534 . 0 0 "[ . 1]" 1
1897 1 35 GLU HB3 1 49 VAL MG1 2.846 . 3.858 3.538 3.457 3.636 . 0 0 "[ . 1]" 1
1898 2 35 GLU HB3 2 49 VAL MG1 2.846 . 3.858 3.538 3.457 3.635 . 0 0 "[ . 1]" 1
1899 1 35 GLU HB2 1 49 VAL MG1 2.982 . 4.093 3.468 3.330 3.535 . 0 0 "[ . 1]" 1
1900 2 35 GLU HB2 2 49 VAL MG1 2.982 . 4.093 3.468 3.328 3.535 . 0 0 "[ . 1]" 1
1901 1 25 GLN HB3 1 26 GLU H 2.343 . 3.029 2.758 2.265 3.504 0.475 6 0 "[ . 1]" 1
1902 2 25 GLN HB3 2 26 GLU H 2.343 . 3.029 2.760 2.266 3.503 0.474 6 0 "[ . 1]" 1
1903 1 25 GLN HB2 1 25 GLN QE 2.466 . 3.226 2.353 2.298 2.528 . 0 0 "[ . 1]" 1
1904 2 25 GLN HB2 2 25 GLN QE 2.466 . 3.226 2.354 2.300 2.534 . 0 0 "[ . 1]" 1
1905 1 42 PHE QE 1 52 VAL HB 3.103 . 4.306 3.655 3.573 3.754 . 0 0 "[ . 1]" 1
1906 2 42 PHE QE 2 52 VAL HB 3.103 . 4.306 3.655 3.573 3.753 . 0 0 "[ . 1]" 1
1907 1 33 ASP H 1 34 ILE HB 3.243 . 4.558 4.282 4.215 4.331 . 0 0 "[ . 1]" 1
1908 2 33 ASP H 2 34 ILE HB 3.243 . 4.558 4.283 4.213 4.333 . 0 0 "[ . 1]" 1
1909 1 38 LEU H 1 41 ASN QB 3.441 . 4.921 3.930 3.884 4.017 . 0 0 "[ . 1]" 1
1910 2 38 LEU H 2 41 ASN QB 3.441 . 4.921 3.932 3.889 4.017 . 0 0 "[ . 1]" 1
1911 1 37 LEU QD 1 41 ASN QB 2.991 . 4.109 3.104 3.066 3.155 . 0 0 "[ . 1]" 1
1912 2 37 LEU QD 2 41 ASN QB 2.991 . 4.109 3.104 3.067 3.162 . 0 0 "[ . 1]" 1
1913 1 37 LEU HG 1 41 ASN QB 2.988 . 4.104 3.141 3.101 3.173 . 0 0 "[ . 1]" 1
1914 1 30 PRO HG2 2 41 ASN QB 2.988 . 4.104 3.142 3.106 3.183 . 0 0 "[ . 1]" 1
1915 1 56 LEU HB3 2 60 TRP HE3 3.465 . 4.966 4.268 4.195 4.392 . 0 0 "[ . 1]" 1
1916 1 60 TRP HE3 2 56 LEU HB3 3.465 . 4.966 4.270 4.182 4.392 . 0 0 "[ . 1]" 1
1917 1 62 LEU H 1 62 LEU HB2 2.477 . 3.244 2.311 2.298 2.326 . 0 0 "[ . 1]" 1
1918 2 62 LEU H 2 62 LEU HB2 2.477 . 3.244 2.312 2.298 2.327 . 0 0 "[ . 1]" 1
1919 1 62 LEU H 1 62 LEU HB3 2.561 . 3.381 3.298 3.285 3.312 . 0 0 "[ . 1]" 1
1920 2 62 LEU H 2 62 LEU HB3 2.561 . 3.381 3.299 3.286 3.313 . 0 0 "[ . 1]" 1
1921 1 55 ARG HD3 2 60 TRP HE3 3.194 . 4.469 3.074 2.958 3.247 . 0 0 "[ . 1]" 1
1922 1 60 TRP HE3 2 55 ARG HD3 3.194 . 4.469 3.073 2.961 3.283 . 0 0 "[ . 1]" 1
1923 1 27 LEU HB2 2 42 PHE QE 3.339 . 4.733 4.411 4.120 4.636 . 0 0 "[ . 1]" 1
1924 1 42 PHE QE 2 27 LEU HB2 3.339 . 4.733 4.409 4.136 4.641 . 0 0 "[ . 1]" 1
1925 1 38 LEU H 1 38 LEU HB3 2.613 . 3.467 3.161 3.152 3.179 . 0 0 "[ . 1]" 1
1926 2 38 LEU H 2 38 LEU HB3 2.613 . 3.467 3.160 3.148 3.176 . 0 0 "[ . 1]" 1
1927 1 38 LEU HB2 1 42 PHE QR 2.979 . 4.088 4.203 4.170 4.226 0.138 7 0 "[ . 1]" 1
1928 2 38 LEU HB2 2 42 PHE QR 2.979 . 4.088 4.202 4.170 4.224 0.136 7 0 "[ . 1]" 1
1929 1 59 GLY HA3 1 62 LEU HB2 2.875 . 3.908 2.873 2.842 2.893 . 0 0 "[ . 1]" 1
1930 1 59 GLY HA3 2 62 LEU HB2 2.875 . 3.908 2.872 2.844 2.892 . 0 0 "[ . 1]" 1
1931 1 38 LEU H 1 40 ASN QB 3.215 . 4.507 4.021 3.942 4.208 . 0 0 "[ . 1]" 1
1932 2 38 LEU H 2 40 ASN QB 3.215 . 4.507 4.022 3.943 4.207 . 0 0 "[ . 1]" 1
1933 1 44 ASN HB2 1 44 ASN HD22 2.541 . 3.348 3.475 3.177 3.612 0.264 7 0 "[ . 1]" 1
1934 2 44 ASN HB2 2 44 ASN HD22 2.541 . 3.348 3.476 3.178 3.610 0.262 7 0 "[ . 1]" 1
1935 1 44 ASN HB3 1 44 ASN HD22 2.380 . 3.088 2.544 2.383 3.333 0.245 7 0 "[ . 1]" 1
1936 2 44 ASN HB3 2 44 ASN HD22 2.380 . 3.088 2.544 2.382 3.330 0.242 7 0 "[ . 1]" 1
1937 1 59 GLY HA3 1 62 LEU H 2.945 . 4.029 3.444 3.421 3.511 . 0 0 "[ . 1]" 1
1938 1 62 LEU H 2 59 GLY HA3 2.945 . 4.029 3.446 3.404 3.520 . 0 0 "[ . 1]" 1
1939 1 59 GLY HA2 1 62 LEU H 2.750 . 3.695 2.918 2.883 2.957 . 0 0 "[ . 1]" 1
1940 1 63 ALA H 2 59 GLY HA2 2.750 . 3.695 2.918 2.879 2.963 . 0 0 "[ . 1]" 1
1941 1 27 LEU HA 2 42 PHE QE 3.187 . 4.456 3.204 2.913 3.559 . 0 0 "[ . 1]" 1
1942 1 42 PHE QE 2 27 LEU HA 3.187 . 4.456 3.201 2.940 3.571 . 0 0 "[ . 1]" 1
1943 1 46 GLN HA 1 48 ALA H 2.580 . 3.412 2.861 2.805 2.908 . 0 0 "[ . 1]" 1
1944 2 46 GLN HA 2 48 ALA H 2.580 . 3.412 2.862 2.802 2.905 . 0 0 "[ . 1]" 1
1945 1 37 LEU HA 1 38 LEU H 2.718 . 3.641 3.354 3.344 3.372 . 0 0 "[ . 1]" 1
1946 2 37 LEU HA 2 38 LEU H 2.718 . 3.641 3.355 3.344 3.373 . 0 0 "[ . 1]" 1
1947 1 38 LEU H 1 38 LEU HA 2.425 . 3.160 2.718 2.714 2.720 . 0 0 "[ . 1]" 1
1948 2 38 LEU H 2 38 LEU HA 2.425 . 3.160 2.718 2.714 2.720 . 0 0 "[ . 1]" 1
1949 1 32 ASP HA 1 33 ASP H 2.625 . 3.486 3.372 3.345 3.401 . 0 0 "[ . 1]" 1
1950 2 32 ASP HA 2 33 ASP H 2.625 . 3.486 3.372 3.343 3.400 . 0 0 "[ . 1]" 1
1951 1 32 ASP HA 1 33 ASP H 2.238 . 2.864 2.608 2.598 2.625 . 0 0 "[ . 1]" 1
1952 2 32 ASP HA 2 33 ASP H 2.238 . 2.864 2.607 2.598 2.626 . 0 0 "[ . 1]" 1
1953 1 62 LEU H 1 62 LEU HA 2.285 . 2.938 2.767 2.762 2.770 . 0 0 "[ . 1]" 1
1954 2 62 LEU H 2 62 LEU HA 2.285 . 2.938 2.767 2.762 2.772 . 0 0 "[ . 1]" 1
1955 1 59 GLY HA3 1 61 SER H 3.400 . 4.845 4.122 4.095 4.144 . 0 0 "[ . 1]" 1
1956 1 60 TRP HE3 2 59 GLY HA3 3.400 . 4.845 4.122 4.093 4.142 . 0 0 "[ . 1]" 1
1957 1 51 GLN HA 1 55 ARG H 3.052 . 4.217 3.783 3.534 4.139 . 0 0 "[ . 1]" 1
1958 1 25 GLN QE 2 51 GLN HA 3.052 . 4.217 3.785 3.512 4.127 . 0 0 "[ . 1]" 1
1959 1 29 VAL HA 2 42 PHE QE 2.927 . 3.998 3.562 3.383 3.686 . 0 0 "[ . 1]" 1
1960 1 42 PHE QE 2 29 VAL HA 2.927 . 3.998 3.558 3.382 3.678 . 0 0 "[ . 1]" 1
1961 1 57 GLN HA 1 60 TRP HD1 3.188 . 4.458 4.000 3.935 4.187 . 0 0 "[ . 1]" 1
1962 2 57 GLN HA 2 60 TRP HD1 3.188 . 4.458 4.000 3.935 4.189 . 0 0 "[ . 1]" 1
1963 1 57 GLN H 1 57 GLN HA 2.425 . 3.160 2.714 2.701 2.722 . 0 0 "[ . 1]" 1
1964 2 57 GLN H 2 57 GLN HA 2.425 . 3.160 2.714 2.702 2.722 . 0 0 "[ . 1]" 1
1965 1 55 ARG HA 1 59 GLY H 2.928 . 4.000 3.136 3.107 3.164 . 0 0 "[ . 1]" 1
1966 2 55 ARG HA 2 59 GLY H 2.928 . 4.000 3.136 3.104 3.164 . 0 0 "[ . 1]" 1
1967 1 59 GLY H 1 60 TRP HA 3.241 . 4.554 4.435 4.397 4.472 . 0 0 "[ . 1]" 1
1968 1 59 GLY H 2 60 TRP HA 3.241 . 4.554 4.433 4.395 4.474 . 0 0 "[ . 1]" 1
1969 1 60 TRP HA 1 62 LEU H 2.634 . 3.501 3.321 3.268 3.364 . 0 0 "[ . 1]" 1
1970 2 60 TRP HA 2 62 LEU H 2.634 . 3.501 3.320 3.266 3.367 . 0 0 "[ . 1]" 1
1971 1 60 TRP HA 1 60 TRP HE3 2.156 . 2.737 2.766 2.658 2.840 0.103 9 0 "[ . 1]" 1
1972 2 60 TRP HA 2 60 TRP HE3 2.156 . 2.737 2.765 2.656 2.839 0.102 9 0 "[ . 1]" 1
1973 1 31 TRP HH2 1 60 TRP HA 3.058 . 4.227 4.465 4.364 4.585 0.358 10 0 "[ . 1]" 1
1974 2 31 TRP HH2 2 60 TRP HA 3.058 . 4.227 4.464 4.367 4.585 0.358 10 0 "[ . 1]" 1
1975 1 33 ASP H 1 34 ILE HA 3.218 . 4.513 4.012 3.975 4.038 . 0 0 "[ . 1]" 1
1976 2 33 ASP H 2 34 ILE HA 3.218 . 4.513 4.012 3.973 4.041 . 0 0 "[ . 1]" 1
1977 1 38 LEU H 1 49 VAL HA 3.422 . 4.885 4.970 4.857 5.044 0.159 8 0 "[ . 1]" 1
1978 2 38 LEU H 2 49 VAL HA 3.422 . 4.885 4.967 4.853 5.042 0.157 8 0 "[ . 1]" 1
1979 1 42 PHE QR 1 52 VAL HA 3.445 . 4.929 5.080 5.027 5.148 0.219 7 0 "[ . 1]" 1
1980 2 42 PHE QR 2 52 VAL HA 3.445 . 4.929 5.080 5.027 5.146 0.217 7 0 "[ . 1]" 1
1981 1 28 THR HB 2 42 PHE QE 3.399 . 4.843 3.636 3.265 3.814 . 0 0 "[ . 1]" 1
1982 1 42 PHE QE 2 28 THR HB 3.399 . 4.843 3.632 3.293 3.793 . 0 0 "[ . 1]" 1
1983 1 35 GLU HA 1 38 LEU H 2.766 . 3.722 3.279 3.223 3.409 . 0 0 "[ . 1]" 1
1984 2 35 GLU HA 2 38 LEU H 2.766 . 3.722 3.279 3.225 3.408 . 0 0 "[ . 1]" 1
1985 1 37 LEU H 1 39 LYS HA 3.244 . 4.559 4.816 4.768 4.871 0.312 7 0 "[ . 1]" 1
1986 2 37 LEU H 2 39 LYS HA 3.244 . 4.559 4.815 4.769 4.872 0.313 7 0 "[ . 1]" 1
1987 1 39 LYS HA 1 41 ASN H 3.084 . 4.273 3.365 3.289 3.451 . 0 0 "[ . 1]" 1
1988 2 39 LYS HA 2 41 ASN H 3.084 . 4.273 3.366 3.290 3.456 . 0 0 "[ . 1]" 1
1989 1 50 ARG QD 1 50 ARG QG 1.930 . 2.396 2.018 1.988 2.087 . 0 0 "[ . 1]" 1
1990 2 50 ARG QD 2 50 ARG QG 1.930 . 2.396 2.018 1.987 2.088 . 0 0 "[ . 1]" 1
1991 1 56 LEU HB2 1 56 LEU MD2 2.467 . 3.228 3.062 3.038 3.094 . 0 0 "[ . 1]" 1
1992 1 56 LEU MD2 2 56 LEU HB2 2.467 . 3.228 3.062 3.039 3.094 . 0 0 "[ . 1]" 1
1993 1 59 GLY HA3 1 62 LEU HB2 2.953 . 4.043 3.610 3.483 3.706 . 0 0 "[ . 1]" 1
1994 1 62 LEU HB2 2 59 GLY HA3 2.953 . 4.043 3.611 3.473 3.711 . 0 0 "[ . 1]" 1
1995 1 59 GLY HA2 1 62 LEU HB2 2.733 . 3.667 2.341 2.250 2.407 . 0 0 "[ . 1]" 1
1996 1 62 LEU HB2 2 59 GLY HA2 2.733 . 3.667 2.340 2.247 2.415 . 0 0 "[ . 1]" 1
1997 1 58 LYS QG 1 59 GLY HA2 2.928 . 4.000 3.327 3.250 3.419 . 0 0 "[ . 1]" 1
1998 2 58 LYS QG 2 59 GLY HA2 2.928 . 4.000 3.326 3.251 3.416 . 0 0 "[ . 1]" 1
1999 1 63 ALA HA 2 55 ARG QG 2.811 . 3.798 3.453 3.224 3.644 . 0 0 "[ . 1]" 1
2000 1 55 ARG QG 2 63 ALA HA 2.811 . 3.798 3.450 3.222 3.620 . 0 0 "[ . 1]" 1
2001 1 42 PHE HA 1 48 ALA MB 2.825 . 3.822 3.900 3.861 3.921 0.099 2 0 "[ . 1]" 1
2002 2 42 PHE HA 2 48 ALA MB 2.825 . 3.822 3.900 3.861 3.922 0.100 1 0 "[ . 1]" 1
2003 1 38 LEU HA 1 49 VAL QG 2.796 . 3.774 3.504 3.475 3.533 . 0 0 "[ . 1]" 1
2004 2 38 LEU HA 2 49 VAL QG 2.796 . 3.774 3.504 3.475 3.534 . 0 0 "[ . 1]" 1
2005 1 32 ASP HA 1 34 ILE MG 2.928 . 4.000 3.608 3.534 3.692 . 0 0 "[ . 1]" 1
2006 1 37 LEU QD 2 33 ASP HA 2.928 . 4.000 3.608 3.538 3.696 . 0 0 "[ . 1]" 1
2007 1 62 LEU HA 1 63 ALA MB 2.879 . 3.915 3.847 3.329 4.821 0.906 6 2 "[ .+ -1]" 1
2008 2 62 LEU HA 2 63 ALA MB 2.879 . 3.915 3.848 3.330 4.817 0.902 6 2 "[ .+ -1]" 1
2009 1 32 ASP HA 1 32 ASP HB2 2.179 . 2.772 2.480 2.301 2.695 . 0 0 "[ . 1]" 1
2010 2 32 ASP HA 2 32 ASP HB2 2.179 . 2.772 2.480 2.300 2.695 . 0 0 "[ . 1]" 1
2011 1 55 ARG HA 2 63 ALA MB 2.504 . 3.288 2.346 2.310 2.375 . 0 0 "[ . 1]" 1
2012 1 63 ALA MB 2 55 ARG HA 2.504 . 3.288 2.347 2.315 2.384 . 0 0 "[ . 1]" 1
2013 1 50 ARG HA 1 54 GLU QG 2.554 . 3.370 2.330 2.306 2.359 . 0 0 "[ . 1]" 1
2014 2 50 ARG HA 2 54 GLU QG 2.554 . 3.370 2.329 2.305 2.358 . 0 0 "[ . 1]" 1
2015 1 49 VAL HB 1 50 ARG HA 2.205 . 2.813 2.946 2.939 2.950 0.137 1 0 "[ . 1]" 1
2016 2 49 VAL HB 2 50 ARG HA 2.205 . 2.813 2.946 2.939 2.951 0.138 1 0 "[ . 1]" 1
2017 1 50 ARG HA 1 50 ARG QG 2.468 . 3.229 2.438 2.341 2.501 . 0 0 "[ . 1]" 1
2018 2 50 ARG HA 2 50 ARG QG 2.468 . 3.229 2.438 2.339 2.499 . 0 0 "[ . 1]" 1
2019 1 46 GLN HA 1 46 GLN HB3 2.013 . 2.519 2.283 2.265 2.323 . 0 0 "[ . 1]" 1
2020 2 46 GLN HA 2 46 GLN HB3 2.013 . 2.519 2.283 2.264 2.323 . 0 0 "[ . 1]" 1
2021 1 51 GLN HA 1 51 GLN HB3 2.053 . 2.580 2.357 2.300 2.393 . 0 0 "[ . 1]" 1
2022 2 51 GLN HA 2 51 GLN HB3 2.053 . 2.580 2.357 2.299 2.395 . 0 0 "[ . 1]" 1
2023 1 60 TRP HA 2 55 ARG HD3 2.617 . 3.473 2.659 2.564 3.098 . 0 0 "[ . 1]" 1
2024 1 55 ARG HD3 2 60 TRP HA 2.617 . 3.473 2.657 2.563 3.092 . 0 0 "[ . 1]" 1
2025 1 35 GLU HA 1 35 GLU HB3 2.217 . 2.831 2.732 2.610 2.946 0.115 9 0 "[ . 1]" 1
2026 2 35 GLU HA 2 35 GLU HB3 2.217 . 2.831 2.732 2.612 2.945 0.114 9 0 "[ . 1]" 1
2027 1 34 ILE MG 1 35 GLU HA 2.408 . 3.133 2.995 2.876 3.071 . 0 0 "[ . 1]" 1
2028 2 34 ILE MG 2 35 GLU HA 2.408 . 3.133 2.995 2.877 3.071 . 0 0 "[ . 1]" 1
2029 1 30 PRO HG2 1 34 ILE HA 2.623 . 3.483 3.304 3.265 3.352 . 0 0 "[ . 1]" 1
2030 2 30 PRO HG2 2 34 ILE HA 2.623 . 3.483 3.302 3.263 3.351 . 0 0 "[ . 1]" 1
2031 1 34 ILE HA 1 34 ILE MG 2.103 . 2.656 2.457 2.415 2.501 . 0 0 "[ . 1]" 1
2032 2 34 ILE HA 2 34 ILE MG 2.103 . 2.656 2.457 2.415 2.500 . 0 0 "[ . 1]" 1
2033 1 34 ILE HA 1 34 ILE HG12 2.149 . 2.726 2.190 2.145 2.241 . 0 0 "[ . 1]" 1
2034 1 37 LEU QD 2 34 ILE HA 2.149 . 2.726 2.190 2.143 2.240 . 0 0 "[ . 1]" 1
2035 1 38 LEU HB3 1 49 VAL HA 2.361 . 3.058 2.505 2.447 2.536 . 0 0 "[ . 1]" 1
2036 2 38 LEU HB3 2 49 VAL HA 2.361 . 3.058 2.505 2.449 2.533 . 0 0 "[ . 1]" 1
2037 1 38 LEU HB2 1 49 VAL HA 2.612 . 3.465 3.404 3.352 3.511 0.046 7 0 "[ . 1]" 1
2038 2 38 LEU HB2 2 49 VAL HA 2.612 . 3.465 3.404 3.349 3.508 0.043 7 0 "[ . 1]" 1
2039 1 49 VAL HA 1 49 VAL MG1 1.987 . 2.481 1.961 1.914 2.021 . 0 0 "[ . 1]" 1
2040 2 49 VAL HA 2 49 VAL MG1 1.987 . 2.481 1.961 1.914 2.022 . 0 0 "[ . 1]" 1
2041 1 37 LEU HB2 1 40 ASN QB 3.413 . 4.666 4.231 4.071 4.531 . 0 0 "[ . 1]" 1
2042 2 37 LEU HB2 2 40 ASN QB 3.413 . 4.666 4.230 4.076 4.530 . 0 0 "[ . 1]" 1
2043 1 42 PHE HB3 1 48 ALA MB 2.575 . 3.404 2.356 2.305 2.377 . 0 0 "[ . 1]" 1
2044 2 42 PHE HB3 2 48 ALA MB 2.575 . 3.404 2.356 2.306 2.378 . 0 0 "[ . 1]" 1
2045 1 37 LEU HB3 1 37 LEU QD 2.421 . 3.154 2.135 2.122 2.146 . 0 0 "[ . 1]" 1
2046 2 37 LEU HB3 2 37 LEU QD 2.421 . 3.154 2.135 2.123 2.147 . 0 0 "[ . 1]" 1
2047 1 38 LEU HB3 1 49 VAL MG1 2.634 . 3.502 2.155 2.111 2.256 . 0 0 "[ . 1]" 1
2048 2 38 LEU HB3 2 49 VAL MG1 2.634 . 3.502 2.155 2.111 2.257 . 0 0 "[ . 1]" 1
2049 1 55 ARG HA 1 58 LYS HB3 2.560 . 3.379 2.472 2.398 2.575 . 0 0 "[ . 1]" 1
2050 2 55 ARG HA 2 58 LYS HB3 2.560 . 3.379 2.472 2.399 2.576 . 0 0 "[ . 1]" 1
2051 1 34 ILE HG13 1 34 ILE MG 2.390 . 3.104 3.102 3.070 3.136 0.032 9 0 "[ . 1]" 1
2052 1 34 ILE MG 2 34 ILE HG13 2.390 . 3.104 3.102 3.070 3.137 0.033 9 0 "[ . 1]" 1
2053 1 58 LYS QG 1 62 LEU MD1 2.041 . 2.561 1.958 1.915 1.995 . 0 0 "[ . 1]" 1
2054 1 62 LEU HB3 2 62 LEU MD1 2.041 . 2.561 1.958 1.914 1.997 . 0 0 "[ . 1]" 1
2055 1 62 LEU HB2 1 62 LEU MD1 1.848 . 2.275 2.195 2.133 2.233 . 0 0 "[ . 1]" 1
2056 1 62 LEU HB2 2 62 LEU MD1 1.848 . 2.275 2.195 2.133 2.232 . 0 0 "[ . 1]" 1
2057 1 39 LYS HD3 1 49 VAL MG1 2.425 . 3.160 2.877 2.686 3.089 . 0 0 "[ . 1]" 1
2058 2 39 LYS HD3 2 49 VAL MG1 2.425 . 3.160 2.877 2.687 3.091 . 0 0 "[ . 1]" 1
2059 1 52 VAL HA 1 56 LEU MD1 3.082 . 4.270 4.237 4.170 4.319 0.049 7 0 "[ . 1]" 1
2060 1 60 TRP HB2 2 56 LEU MD1 3.082 . 4.270 4.238 4.160 4.317 0.047 7 0 "[ . 1]" 1
2061 1 46 GLN HA 1 49 VAL MG1 2.639 . 3.510 3.263 3.220 3.340 . 0 0 "[ . 1]" 1
2062 2 46 GLN HA 2 49 VAL MG1 2.639 . 3.510 3.264 3.221 3.344 . 0 0 "[ . 1]" 1
2063 1 39 LYS HD3 1 39 LYS HE2 2.045 . 2.568 2.309 2.180 2.362 . 0 0 "[ . 1]" 1
2064 2 39 LYS HD3 2 39 LYS HE2 2.045 . 2.568 2.309 2.180 2.362 . 0 0 "[ . 1]" 1
2065 1 45 ASP H 1 46 GLN HG3 3.356 . 4.764 4.549 3.973 4.791 0.027 3 0 "[ . 1]" 1
2066 1 25 GLN QE 2 51 GLN HG3 3.356 . 4.764 4.550 3.947 4.788 0.024 3 0 "[ . 1]" 1
2067 1 62 LEU H 1 64 LYS QB 3.064 . 4.237 4.356 4.022 4.819 0.582 8 2 "[ - + 1]" 1
2068 2 62 LEU H 2 64 LYS QB 3.064 . 4.237 4.357 4.020 4.825 0.588 8 2 "[ - + 1]" 1
2069 1 60 TRP HB3 1 60 TRP HD1 2.550 . 3.363 2.341 2.312 2.363 . 0 0 "[ . 1]" 1
2070 2 60 TRP HB3 2 60 TRP HD1 2.550 . 3.363 2.340 2.314 2.365 . 0 0 "[ . 1]" 1
2071 1 60 TRP HB2 1 63 ALA MB 3.118 . 4.333 4.573 4.457 4.718 0.385 3 0 "[ . 1]" 1
2072 1 56 LEU MD1 2 60 TRP HB2 3.118 . 4.333 4.573 4.450 4.727 0.394 3 0 "[ . 1]" 1
2073 1 60 TRP HB3 2 55 ARG QG 3.784 . 5.574 3.918 3.840 4.044 . 0 0 "[ . 1]" 1
2074 1 55 ARG QG 2 60 TRP HB3 3.784 . 5.574 3.916 3.825 4.027 . 0 0 "[ . 1]" 1
2075 1 30 PRO HB2 1 34 ILE HG12 3.181 . 4.446 2.938 2.841 2.999 . 0 0 "[ . 1]" 1
2076 1 37 LEU QD 2 30 PRO HB2 3.181 . 4.446 2.937 2.828 2.998 . 0 0 "[ . 1]" 1
2077 1 34 ILE MD 1 56 LEU HG 3.782 . 5.570 4.596 4.378 4.720 . 0 0 "[ . 1]" 1
2078 1 34 ILE MD 2 56 LEU HG 3.782 . 5.570 4.595 4.376 4.713 . 0 0 "[ . 1]" 1
2079 1 30 PRO HB3 1 34 ILE MD 3.269 . 4.605 4.285 4.156 4.461 . 0 0 "[ . 1]" 1
2080 2 30 PRO HB3 2 34 ILE MD 3.269 . 4.605 4.284 4.150 4.464 . 0 0 "[ . 1]" 1
2081 1 29 VAL HA 1 30 PRO HB3 3.398 . 4.842 4.118 4.105 4.144 . 0 0 "[ . 1]" 1
2082 2 29 VAL HA 2 30 PRO HB3 3.398 . 4.842 4.117 4.104 4.145 . 0 0 "[ . 1]" 1
2083 1 30 PRO HB3 2 37 LEU QD 2.900 . 3.951 2.990 2.917 3.084 . 0 0 "[ . 1]" 1
2084 1 37 LEU QD 2 30 PRO HB3 2.900 . 3.951 2.989 2.899 3.089 . 0 0 "[ . 1]" 1
2085 1 39 LYS QG 1 45 ASP H 3.812 . 5.629 5.500 5.395 5.656 0.027 4 0 "[ . 1]" 1
2086 2 39 LYS QG 2 45 ASP H 3.812 . 5.629 5.499 5.396 5.656 0.027 4 0 "[ . 1]" 1
2087 1 58 LYS QG 1 62 LEU H 3.788 . 5.582 4.140 4.075 4.212 . 0 0 "[ . 1]" 1
2088 1 63 ALA H 2 58 LYS QG 3.788 . 5.582 4.141 4.076 4.210 . 0 0 "[ . 1]" 1
2089 1 58 LYS QG 1 62 LEU H 3.442 . 4.923 3.734 3.411 4.240 . 0 0 "[ . 1]" 1
2090 2 58 LYS QG 2 62 LEU H 3.442 . 4.923 3.734 3.411 4.243 . 0 0 "[ . 1]" 1
2091 1 56 LEU HG 2 60 TRP HE3 2.966 . 4.066 2.144 2.046 2.275 . 0 0 "[ . 1]" 1
2092 1 60 TRP HE3 2 56 LEU HG 2.966 . 4.066 2.146 2.031 2.272 . 0 0 "[ . 1]" 1
2093 1 31 TRP HH2 1 56 LEU HG 3.606 . 5.232 4.044 3.967 4.256 . 0 0 "[ . 1]" 1
2094 1 31 TRP HH2 2 56 LEU HG 3.606 . 5.232 4.046 3.964 4.254 . 0 0 "[ . 1]" 1
2095 1 43 GLU HB2 1 45 ASP H 3.275 . 4.616 4.725 4.612 4.862 0.246 4 0 "[ . 1]" 1
2096 2 43 GLU HB2 2 45 ASP H 3.275 . 4.616 4.724 4.610 4.866 0.250 4 0 "[ . 1]" 1
2097 1 38 LEU HG 1 42 PHE QR 3.650 . 5.315 3.727 3.680 3.766 . 0 0 "[ . 1]" 1
2098 2 38 LEU HG 2 42 PHE QR 3.650 . 5.315 3.727 3.681 3.770 . 0 0 "[ . 1]" 1
2099 1 27 LEU HG 1 28 THR H 3.021 . 4.162 4.151 4.123 4.193 0.031 9 0 "[ . 1]" 1
2100 2 27 LEU HG 2 28 THR H 3.021 . 4.162 4.151 4.124 4.196 0.034 9 0 "[ . 1]" 1
2101 1 27 LEU HG 1 60 TRP HZ2 2.780 . 3.746 3.907 3.832 4.008 0.262 7 0 "[ . 1]" 1
2102 2 27 LEU HG 2 60 TRP HZ2 2.780 . 3.746 3.907 3.832 4.009 0.263 7 0 "[ . 1]" 1
2103 1 27 LEU HG 2 51 GLN QE 3.477 . 4.988 4.494 4.329 4.661 . 0 0 "[ . 1]" 1
2104 1 51 GLN QE 2 27 LEU HG 3.477 . 4.988 4.488 4.349 4.679 . 0 0 "[ . 1]" 1
2105 1 38 LEU MD1 2 29 VAL H 3.593 . 5.206 4.924 4.864 4.993 . 0 0 "[ . 1]" 1
2106 1 29 VAL H 2 38 LEU MD1 3.593 . 5.206 4.927 4.852 5.002 . 0 0 "[ . 1]" 1
2107 1 28 THR MG 2 42 PHE QE 3.211 . 4.499 4.493 4.216 4.615 0.116 9 0 "[ . 1]" 1
2108 1 42 PHE QE 2 28 THR MG 3.211 . 4.499 4.489 4.238 4.609 0.110 6 0 "[ . 1]" 1
2109 1 38 LEU H 1 52 VAL MG1 3.685 . 5.383 5.224 5.168 5.298 . 0 0 "[ . 1]" 1
2110 2 38 LEU H 2 52 VAL MG1 3.685 . 5.383 5.224 5.167 5.299 . 0 0 "[ . 1]" 1
2111 1 33 ASP H 1 34 ILE MD 3.631 . 5.279 5.185 5.125 5.245 . 0 0 "[ . 1]" 1
2112 2 33 ASP H 2 34 ILE MD 3.631 . 5.279 5.185 5.132 5.244 . 0 0 "[ . 1]" 1
2113 1 34 ILE MD 1 37 LEU H 3.663 . 5.340 5.505 5.441 5.571 0.231 7 0 "[ . 1]" 1
2114 1 37 LEU H 2 34 ILE MD 3.663 . 5.340 5.504 5.429 5.572 0.232 7 0 "[ . 1]" 1
2115 1 34 ILE MD 1 38 LEU H 3.741 . 5.490 5.097 4.966 5.210 . 0 0 "[ . 1]" 1
2116 1 38 LEU H 2 34 ILE MD 3.741 . 5.490 5.096 4.950 5.205 . 0 0 "[ . 1]" 1
2117 1 43 GLU QG 1 45 ASP H 3.117 . 4.332 4.023 3.947 4.128 . 0 0 "[ . 1]" 1
2118 2 43 GLU QG 2 45 ASP H 3.117 . 4.332 4.023 3.953 4.127 . 0 0 "[ . 1]" 1
2119 1 56 LEU HB2 2 60 TRP HE3 3.295 . 4.652 3.930 3.828 4.082 . 0 0 "[ . 1]" 1
2120 1 60 TRP HE3 2 56 LEU HB2 3.295 . 4.652 3.933 3.813 4.084 . 0 0 "[ . 1]" 1
2121 1 29 VAL H 1 30 PRO HD2 3.563 . 5.150 4.385 4.367 4.397 . 0 0 "[ . 1]" 1
2122 2 29 VAL H 2 30 PRO HD2 3.563 . 5.150 4.386 4.369 4.398 . 0 0 "[ . 1]" 1
2123 1 30 PRO HD3 2 42 PHE QE 3.239 . 4.551 3.762 3.544 3.957 . 0 0 "[ . 1]" 1
2124 1 42 PHE QE 2 30 PRO HD3 3.239 . 4.551 3.760 3.537 3.973 . 0 0 "[ . 1]" 1
2125 1 30 PRO HD2 2 42 PHE QR 3.198 . 4.476 4.214 3.942 4.364 . 0 0 "[ . 1]" 1
2126 1 42 PHE QR 2 30 PRO HD2 3.198 . 4.476 4.213 3.940 4.371 . 0 0 "[ . 1]" 1
2127 1 63 ALA HA 1 64 LYS HA 3.067 . 4.243 3.996 3.904 4.185 . 0 0 "[ . 1]" 1
2128 1 59 GLY HA2 2 63 ALA HA 3.067 . 4.243 3.994 3.894 4.192 . 0 0 "[ . 1]" 1
2129 1 58 LYS QG 1 59 GLY HA3 3.155 . 4.399 4.240 4.161 4.368 . 0 0 "[ . 1]" 1
2130 1 62 LEU HB3 2 59 GLY HA3 3.155 . 4.399 4.239 4.166 4.368 . 0 0 "[ . 1]" 1
2131 1 47 ALA HA 1 48 ALA MB 3.055 . 4.221 4.441 4.312 4.483 0.262 9 0 "[ . 1]" 1
2132 2 47 ALA HA 2 48 ALA MB 3.055 . 4.221 4.441 4.309 4.481 0.260 9 0 "[ . 1]" 1
2133 1 36 ALA HA 1 49 VAL QG 3.375 . 4.799 4.514 4.373 4.680 . 0 0 "[ . 1]" 1
2134 2 36 ALA HA 2 49 VAL QG 3.375 . 4.799 4.515 4.374 4.680 . 0 0 "[ . 1]" 1
2135 1 60 TRP HA 1 62 LEU HB2 3.120 . 4.337 4.332 4.064 4.428 0.091 5 0 "[ . 1]" 1
2136 1 55 ARG QB 2 60 TRP HA 3.120 . 4.337 4.330 4.051 4.425 0.088 5 0 "[ . 1]" 1
2137 1 35 GLU HA 1 37 LEU HB2 3.155 . 4.399 3.897 3.284 4.289 . 0 0 "[ . 1]" 1
2138 2 35 GLU HA 2 37 LEU HB2 3.155 . 4.399 3.898 3.286 4.289 . 0 0 "[ . 1]" 1
2139 1 31 TRP HA 1 34 ILE HG12 3.143 . 4.378 4.477 4.381 4.548 0.170 5 0 "[ . 1]" 1
2140 1 37 LEU QD 2 31 TRP HA 3.143 . 4.378 4.477 4.388 4.544 0.166 5 0 "[ . 1]" 1
2141 1 46 GLN HA 1 49 VAL HA 3.166 . 4.419 4.328 4.294 4.378 . 0 0 "[ . 1]" 1
2142 2 46 GLN HA 2 49 VAL HA 3.166 . 4.419 4.328 4.294 4.376 . 0 0 "[ . 1]" 1
2143 1 49 VAL HA 1 50 ARG HG2 3.413 . 4.869 4.586 4.093 4.855 . 0 0 "[ . 1]" 1
2144 2 49 VAL HA 2 50 ARG HG2 3.413 . 4.869 4.586 4.093 4.857 . 0 0 "[ . 1]" 1
2145 1 48 ALA MB 1 51 GLN HA 3.356 . 4.764 4.903 4.885 4.921 0.157 7 0 "[ . 1]" 1
2146 2 48 ALA MB 2 51 GLN HA 3.356 . 4.764 4.902 4.887 4.922 0.158 7 0 "[ . 1]" 1
2147 1 40 ASN QB 1 43 GLU HA 3.096 . 4.294 4.525 4.482 4.567 0.273 7 0 "[ . 1]" 1
2148 2 40 ASN QB 2 43 GLU HA 3.096 . 4.294 4.525 4.486 4.568 0.274 7 0 "[ . 1]" 1
2149 1 38 LEU HA 1 41 ASN HA 3.097 . 4.296 4.222 4.152 4.326 0.030 7 0 "[ . 1]" 1
2150 1 59 GLY HA2 2 62 LEU HA 3.097 . 4.296 4.221 4.152 4.325 0.029 7 0 "[ . 1]" 1
2151 1 59 GLY HA2 1 62 LEU HB2 3.517 . 5.064 2.341 2.248 2.411 . 0 0 "[ . 1]" 1
2152 1 59 GLY HA2 2 62 LEU HB2 3.517 . 5.064 2.340 2.249 2.411 . 0 0 "[ . 1]" 1
2153 1 59 GLY HA2 1 62 LEU HB3 3.323 . 4.703 3.749 3.629 3.822 . 0 0 "[ . 1]" 1
2154 1 59 GLY HA2 2 62 LEU HB3 3.323 . 4.703 3.748 3.632 3.820 . 0 0 "[ . 1]" 1
2155 1 62 LEU HB2 1 62 LEU MD1 2.327 . 3.004 2.195 2.133 2.233 . 0 0 "[ . 1]" 1
2156 1 62 LEU MD1 2 62 LEU HB2 2.327 . 3.004 2.195 2.133 2.231 . 0 0 "[ . 1]" 1
2157 1 56 LEU HB3 1 56 LEU MD2 2.569 . 3.394 2.112 2.066 2.176 . 0 0 "[ . 1]" 1
2158 1 56 LEU MD2 2 56 LEU HB3 2.569 . 3.394 2.111 2.066 2.177 . 0 0 "[ . 1]" 1
2159 1 62 LEU HB3 1 62 LEU MD1 2.261 . 2.900 2.186 2.101 2.244 . 0 0 "[ . 1]" 1
2160 1 62 LEU MD1 2 62 LEU HB3 2.261 . 2.900 2.186 2.103 2.243 . 0 0 "[ . 1]" 1
2161 1 36 ALA HA 1 39 LYS QG 3.339 . 4.732 3.803 3.718 3.938 . 0 0 "[ . 1]" 1
2162 2 36 ALA HA 2 39 LYS QG 3.339 . 4.732 3.804 3.716 3.937 . 0 0 "[ . 1]" 1
2163 1 58 LYS HB3 1 58 LYS QG 2.484 . 3.255 2.169 2.093 2.220 . 0 0 "[ . 1]" 1
2164 1 63 ALA MB 2 58 LYS HB3 2.484 . 3.255 2.169 2.085 2.224 . 0 0 "[ . 1]" 1
2165 1 49 VAL HB 1 49 VAL QG 2.043 . 2.565 1.895 1.893 1.896 . 0 0 "[ . 1]" 1
2166 2 49 VAL HB 2 49 VAL QG 2.043 . 2.565 1.895 1.894 1.896 . 0 0 "[ . 1]" 1
2167 1 39 LYS HD3 1 49 VAL MG1 2.522 . 3.317 2.936 2.596 3.168 . 0 0 "[ . 1]" 1
2168 2 39 LYS HD3 2 49 VAL MG1 2.522 . 3.317 2.937 2.595 3.170 . 0 0 "[ . 1]" 1
2169 1 48 ALA MB 1 51 GLN HG3 3.319 . 4.696 4.604 4.481 4.703 0.007 7 0 "[ . 1]" 1
2170 2 48 ALA MB 2 51 GLN HG3 3.319 . 4.696 4.605 4.485 4.708 0.012 7 0 "[ . 1]" 1
2171 1 52 VAL HA 1 56 LEU H 3.187 . 4.457 3.666 3.617 3.708 . 0 0 "[ . 1]" 1
2172 2 52 VAL HA 2 56 LEU H 3.187 . 4.457 3.666 3.617 3.708 . 0 0 "[ . 1]" 1
2173 1 55 ARG QG 1 56 LEU H 2.748 . 3.692 3.242 3.207 3.410 . 0 0 "[ . 1]" 1
2174 2 55 ARG QG 2 56 LEU H 2.748 . 3.692 3.242 3.209 3.407 . 0 0 "[ . 1]" 1
2175 1 39 LYS H 1 39 LYS HE2 3.447 . 4.932 3.894 3.686 4.198 . 0 0 "[ . 1]" 1
2176 2 39 LYS H 2 39 LYS HE2 3.447 . 4.932 3.895 3.687 4.201 . 0 0 "[ . 1]" 1
2177 1 36 ALA MB 1 39 LYS H 2.987 . 4.102 3.713 3.681 3.731 . 0 0 "[ . 1]" 1
2178 2 36 ALA MB 2 39 LYS H 2.987 . 4.102 3.713 3.680 3.731 . 0 0 "[ . 1]" 1
2179 1 37 LEU QD 1 39 LYS H 4.080 . 6.161 4.886 4.863 4.949 . 0 0 "[ . 1]" 1
2180 1 37 LEU QD 2 39 LYS H 4.080 . 6.161 4.888 4.864 4.953 . 0 0 "[ . 1]" 1
2181 1 36 ALA H 1 39 LYS HE2 4.101 . 6.203 5.055 4.293 5.806 . 0 0 "[ . 1]" 1
2182 2 36 ALA H 2 39 LYS HE2 4.101 . 6.203 5.055 4.296 5.804 . 0 0 "[ . 1]" 1
2183 1 42 PHE HB2 1 43 GLU H 3.062 . 4.234 3.913 3.896 3.937 . 0 0 "[ . 1]" 1
2184 2 42 PHE HB2 2 43 GLU H 3.062 . 4.234 3.912 3.895 3.938 . 0 0 "[ . 1]" 1
2185 1 37 LEU HG 1 41 ASN H 3.479 . 4.992 4.224 4.175 4.267 . 0 0 "[ . 1]" 1
2186 2 37 LEU HG 2 41 ASN H 3.479 . 4.992 4.225 4.176 4.265 . 0 0 "[ . 1]" 1
2187 1 39 LYS QG 1 43 GLU H 3.934 . 5.868 5.006 4.888 5.288 . 0 0 "[ . 1]" 1
2188 1 30 PRO HG3 2 43 GLU H 3.934 . 5.868 5.006 4.887 5.291 . 0 0 "[ . 1]" 1
2189 1 41 ASN H 1 49 VAL QG 3.848 . 5.699 4.389 4.326 4.457 . 0 0 "[ . 1]" 1
2190 2 41 ASN H 2 49 VAL QG 3.848 . 5.699 4.387 4.316 4.453 . 0 0 "[ . 1]" 1
2191 1 43 GLU H 1 49 VAL QG 3.683 . 5.378 4.400 4.331 4.477 . 0 0 "[ . 1]" 1
2192 2 43 GLU H 2 49 VAL QG 3.683 . 5.378 4.399 4.330 4.477 . 0 0 "[ . 1]" 1
2193 1 34 ILE MG 1 36 ALA H 3.476 . 4.986 4.364 4.298 4.423 . 0 0 "[ . 1]" 1
2194 2 34 ILE MG 2 36 ALA H 3.476 . 4.986 4.365 4.298 4.424 . 0 0 "[ . 1]" 1
2195 1 37 LEU QD 1 41 ASN H 3.686 . 5.384 3.908 3.851 3.953 . 0 0 "[ . 1]" 1
2196 1 34 ILE HG12 2 41 ASN H 3.686 . 5.384 3.909 3.848 3.951 . 0 0 "[ . 1]" 1
2197 1 34 ILE HG12 1 36 ALA H 3.849 . 5.701 4.770 4.712 4.865 . 0 0 "[ . 1]" 1
2198 1 37 LEU QD 2 36 ALA H 3.849 . 5.701 4.768 4.714 4.866 . 0 0 "[ . 1]" 1
2199 1 32 ASP HA 1 36 ALA H 2.775 . 3.738 3.217 3.158 3.303 . 0 0 "[ . 1]" 1
2200 2 32 ASP HA 2 36 ALA H 2.775 . 3.738 3.216 3.163 3.302 . 0 0 "[ . 1]" 1
2201 1 31 TRP HH2 1 56 LEU H 3.291 . 4.645 4.548 4.324 4.752 0.107 7 0 "[ . 1]" 1
2202 2 31 TRP HH2 2 56 LEU H 3.291 . 4.645 4.549 4.329 4.751 0.106 7 0 "[ . 1]" 1
2203 1 36 ALA H 1 38 LEU H 3.351 . 4.755 3.826 3.788 3.859 . 0 0 "[ . 1]" 1
2204 2 36 ALA H 2 38 LEU H 3.351 . 4.755 3.828 3.791 3.858 . 0 0 "[ . 1]" 1
2205 1 40 ASN QD 1 42 PHE H 3.528 . 5.083 4.554 4.447 4.790 . 0 0 "[ . 1]" 1
2206 2 40 ASN QD 2 42 PHE H 3.528 . 5.083 4.554 4.448 4.789 . 0 0 "[ . 1]" 1
2207 1 36 ALA MB 1 40 ASN H 3.443 . 4.925 3.513 3.385 3.642 . 0 0 "[ . 1]" 1
2208 2 36 ALA MB 2 40 ASN H 3.443 . 4.925 3.514 3.390 3.640 . 0 0 "[ . 1]" 1
2209 1 40 ASN H 1 49 VAL QG 3.639 . 5.294 4.239 4.196 4.286 . 0 0 "[ . 1]" 1
2210 2 40 ASN H 2 49 VAL QG 3.639 . 5.294 4.237 4.196 4.284 . 0 0 "[ . 1]" 1
2211 1 39 LYS QG 1 49 VAL H 3.702 . 5.415 5.101 5.001 5.230 . 0 0 "[ . 1]" 1
2212 2 39 LYS QG 2 49 VAL H 3.702 . 5.415 5.101 4.997 5.231 . 0 0 "[ . 1]" 1
2213 1 30 PRO HD3 1 32 ASP H 4.221 . 6.448 5.993 5.926 6.095 . 0 0 "[ . 1]" 1
2214 2 30 PRO HD3 2 32 ASP H 4.221 . 6.448 5.994 5.920 6.098 . 0 0 "[ . 1]" 1
2215 1 32 ASP H 1 35 GLU HB3 3.240 . 4.553 4.366 4.098 4.672 0.119 3 0 "[ . 1]" 1
2216 2 32 ASP H 2 35 GLU HB3 3.240 . 4.553 4.366 4.106 4.678 0.125 3 0 "[ . 1]" 1
2217 1 30 PRO HG2 1 32 ASP H 3.728 . 5.465 5.587 5.499 5.777 0.312 7 0 "[ . 1]" 1
2218 1 37 LEU HG 2 32 ASP H 3.728 . 5.465 5.588 5.491 5.778 0.313 7 0 "[ . 1]" 1
2219 1 30 PRO HB3 1 32 ASP H 3.901 . 5.804 4.663 4.612 4.782 . 0 0 "[ . 1]" 1
2220 2 30 PRO HB3 2 32 ASP H 3.901 . 5.804 4.663 4.610 4.783 . 0 0 "[ . 1]" 1
2221 1 32 ASP H 1 34 ILE MG 4.044 . 6.089 5.069 4.962 5.123 . 0 0 "[ . 1]" 1
2222 1 37 LEU QD 2 32 ASP H 4.044 . 6.089 5.069 4.949 5.125 . 0 0 "[ . 1]" 1
2223 1 32 ASP H 1 34 ILE HG12 4.192 . 6.388 5.270 5.193 5.342 . 0 0 "[ . 1]" 1
2224 1 37 LEU QD 2 32 ASP H 4.192 . 6.388 5.269 5.174 5.344 . 0 0 "[ . 1]" 1
2225 1 49 VAL HA 1 51 GLN H 3.603 . 5.226 4.123 3.987 4.202 . 0 0 "[ . 1]" 1
2226 2 49 VAL HA 2 51 GLN H 3.603 . 5.226 4.124 3.990 4.204 . 0 0 "[ . 1]" 1
2227 1 50 ARG QG 1 51 GLN H 3.266 . 4.600 3.940 3.841 4.009 . 0 0 "[ . 1]" 1
2228 2 50 ARG QG 2 51 GLN H 3.266 . 4.600 3.941 3.842 4.012 . 0 0 "[ . 1]" 1
2229 1 49 VAL HA 1 50 ARG H 3.112 . 4.322 3.244 3.196 3.319 . 0 0 "[ . 1]" 1
2230 2 49 VAL HA 2 50 ARG H 3.112 . 4.322 3.244 3.196 3.318 . 0 0 "[ . 1]" 1
2231 1 49 VAL QG 1 50 ARG H 2.656 . 3.537 3.058 3.015 3.084 . 0 0 "[ . 1]" 1
2232 2 49 VAL QG 2 50 ARG H 2.656 . 3.537 3.059 3.017 3.085 . 0 0 "[ . 1]" 1
2233 1 48 ALA MB 1 51 GLN H 3.182 . 4.448 3.785 3.764 3.795 . 0 0 "[ . 1]" 1
2234 2 48 ALA MB 2 51 GLN H 3.182 . 4.448 3.782 3.754 3.796 . 0 0 "[ . 1]" 1
2235 1 28 THR H 1 28 THR MG 2.774 . 3.736 3.443 3.385 3.514 . 0 0 "[ . 1]" 1
2236 1 52 VAL MG1 2 28 THR H 2.774 . 3.736 3.442 3.394 3.510 . 0 0 "[ . 1]" 1
2237 1 28 THR H 2 48 ALA MB 3.816 . 5.636 4.822 4.684 4.943 . 0 0 "[ . 1]" 1
2238 1 48 ALA MB 2 28 THR H 3.816 . 5.636 4.816 4.709 4.948 . 0 0 "[ . 1]" 1
2239 1 25 GLN HB3 1 28 THR H 3.994 . 5.988 5.491 5.098 5.836 . 0 0 "[ . 1]" 1
2240 2 25 GLN HB3 2 28 THR H 3.994 . 5.988 5.489 5.102 5.841 . 0 0 "[ . 1]" 1
2241 1 49 VAL MG1 1 54 GLU H 3.385 . 4.817 4.178 4.111 4.254 . 0 0 "[ . 1]" 1
2242 2 49 VAL MG1 2 54 GLU H 3.385 . 4.817 4.177 4.109 4.254 . 0 0 "[ . 1]" 1
2243 1 56 LEU HB3 1 57 GLN H 2.553 . 3.367 2.330 2.209 2.367 . 0 0 "[ . 1]" 1
2244 2 56 LEU HB3 2 57 GLN H 2.553 . 3.367 2.331 2.212 2.361 . 0 0 "[ . 1]" 1
2245 1 56 LEU MD1 1 57 GLN H 3.347 . 4.747 4.309 4.276 4.340 . 0 0 "[ . 1]" 1
2246 1 63 ALA MB 2 57 GLN H 3.347 . 4.747 4.309 4.278 4.339 . 0 0 "[ . 1]" 1
2247 1 55 ARG QG 1 57 GLN H 3.264 . 4.596 4.130 4.102 4.170 . 0 0 "[ . 1]" 1
2248 1 56 LEU MD2 2 57 GLN H 3.264 . 4.596 4.130 4.103 4.166 . 0 0 "[ . 1]" 1
2249 1 60 TRP HD1 1 64 LYS H 4.096 . 6.194 5.469 5.150 5.809 . 0 0 "[ . 1]" 1
2250 2 60 TRP HD1 2 64 LYS H 4.096 . 6.194 5.468 5.156 5.804 . 0 0 "[ . 1]" 1
2251 1 62 LEU HA 1 64 LYS H 2.531 . 3.332 2.898 2.824 3.055 . 0 0 "[ . 1]" 1
2252 2 62 LEU HA 2 64 LYS H 2.531 . 3.332 2.899 2.824 3.056 . 0 0 "[ . 1]" 1
2253 1 62 LEU HB2 1 64 LYS H 3.371 . 4.792 4.811 4.725 4.862 0.070 3 0 "[ . 1]" 1
2254 1 62 LEU HB2 2 64 LYS H 3.371 . 4.792 4.812 4.728 4.860 0.068 3 0 "[ . 1]" 1
2255 1 58 LYS QG 1 62 LEU H 2.677 . 3.573 3.458 3.420 3.472 . 0 0 "[ . 1]" 1
2256 2 58 LYS QG 2 62 LEU H 2.677 . 3.573 3.459 3.422 3.473 . 0 0 "[ . 1]" 1
2257 1 62 LEU H 1 62 LEU MD1 2.654 . 3.534 3.542 3.505 3.569 0.035 4 0 "[ . 1]" 1
2258 1 62 LEU MD1 2 62 LEU H 2.654 . 3.534 3.542 3.500 3.574 0.040 4 0 "[ . 1]" 1
2259 1 62 LEU HB3 1 63 ALA H 2.732 . 3.665 3.698 3.649 3.739 0.074 9 0 "[ . 1]" 1
2260 1 58 LYS QG 2 63 ALA H 2.732 . 3.665 3.699 3.649 3.739 0.074 4 0 "[ . 1]" 1
2261 1 33 ASP H 1 34 ILE MG 3.366 . 4.782 3.813 3.751 3.860 . 0 0 "[ . 1]" 1
2262 1 37 LEU QD 2 33 ASP H 3.366 . 4.782 3.812 3.755 3.854 . 0 0 "[ . 1]" 1
2263 1 33 ASP H 1 34 ILE HG12 3.282 . 4.628 3.824 3.754 3.879 . 0 0 "[ . 1]" 1
2264 1 37 LEU QD 2 33 ASP H 3.282 . 4.628 3.823 3.758 3.864 . 0 0 "[ . 1]" 1
2265 1 37 LEU H 1 39 LYS HE2 3.843 . 5.689 4.682 4.584 4.854 . 0 0 "[ . 1]" 1
2266 2 37 LEU H 2 39 LYS HE2 3.843 . 5.689 4.681 4.581 4.853 . 0 0 "[ . 1]" 1
2267 1 37 LEU H 1 37 LEU HB3 2.397 . 3.115 2.166 2.143 2.273 . 0 0 "[ . 1]" 1
2268 2 37 LEU H 2 37 LEU HB3 2.397 . 3.115 2.166 2.142 2.273 . 0 0 "[ . 1]" 1
2269 1 34 ILE MG 1 37 LEU H 2.839 . 3.846 3.286 3.272 3.295 . 0 0 "[ . 1]" 1
2270 2 34 ILE MG 2 37 LEU H 2.839 . 3.846 3.286 3.269 3.294 . 0 0 "[ . 1]" 1
2271 1 37 LEU H 1 37 LEU QD 2.993 . 4.113 3.441 3.417 3.515 . 0 0 "[ . 1]" 1
2272 1 27 LEU QD 2 55 ARG H 2.993 . 4.113 3.440 3.416 3.514 . 0 0 "[ . 1]" 1
2273 1 32 ASP HB2 1 33 ASP H 2.282 . 2.933 2.322 2.137 2.453 . 0 0 "[ . 1]" 1
2274 2 32 ASP HB2 2 33 ASP H 2.282 . 2.933 2.321 2.135 2.445 . 0 0 "[ . 1]" 1
2275 1 62 LEU HA 1 63 ALA H 2.332 . 3.012 2.698 2.683 2.712 . 0 0 "[ . 1]" 1
2276 1 59 GLY HA3 2 63 ALA H 2.332 . 3.012 2.698 2.681 2.715 . 0 0 "[ . 1]" 1
2277 1 59 GLY HA2 1 63 ALA H 2.862 . 3.886 3.338 3.257 3.381 . 0 0 "[ . 1]" 1
2278 1 59 GLY HA2 2 63 ALA H 2.862 . 3.886 3.337 3.263 3.381 . 0 0 "[ . 1]" 1
2279 1 59 GLY HA3 1 62 LEU H 2.445 . 3.192 2.857 2.849 2.864 . 0 0 "[ . 1]" 1
2280 2 59 GLY HA3 2 62 LEU H 2.445 . 3.192 2.857 2.850 2.864 . 0 0 "[ . 1]" 1
2281 1 58 LYS HE3 1 62 LEU H 4.437 . 6.898 5.590 4.654 6.487 . 0 0 "[ . 1]" 1
2282 1 58 LYS HE3 2 62 LEU H 4.437 . 6.898 5.591 4.658 6.493 . 0 0 "[ . 1]" 1
2283 1 56 LEU HA 1 61 SER H 4.067 . 6.135 5.893 5.840 5.935 . 0 0 "[ . 1]" 1
2284 1 56 LEU HA 2 61 SER H 4.067 . 6.135 5.891 5.835 5.937 . 0 0 "[ . 1]" 1
2285 1 60 TRP HA 1 61 SER H 2.398 . 3.117 2.737 2.732 2.745 . 0 0 "[ . 1]" 1
2286 2 60 TRP HA 2 61 SER H 2.398 . 3.117 2.738 2.731 2.745 . 0 0 "[ . 1]" 1
2287 1 57 GLN QB 1 61 SER H 3.524 . 5.076 4.183 4.154 4.254 . 0 0 "[ . 1]" 1
2288 2 57 GLN QB 2 61 SER H 3.524 . 5.076 4.183 4.152 4.252 . 0 0 "[ . 1]" 1
2289 1 58 LYS QG 1 61 SER H 3.408 . 4.860 4.144 4.074 4.181 . 0 0 "[ . 1]" 1
2290 1 63 ALA MB 2 61 SER H 3.408 . 4.860 4.143 4.073 4.181 . 0 0 "[ . 1]" 1
2291 1 61 SER H 1 62 LEU QD 3.670 . 5.354 4.495 4.425 4.549 . 0 0 "[ . 1]" 1
2292 2 61 SER H 2 62 LEU QD 3.670 . 5.354 4.496 4.426 4.550 . 0 0 "[ . 1]" 1
2293 1 60 TRP HA 1 60 TRP HE1 3.601 . 5.222 4.906 4.814 4.987 . 0 0 "[ . 1]" 1
2294 2 60 TRP HA 2 60 TRP HE1 3.601 . 5.222 4.905 4.809 4.990 . 0 0 "[ . 1]" 1
2295 1 29 VAL HA 1 60 TRP HE1 4.584 . 7.210 5.948 5.573 6.201 . 0 0 "[ . 1]" 1
2296 2 29 VAL HA 2 60 TRP HE1 4.584 . 7.210 5.948 5.574 6.200 . 0 0 "[ . 1]" 1
2297 1 25 GLN QG 1 60 TRP HE1 4.116 . 6.234 6.477 5.537 6.750 0.516 8 1 "[ . + 1]" 1
2298 1 56 LEU HG 2 60 TRP HE1 4.116 . 6.234 6.476 5.539 6.764 0.530 8 1 "[ . + 1]" 1
2299 1 25 GLN HB2 1 60 TRP HE1 4.252 . 6.512 5.722 5.336 6.246 . 0 0 "[ . 1]" 1
2300 1 55 ARG HB3 2 60 TRP HE1 4.252 . 6.512 5.721 5.336 6.253 . 0 0 "[ . 1]" 1
2301 1 60 TRP HE1 1 64 LYS QB 3.689 . 5.390 4.565 4.204 4.891 . 0 0 "[ . 1]" 1
2302 1 55 ARG HD3 2 60 TRP HE1 3.689 . 5.390 4.562 4.212 4.882 . 0 0 "[ . 1]" 1
2303 1 60 TRP HE1 1 63 ALA MB 3.943 . 5.886 5.728 5.000 6.174 0.288 2 0 "[ . 1]" 1
2304 1 56 LEU MD1 2 60 TRP HE1 3.943 . 5.886 5.726 5.000 6.178 0.292 2 0 "[ . 1]" 1
2305 1 60 TRP HE1 2 55 ARG QG 4.045 . 6.090 5.126 5.054 5.335 . 0 0 "[ . 1]" 1
2306 1 55 ARG QG 2 60 TRP HE1 4.045 . 6.090 5.123 5.061 5.332 . 0 0 "[ . 1]" 1
2307 1 27 LEU QD 1 60 TRP HE1 4.491 . 7.012 5.826 5.460 6.426 . 0 0 "[ . 1]" 1
2308 2 27 LEU QD 2 60 TRP HE1 4.491 . 7.012 5.826 5.461 6.425 . 0 0 "[ . 1]" 1
2309 1 30 PRO HB2 1 31 TRP HE1 4.613 . 7.273 7.045 6.947 7.134 . 0 0 "[ . 1]" 1
2310 1 56 LEU HG 2 31 TRP HE1 4.613 . 7.273 7.044 6.952 7.129 . 0 0 "[ . 1]" 1
2311 1 31 TRP HE1 1 56 LEU MD2 4.167 . 6.337 5.400 5.260 5.497 . 0 0 "[ . 1]" 1
2312 1 56 LEU MD2 2 31 TRP HE1 4.167 . 6.337 5.400 5.264 5.493 . 0 0 "[ . 1]" 1
2313 1 31 TRP HE1 1 57 GLN HA 3.469 . 4.974 4.617 4.494 4.762 . 0 0 "[ . 1]" 1
2314 2 31 TRP HE1 2 57 GLN HA 3.469 . 4.974 4.619 4.500 4.761 . 0 0 "[ . 1]" 1
2315 1 56 LEU HB3 1 60 TRP H 3.402 . 4.849 4.065 4.029 4.147 . 0 0 "[ . 1]" 1
2316 2 56 LEU HB3 2 60 TRP H 3.402 . 4.849 4.064 4.028 4.148 . 0 0 "[ . 1]" 1
2317 1 55 ARG QG 1 60 TRP H 3.558 . 5.140 4.105 4.053 4.227 . 0 0 "[ . 1]" 1
2318 1 55 ARG QG 2 60 TRP H 3.558 . 5.140 4.105 4.051 4.228 . 0 0 "[ . 1]" 1
2319 1 58 LYS QG 1 60 TRP H 2.993 . 4.113 3.995 3.956 4.051 . 0 0 "[ . 1]" 1
2320 1 63 ALA MB 2 60 TRP H 2.993 . 4.113 3.996 3.966 4.045 . 0 0 "[ . 1]" 1
2321 1 56 LEU MD2 1 60 TRP H 3.616 . 5.250 3.726 3.657 3.810 . 0 0 "[ . 1]" 1
2322 1 55 ARG QG 2 60 TRP H 3.616 . 5.250 3.725 3.670 3.789 . 0 0 "[ . 1]" 1
2323 1 60 TRP H 1 62 LEU MD1 3.916 . 5.833 5.024 4.938 5.123 . 0 0 "[ . 1]" 1
2324 1 62 LEU MD1 2 60 TRP H 3.916 . 5.833 5.024 4.935 5.120 . 0 0 "[ . 1]" 1
2325 1 56 LEU HA 1 60 TRP H 3.535 . 5.097 3.690 3.648 3.748 . 0 0 "[ . 1]" 1
2326 1 56 LEU HA 2 60 TRP H 3.535 . 5.097 3.690 3.643 3.750 . 0 0 "[ . 1]" 1
2327 1 60 TRP H 1 62 LEU H 3.464 . 4.964 3.728 3.690 3.760 . 0 0 "[ . 1]" 1
2328 2 60 TRP H 2 62 LEU H 3.464 . 4.964 3.727 3.689 3.757 . 0 0 "[ . 1]" 1
2329 1 59 GLY H 1 62 LEU H 3.542 . 5.111 4.252 4.216 4.287 . 0 0 "[ . 1]" 1
2330 1 63 ALA H 2 59 GLY H 3.542 . 5.111 4.253 4.203 4.293 . 0 0 "[ . 1]" 1
2331 1 59 GLY H 1 61 SER H 3.271 . 4.608 4.020 3.989 4.041 . 0 0 "[ . 1]" 1
2332 1 60 TRP HE3 2 59 GLY H 3.271 . 4.608 4.019 3.989 4.036 . 0 0 "[ . 1]" 1
2333 1 57 GLN HA 1 59 GLY H 3.229 . 4.532 4.299 4.274 4.344 . 0 0 "[ . 1]" 1
2334 2 57 GLN HA 2 59 GLY H 3.229 . 4.532 4.299 4.273 4.346 . 0 0 "[ . 1]" 1
2335 1 55 ARG QG 1 59 GLY H 3.168 . 4.423 3.180 3.125 3.257 . 0 0 "[ . 1]" 1
2336 2 55 ARG QG 2 59 GLY H 3.168 . 4.423 3.180 3.127 3.253 . 0 0 "[ . 1]" 1
2337 1 55 ARG QG 1 59 GLY H 3.586 . 5.193 3.772 3.727 3.898 . 0 0 "[ . 1]" 1
2338 2 55 ARG QG 2 59 GLY H 3.586 . 5.193 3.774 3.728 3.901 . 0 0 "[ . 1]" 1
2339 1 56 LEU HG 1 59 GLY H 4.473 . 6.974 6.126 6.086 6.173 . 0 0 "[ . 1]" 1
2340 1 56 LEU HG 2 59 GLY H 4.473 . 6.974 6.126 6.086 6.173 . 0 0 "[ . 1]" 1
2341 1 58 LYS H 1 61 SER H 3.636 . 5.288 4.630 4.585 4.693 . 0 0 "[ . 1]" 1
2342 1 60 TRP HE3 2 58 LYS H 3.636 . 5.288 4.630 4.581 4.689 . 0 0 "[ . 1]" 1
2343 1 58 LYS H 1 62 LEU H 4.139 . 6.280 5.898 5.870 5.947 . 0 0 "[ . 1]" 1
2344 1 63 ALA H 2 58 LYS H 4.139 . 6.280 5.898 5.872 5.943 . 0 0 "[ . 1]" 1
2345 1 31 TRP HH2 1 58 LYS H 4.279 . 6.568 5.258 5.166 5.329 . 0 0 "[ . 1]" 1
2346 2 31 TRP HH2 2 58 LYS H 4.279 . 6.568 5.259 5.165 5.329 . 0 0 "[ . 1]" 1
2347 1 55 ARG HA 1 58 LYS H 2.463 . 3.222 2.683 2.671 2.704 . 0 0 "[ . 1]" 1
2348 2 55 ARG HA 2 58 LYS H 2.463 . 3.222 2.683 2.673 2.703 . 0 0 "[ . 1]" 1
2349 1 54 GLU QG 1 58 LYS H 3.797 . 5.599 4.751 4.713 4.782 . 0 0 "[ . 1]" 1
2350 2 54 GLU QG 2 58 LYS H 3.797 . 5.599 4.751 4.711 4.783 . 0 0 "[ . 1]" 1
2351 1 58 LYS H 1 58 LYS QG 2.986 . 4.100 3.652 3.597 3.685 . 0 0 "[ . 1]" 1
2352 1 63 ALA MB 2 58 LYS H 2.986 . 4.100 3.653 3.585 3.691 . 0 0 "[ . 1]" 1
2353 1 55 ARG QG 1 58 LYS H 3.886 . 5.774 4.700 4.632 4.742 . 0 0 "[ . 1]" 1
2354 1 56 LEU MD2 2 58 LYS H 3.886 . 5.774 4.701 4.636 4.741 . 0 0 "[ . 1]" 1
2355 1 34 ILE MG 1 58 LYS H 4.033 . 6.066 5.604 5.527 5.665 . 0 0 "[ . 1]" 1
2356 2 34 ILE MG 2 58 LYS H 4.033 . 6.066 5.604 5.526 5.664 . 0 0 "[ . 1]" 1
2357 1 25 GLN QE 2 47 ALA MB 4.373 . 6.763 6.906 6.043 7.565 0.802 1 2 "[+ . - 1]" 1
2358 1 47 ALA MB 2 25 GLN QE 4.373 . 6.763 6.901 6.065 7.551 0.788 1 2 "[+ . - 1]" 1
2359 1 25 GLN QE 1 27 LEU HB3 4.214 . 6.433 4.495 3.649 5.370 . 0 0 "[ . 1]" 1
2360 2 25 GLN QE 2 27 LEU HB3 4.214 . 6.433 4.495 3.641 5.370 . 0 0 "[ . 1]" 1
2361 1 25 GLN QE 2 48 ALA MB 4.379 . 6.776 3.505 2.849 4.497 . 0 0 "[ . 1]" 1
2362 1 48 ALA MB 2 25 GLN QE 4.379 . 6.776 3.506 2.845 4.499 . 0 0 "[ . 1]" 1
2363 1 25 GLN QE 1 27 LEU HB2 4.551 . 7.140 4.541 3.820 5.136 . 0 0 "[ . 1]" 1
2364 2 25 GLN QE 2 27 LEU HB2 4.551 . 7.140 4.541 3.813 5.137 . 0 0 "[ . 1]" 1
2365 1 25 GLN QE 2 52 VAL MG2 4.313 . 6.638 3.551 2.853 4.758 . 0 0 "[ . 1]" 1
2366 1 52 VAL MG2 2 25 GLN QE 4.313 . 6.638 3.552 2.849 4.753 . 0 0 "[ . 1]" 1
2367 1 40 ASN QB 1 40 ASN QD 2.783 . 3.751 1.965 1.945 2.095 . 0 0 "[ . 1]" 1
2368 2 40 ASN QB 2 40 ASN QD 2.783 . 3.751 1.964 1.943 2.096 . 0 0 "[ . 1]" 1
2369 1 40 ASN QD 1 43 GLU HB2 4.491 . 7.012 6.524 6.231 6.790 . 0 0 "[ . 1]" 1
2370 2 40 ASN QD 2 43 GLU HB2 4.491 . 7.012 6.524 6.229 6.799 . 0 0 "[ . 1]" 1
2371 1 37 LEU HB3 1 40 ASN QD 3.971 . 5.942 5.160 3.117 5.487 . 0 0 "[ . 1]" 1
2372 2 37 LEU HB3 2 40 ASN QD 3.971 . 5.942 5.159 3.118 5.483 . 0 0 "[ . 1]" 1
2373 1 37 LEU HB2 1 40 ASN QD 3.945 . 5.891 4.986 4.033 5.203 . 0 0 "[ . 1]" 1
2374 1 30 PRO HG2 2 40 ASN QD 3.945 . 5.891 4.987 4.030 5.196 . 0 0 "[ . 1]" 1
2375 1 36 ALA MB 1 40 ASN QD 3.970 . 5.770 4.605 3.172 4.990 . 0 0 "[ . 1]" 1
2376 1 30 PRO HB3 2 40 ASN QD 3.970 . 5.770 4.613 3.173 5.002 . 0 0 "[ . 1]" 1
2377 1 40 ASN QD 1 41 ASN QB 4.270 . 6.549 3.610 3.179 5.308 . 0 0 "[ . 1]" 1
2378 2 40 ASN QD 2 41 ASN QB 4.270 . 6.549 3.613 3.186 5.315 . 0 0 "[ . 1]" 1
2379 1 40 ASN QD 1 43 GLU HB2 4.144 . 6.290 4.658 4.328 5.471 . 0 0 "[ . 1]" 1
2380 2 40 ASN QD 2 43 GLU HB2 4.144 . 6.290 4.660 4.331 5.472 . 0 0 "[ . 1]" 1
2381 1 37 LEU QD 1 40 ASN QD 4.345 . 6.704 2.971 2.605 4.075 . 0 0 "[ . 1]" 1
2382 1 27 LEU QD 2 44 ASN HD21 4.345 . 6.704 2.972 2.606 4.082 . 0 0 "[ . 1]" 1
2383 1 40 ASN QD 1 41 ASN HA 4.053 . 6.106 3.096 2.932 3.973 . 0 0 "[ . 1]" 1
2384 2 40 ASN QD 2 41 ASN HA 4.053 . 6.106 3.097 2.933 3.973 . 0 0 "[ . 1]" 1
2385 1 25 GLN QE 2 51 GLN HA 4.696 . 7.452 3.880 3.446 4.282 . 0 0 "[ . 1]" 1
2386 1 51 GLN HA 2 25 GLN QE 4.696 . 7.452 3.877 3.432 4.296 . 0 0 "[ . 1]" 1
2387 1 25 GLN QE 2 48 ALA HA 4.336 . 6.686 6.676 5.365 7.506 0.820 2 3 "[ +*-. 1]" 1
2388 1 48 ALA HA 2 25 GLN QE 4.336 . 6.686 6.671 5.406 7.522 0.836 2 3 "[ +*-. 1]" 1
2389 1 25 GLN QE 1 64 LYS HA 4.275 . 6.559 4.130 3.154 5.567 . 0 0 "[ . 1]" 1
2390 2 25 GLN QE 2 64 LYS HA 4.275 . 6.559 4.129 3.153 5.554 . 0 0 "[ . 1]" 1
2391 1 55 ARG HA 1 57 GLN H 3.428 . 4.897 4.113 4.065 4.168 . 0 0 "[ . 1]" 1
2392 2 55 ARG HA 2 57 GLN H 3.428 . 4.897 4.113 4.068 4.169 . 0 0 "[ . 1]" 1
2393 1 53 MET ME 1 57 GLN H 3.455 . 4.948 4.466 4.133 5.016 0.068 10 0 "[ . 1]" 1
2394 2 53 MET ME 2 57 GLN H 3.455 . 4.948 4.467 4.128 5.021 0.073 10 0 "[ . 1]" 1
2395 1 31 TRP HH2 1 54 GLU H 4.205 . 6.415 6.535 6.186 6.792 0.377 7 0 "[ . 1]" 1
2396 2 31 TRP HH2 2 54 GLU H 4.205 . 6.415 6.536 6.188 6.791 0.376 7 0 "[ . 1]" 1
2397 1 31 TRP HH2 1 57 GLN H 3.288 . 4.640 3.476 3.310 3.573 . 0 0 "[ . 1]" 1
2398 2 31 TRP HH2 2 57 GLN H 3.288 . 4.640 3.478 3.311 3.572 . 0 0 "[ . 1]" 1
2399 1 31 TRP HE3 1 54 GLU H 4.448 . 6.921 6.780 6.669 7.013 0.092 7 0 "[ . 1]" 1
2400 2 31 TRP HE3 2 54 GLU H 4.448 . 6.921 6.780 6.671 7.014 0.093 7 0 "[ . 1]" 1
2401 1 29 VAL QG 1 56 LEU H 4.544 . 7.125 4.715 4.629 4.819 . 0 0 "[ . 1]" 1
2402 1 29 VAL QG 2 56 LEU H 4.544 . 7.125 4.715 4.607 4.833 . 0 0 "[ . 1]" 1
2403 1 37 LEU H 1 37 LEU HA 2.622 . 3.481 2.554 2.548 2.557 . 0 0 "[ . 1]" 1
2404 2 37 LEU H 2 37 LEU HA 2.622 . 3.481 2.554 2.549 2.558 . 0 0 "[ . 1]" 1
2405 1 52 VAL HA 1 55 ARG H 2.807 . 3.792 3.057 3.002 3.109 . 0 0 "[ . 1]" 1
2406 2 52 VAL HA 2 55 ARG H 2.807 . 3.792 3.057 3.002 3.110 . 0 0 "[ . 1]" 1
2407 1 54 GLU QG 1 55 ARG H 3.094 . 4.291 3.826 3.814 3.847 . 0 0 "[ . 1]" 1
2408 2 54 GLU QG 2 55 ARG H 3.094 . 4.291 3.826 3.814 3.846 . 0 0 "[ . 1]" 1
2409 1 55 ARG H 1 56 LEU MD1 3.406 . 4.857 4.539 4.511 4.586 . 0 0 "[ . 1]" 1
2410 1 63 ALA MB 2 55 ARG H 3.406 . 4.857 4.540 4.510 4.585 . 0 0 "[ . 1]" 1
2411 1 52 VAL MG2 1 55 ARG H 3.008 . 4.139 3.811 3.746 3.823 . 0 0 "[ . 1]" 1
2412 2 52 VAL MG2 2 55 ARG H 3.008 . 4.139 3.811 3.744 3.825 . 0 0 "[ . 1]" 1
2413 1 49 VAL HA 1 54 GLU H 4.078 . 6.157 6.027 5.892 6.103 . 0 0 "[ . 1]" 1
2414 2 49 VAL HA 2 54 GLU H 4.078 . 6.157 6.027 5.893 6.104 . 0 0 "[ . 1]" 1
2415 1 29 VAL QG 1 57 GLN H 4.593 . 7.230 5.594 5.516 5.644 . 0 0 "[ . 1]" 1
2416 1 29 VAL QG 2 57 GLN H 4.593 . 7.230 5.594 5.512 5.642 . 0 0 "[ . 1]" 1
2417 1 42 PHE QR 1 53 MET H 4.237 . 6.481 5.344 5.260 5.438 . 0 0 "[ . 1]" 1
2418 2 42 PHE QR 2 53 MET H 4.237 . 6.481 5.344 5.259 5.439 . 0 0 "[ . 1]" 1
2419 1 31 TRP HH2 1 53 MET H 4.458 . 6.942 6.088 5.851 6.288 . 0 0 "[ . 1]" 1
2420 2 31 TRP HH2 2 53 MET H 4.458 . 6.942 6.089 5.854 6.289 . 0 0 "[ . 1]" 1
2421 1 50 ARG HA 1 53 MET H 2.845 . 3.857 3.235 3.199 3.262 . 0 0 "[ . 1]" 1
2422 2 50 ARG HA 2 53 MET H 2.845 . 3.857 3.235 3.199 3.261 . 0 0 "[ . 1]" 1
2423 1 34 ILE MD 1 53 MET H 4.792 . 7.662 6.692 6.633 6.803 . 0 0 "[ . 1]" 1
2424 1 34 ILE MD 2 53 MET H 4.792 . 7.662 6.693 6.631 6.806 . 0 0 "[ . 1]" 1
2425 1 52 VAL H 1 53 MET QB 3.723 . 5.456 4.179 3.996 4.301 . 0 0 "[ . 1]" 1
2426 1 27 LEU HB2 2 52 VAL H 3.723 . 5.456 4.180 3.999 4.300 . 0 0 "[ . 1]" 1
2427 1 48 ALA H 1 52 VAL H 3.569 . 5.161 4.457 4.414 4.495 . 0 0 "[ . 1]" 1
2428 2 48 ALA H 2 52 VAL H 3.569 . 5.161 4.457 4.415 4.491 . 0 0 "[ . 1]" 1
2429 1 42 PHE QR 1 52 VAL H 3.660 . 5.334 4.385 4.344 4.437 . 0 0 "[ . 1]" 1
2430 2 42 PHE QR 2 52 VAL H 3.660 . 5.334 4.385 4.348 4.437 . 0 0 "[ . 1]" 1
2431 1 40 ASN HA 1 41 ASN HD21 4.321 . 6.654 6.586 6.474 6.760 0.106 4 0 "[ . 1]" 1
2432 1 33 ASP HA 2 41 ASN HD21 4.321 . 6.654 6.586 6.474 6.754 0.100 4 0 "[ . 1]" 1
2433 1 38 LEU HA 1 41 ASN HD21 3.852 . 5.707 4.533 4.441 4.742 . 0 0 "[ . 1]" 1
2434 1 29 VAL HA 2 41 ASN HD21 3.852 . 5.707 4.532 4.451 4.740 . 0 0 "[ . 1]" 1
2435 1 51 GLN QE 1 53 MET HA 4.524 . 7.082 6.466 6.181 6.801 . 0 0 "[ . 1]" 1
2436 1 27 LEU HA 2 51 GLN QE 4.524 . 7.082 6.471 6.212 6.819 . 0 0 "[ . 1]" 1
2437 1 47 ALA HA 1 51 GLN QE 3.712 . 5.435 3.899 3.734 4.059 . 0 0 "[ . 1]" 1
2438 2 47 ALA HA 2 51 GLN QE 3.712 . 5.435 3.901 3.743 4.070 . 0 0 "[ . 1]" 1
2439 1 50 ARG QG 1 51 GLN QE 3.871 . 5.744 4.518 4.371 4.716 . 0 0 "[ . 1]" 1
2440 1 27 LEU HG 2 51 GLN QE 3.871 . 5.744 4.524 4.349 4.700 . 0 0 "[ . 1]" 1
2441 1 41 ASN QB 1 41 ASN HD21 2.976 . 4.083 2.190 2.182 2.201 . 0 0 "[ . 1]" 1
2442 1 30 PRO HB2 2 41 ASN HD21 2.976 . 4.083 2.189 2.179 2.201 . 0 0 "[ . 1]" 1
2443 1 37 LEU HG 1 41 ASN HD21 3.174 . 4.434 3.796 3.675 3.895 . 0 0 "[ . 1]" 1
2444 1 30 PRO HG2 2 41 ASN HD21 3.174 . 4.434 3.795 3.689 3.883 . 0 0 "[ . 1]" 1
2445 1 41 ASN HD21 1 48 ALA MB 4.253 . 6.514 6.117 6.038 6.222 . 0 0 "[ . 1]" 1
2446 2 41 ASN HD21 2 48 ALA MB 4.253 . 6.514 6.117 6.030 6.224 . 0 0 "[ . 1]" 1
2447 1 37 LEU QD 1 41 ASN HD21 3.468 . 4.971 3.777 3.588 3.904 . 0 0 "[ . 1]" 1
2448 1 34 ILE HG12 2 41 ASN HD21 3.468 . 4.971 3.774 3.588 3.897 . 0 0 "[ . 1]" 1
2449 1 41 ASN QB 1 41 ASN HD22 3.290 . 4.643 3.170 3.140 3.210 . 0 0 "[ . 1]" 1
2450 1 30 PRO HB2 2 41 ASN HD22 3.290 . 4.643 3.170 3.143 3.208 . 0 0 "[ . 1]" 1
2451 1 37 LEU HB3 1 41 ASN HD22 4.719 . 7.503 7.648 7.530 7.733 0.230 10 0 "[ . 1]" 1
2452 2 37 LEU HB3 2 41 ASN HD22 4.719 . 7.503 7.649 7.534 7.739 0.236 10 0 "[ . 1]" 1
2453 1 37 LEU HG 1 41 ASN HD22 3.701 . 5.413 4.437 4.290 4.582 . 0 0 "[ . 1]" 1
2454 1 30 PRO HG2 2 41 ASN HD22 3.701 . 5.413 4.437 4.307 4.585 . 0 0 "[ . 1]" 1
2455 1 38 LEU HB2 1 41 ASN HD22 4.807 . 7.695 6.760 6.581 7.111 . 0 0 "[ . 1]" 1
2456 2 38 LEU HB2 2 41 ASN HD22 4.807 . 7.695 6.762 6.603 7.110 . 0 0 "[ . 1]" 1
2457 1 39 LYS H 1 49 VAL H 4.434 . 6.892 6.578 6.515 6.603 . 0 0 "[ . 1]" 1
2458 2 39 LYS H 2 49 VAL H 4.434 . 6.892 6.576 6.510 6.598 . 0 0 "[ . 1]" 1
2459 1 46 GLN HB2 1 48 ALA H 2.977 . 4.085 4.194 4.129 4.223 0.138 7 0 "[ . 1]" 1
2460 2 46 GLN HB2 2 48 ALA H 2.977 . 4.085 4.194 4.129 4.228 0.143 7 0 "[ . 1]" 1
2461 1 48 ALA H 2 27 LEU QD 3.426 . 4.893 4.458 4.112 4.676 . 0 0 "[ . 1]" 1
2462 1 27 LEU QD 2 48 ALA H 3.426 . 4.893 4.464 4.106 4.651 . 0 0 "[ . 1]" 1
2463 1 42 PHE HB2 1 47 ALA H 4.644 . 7.340 6.263 5.889 6.499 . 0 0 "[ . 1]" 1
2464 2 42 PHE HB2 2 47 ALA H 4.644 . 7.340 6.265 5.887 6.503 . 0 0 "[ . 1]" 1
2465 1 47 ALA H 1 48 ALA MB 2.958 . 4.052 3.936 3.601 4.064 0.012 2 0 "[ . 1]" 1
2466 2 47 ALA H 2 48 ALA MB 2.958 . 4.052 3.938 3.601 4.066 0.014 2 0 "[ . 1]" 1
2467 1 39 LYS HD3 1 46 GLN HE21 3.688 . 5.388 4.025 3.617 4.199 . 0 0 "[ . 1]" 1
2468 2 39 LYS HD3 2 46 GLN HE21 3.688 . 5.388 4.027 3.624 4.207 . 0 0 "[ . 1]" 1
2469 1 43 GLU HB2 1 46 GLN HE22 3.756 . 5.520 4.312 4.155 4.483 . 0 0 "[ . 1]" 1
2470 2 43 GLU HB2 2 46 GLN HE22 3.756 . 5.520 4.313 4.154 4.485 . 0 0 "[ . 1]" 1
2471 1 44 ASN HB2 1 46 GLN HE21 4.021 . 6.042 5.187 4.902 5.831 . 0 0 "[ . 1]" 1
2472 2 44 ASN HB2 2 46 GLN HE21 4.021 . 6.042 5.186 4.892 5.821 . 0 0 "[ . 1]" 1
2473 1 44 ASN HB2 1 46 GLN HE22 4.440 . 6.904 6.139 5.837 6.605 . 0 0 "[ . 1]" 1
2474 2 44 ASN HB2 2 46 GLN HE22 4.440 . 6.904 6.138 5.832 6.605 . 0 0 "[ . 1]" 1
2475 1 39 LYS HE2 1 46 GLN HE22 4.300 . 6.611 5.711 5.460 6.172 . 0 0 "[ . 1]" 1
2476 2 39 LYS HE2 2 46 GLN HE22 4.300 . 6.611 5.711 5.465 6.172 . 0 0 "[ . 1]" 1
2477 1 43 GLU HA 1 46 GLN HE22 4.015 . 6.030 2.801 2.588 2.966 . 0 0 "[ . 1]" 1
2478 2 43 GLU HA 2 46 GLN HE22 4.015 . 6.030 2.800 2.578 2.968 . 0 0 "[ . 1]" 1
2479 1 46 GLN H 1 49 VAL HA 4.658 . 7.370 5.977 5.820 6.223 . 0 0 "[ . 1]" 1
2480 2 46 GLN H 2 49 VAL HA 4.658 . 7.370 5.979 5.820 6.225 . 0 0 "[ . 1]" 1
2481 1 46 GLN H 1 48 ALA MB 3.234 . 4.542 3.869 3.811 3.902 . 0 0 "[ . 1]" 1
2482 2 46 GLN H 2 48 ALA MB 3.234 . 4.542 3.870 3.811 3.902 . 0 0 "[ . 1]" 1
2483 1 42 PHE HB2 1 46 GLN H 3.981 . 5.962 5.231 5.087 5.541 . 0 0 "[ . 1]" 1
2484 2 42 PHE HB2 2 46 GLN H 3.981 . 5.962 5.231 5.084 5.541 . 0 0 "[ . 1]" 1
2485 1 25 GLN HB3 1 27 LEU H 2.282 . 2.933 2.400 2.174 2.537 . 0 0 "[ . 1]" 1
2486 2 25 GLN HB3 2 27 LEU H 2.282 . 2.933 2.400 2.172 2.535 . 0 0 "[ . 1]" 1
2487 1 27 LEU H 1 60 TRP HZ2 2.918 . 3.982 3.117 2.471 3.335 . 0 0 "[ . 1]" 1
2488 2 27 LEU H 2 60 TRP HZ2 2.918 . 3.982 3.117 2.472 3.335 . 0 0 "[ . 1]" 1
2489 1 27 LEU H 2 42 PHE QE 3.849 . 5.701 5.022 4.862 5.198 . 0 0 "[ . 1]" 1
2490 1 42 PHE QE 2 27 LEU H 3.849 . 5.701 5.020 4.880 5.194 . 0 0 "[ . 1]" 1
2491 1 43 GLU HA 1 45 ASP H 3.351 . 4.755 4.143 3.602 4.227 . 0 0 "[ . 1]" 1
2492 2 43 GLU HA 2 45 ASP H 3.351 . 4.755 4.143 3.598 4.226 . 0 0 "[ . 1]" 1
2493 1 39 LYS QG 1 45 ASP H 3.974 . 5.948 5.650 5.436 5.784 . 0 0 "[ . 1]" 1
2494 2 39 LYS QG 2 45 ASP H 3.974 . 5.948 5.650 5.432 5.783 . 0 0 "[ . 1]" 1
2495 1 45 ASP H 1 48 ALA MB 2.870 . 3.899 3.762 3.631 4.133 0.234 7 0 "[ . 1]" 1
2496 2 45 ASP H 2 48 ALA MB 2.870 . 3.899 3.762 3.632 4.128 0.229 7 0 "[ . 1]" 1
2497 1 39 LYS QG 1 42 PHE H 3.842 . 5.687 4.879 4.827 5.019 . 0 0 "[ . 1]" 1
2498 1 30 PRO HG2 2 42 PHE H 3.842 . 5.687 4.880 4.825 5.021 . 0 0 "[ . 1]" 1
2499 1 39 LYS QG 1 42 PHE H 4.144 . 6.291 4.757 4.711 4.876 . 0 0 "[ . 1]" 1
2500 1 30 PRO HG3 2 42 PHE H 4.144 . 6.291 4.758 4.708 4.877 . 0 0 "[ . 1]" 1
2501 1 38 LEU HB2 1 42 PHE H 4.051 . 6.103 5.402 5.347 5.474 . 0 0 "[ . 1]" 1
2502 2 38 LEU HB2 2 42 PHE H 4.051 . 6.103 5.403 5.347 5.470 . 0 0 "[ . 1]" 1
2503 1 37 LEU QD 1 42 PHE H 3.974 . 5.948 5.225 5.185 5.296 . 0 0 "[ . 1]" 1
2504 2 37 LEU QD 2 42 PHE H 3.974 . 5.948 5.225 5.186 5.300 . 0 0 "[ . 1]" 1
2505 1 41 ASN H 1 41 ASN HD21 3.947 . 5.894 4.214 4.141 4.310 . 0 0 "[ . 1]" 1
2506 2 41 ASN H 2 41 ASN HD21 3.947 . 5.894 4.214 4.142 4.319 . 0 0 "[ . 1]" 1
2507 1 36 ALA HA 1 41 ASN H 3.869 . 5.740 5.465 5.392 5.635 . 0 0 "[ . 1]" 1
2508 2 36 ALA HA 2 41 ASN H 3.869 . 5.740 5.465 5.394 5.640 . 0 0 "[ . 1]" 1
2509 1 38 LEU H 1 42 PHE QR 3.760 . 5.527 5.260 5.225 5.290 . 0 0 "[ . 1]" 1
2510 2 38 LEU H 2 42 PHE QR 3.760 . 5.527 5.258 5.225 5.290 . 0 0 "[ . 1]" 1
2511 1 33 ASP HA 1 38 LEU H 4.381 . 6.780 6.022 5.984 6.059 . 0 0 "[ . 1]" 1
2512 2 33 ASP HA 2 38 LEU H 4.381 . 6.780 6.022 5.983 6.061 . 0 0 "[ . 1]" 1
2513 1 38 LEU H 1 39 LYS HE2 4.147 . 6.296 4.748 4.664 4.930 . 0 0 "[ . 1]" 1
2514 2 38 LEU H 2 39 LYS HE2 4.147 . 6.296 4.748 4.664 4.930 . 0 0 "[ . 1]" 1
2515 1 36 ALA MB 1 38 LEU H 3.405 . 4.854 4.306 4.279 4.328 . 0 0 "[ . 1]" 1
2516 1 30 PRO HG3 2 38 LEU H 3.405 . 4.854 4.308 4.278 4.330 . 0 0 "[ . 1]" 1
2517 1 38 LEU H 1 49 VAL MG1 3.153 . 4.396 3.927 3.881 4.081 . 0 0 "[ . 1]" 1
2518 2 38 LEU H 2 49 VAL MG1 3.153 . 4.396 3.927 3.879 4.082 . 0 0 "[ . 1]" 1
2519 1 37 LEU QD 1 38 LEU H 3.158 . 4.405 3.703 3.665 3.739 . 0 0 "[ . 1]" 1
2520 1 37 LEU QD 2 38 LEU H 3.158 . 4.405 3.703 3.664 3.736 . 0 0 "[ . 1]" 1
2521 1 34 ILE MD 1 38 LEU H 3.939 . 5.879 5.096 4.950 5.205 . 0 0 "[ . 1]" 1
2522 1 34 ILE MD 2 38 LEU H 3.939 . 5.879 5.097 4.966 5.211 . 0 0 "[ . 1]" 1
2523 1 37 LEU H 1 38 LEU MD1 3.657 . 5.328 5.605 5.541 5.645 0.317 3 0 "[ . 1]" 1
2524 2 37 LEU H 2 38 LEU MD1 3.657 . 5.328 5.606 5.542 5.645 0.317 8 0 "[ . 1]" 1
2525 1 34 ILE MD 1 37 LEU H 4.130 . 6.263 5.647 5.551 5.714 . 0 0 "[ . 1]" 1
2526 1 34 ILE MD 2 37 LEU H 4.130 . 6.263 5.647 5.563 5.719 . 0 0 "[ . 1]" 1
2527 1 34 ILE MD 1 36 ALA H 4.627 . 7.304 6.158 6.088 6.233 . 0 0 "[ . 1]" 1
2528 1 34 ILE MD 2 36 ALA H 4.627 . 7.304 6.158 6.092 6.236 . 0 0 "[ . 1]" 1
2529 1 35 GLU H 1 35 GLU HB3 2.401 . 3.122 2.367 2.298 2.461 . 0 0 "[ . 1]" 1
2530 2 35 GLU H 2 35 GLU HB3 2.401 . 3.122 2.369 2.297 2.462 . 0 0 "[ . 1]" 1
2531 1 34 ILE HG13 1 35 GLU H 3.176 . 4.437 3.959 3.917 4.026 . 0 0 "[ . 1]" 1
2532 2 34 ILE HG13 2 35 GLU H 3.176 . 4.437 3.960 3.914 4.028 . 0 0 "[ . 1]" 1
2533 1 35 GLU H 1 38 LEU HB2 4.103 . 6.207 4.728 4.697 4.780 . 0 0 "[ . 1]" 1
2534 2 35 GLU H 2 38 LEU HB2 4.103 . 6.207 4.729 4.700 4.777 . 0 0 "[ . 1]" 1
2535 1 34 ILE HG12 1 35 GLU H 3.434 . 4.908 4.339 4.311 4.376 . 0 0 "[ . 1]" 1
2536 1 37 LEU QD 2 35 GLU H 3.434 . 4.908 4.338 4.314 4.377 . 0 0 "[ . 1]" 1
2537 1 32 ASP HA 1 35 GLU H 2.994 . 4.115 3.389 3.290 3.520 . 0 0 "[ . 1]" 1
2538 2 32 ASP HA 2 35 GLU H 2.994 . 4.115 3.389 3.290 3.518 . 0 0 "[ . 1]" 1
2539 1 31 TRP HH2 1 34 ILE H 4.600 . 7.245 6.779 6.640 6.889 . 0 0 "[ . 1]" 1
2540 2 31 TRP HH2 2 34 ILE H 4.600 . 7.245 6.779 6.638 6.892 . 0 0 "[ . 1]" 1
2541 1 30 PRO HD2 1 34 ILE H 4.198 . 6.401 5.010 4.972 5.056 . 0 0 "[ . 1]" 1
2542 2 30 PRO HD2 2 34 ILE H 4.198 . 6.401 5.010 4.977 5.053 . 0 0 "[ . 1]" 1
2543 1 34 ILE H 1 34 ILE MG 2.760 . 3.712 2.796 2.750 2.841 . 0 0 "[ . 1]" 1
2544 1 37 LEU QD 2 34 ILE H 2.760 . 3.712 2.794 2.758 2.845 . 0 0 "[ . 1]" 1
2545 1 34 ILE H 1 34 ILE HG12 2.766 . 3.722 2.778 2.728 2.828 . 0 0 "[ . 1]" 1
2546 1 37 LEU QD 2 34 ILE H 2.766 . 3.722 2.777 2.728 2.832 . 0 0 "[ . 1]" 1
2547 1 32 ASP HA 1 33 ASP H 2.611 . 3.463 2.725 2.719 2.733 . 0 0 "[ . 1]" 1
2548 2 32 ASP HA 2 33 ASP H 2.611 . 3.463 2.724 2.718 2.733 . 0 0 "[ . 1]" 1
2549 1 29 VAL HA 1 33 ASP H 4.820 . 7.724 7.330 7.258 7.378 . 0 0 "[ . 1]" 1
2550 1 38 LEU HA 2 33 ASP H 4.820 . 7.724 7.330 7.261 7.376 . 0 0 "[ . 1]" 1
2551 1 30 PRO HB3 1 33 ASP H 3.086 . 4.276 3.973 3.924 4.022 . 0 0 "[ . 1]" 1
2552 2 30 PRO HB3 2 33 ASP H 3.086 . 4.276 3.974 3.924 4.025 . 0 0 "[ . 1]" 1
2553 1 31 TRP H 1 35 GLU HA 4.718 . 7.500 7.341 7.281 7.400 . 0 0 "[ . 1]" 1
2554 2 31 TRP H 2 35 GLU HA 4.718 . 7.500 7.340 7.283 7.401 . 0 0 "[ . 1]" 1
2555 1 31 TRP H 1 32 ASP HB2 3.470 . 4.975 4.624 4.502 4.751 . 0 0 "[ . 1]" 1
2556 2 31 TRP H 2 32 ASP HB2 3.470 . 4.975 4.626 4.504 4.758 . 0 0 "[ . 1]" 1
2557 1 31 TRP H 1 34 ILE MG 3.775 . 5.556 4.972 4.915 5.010 . 0 0 "[ . 1]" 1
2558 1 37 LEU QD 2 31 TRP H 3.775 . 5.556 4.972 4.911 5.017 . 0 0 "[ . 1]" 1
2559 1 31 TRP H 1 34 ILE HG12 3.956 . 5.912 5.374 5.315 5.456 . 0 0 "[ . 1]" 1
2560 1 37 LEU QD 2 31 TRP H 3.956 . 5.912 5.374 5.320 5.450 . 0 0 "[ . 1]" 1
2561 1 27 LEU QD 1 29 VAL H 4.281 . 6.572 5.951 5.877 6.040 . 0 0 "[ . 1]" 1
2562 2 27 LEU QD 2 29 VAL H 4.281 . 6.572 5.950 5.874 6.041 . 0 0 "[ . 1]" 1
2563 1 27 LEU HB2 1 29 VAL H 4.183 . 6.371 5.593 5.489 5.767 . 0 0 "[ . 1]" 1
2564 2 27 LEU HB2 2 29 VAL H 4.183 . 6.371 5.593 5.487 5.761 . 0 0 "[ . 1]" 1
2565 1 29 VAL H 1 30 PRO HB3 4.531 . 7.097 5.753 5.709 5.811 . 0 0 "[ . 1]" 1
2566 1 55 ARG HD3 2 29 VAL H 4.531 . 7.097 5.752 5.705 5.810 . 0 0 "[ . 1]" 1
2567 1 29 VAL H 2 48 ALA MB 3.833 . 5.669 5.448 5.367 5.556 . 0 0 "[ . 1]" 1
2568 1 48 ALA MB 2 29 VAL H 3.833 . 5.669 5.447 5.367 5.553 . 0 0 "[ . 1]" 1
2569 1 28 THR H 1 30 PRO HD2 4.609 . 7.264 6.598 6.373 6.703 . 0 0 "[ . 1]" 1
2570 1 45 ASP HB3 2 28 THR H 4.609 . 7.264 6.598 6.374 6.703 . 0 0 "[ . 1]" 1
2571 1 25 GLN QG 1 28 THR H 3.899 . 5.799 6.004 5.012 6.543 0.744 5 2 "[- + 1]" 1
2572 1 41 ASN QB 2 28 THR H 3.899 . 5.799 6.003 5.003 6.541 0.742 5 2 "[- + 1]" 1
2573 1 26 GLU H 2 48 ALA MB 4.851 . 7.793 6.349 5.993 6.581 . 0 0 "[ . 1]" 1
2574 1 48 ALA MB 2 26 GLU H 4.851 . 7.793 6.342 6.019 6.594 . 0 0 "[ . 1]" 1
2575 1 26 GLU H 1 27 LEU QD 3.841 . 5.685 3.774 3.374 3.984 . 0 0 "[ . 1]" 1
2576 2 26 GLU H 2 27 LEU QD 3.841 . 5.685 3.773 3.378 3.985 . 0 0 "[ . 1]" 1
2577 1 54 GLU QG 1 57 GLN HE21 4.556 . 7.151 4.734 4.180 5.338 . 0 0 "[ . 1]" 1
2578 2 54 GLU QG 2 57 GLN HE21 4.556 . 7.151 4.732 4.176 5.332 . 0 0 "[ . 1]" 1
2579 1 40 ASN QB 1 41 ASN HD22 4.867 . 7.828 6.967 6.770 7.115 . 0 0 "[ . 1]" 1
2580 2 40 ASN QB 2 41 ASN HD22 4.867 . 7.828 6.968 6.758 7.128 . 0 0 "[ . 1]" 1
2581 1 58 LYS HE3 1 61 SER H 4.634 . 7.318 7.300 6.904 7.588 0.270 2 0 "[ . 1]" 1
2582 1 58 LYS HE3 2 61 SER H 4.634 . 7.318 7.298 6.901 7.591 0.273 2 0 "[ . 1]" 1
2583 1 25 GLN QG 1 61 SER H 4.628 . 7.306 7.487 7.313 7.559 0.253 8 0 "[ . 1]" 1
2584 1 56 LEU HG 2 61 SER H 4.628 . 7.306 7.486 7.301 7.583 0.277 8 0 "[ . 1]" 1
2585 1 34 ILE MD 1 56 LEU H 4.673 . 7.403 6.073 5.840 6.191 . 0 0 "[ . 1]" 1
2586 1 34 ILE MD 2 56 LEU H 4.673 . 7.403 6.072 5.837 6.208 . 0 0 "[ . 1]" 1
2587 1 29 VAL QG 1 55 ARG H 4.864 . 7.821 5.750 5.678 5.827 . 0 0 "[ . 1]" 1
2588 1 29 VAL QG 2 55 ARG H 4.864 . 7.821 5.751 5.653 5.843 . 0 0 "[ . 1]" 1
2589 1 31 TRP HH2 1 59 GLY H 4.378 . 6.774 5.300 5.219 5.349 . 0 0 "[ . 1]" 1
2590 1 31 TRP HH2 2 59 GLY H 4.378 . 6.774 5.302 5.227 5.352 . 0 0 "[ . 1]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 96
_Distance_constraint_stats_list.Viol_count 73
_Distance_constraint_stats_list.Viol_total 20.782
_Distance_constraint_stats_list.Viol_max 0.061
_Distance_constraint_stats_list.Viol_rms 0.0089
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0022
_Distance_constraint_stats_list.Viol_average_violations_only 0.0285
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
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 30 PRO 0.000 0.000 . 0 "[ . 1]"
1 31 TRP 0.000 0.000 . 0 "[ . 1]"
1 32 ASP 0.000 0.000 . 0 "[ . 1]"
1 33 ASP 0.000 0.000 . 0 "[ . 1]"
1 34 ILE 0.000 0.000 . 0 "[ . 1]"
1 35 GLU 0.106 0.033 1 0 "[ . 1]"
1 36 ALA 0.000 0.000 . 0 "[ . 1]"
1 37 LEU 0.199 0.044 6 0 "[ . 1]"
1 38 LEU 0.215 0.039 3 0 "[ . 1]"
1 39 LYS 0.106 0.033 1 0 "[ . 1]"
1 40 ASN 0.000 0.000 . 0 "[ . 1]"
1 41 ASN 0.199 0.044 6 0 "[ . 1]"
1 42 PHE 0.215 0.039 3 0 "[ . 1]"
1 45 ASP 0.000 0.000 . 0 "[ . 1]"
1 46 GLN 0.000 0.000 . 0 "[ . 1]"
1 47 ALA 0.000 0.000 . 0 "[ . 1]"
1 48 ALA 0.031 0.025 7 0 "[ . 1]"
1 49 VAL 0.000 0.000 . 0 "[ . 1]"
1 50 ARG 0.000 0.000 . 0 "[ . 1]"
1 51 GLN 0.000 0.000 . 0 "[ . 1]"
1 52 VAL 0.031 0.025 7 0 "[ . 1]"
1 53 MET 0.000 0.000 . 0 "[ . 1]"
1 54 GLU 0.000 0.000 . 0 "[ . 1]"
1 55 ARG 0.004 0.003 5 0 "[ . 1]"
1 56 LEU 0.000 0.000 . 0 "[ . 1]"
1 57 GLN 0.000 0.000 . 0 "[ . 1]"
1 58 LYS 0.000 0.000 . 0 "[ . 1]"
1 59 GLY 0.494 0.061 6 0 "[ . 1]"
1 60 TRP 0.000 0.000 . 0 "[ . 1]"
1 61 SER 0.000 0.000 . 0 "[ . 1]"
1 62 LEU 0.000 0.000 . 0 "[ . 1]"
1 63 ALA 0.490 0.061 6 0 "[ . 1]"
2 30 PRO 0.000 0.000 . 0 "[ . 1]"
2 31 TRP 0.000 0.000 . 0 "[ . 1]"
2 32 ASP 0.000 0.000 . 0 "[ . 1]"
2 33 ASP 0.000 0.000 . 0 "[ . 1]"
2 34 ILE 0.000 0.000 . 0 "[ . 1]"
2 35 GLU 0.103 0.033 1 0 "[ . 1]"
2 36 ALA 0.000 0.000 . 0 "[ . 1]"
2 37 LEU 0.200 0.043 6 0 "[ . 1]"
2 38 LEU 0.205 0.036 3 0 "[ . 1]"
2 39 LYS 0.103 0.033 1 0 "[ . 1]"
2 40 ASN 0.000 0.000 . 0 "[ . 1]"
2 41 ASN 0.200 0.043 6 0 "[ . 1]"
2 42 PHE 0.205 0.036 3 0 "[ . 1]"
2 45 ASP 0.000 0.000 . 0 "[ . 1]"
2 46 GLN 0.000 0.000 . 0 "[ . 1]"
2 47 ALA 0.000 0.000 . 0 "[ . 1]"
2 48 ALA 0.032 0.026 7 0 "[ . 1]"
2 49 VAL 0.000 0.000 . 0 "[ . 1]"
2 50 ARG 0.000 0.000 . 0 "[ . 1]"
2 51 GLN 0.000 0.000 . 0 "[ . 1]"
2 52 VAL 0.032 0.026 7 0 "[ . 1]"
2 53 MET 0.000 0.000 . 0 "[ . 1]"
2 54 GLU 0.000 0.000 . 0 "[ . 1]"
2 55 ARG 0.003 0.003 5 0 "[ . 1]"
2 56 LEU 0.000 0.000 . 0 "[ . 1]"
2 57 GLN 0.000 0.000 . 0 "[ . 1]"
2 58 LYS 0.000 0.000 . 0 "[ . 1]"
2 59 GLY 0.493 0.061 6 0 "[ . 1]"
2 60 TRP 0.000 0.000 . 0 "[ . 1]"
2 61 SER 0.000 0.000 . 0 "[ . 1]"
2 62 LEU 0.000 0.000 . 0 "[ . 1]"
2 63 ALA 0.490 0.061 6 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 59 GLY O 1 63 ALA H 2.000 . 2.300 1.868 1.834 1.885 . 0 0 "[ . 1]" 2
2 1 59 GLY O 1 63 ALA N 3.000 2.800 3.300 2.751 2.739 2.765 0.061 6 0 "[ . 1]" 2
3 1 58 LYS O 1 62 LEU H 2.000 . 2.300 2.135 2.058 2.178 . 0 0 "[ . 1]" 2
4 1 58 LYS O 1 62 LEU N 3.000 2.800 3.300 2.852 2.806 2.900 . 0 0 "[ . 1]" 2
5 1 57 GLN O 1 61 SER H 2.000 . 2.300 2.137 2.096 2.182 . 0 0 "[ . 1]" 2
6 1 57 GLN O 1 61 SER N 3.000 2.800 3.300 3.012 2.963 3.068 . 0 0 "[ . 1]" 2
7 1 56 LEU O 1 60 TRP H 2.000 . 2.300 1.944 1.920 1.968 . 0 0 "[ . 1]" 2
8 1 56 LEU O 1 60 TRP N 3.000 2.800 3.300 2.825 2.808 2.845 . 0 0 "[ . 1]" 2
9 1 55 ARG O 1 59 GLY H 2.000 . 2.300 1.897 1.864 1.918 . 0 0 "[ . 1]" 2
10 1 55 ARG O 1 59 GLY N 3.000 2.800 3.300 2.811 2.797 2.833 0.003 5 0 "[ . 1]" 2
11 1 54 GLU O 1 58 LYS H 2.000 . 2.300 1.992 1.946 2.036 . 0 0 "[ . 1]" 2
12 1 54 GLU O 1 58 LYS N 3.000 2.800 3.300 2.938 2.890 2.983 . 0 0 "[ . 1]" 2
13 1 53 MET O 1 57 GLN H 2.000 . 2.300 2.020 1.988 2.049 . 0 0 "[ . 1]" 2
14 1 53 MET O 1 57 GLN N 3.000 2.800 3.300 2.919 2.885 2.941 . 0 0 "[ . 1]" 2
15 1 52 VAL O 1 56 LEU H 2.000 . 2.300 1.964 1.938 1.999 . 0 0 "[ . 1]" 2
16 1 52 VAL O 1 56 LEU N 3.000 2.800 3.300 2.908 2.878 2.938 . 0 0 "[ . 1]" 2
17 1 51 GLN O 1 55 ARG H 2.000 . 2.300 2.213 2.179 2.287 . 0 0 "[ . 1]" 2
18 1 51 GLN O 1 55 ARG N 3.000 2.800 3.300 2.991 2.957 3.038 . 0 0 "[ . 1]" 2
19 1 50 ARG O 1 54 GLU H 2.000 . 2.300 1.992 1.911 2.030 . 0 0 "[ . 1]" 2
20 1 50 ARG O 1 54 GLU N 3.000 2.800 3.300 2.898 2.828 2.932 . 0 0 "[ . 1]" 2
21 1 49 VAL O 1 53 MET H 2.000 . 2.300 2.083 2.068 2.097 . 0 0 "[ . 1]" 2
22 1 49 VAL O 1 53 MET N 3.000 2.800 3.300 3.005 2.973 3.028 . 0 0 "[ . 1]" 2
23 1 48 ALA O 1 52 VAL H 2.000 . 2.300 1.936 1.869 1.971 . 0 0 "[ . 1]" 2
24 1 48 ALA O 1 52 VAL N 3.000 2.800 3.300 2.834 2.775 2.872 0.025 7 0 "[ . 1]" 2
25 1 47 ALA O 1 51 GLN H 2.000 . 2.300 2.106 2.049 2.142 . 0 0 "[ . 1]" 2
26 1 47 ALA O 1 51 GLN N 3.000 2.800 3.300 3.056 2.994 3.092 . 0 0 "[ . 1]" 2
27 1 46 GLN O 1 50 ARG H 2.000 . 2.300 2.040 1.974 2.165 . 0 0 "[ . 1]" 2
28 1 46 GLN O 1 50 ARG N 3.000 2.800 3.300 2.965 2.902 3.104 . 0 0 "[ . 1]" 2
29 1 45 ASP O 1 49 VAL H 2.000 . 2.300 2.140 2.083 2.219 . 0 0 "[ . 1]" 2
30 1 45 ASP O 1 49 VAL N 3.000 2.800 3.300 3.062 2.997 3.158 . 0 0 "[ . 1]" 2
31 1 38 LEU O 1 42 PHE H 2.000 . 2.300 1.983 1.957 2.023 . 0 0 "[ . 1]" 2
32 1 38 LEU O 1 42 PHE N 3.000 2.800 3.300 2.781 2.761 2.821 0.039 3 0 "[ . 1]" 2
33 1 37 LEU O 1 41 ASN H 2.000 . 2.300 1.917 1.885 1.964 . 0 0 "[ . 1]" 2
34 1 37 LEU O 1 41 ASN N 3.000 2.800 3.300 2.780 2.756 2.802 0.044 6 0 "[ . 1]" 2
35 1 36 ALA O 1 40 ASN H 2.000 . 2.300 2.036 1.984 2.089 . 0 0 "[ . 1]" 2
36 1 36 ALA O 1 40 ASN N 3.000 2.800 3.300 2.980 2.937 3.027 . 0 0 "[ . 1]" 2
37 1 35 GLU O 1 39 LYS H 2.000 . 2.300 2.000 1.964 2.039 . 0 0 "[ . 1]" 2
38 1 35 GLU O 1 39 LYS N 3.000 2.800 3.300 2.803 2.767 2.859 0.033 1 0 "[ . 1]" 2
39 1 34 ILE O 1 38 LEU H 2.000 . 2.300 1.887 1.845 1.919 . 0 0 "[ . 1]" 2
40 1 34 ILE O 1 38 LEU N 3.000 2.800 3.300 2.844 2.815 2.880 . 0 0 "[ . 1]" 2
41 1 33 ASP O 1 37 LEU H 2.000 . 2.300 2.121 2.077 2.177 . 0 0 "[ . 1]" 2
42 1 33 ASP O 1 37 LEU N 3.000 2.800 3.300 2.950 2.903 2.995 . 0 0 "[ . 1]" 2
43 1 32 ASP O 1 36 ALA H 2.000 . 2.300 2.118 2.053 2.157 . 0 0 "[ . 1]" 2
44 1 32 ASP O 1 36 ALA N 3.000 2.800 3.300 2.985 2.919 3.031 . 0 0 "[ . 1]" 2
45 1 31 TRP O 1 35 GLU H 2.000 . 2.300 1.955 1.888 1.999 . 0 0 "[ . 1]" 2
46 1 31 TRP O 1 35 GLU N 3.000 2.800 3.300 2.878 2.845 2.905 . 0 0 "[ . 1]" 2
47 1 30 PRO O 1 34 ILE H 2.000 . 2.300 2.012 1.988 2.059 . 0 0 "[ . 1]" 2
48 1 30 PRO O 1 34 ILE N 3.000 2.800 3.300 2.931 2.914 2.970 . 0 0 "[ . 1]" 2
49 2 59 GLY O 2 63 ALA H 2.000 . 2.300 1.868 1.834 1.883 . 0 0 "[ . 1]" 2
50 2 59 GLY O 2 63 ALA N 3.000 2.800 3.300 2.751 2.739 2.766 0.061 6 0 "[ . 1]" 2
51 2 58 LYS O 2 62 LEU H 2.000 . 2.300 2.136 2.058 2.176 . 0 0 "[ . 1]" 2
52 2 58 LYS O 2 62 LEU N 3.000 2.800 3.300 2.852 2.806 2.894 . 0 0 "[ . 1]" 2
53 2 57 GLN O 2 61 SER H 2.000 . 2.300 2.136 2.099 2.188 . 0 0 "[ . 1]" 2
54 2 57 GLN O 2 61 SER N 3.000 2.800 3.300 3.012 2.968 3.067 . 0 0 "[ . 1]" 2
55 2 56 LEU O 2 60 TRP H 2.000 . 2.300 1.945 1.923 1.971 . 0 0 "[ . 1]" 2
56 2 56 LEU O 2 60 TRP N 3.000 2.800 3.300 2.826 2.808 2.847 . 0 0 "[ . 1]" 2
57 2 55 ARG O 2 59 GLY H 2.000 . 2.300 1.898 1.865 1.920 . 0 0 "[ . 1]" 2
58 2 55 ARG O 2 59 GLY N 3.000 2.800 3.300 2.812 2.797 2.835 0.003 5 0 "[ . 1]" 2
59 2 54 GLU O 2 58 LYS H 2.000 . 2.300 1.992 1.957 2.029 . 0 0 "[ . 1]" 2
60 2 54 GLU O 2 58 LYS N 3.000 2.800 3.300 2.938 2.899 2.976 . 0 0 "[ . 1]" 2
61 2 53 MET O 2 57 GLN H 2.000 . 2.300 2.019 1.991 2.049 . 0 0 "[ . 1]" 2
62 2 53 MET O 2 57 GLN N 3.000 2.800 3.300 2.919 2.887 2.939 . 0 0 "[ . 1]" 2
63 2 52 VAL O 2 56 LEU H 2.000 . 2.300 1.964 1.936 2.005 . 0 0 "[ . 1]" 2
64 2 52 VAL O 2 56 LEU N 3.000 2.800 3.300 2.909 2.877 2.941 . 0 0 "[ . 1]" 2
65 2 51 GLN O 2 55 ARG H 2.000 . 2.300 2.210 2.174 2.281 . 0 0 "[ . 1]" 2
66 2 51 GLN O 2 55 ARG N 3.000 2.800 3.300 2.989 2.955 3.032 . 0 0 "[ . 1]" 2
67 2 50 ARG O 2 54 GLU H 2.000 . 2.300 1.994 1.912 2.032 . 0 0 "[ . 1]" 2
68 2 50 ARG O 2 54 GLU N 3.000 2.800 3.300 2.901 2.831 2.934 . 0 0 "[ . 1]" 2
69 2 49 VAL O 2 53 MET H 2.000 . 2.300 2.082 2.070 2.096 . 0 0 "[ . 1]" 2
70 2 49 VAL O 2 53 MET N 3.000 2.800 3.300 3.004 2.975 3.031 . 0 0 "[ . 1]" 2
71 2 48 ALA O 2 52 VAL H 2.000 . 2.300 1.936 1.868 1.974 . 0 0 "[ . 1]" 2
72 2 48 ALA O 2 52 VAL N 3.000 2.800 3.300 2.834 2.774 2.875 0.026 7 0 "[ . 1]" 2
73 2 47 ALA O 2 51 GLN H 2.000 . 2.300 2.108 2.052 2.137 . 0 0 "[ . 1]" 2
74 2 47 ALA O 2 51 GLN N 3.000 2.800 3.300 3.057 2.994 3.086 . 0 0 "[ . 1]" 2
75 2 46 GLN O 2 50 ARG H 2.000 . 2.300 2.041 1.971 2.173 . 0 0 "[ . 1]" 2
76 2 46 GLN O 2 50 ARG N 3.000 2.800 3.300 2.966 2.902 3.100 . 0 0 "[ . 1]" 2
77 2 45 ASP O 2 49 VAL H 2.000 . 2.300 2.141 2.079 2.213 . 0 0 "[ . 1]" 2
78 2 45 ASP O 2 49 VAL N 3.000 2.800 3.300 3.062 2.996 3.152 . 0 0 "[ . 1]" 2
79 2 38 LEU O 2 42 PHE H 2.000 . 2.300 1.983 1.955 2.026 . 0 0 "[ . 1]" 2
80 2 38 LEU O 2 42 PHE N 3.000 2.800 3.300 2.782 2.764 2.818 0.036 3 0 "[ . 1]" 2
81 2 37 LEU O 2 41 ASN H 2.000 . 2.300 1.917 1.881 1.969 . 0 0 "[ . 1]" 2
82 2 37 LEU O 2 41 ASN N 3.000 2.800 3.300 2.780 2.757 2.800 0.043 6 0 "[ . 1]" 2
83 2 36 ALA O 2 40 ASN H 2.000 . 2.300 2.037 1.984 2.092 . 0 0 "[ . 1]" 2
84 2 36 ALA O 2 40 ASN N 3.000 2.800 3.300 2.981 2.939 3.028 . 0 0 "[ . 1]" 2
85 2 35 GLU O 2 39 LYS H 2.000 . 2.300 1.999 1.964 2.042 . 0 0 "[ . 1]" 2
86 2 35 GLU O 2 39 LYS N 3.000 2.800 3.300 2.804 2.767 2.861 0.033 1 0 "[ . 1]" 2
87 2 34 ILE O 2 38 LEU H 2.000 . 2.300 1.888 1.844 1.922 . 0 0 "[ . 1]" 2
88 2 34 ILE O 2 38 LEU N 3.000 2.800 3.300 2.844 2.814 2.882 . 0 0 "[ . 1]" 2
89 2 33 ASP O 2 37 LEU H 2.000 . 2.300 2.121 2.072 2.177 . 0 0 "[ . 1]" 2
90 2 33 ASP O 2 37 LEU N 3.000 2.800 3.300 2.950 2.899 2.995 . 0 0 "[ . 1]" 2
91 2 32 ASP O 2 36 ALA H 2.000 . 2.300 2.118 2.055 2.163 . 0 0 "[ . 1]" 2
92 2 32 ASP O 2 36 ALA N 3.000 2.800 3.300 2.984 2.919 3.033 . 0 0 "[ . 1]" 2
93 2 31 TRP O 2 35 GLU H 2.000 . 2.300 1.953 1.889 2.001 . 0 0 "[ . 1]" 2
94 2 31 TRP O 2 35 GLU N 3.000 2.800 3.300 2.877 2.848 2.906 . 0 0 "[ . 1]" 2
95 2 30 PRO O 2 34 ILE H 2.000 . 2.300 2.013 1.990 2.062 . 0 0 "[ . 1]" 2
96 2 30 PRO O 2 34 ILE N 3.000 2.800 3.300 2.932 2.916 2.972 . 0 0 "[ . 1]" 2
stop_
save_
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