NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
572662 |
2mgx   |
19607 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mgx
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 1627
_Distance_constraint_stats_list.Viol_count 4778
_Distance_constraint_stats_list.Viol_total 15650.675
_Distance_constraint_stats_list.Viol_max 1.950
_Distance_constraint_stats_list.Viol_rms 0.1475
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0428
_Distance_constraint_stats_list.Viol_average_violations_only 0.2184
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 SER 0.302 0.170 4 0 "[ . 1 .]"
1 3 GLU 9.046 1.175 9 3 "[ *. -+1 .]"
1 4 ALA 4.282 0.568 8 1 "[ . + 1 .]"
1 5 VAL 17.526 1.201 12 8 "[-** . **1*+* .]"
1 6 MET 57.551 1.025 2 15 [*+*********-***]
1 7 GLU 18.397 1.612 7 12 "[ ***- +**1*****]"
1 8 ASP 15.204 1.201 12 7 "[-** . **1 +* .]"
1 9 VAL 7.259 0.806 12 1 "[ . 1 + .]"
1 10 LEU 22.126 1.612 7 12 "[ ***- +**** ***]"
1 11 ARG 13.458 0.803 8 3 "[* . + 1 - .]"
1 12 PRO 13.127 0.744 10 7 "[* -* * +** .]"
1 13 LEU 1.556 0.305 15 0 "[ . 1 .]"
1 14 GLU 2.220 0.431 10 0 "[ . 1 .]"
1 15 GLN 13.738 0.571 1 4 "[+ ** 1 -]"
1 16 ALA 7.005 0.638 1 3 "[+ * 1 -]"
1 17 LEU 26.401 0.813 12 8 "[* *-*** 1 + *]"
1 18 GLU 6.936 0.440 1 0 "[ . 1 .]"
1 19 ASP 6.699 1.186 15 4 "[ . *1 - *+]"
1 20 CYS 14.746 0.597 7 1 "[ . + 1 .]"
1 21 ARG 7.805 0.813 12 4 "[* -* 1 + .]"
1 22 GLY 4.573 0.615 9 2 "[ . - +1 .]"
1 23 HIS 1.386 0.615 9 2 "[ . - +1 .]"
1 24 THR 6.327 0.429 15 0 "[ . 1 .]"
1 25 ARG 5.998 0.864 12 1 "[ . 1 + .]"
1 26 LYS 3.285 0.328 8 0 "[ . 1 .]"
1 27 GLN 7.446 0.909 1 5 "[+ . * -* *]"
1 28 VAL 11.995 0.429 15 0 "[ . 1 .]"
1 29 CYS 3.876 0.510 3 1 "[ + . 1 .]"
1 30 ASP 3.102 0.529 10 1 "[ . + .]"
1 31 ASP 9.980 0.909 1 4 "[+ . * 1* -]"
1 32 ILE 4.640 0.467 14 0 "[ . 1 .]"
1 33 SER 3.135 0.510 3 1 "[ + . 1 .]"
1 34 ARG 1.691 0.305 15 0 "[ . 1 .]"
1 35 ARG 11.649 1.343 1 7 "[+ -** 1* **]"
1 36 LEU 10.489 0.894 4 1 "[ +. 1 .]"
1 37 ALA 2.443 0.869 7 1 "[ . + 1 .]"
1 38 LEU 21.637 0.590 15 8 "[* **-**1 * +]"
1 39 LEU 17.805 0.894 4 1 "[ +. 1 .]"
1 40 GLN 13.560 0.869 7 5 "[* * . + -* .]"
1 41 GLU 5.205 0.635 10 7 "[ -**** + *]"
1 42 GLN 2.731 0.708 14 3 "[ * . - +.]"
1 43 TRP 99.407 1.416 8 15 [***-***+*******]
1 44 ALA 1.448 0.115 15 0 "[ . 1 .]"
1 45 GLY 0.037 0.014 9 0 "[ . 1 .]"
1 46 GLY 0.515 0.076 8 0 "[ . 1 .]"
1 47 LYS 21.041 1.411 13 8 "[* ** *1 *+-*]"
1 48 LEU 16.035 0.740 3 2 "[- + . 1 .]"
1 49 SER 14.641 1.309 13 5 "[ * -. ** + .]"
1 50 ILE 11.898 0.616 5 1 "[ + 1 .]"
1 51 PRO 12.794 0.916 11 3 "[ *- 1+ .]"
1 52 VAL 40.070 1.372 10 15 [*****-***+*****]
1 53 LYS 90.443 1.688 10 15 [****-****+*****]
1 54 LYS 14.329 0.789 13 7 "[-** ** 1* + .]"
1 55 ARG 3.940 0.399 5 0 "[ . 1 .]"
1 56 MET 53.047 1.184 14 15 [******-******+*]
1 57 ALA 0.023 0.014 10 0 "[ . 1 .]"
1 58 LEU 7.413 0.299 13 0 "[ . 1 .]"
1 59 LEU 40.512 1.065 4 15 [***+**-********]
1 60 VAL 41.864 1.655 14 15 [****-********+*]
1 61 GLN 3.852 0.629 10 1 "[ . + .]"
1 62 GLU 12.280 0.856 10 7 "[ ** ** + *-.]"
1 63 LEU 6.543 0.184 1 0 "[ . 1 .]"
1 64 SER 2.447 0.166 6 0 "[ . 1 .]"
1 65 SER 10.565 1.105 12 3 "[ . - 1*+ .]"
1 66 HIS 6.447 0.627 11 1 "[ . 1+ .]"
1 67 ARG 12.359 1.105 12 4 "[ . * 1*+ -.]"
1 68 TRP 11.480 0.699 10 1 "[ . + .]"
1 69 ASP 2.152 0.228 10 0 "[ . 1 .]"
1 70 ALA 4.658 0.856 10 5 "[ . ** + *-.]"
1 71 ALA 7.197 0.831 6 2 "[ .+ 1 -.]"
1 72 ASP 1.407 0.831 6 1 "[ .+ 1 .]"
1 73 ASP 2.704 0.408 14 0 "[ . 1 .]"
1 74 ILE 6.746 0.686 6 1 "[ .+ 1 .]"
1 75 HIS 16.445 1.543 10 14 "[***-**** +*****]"
1 76 ARG 14.731 0.509 12 1 "[ . 1 + .]"
1 77 SER 1.485 0.509 12 1 "[ . 1 + .]"
1 78 LEU 54.784 1.543 10 15 [*********+*****]
1 79 MET 6.365 0.489 10 0 "[ . 1 .]"
1 80 VAL 16.313 1.088 8 5 "[ -. +*1* * .]"
1 81 ASP 11.076 1.088 8 5 "[ -. +*1* * .]"
1 82 HIS 40.873 1.559 14 15 [*************+*]
1 83 VAL 1.150 0.388 9 0 "[ . 1 .]"
1 84 THR 0.569 0.078 9 0 "[ . 1 .]"
1 85 GLU 26.893 1.559 14 13 "[****** * *-**+*]"
1 86 VAL 28.709 1.527 15 13 "[** *********-+]"
1 87 SER 1.097 0.145 9 0 "[ . 1 .]"
1 88 GLN 36.393 1.370 4 15 [***+***-*******]
1 89 TRP 74.727 1.370 4 15 [***+**-********]
1 90 MET 2.937 1.277 10 1 "[ . + .]"
1 91 VAL 0.408 0.305 15 0 "[ . 1 .]"
1 92 GLY 0.314 0.032 3 0 "[ . 1 .]"
1 93 VAL 4.329 0.336 14 0 "[ . 1 .]"
1 94 LYS 17.370 1.412 5 7 "[ *+ * *- **]"
1 95 ARG 4.924 0.705 6 1 "[ .+ 1 .]"
1 96 LEU 4.458 0.201 13 0 "[ . 1 .]"
1 97 ILE 3.822 0.286 14 0 "[ . 1 .]"
1 98 ALA 14.144 1.038 2 13 "[*+ *****-*****]"
1 99 GLU 6.797 0.715 15 3 "[ - . * 1 +]"
1 100 LYS 30.311 1.950 9 13 "[ ******+**-***]"
1 101 ARG 27.820 1.038 2 14 "[*+ **********-*]"
1 102 SER 0.824 0.180 10 0 "[ . 1 .]"
1 103 LEU 28.911 1.950 9 9 "[ -****+1 * **]"
1 104 PHE 1.857 0.324 9 0 "[ . 1 .]"
1 105 SER 1.643 0.202 6 0 "[ . 1 .]"
1 106 GLU 3.860 0.640 6 1 "[ .+ 1 .]"
1 107 GLU 4.703 0.287 8 0 "[ . 1 .]"
1 108 ALA 1.102 0.222 11 0 "[ . 1 .]"
1 109 ALA 0.133 0.080 12 0 "[ . 1 .]"
1 110 ASN 0.208 0.080 12 0 "[ . 1 .]"
1 111 GLU 1.100 0.318 4 0 "[ . 1 .]"
1 112 GLU 2.177 0.655 15 1 "[ . 1 +]"
1 113 LYS 9.702 0.945 5 7 "[ *-*+* 1 * *]"
1 114 SER 0.967 0.223 9 0 "[ . 1 .]"
1 115 ALA 2.222 0.378 5 0 "[ . 1 .]"
1 116 ALA 1.408 0.206 1 0 "[ . 1 .]"
1 117 THR 0.192 0.048 1 0 "[ . 1 .]"
1 118 ALA 1.286 0.196 8 0 "[ . 1 .]"
1 119 GLU 0.161 0.083 7 0 "[ . 1 .]"
1 120 LYS 17.010 1.265 11 13 "[*****-* **+ ***]"
1 121 ASN 7.166 0.975 11 7 "[ -* **1+ **.]"
1 123 THR 0.320 0.096 3 0 "[ . 1 .]"
1 124 ILE 13.051 0.655 14 15 [******-******+*]
1 125 PRO 14.007 0.655 14 15 [******-******+*]
1 126 GLY 0.411 0.180 14 0 "[ . 1 .]"
1 127 PHE 1.612 0.490 11 0 "[ . 1 .]"
1 128 GLN 0.000 0.000 . 0 "[ . 1 .]"
1 129 GLN 0.060 0.060 5 0 "[ . 1 .]"
1 130 ALA 0.561 0.086 12 0 "[ . 1 .]"
1 131 SER 4.411 0.505 4 1 "[ +. 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 45 GLY H 1 46 GLY H 3.339 2.170 4.007 2.483 2.286 2.895 . 0 0 "[ . 1 .]" 1
2 1 50 ILE MG 1 54 LYS H 3.515 2.285 4.218 3.575 3.357 3.781 . 0 0 "[ . 1 .]" 1
3 1 45 GLY H 1 47 LYS H 2.991 . 3.589 2.912 2.749 3.062 . 0 0 "[ . 1 .]" 1
4 1 67 ARG H 1 69 ASP H 3.148 2.046 3.778 2.537 2.417 2.634 . 0 0 "[ . 1 .]" 1
5 1 60 VAL H 1 61 GLN H 3.275 2.129 3.930 2.616 2.442 2.765 . 0 0 "[ . 1 .]" 1
6 1 54 LYS H 1 55 ARG H 3.255 2.116 3.906 2.759 2.529 2.961 . 0 0 "[ . 1 .]" 1
7 1 94 LYS H 1 96 LEU H 3.942 2.562 4.730 3.882 3.751 4.006 . 0 0 "[ . 1 .]" 1
8 1 60 VAL HB 1 61 GLN H 2.610 . 3.132 2.729 2.435 3.301 0.169 10 0 "[ . 1 .]" 1
9 1 7 GLU H 1 8 ASP H 3.383 2.199 4.060 2.598 2.458 2.856 . 0 0 "[ . 1 .]" 1
10 1 31 ASP H 1 35 ARG H 4.455 2.896 5.346 4.667 4.546 4.799 . 0 0 "[ . 1 .]" 1
11 1 95 ARG H 1 96 LEU H 3.276 2.129 3.931 2.549 2.342 2.702 . 0 0 "[ . 1 .]" 1
12 1 11 ARG H 1 14 GLU H 3.912 2.543 4.694 3.958 3.828 4.214 . 0 0 "[ . 1 .]" 1
13 1 93 VAL H 1 97 ILE H 2.844 . 3.413 2.607 2.321 2.686 . 0 0 "[ . 1 .]" 1
14 1 89 TRP QB 1 93 VAL H 3.432 2.231 4.118 2.780 2.711 2.815 . 0 0 "[ . 1 .]" 1
15 1 71 ALA H 1 73 ASP H 3.749 2.437 4.499 3.565 3.415 3.666 . 0 0 "[ . 1 .]" 1
16 1 24 THR HA 1 27 GLN H 3.773 2.452 4.528 2.556 2.284 2.894 0.168 11 0 "[ . 1 .]" 1
17 1 17 LEU H 1 19 ASP H 2.982 . 3.578 2.664 2.533 2.763 . 0 0 "[ . 1 .]" 1
18 1 36 LEU H 1 39 LEU H 4.436 2.884 5.323 4.648 4.446 4.751 . 0 0 "[ . 1 .]" 1
19 1 34 ARG H 1 36 LEU H 3.235 2.103 3.882 2.611 2.444 2.834 . 0 0 "[ . 1 .]" 1
20 1 25 ARG H 1 29 CYS H 5.330 3.465 6.396 5.002 4.380 5.360 . 0 0 "[ . 1 .]" 1
21 1 53 LYS QB 1 54 LYS H 3.228 2.098 3.874 2.516 2.323 2.814 . 0 0 "[ . 1 .]" 1
22 1 50 ILE MD 1 51 PRO HD3 4.315 2.805 5.178 3.769 3.407 3.988 . 0 0 "[ . 1 .]" 1
23 1 124 ILE HB 1 125 PRO QD 4.506 2.929 5.407 3.222 3.149 3.280 . 0 0 "[ . 1 .]" 1
24 1 50 ILE HA 1 50 ILE MD 3.845 2.499 4.614 3.439 3.247 3.535 . 0 0 "[ . 1 .]" 1
25 1 48 LEU HB2 1 49 SER HA 5.456 3.547 6.500 4.635 4.495 4.774 . 0 0 "[ . 1 .]" 1
26 1 50 ILE HA 1 50 ILE HG12 4.195 2.727 5.034 2.667 2.582 2.966 0.145 5 0 "[ . 1 .]" 1
27 1 61 GLN HA 1 64 SER QB 3.019 . 3.623 2.262 2.176 2.375 . 0 0 "[ . 1 .]" 1
28 1 56 MET HB2 1 56 MET ME 3.541 2.302 4.249 2.222 2.122 2.261 0.180 6 0 "[ . 1 .]" 1
29 1 50 ILE HA 1 50 ILE MD 3.578 2.326 4.294 2.389 2.331 2.430 . 0 0 "[ . 1 .]" 1
30 1 59 LEU QD 1 74 ILE HB 3.992 2.595 4.790 2.545 2.361 3.201 0.234 14 0 "[ . 1 .]" 1
31 1 79 MET QB 1 80 VAL HA 3.549 2.307 4.259 2.414 2.362 2.462 . 0 0 "[ . 1 .]" 1
32 1 75 HIS HA 1 83 VAL MG1 4.875 3.169 5.850 4.346 3.817 4.733 . 0 0 "[ . 1 .]" 1
33 1 49 SER QB 1 52 VAL QG 4.544 2.954 5.453 3.284 2.460 3.947 0.494 13 0 "[ . 1 .]" 1
34 1 56 MET HA 1 59 LEU QD 4.224 2.746 5.069 3.263 3.098 3.390 . 0 0 "[ . 1 .]" 1
35 1 50 ILE HA 1 50 ILE HG13 3.781 2.458 4.537 2.603 2.422 2.780 0.036 10 0 "[ . 1 .]" 1
36 1 52 VAL QG 1 56 MET QG 4.269 2.775 5.123 3.650 3.032 4.128 . 0 0 "[ . 1 .]" 1
37 1 17 LEU HA 1 39 LEU MD1 4.612 2.998 5.534 3.473 3.086 3.833 . 0 0 "[ . 1 .]" 1
38 1 35 ARG HA 1 89 TRP QB 4.858 3.158 5.830 3.853 3.161 4.412 . 0 0 "[ . 1 .]" 1
39 1 3 GLU HB2 1 103 LEU HB3 5.970 3.880 6.500 5.642 3.575 6.562 0.305 15 0 "[ . 1 .]" 1
40 1 80 VAL HA 1 83 VAL MG1 3.725 2.421 4.470 3.139 3.076 3.176 . 0 0 "[ . 1 .]" 1
41 1 12 PRO HB2 1 32 ILE HG13 4.006 2.604 4.807 2.839 2.378 3.552 0.226 5 0 "[ . 1 .]" 1
42 1 12 PRO HB2 1 60 VAL HA 4.122 2.679 4.946 2.833 2.610 3.306 0.069 10 0 "[ . 1 .]" 1
43 1 56 MET ME 1 59 LEU QD 3.278 2.131 3.934 1.831 1.750 1.900 0.381 4 0 "[ . 1 .]" 1
44 1 52 VAL QG 1 56 MET HB2 4.115 2.675 4.938 3.257 2.968 4.324 . 0 0 "[ . 1 .]" 1
45 1 13 LEU H 1 13 LEU QD 3.188 2.072 3.826 3.531 3.472 3.594 . 0 0 "[ . 1 .]" 1
46 1 103 LEU H 1 103 LEU QD 3.481 2.263 4.177 3.077 2.218 3.740 0.045 8 0 "[ . 1 .]" 1
47 1 6 MET HA 1 6 MET QG 3.662 2.613 4.394 2.779 2.417 3.489 0.196 15 0 "[ . 1 .]" 1
48 1 103 LEU HA 1 103 LEU QD 3.759 2.443 4.386 2.599 2.112 3.435 0.331 10 0 "[ . 1 .]" 1
49 1 5 VAL HA 1 5 VAL QG 3.408 2.400 4.090 2.225 2.151 2.313 0.249 15 0 "[ . 1 .]" 1
50 1 51 PRO QD 1 52 VAL QG 5.221 3.394 6.265 4.183 3.847 4.518 . 0 0 "[ . 1 .]" 1
51 1 50 ILE H 1 50 ILE HB 3.107 2.020 3.728 2.605 2.533 2.728 . 0 0 "[ . 1 .]" 1
52 1 7 GLU H 1 9 VAL MG2 5.010 3.256 6.012 5.202 4.876 6.818 0.806 12 1 "[ . 1 + .]" 1
53 1 15 GLN HA 1 16 ALA H 3.464 2.252 4.157 3.492 3.421 3.560 . 0 0 "[ . 1 .]" 1
54 1 88 GLN H 1 88 GLN QB 3.828 2.488 4.415 2.365 2.264 2.462 0.224 9 0 "[ . 1 .]" 1
55 1 100 LYS H 1 103 LEU H 4.919 3.197 5.903 4.850 4.516 5.305 . 0 0 "[ . 1 .]" 1
56 1 39 LEU H 1 39 LEU MD1 3.714 2.414 4.457 4.063 3.984 4.176 . 0 0 "[ . 1 .]" 1
57 1 71 ALA HA 1 74 ILE H 4.262 2.770 5.114 3.908 3.562 4.486 . 0 0 "[ . 1 .]" 1
58 1 61 GLN HA 1 62 GLU H 3.874 2.518 4.649 3.506 3.463 3.547 . 0 0 "[ . 1 .]" 1
59 1 42 GLN H 1 42 GLN HE21 4.775 3.104 5.730 4.411 2.982 5.794 0.122 2 0 "[ . 1 .]" 1
60 1 107 GLU HG3 1 108 ALA H 4.188 2.722 5.026 3.837 2.593 5.248 0.222 11 0 "[ . 1 .]" 1
61 1 106 GLU H 1 106 GLU HB2 3.094 2.011 3.713 2.596 2.350 3.611 . 0 0 "[ . 1 .]" 1
62 1 30 ASP H 1 33 SER H 4.205 2.733 5.046 4.682 4.539 4.857 . 0 0 "[ . 1 .]" 1
63 1 68 TRP H 1 69 ASP HB2 4.989 3.243 5.987 4.876 4.590 6.045 0.058 7 0 "[ . 1 .]" 1
64 1 85 GLU H 1 86 VAL MG1 3.618 2.352 4.342 4.161 3.964 4.418 0.076 11 0 "[ . 1 .]" 1
65 1 25 ARG H 1 28 VAL H 4.819 3.132 5.783 4.768 3.864 5.762 . 0 0 "[ . 1 .]" 1
66 1 81 ASP H 1 81 ASP HA 4.160 2.704 4.992 2.899 2.841 2.948 . 0 0 "[ . 1 .]" 1
67 1 52 VAL H 1 53 LYS QG 4.989 3.243 5.987 4.394 4.030 5.557 . 0 0 "[ . 1 .]" 1
68 1 37 ALA MB 1 39 LEU H 4.081 2.653 4.897 4.553 4.391 4.637 . 0 0 "[ . 1 .]" 1
69 1 71 ALA H 1 73 ASP HB2 4.624 3.006 5.549 5.592 5.227 5.957 0.408 14 0 "[ . 1 .]" 1
70 1 43 TRP H 1 44 ALA MB 3.972 2.582 4.766 4.257 3.997 4.403 . 0 0 "[ . 1 .]" 1
71 1 72 ASP H 1 74 ILE H 4.011 2.607 4.813 4.417 4.120 4.796 . 0 0 "[ . 1 .]" 1
72 1 34 ARG QD 1 35 ARG H 4.059 2.638 4.871 4.150 3.341 4.707 . 0 0 "[ . 1 .]" 1
73 1 103 LEU H 1 104 PHE HB2 4.508 2.930 5.410 4.439 4.360 4.553 . 0 0 "[ . 1 .]" 1
74 1 90 MET H 1 90 MET HB2 3.386 2.201 4.063 3.498 2.660 3.647 . 0 0 "[ . 1 .]" 1
75 1 34 ARG H 1 34 ARG HB3 3.018 . 3.622 2.553 2.461 2.707 . 0 0 "[ . 1 .]" 1
76 1 96 LEU H 1 97 ILE MD 3.463 2.251 4.156 4.101 3.839 4.354 0.198 14 0 "[ . 1 .]" 1
77 1 95 ARG H 1 98 ALA MB 4.181 2.718 5.017 4.555 4.264 5.026 0.009 13 0 "[ . 1 .]" 1
78 1 124 ILE H 1 124 ILE HA 4.394 2.856 5.273 2.909 2.872 2.939 . 0 0 "[ . 1 .]" 1
79 1 45 GLY H 1 45 GLY HA2 3.465 2.252 4.158 2.911 2.887 2.924 . 0 0 "[ . 1 .]" 1
80 1 96 LEU H 1 99 GLU H 4.363 2.836 5.236 4.804 4.624 4.990 . 0 0 "[ . 1 .]" 1
81 1 115 ALA H 1 115 ALA HA 4.178 2.716 5.014 2.872 2.338 2.948 0.378 5 0 "[ . 1 .]" 1
82 1 103 LEU H 1 103 LEU HB3 2.850 . 3.420 3.017 2.350 3.541 0.121 8 0 "[ . 1 .]" 1
83 1 24 THR HB 1 25 ARG H 4.645 3.019 5.574 3.778 2.823 4.623 0.196 14 0 "[ . 1 .]" 1
84 1 5 VAL H 1 5 VAL HA 2.773 . 3.328 2.905 2.876 2.929 . 0 0 "[ . 1 .]" 1
85 1 68 TRP H 1 68 TRP HE1 4.751 3.088 5.701 4.548 4.305 4.713 . 0 0 "[ . 1 .]" 1
86 1 42 GLN H 1 44 ALA H 4.477 2.910 5.372 4.011 3.834 4.214 . 0 0 "[ . 1 .]" 1
87 1 69 ASP H 1 70 ALA H 3.433 2.232 4.120 2.541 2.420 2.640 . 0 0 "[ . 1 .]" 1
88 1 61 GLN HA 1 63 LEU H 4.150 2.697 4.980 4.224 4.015 4.581 . 0 0 "[ . 1 .]" 1
89 1 56 MET H 1 58 LEU H 4.124 2.681 4.949 3.991 3.840 4.220 . 0 0 "[ . 1 .]" 1
90 1 19 ASP H 1 20 CYS H 3.316 2.156 3.979 2.460 2.326 2.572 . 0 0 "[ . 1 .]" 1
91 1 49 SER H 1 50 ILE H 5.099 3.314 6.119 4.595 4.465 4.657 . 0 0 "[ . 1 .]" 1
92 1 50 ILE HA 1 52 VAL H 4.077 2.650 4.892 4.390 3.966 4.699 . 0 0 "[ . 1 .]" 1
93 1 32 ILE HG13 1 33 SER H 4.595 2.987 5.514 4.310 4.139 4.788 . 0 0 "[ . 1 .]" 1
94 1 79 MET HA 1 80 VAL H 3.754 2.440 4.505 3.493 3.418 3.531 . 0 0 "[ . 1 .]" 1
95 1 61 GLN H 1 63 LEU H 3.285 2.135 3.942 3.746 3.572 3.888 . 0 0 "[ . 1 .]" 1
96 1 100 LYS H 1 100 LYS HB3 3.035 . 3.642 3.425 2.595 3.614 . 0 0 "[ . 1 .]" 1
97 1 47 LYS H 1 47 LYS HB2 3.024 . 3.629 3.218 2.435 3.569 . 0 0 "[ . 1 .]" 1
98 1 57 ALA MB 1 61 GLN HE21 4.597 2.988 5.516 3.814 2.980 4.646 0.008 7 0 "[ . 1 .]" 1
99 1 48 LEU H 1 48 LEU HB3 3.425 2.226 4.110 3.575 3.449 3.672 . 0 0 "[ . 1 .]" 1
100 1 6 MET H 1 8 ASP H 4.278 2.781 5.134 4.227 3.895 4.664 . 0 0 "[ . 1 .]" 1
101 1 55 ARG H 1 55 ARG HA 3.516 2.285 4.219 2.807 2.763 2.880 . 0 0 "[ . 1 .]" 1
102 1 52 VAL QG 1 55 ARG H 4.835 3.143 5.802 4.539 4.346 4.753 . 0 0 "[ . 1 .]" 1
103 1 52 VAL QG 1 53 LYS H . 3.830 3.881 3.140 2.458 3.305 1.372 10 15 [*****-***+*****] 1
104 1 15 GLN H 1 15 GLN HB2 2.695 . 3.234 2.591 2.462 2.723 . 0 0 "[ . 1 .]" 1
105 1 68 TRP H 1 68 TRP HA 2.844 . 3.413 2.840 2.790 2.872 . 0 0 "[ . 1 .]" 1
106 1 93 VAL H 1 96 LEU H 4.287 2.786 5.144 4.776 4.530 5.066 . 0 0 "[ . 1 .]" 1
107 1 35 ARG H 1 35 ARG QB 2.904 2.349 3.485 2.353 2.171 2.701 0.178 7 0 "[ . 1 .]" 1
108 1 86 VAL MG1 1 89 TRP HE1 3.682 2.393 4.418 3.971 3.261 4.489 0.071 4 0 "[ . 1 .]" 1
109 1 21 ARG H 1 21 ARG HA 3.531 2.295 4.237 2.798 2.768 2.847 . 0 0 "[ . 1 .]" 1
110 1 78 LEU H 1 78 LEU HA 3.703 2.407 4.444 2.868 2.845 2.882 . 0 0 "[ . 1 .]" 1
111 1 14 GLU H 1 14 GLU HB2 2.971 . 3.565 3.319 2.411 3.624 0.059 6 0 "[ . 1 .]" 1
112 1 96 LEU H 1 96 LEU HA 3.513 2.283 4.216 2.800 2.750 2.900 . 0 0 "[ . 1 .]" 1
113 1 78 LEU H 1 78 LEU QD 3.313 2.154 3.976 2.907 2.320 3.728 . 0 0 "[ . 1 .]" 1
114 1 44 ALA MB 1 45 GLY H 3.373 2.193 4.048 2.214 2.179 2.371 0.014 9 0 "[ . 1 .]" 1
115 1 14 GLU H 1 14 GLU HA 3.508 2.280 4.210 2.809 2.774 2.843 . 0 0 "[ . 1 .]" 1
116 1 7 GLU QB 1 9 VAL H 4.297 2.793 5.156 4.573 4.402 4.795 . 0 0 "[ . 1 .]" 1
117 1 40 GLN H 1 43 TRP H 4.265 2.772 5.118 4.823 4.726 4.945 . 0 0 "[ . 1 .]" 1
118 1 7 GLU HG3 1 8 ASP H 4.165 2.707 4.998 4.637 3.904 5.127 0.129 11 0 "[ . 1 .]" 1
119 1 36 LEU H 1 36 LEU HB3 2.859 . 3.431 2.906 2.416 3.598 0.167 3 0 "[ . 1 .]" 1
120 1 3 GLU HB3 1 4 ALA H 4.274 2.778 5.129 4.152 2.672 4.643 0.106 3 0 "[ . 1 .]" 1
121 1 103 LEU H 1 104 PHE H 3.190 2.073 3.828 2.398 2.337 2.513 . 0 0 "[ . 1 .]" 1
122 1 60 VAL QG 1 63 LEU H 4.532 2.946 5.438 4.275 4.103 4.474 . 0 0 "[ . 1 .]" 1
123 1 129 GLN HA 1 130 ALA H 5.091 3.309 6.109 3.505 3.249 3.582 0.060 5 0 "[ . 1 .]" 1
124 1 77 SER H 1 80 VAL QG 4.219 2.742 5.063 4.462 4.294 4.627 . 0 0 "[ . 1 .]" 1
125 1 99 GLU H 1 101 ARG H 4.636 3.014 5.563 4.155 3.836 4.522 . 0 0 "[ . 1 .]" 1
126 1 41 GLU H 1 41 GLU HG2 3.159 2.054 3.791 2.576 1.953 3.612 0.101 3 0 "[ . 1 .]" 1
127 1 99 GLU H 1 100 LYS H 3.278 2.131 3.934 2.461 2.238 2.570 . 0 0 "[ . 1 .]" 1
128 1 46 GLY H 1 47 LYS H 3.211 2.087 3.853 2.368 2.072 2.558 0.015 5 0 "[ . 1 .]" 1
129 1 43 TRP HA 1 44 ALA H 3.578 2.326 4.294 3.516 3.451 3.551 . 0 0 "[ . 1 .]" 1
130 1 69 ASP H 1 69 ASP HA 4.093 2.660 4.912 2.842 2.814 2.866 . 0 0 "[ . 1 .]" 1
131 1 61 GLN HE21 1 62 GLU H 5.004 3.253 6.005 5.436 4.877 6.030 0.025 4 0 "[ . 1 .]" 1
132 1 60 VAL H 1 60 VAL HA 3.422 2.224 4.106 2.801 2.777 2.850 . 0 0 "[ . 1 .]" 1
133 1 6 MET HA 1 43 TRP HE1 4.150 2.698 4.980 3.715 3.088 4.444 . 0 0 "[ . 1 .]" 1
134 1 11 ARG H 1 13 LEU H 4.158 2.703 4.990 3.933 3.715 4.280 . 0 0 "[ . 1 .]" 1
135 1 95 ARG H 1 96 LEU H 3.375 2.194 4.050 2.571 2.353 2.735 . 0 0 "[ . 1 .]" 1
136 1 72 ASP H 1 75 HIS H 4.865 3.162 5.838 5.333 5.082 5.803 . 0 0 "[ . 1 .]" 1
137 1 50 ILE H 1 53 LYS H 5.140 3.341 6.168 5.132 4.943 5.262 . 0 0 "[ . 1 .]" 1
138 1 59 LEU H 1 59 LEU HA 3.531 2.295 4.237 2.810 2.788 2.866 . 0 0 "[ . 1 .]" 1
139 1 29 CYS H 1 32 ILE H 5.383 3.499 6.460 4.887 4.629 5.363 . 0 0 "[ . 1 .]" 1
140 1 39 LEU H 1 40 GLN H 3.273 2.127 3.928 2.720 2.569 2.808 . 0 0 "[ . 1 .]" 1
141 1 32 ILE MG 1 36 LEU H 3.727 2.423 4.472 3.972 3.687 4.249 . 0 0 "[ . 1 .]" 1
142 1 68 TRP HA 1 70 ALA H 3.716 2.415 4.459 4.196 3.945 4.490 0.031 9 0 "[ . 1 .]" 1
143 1 7 GLU H 1 7 GLU HG3 3.506 2.279 4.207 3.779 2.244 4.489 0.282 10 0 "[ . 1 .]" 1
144 1 61 GLN HE21 1 61 GLN HG3 4.003 2.602 4.804 3.121 2.226 3.538 0.376 5 0 "[ . 1 .]" 1
145 1 15 GLN QG 1 16 ALA H 3.773 2.452 4.528 3.831 3.408 4.063 . 0 0 "[ . 1 .]" 1
146 1 62 GLU H 1 63 LEU HA 4.065 2.642 4.878 4.889 4.793 4.981 0.103 5 0 "[ . 1 .]" 1
147 1 100 LYS H 1 103 LEU QD 4.683 3.044 5.620 4.336 3.757 5.108 . 0 0 "[ . 1 .]" 1
148 1 84 THR HG1 1 85 GLU H 3.525 2.291 4.230 4.123 3.638 4.288 0.058 13 0 "[ . 1 .]" 1
149 1 48 LEU H 1 48 LEU MD1 3.598 2.339 4.318 3.652 3.502 3.819 . 0 0 "[ . 1 .]" 1
150 1 62 GLU H 1 64 SER H 4.209 2.736 5.051 4.023 3.801 4.186 . 0 0 "[ . 1 .]" 1
151 1 90 MET H 1 93 VAL H 4.137 2.689 4.964 4.965 4.815 5.034 0.070 11 0 "[ . 1 .]" 1
152 1 32 ILE H 1 32 ILE HA 3.498 2.274 4.198 2.829 2.792 2.881 . 0 0 "[ . 1 .]" 1
153 1 37 ALA H 1 38 LEU H 3.030 . 3.636 2.670 2.502 2.819 . 0 0 "[ . 1 .]" 1
154 1 54 LYS H 1 57 ALA H 4.569 2.970 5.483 4.692 4.522 4.853 . 0 0 "[ . 1 .]" 1
155 1 62 GLU H 1 65 SER H 5.112 3.323 6.134 5.320 4.920 5.504 . 0 0 "[ . 1 .]" 1
156 1 18 GLU H 1 18 GLU HB3 2.671 . 3.205 3.316 2.597 3.617 0.412 1 0 "[ . 1 .]" 1
157 1 94 LYS H 1 95 ARG H 3.404 2.213 4.085 2.534 2.389 2.667 . 0 0 "[ . 1 .]" 1
158 1 40 GLN HA 1 43 TRP H 3.917 2.546 4.700 3.754 3.606 3.951 . 0 0 "[ . 1 .]" 1
159 1 35 ARG H 1 38 LEU H 4.120 2.678 4.944 4.862 4.684 5.012 0.068 7 0 "[ . 1 .]" 1
160 1 7 GLU HA 1 10 LEU H 3.814 2.479 4.577 3.249 3.040 3.589 . 0 0 "[ . 1 .]" 1
161 1 124 ILE H 1 124 ILE HB 4.696 3.052 5.635 3.192 2.854 3.558 0.198 12 0 "[ . 1 .]" 1
162 1 55 ARG H 1 56 MET H 3.163 2.056 3.796 2.677 2.404 2.836 . 0 0 "[ . 1 .]" 1
163 1 101 ARG HB3 1 102 SER H 3.238 2.105 3.886 3.890 3.746 4.025 0.139 9 0 "[ . 1 .]" 1
164 1 48 LEU HB2 1 49 SER H 4.103 2.667 4.924 3.901 3.429 4.251 . 0 0 "[ . 1 .]" 1
165 1 42 GLN H 1 43 TRP H 3.221 2.094 3.865 2.494 2.289 2.630 . 0 0 "[ . 1 .]" 1
166 1 7 GLU H 1 7 GLU QB 2.885 . 3.462 2.289 2.094 2.581 . 0 0 "[ . 1 .]" 1
167 1 107 GLU H 1 107 GLU HB2 2.806 . 3.367 3.234 2.408 3.654 0.287 8 0 "[ . 1 .]" 1
168 1 55 ARG H 1 55 ARG HB3 2.871 . 3.445 3.276 2.607 3.606 0.161 7 0 "[ . 1 .]" 1
169 1 72 ASP H 1 73 ASP H 3.176 2.064 3.811 2.396 2.330 2.504 . 0 0 "[ . 1 .]" 1
170 1 57 ALA MB 1 58 LEU H 3.045 . 3.654 2.804 2.665 2.897 . 0 0 "[ . 1 .]" 1
171 1 74 ILE H 1 74 ILE MD 3.364 2.187 4.037 3.123 2.002 3.547 0.185 4 0 "[ . 1 .]" 1
172 1 87 SER H 1 89 TRP H 4.809 3.126 5.771 4.945 4.520 5.216 . 0 0 "[ . 1 .]" 1
173 1 21 ARG H 1 21 ARG QB 2.812 . 3.374 2.230 2.151 2.270 . 0 0 "[ . 1 .]" 1
174 1 98 ALA H 1 99 GLU H 3.360 2.184 4.032 2.681 2.496 2.750 . 0 0 "[ . 1 .]" 1
175 1 62 GLU H 1 63 LEU H 3.263 2.121 3.916 2.269 2.195 2.364 . 0 0 "[ . 1 .]" 1
176 1 88 GLN H 1 90 MET H 4.688 3.047 5.626 3.510 3.153 3.806 . 0 0 "[ . 1 .]" 1
177 1 69 ASP H 1 70 ALA MB 3.852 2.504 4.622 4.262 4.123 4.375 . 0 0 "[ . 1 .]" 1
178 1 99 GLU H 1 99 GLU HB3 3.329 2.164 3.995 3.403 2.459 3.685 . 0 0 "[ . 1 .]" 1
179 1 50 ILE H 1 50 ILE MD 3.372 2.192 4.046 3.376 2.858 3.540 . 0 0 "[ . 1 .]" 1
180 1 65 SER QB 1 66 HIS H 3.841 2.497 4.609 2.369 1.870 2.976 0.627 11 1 "[ . 1+ .]" 1
181 1 46 GLY H 1 48 LEU H 3.948 2.566 4.738 4.610 4.335 4.756 0.018 13 0 "[ . 1 .]" 1
182 1 58 LEU H 1 60 VAL H 4.333 2.816 5.200 3.947 3.820 4.077 . 0 0 "[ . 1 .]" 1
183 1 20 CYS H 1 103 LEU QD 4.362 2.835 5.234 4.600 4.079 5.089 . 0 0 "[ . 1 .]" 1
184 1 96 LEU H 1 96 LEU HB3 3.095 2.012 3.714 2.734 2.438 3.583 . 0 0 "[ . 1 .]" 1
185 1 18 GLU H 1 20 CYS H 3.843 2.498 4.612 4.393 3.987 4.645 0.033 4 0 "[ . 1 .]" 1
186 1 24 THR H 1 24 THR HA 3.676 2.389 4.411 2.890 2.780 2.933 . 0 0 "[ . 1 .]" 1
187 1 102 SER H 1 104 PHE H 3.650 2.372 4.380 4.110 3.911 4.327 . 0 0 "[ . 1 .]" 1
188 1 6 MET HA 1 7 GLU H 3.510 2.281 4.212 3.470 3.345 3.553 . 0 0 "[ . 1 .]" 1
189 1 9 VAL H 1 9 VAL MG2 3.618 2.352 4.342 2.453 2.315 3.753 0.037 1 0 "[ . 1 .]" 1
190 1 14 GLU H 1 16 ALA H 4.057 2.637 4.868 4.153 3.962 4.536 . 0 0 "[ . 1 .]" 1
191 1 54 LYS HB2 1 55 ARG H 2.884 . 3.461 2.913 2.034 3.529 0.068 3 0 "[ . 1 .]" 1
192 1 70 ALA MB 1 73 ASP H 3.904 2.538 4.685 4.280 4.149 4.411 . 0 0 "[ . 1 .]" 1
193 1 70 ALA H 1 70 ALA MB 2.873 . 3.448 2.261 2.235 2.285 . 0 0 "[ . 1 .]" 1
194 1 106 GLU H 1 106 GLU HB3 3.343 2.173 4.012 3.329 2.367 3.690 . 0 0 "[ . 1 .]" 1
195 1 32 ILE H 1 34 ARG H 4.102 2.666 4.922 4.172 3.864 4.339 . 0 0 "[ . 1 .]" 1
196 1 49 SER H 1 52 VAL H 4.761 3.095 5.713 4.454 3.806 4.807 . 0 0 "[ . 1 .]" 1
197 1 47 LYS H 1 48 LEU HG 4.552 2.959 5.462 4.593 4.079 5.117 . 0 0 "[ . 1 .]" 1
198 1 42 GLN HB2 1 42 GLN HE21 3.742 2.432 4.490 3.588 1.724 4.556 0.708 14 3 "[ * . - +.]" 1
199 1 76 ARG HA 1 80 VAL H 4.530 2.945 5.436 4.538 4.086 4.957 . 0 0 "[ . 1 .]" 1
200 1 40 GLN H 1 42 GLN H 4.161 2.704 4.993 4.141 3.918 4.460 . 0 0 "[ . 1 .]" 1
201 1 10 LEU QD 1 14 GLU H 5.154 3.350 6.185 4.916 4.492 5.474 . 0 0 "[ . 1 .]" 1
202 1 85 GLU HA 1 86 VAL H 4.915 3.195 5.898 3.549 3.449 3.605 . 0 0 "[ . 1 .]" 1
203 1 57 ALA H 1 59 LEU H 4.223 2.745 5.068 4.120 3.901 4.324 . 0 0 "[ . 1 .]" 1
204 1 85 GLU H 1 86 VAL H 3.056 . 3.667 2.323 1.925 2.737 0.061 4 0 "[ . 1 .]" 1
205 1 114 SER H 1 115 ALA HA 4.023 2.615 4.828 4.657 3.995 4.981 0.153 15 0 "[ . 1 .]" 1
206 1 17 LEU H 1 17 LEU HB3 3.082 2.003 3.698 3.162 2.050 3.613 . 0 0 "[ . 1 .]" 1
207 1 22 GLY H 1 22 GLY HA2 3.831 2.490 4.597 2.729 2.306 2.833 0.184 9 0 "[ . 1 .]" 1
208 1 24 THR HG1 1 29 CYS H 3.410 2.217 4.092 3.611 2.905 4.171 0.079 12 0 "[ . 1 .]" 1
209 1 43 TRP HD1 1 44 ALA H 4.400 2.860 5.280 3.713 3.339 4.030 . 0 0 "[ . 1 .]" 1
210 1 88 GLN H 1 88 GLN HG2 3.872 2.517 4.646 3.926 2.526 4.698 0.052 5 0 "[ . 1 .]" 1
211 1 86 VAL H 1 86 VAL HB 4.067 2.644 4.880 3.758 3.649 3.821 . 0 0 "[ . 1 .]" 1
212 1 22 GLY H 1 24 THR H 5.027 3.268 6.032 5.786 5.499 6.061 0.029 7 0 "[ . 1 .]" 1
213 1 8 ASP HA 1 9 VAL H 4.124 2.681 4.949 3.455 3.405 3.485 . 0 0 "[ . 1 .]" 1
214 1 28 VAL H 1 29 CYS QB 4.793 3.115 5.752 5.246 4.823 5.430 . 0 0 "[ . 1 .]" 1
215 1 53 LYS HA 1 54 LYS H 4.036 2.624 4.843 3.516 3.480 3.563 . 0 0 "[ . 1 .]" 1
216 1 84 THR H 1 85 GLU QB 5.357 3.482 5.396 4.112 3.601 4.706 . 0 0 "[ . 1 .]" 1
217 1 52 VAL H 1 52 VAL QG 3.014 . 3.617 2.150 1.871 2.265 0.088 10 0 "[ . 1 .]" 1
218 1 56 MET H 1 56 MET HB3 3.043 . 3.652 2.590 2.274 2.941 . 0 0 "[ . 1 .]" 1
219 1 101 ARG H 1 102 SER H 3.274 2.128 3.929 2.675 2.574 2.786 . 0 0 "[ . 1 .]" 1
220 1 30 ASP H 1 30 ASP HA 3.686 2.396 4.423 2.810 2.771 2.858 . 0 0 "[ . 1 .]" 1
221 1 76 ARG HA 1 78 LEU H 4.819 3.132 5.783 4.477 4.270 4.698 . 0 0 "[ . 1 .]" 1
222 1 61 GLN H 1 61 GLN HE22 4.367 2.839 5.240 4.656 4.389 5.274 0.034 5 0 "[ . 1 .]" 1
223 1 67 ARG H 1 67 ARG QB 3.258 2.118 3.712 2.409 2.259 2.524 . 0 0 "[ . 1 .]" 1
224 1 84 THR H 1 86 VAL MG2 5.051 3.283 6.061 4.896 4.412 5.373 . 0 0 "[ . 1 .]" 1
225 1 86 VAL MG2 1 87 SER H 3.257 2.117 3.908 3.194 2.806 3.620 . 0 0 "[ . 1 .]" 1
226 1 84 THR H 1 85 GLU H 3.339 2.170 4.007 2.565 2.158 2.964 0.012 7 0 "[ . 1 .]" 1
227 1 65 SER H 1 65 SER QB 3.325 2.161 3.990 2.581 2.453 2.994 . 0 0 "[ . 1 .]" 1
228 1 52 VAL H 1 54 LYS H 4.335 2.818 5.202 4.119 3.956 4.448 . 0 0 "[ . 1 .]" 1
229 1 96 LEU H 1 98 ALA H 4.287 2.786 5.144 4.005 3.488 4.185 . 0 0 "[ . 1 .]" 1
230 1 45 GLY HA2 1 46 GLY H 3.810 2.477 4.572 3.507 3.427 3.595 . 0 0 "[ . 1 .]" 1
231 1 54 LYS H 1 54 LYS HD3 2.995 . 3.594 3.601 2.878 3.830 0.236 3 0 "[ . 1 .]" 1
232 1 63 LEU HG 1 65 SER H 4.394 2.856 5.273 5.175 5.060 5.335 0.062 4 0 "[ . 1 .]" 1
233 1 54 LYS HA 1 57 ALA H 3.898 2.534 4.678 3.530 3.172 3.775 . 0 0 "[ . 1 .]" 1
234 1 64 SER H 1 65 SER H 3.248 2.111 3.898 2.331 2.189 2.495 . 0 0 "[ . 1 .]" 1
235 1 47 LYS H 1 47 LYS QE 4.461 2.900 5.353 4.600 3.497 5.156 . 0 0 "[ . 1 .]" 1
236 1 66 HIS H 1 66 HIS HB3 3.864 2.512 4.637 3.574 2.910 3.694 . 0 0 "[ . 1 .]" 1
237 1 80 VAL H 1 86 VAL MG2 5.048 3.281 6.058 6.022 5.669 6.187 0.129 9 0 "[ . 1 .]" 1
238 1 84 THR H 1 84 THR HA 3.674 2.388 4.409 2.891 2.815 2.943 . 0 0 "[ . 1 .]" 1
239 1 52 VAL QG 1 56 MET H 5.157 3.352 6.188 4.059 3.886 4.759 . 0 0 "[ . 1 .]" 1
240 1 64 SER H 1 67 ARG H 4.596 2.987 5.515 5.607 5.530 5.681 0.166 6 0 "[ . 1 .]" 1
241 1 36 LEU H 1 39 LEU H 4.472 2.907 5.366 4.825 4.564 4.944 . 0 0 "[ . 1 .]" 1
242 1 30 ASP HA 1 31 ASP H 4.159 2.703 4.991 3.519 3.444 3.553 . 0 0 "[ . 1 .]" 1
243 1 20 CYS H 1 21 ARG H 2.965 . 3.558 2.504 2.251 2.728 . 0 0 "[ . 1 .]" 1
244 1 82 HIS H 1 82 HIS HA 4.411 2.867 5.293 2.927 2.894 2.950 . 0 0 "[ . 1 .]" 1
245 1 57 ALA H 1 60 VAL H 4.266 2.773 5.119 4.833 4.677 4.950 . 0 0 "[ . 1 .]" 1
246 1 46 GLY H 1 47 LYS HB2 4.553 2.960 5.464 5.203 4.294 5.540 0.076 8 0 "[ . 1 .]" 1
247 1 78 LEU HA 1 81 ASP H 4.251 2.763 5.101 3.430 3.213 3.750 . 0 0 "[ . 1 .]" 1
248 1 75 HIS H 1 75 HIS QB 3.474 2.258 3.911 2.352 2.152 2.520 0.106 10 0 "[ . 1 .]" 1
249 1 55 ARG H 1 56 MET HB2 4.470 2.906 5.364 5.007 4.531 5.365 0.001 5 0 "[ . 1 .]" 1
250 1 39 LEU H 1 43 TRP H 5.256 3.416 6.307 6.087 5.913 6.321 0.014 4 0 "[ . 1 .]" 1
251 1 3 GLU HB2 1 4 ALA H 3.978 2.586 4.774 4.272 3.814 4.614 . 0 0 "[ . 1 .]" 1
252 1 13 LEU MD1 1 17 LEU H 3.795 2.467 4.554 3.721 3.398 4.091 . 0 0 "[ . 1 .]" 1
253 1 13 LEU H 1 16 ALA H 4.831 3.140 5.797 4.896 4.606 5.220 . 0 0 "[ . 1 .]" 1
254 1 20 CYS H 1 20 CYS QB 3.082 2.003 3.698 2.412 2.298 2.530 . 0 0 "[ . 1 .]" 1
255 1 74 ILE H 1 76 ARG H 4.003 2.602 4.804 4.341 4.193 4.687 . 0 0 "[ . 1 .]" 1
256 1 82 HIS QB 1 83 VAL H 4.335 2.957 5.202 3.824 2.693 3.926 0.264 9 0 "[ . 1 .]" 1
257 1 61 GLN H 1 62 GLU H 3.047 . 3.656 2.520 2.337 2.740 . 0 0 "[ . 1 .]" 1
258 1 37 ALA MB 1 40 GLN H 3.837 2.494 4.604 4.552 4.354 4.685 0.081 10 0 "[ . 1 .]" 1
259 1 27 GLN HA 1 29 CYS H 4.477 2.910 5.372 4.378 3.824 4.997 . 0 0 "[ . 1 .]" 1
260 1 66 HIS H 1 67 ARG H 3.199 2.079 3.839 3.094 2.687 3.399 . 0 0 "[ . 1 .]" 1
261 1 36 LEU H 1 39 LEU MD1 5.281 3.433 6.337 5.620 5.343 5.983 . 0 0 "[ . 1 .]" 1
262 1 104 PHE HB2 1 105 SER H 4.001 2.601 4.801 3.139 2.691 4.161 . 0 0 "[ . 1 .]" 1
263 1 71 ALA H 1 72 ASP HB3 4.284 2.784 5.141 4.833 4.464 5.972 0.831 6 1 "[ .+ 1 .]" 1
264 1 15 GLN H 1 18 GLU H 4.797 3.118 5.756 4.768 4.531 5.052 . 0 0 "[ . 1 .]" 1
265 1 43 TRP H 1 43 TRP QB 3.169 2.060 3.785 2.203 2.156 2.241 . 0 0 "[ . 1 .]" 1
266 1 44 ALA H 1 45 GLY H 3.298 2.144 3.958 2.717 2.548 2.996 . 0 0 "[ . 1 .]" 1
267 1 20 CYS QB 1 22 GLY H 4.638 3.046 5.566 4.607 4.316 4.925 . 0 0 "[ . 1 .]" 1
268 1 76 ARG H 1 79 MET QG 4.699 3.054 5.639 4.787 4.200 5.203 . 0 0 "[ . 1 .]" 1
269 1 95 ARG HA 1 98 ALA H 4.370 2.841 5.244 3.277 3.079 3.614 . 0 0 "[ . 1 .]" 1
270 1 11 ARG H 1 11 ARG HG3 3.580 2.327 4.296 3.176 1.967 4.588 0.360 12 0 "[ . 1 .]" 1
271 1 32 ILE H 1 33 SER H 3.301 2.146 3.961 2.636 2.419 2.763 . 0 0 "[ . 1 .]" 1
272 1 54 LYS HA 1 55 ARG H 3.929 2.554 4.715 3.550 3.506 3.580 . 0 0 "[ . 1 .]" 1
273 1 71 ALA HA 1 72 ASP H 4.135 2.688 4.962 3.464 3.421 3.512 . 0 0 "[ . 1 .]" 1
274 1 42 GLN HA 1 45 GLY H 4.159 2.703 4.991 4.294 3.731 4.994 0.003 11 0 "[ . 1 .]" 1
275 1 89 TRP H 1 89 TRP HD1 3.986 2.714 4.783 4.414 4.276 4.588 . 0 0 "[ . 1 .]" 1
276 1 6 MET QB 1 7 GLU H 3.493 2.271 4.192 3.039 2.404 3.793 . 0 0 "[ . 1 .]" 1
277 1 11 ARG H 1 11 ARG HA 3.443 2.238 4.132 2.789 2.744 2.829 . 0 0 "[ . 1 .]" 1
278 1 39 LEU HA 1 41 GLU H 4.883 3.174 5.860 4.564 4.246 4.805 . 0 0 "[ . 1 .]" 1
279 1 52 VAL HA 1 55 ARG H 3.986 2.591 4.783 3.626 3.341 3.937 . 0 0 "[ . 1 .]" 1
280 1 89 TRP H 1 90 MET H 3.015 . 3.618 2.214 1.914 2.631 0.046 10 0 "[ . 1 .]" 1
281 1 13 LEU H 1 15 GLN H 4.033 2.622 4.840 3.902 3.696 4.045 . 0 0 "[ . 1 .]" 1
282 1 35 ARG QB 1 36 LEU H 4.141 2.692 4.446 2.856 2.624 3.652 0.068 15 0 "[ . 1 .]" 1
283 1 10 LEU H 1 11 ARG H 3.185 2.070 3.822 2.567 2.424 2.735 . 0 0 "[ . 1 .]" 1
284 1 48 LEU H 1 49 SER H 4.598 2.989 5.518 4.591 4.480 4.648 . 0 0 "[ . 1 .]" 1
285 1 73 ASP H 1 76 ARG H 4.387 2.851 5.264 5.217 4.835 5.470 0.206 9 0 "[ . 1 .]" 1
286 1 76 ARG H 1 76 ARG HG2 3.220 2.093 3.864 2.869 2.049 3.519 0.044 8 0 "[ . 1 .]" 1
287 1 44 ALA H 1 44 ALA HA 3.458 2.248 4.150 2.875 2.797 2.914 . 0 0 "[ . 1 .]" 1
288 1 71 ALA H 1 73 ASP H 4.102 2.666 4.922 3.946 3.708 4.119 . 0 0 "[ . 1 .]" 1
289 1 76 ARG H 1 76 ARG HD2 4.172 2.712 5.006 4.322 3.715 4.911 . 0 0 "[ . 1 .]" 1
290 1 53 LYS H 1 53 LYS QG 3.246 2.282 3.895 2.369 2.098 3.519 0.184 4 0 "[ . 1 .]" 1
291 1 121 ASN H 1 121 ASN HB3 5.693 3.700 6.500 3.222 2.725 3.702 0.975 11 7 "[ -* **1+ **.]" 1
292 1 36 LEU H 1 37 ALA MB 4.145 2.694 4.974 4.316 4.155 4.490 . 0 0 "[ . 1 .]" 1
293 1 101 ARG H 1 101 ARG HB2 3.210 2.087 3.852 2.843 2.490 3.617 . 0 0 "[ . 1 .]" 1
294 1 44 ALA H 1 47 LYS H 5.596 3.638 6.500 4.801 4.070 6.172 . 0 0 "[ . 1 .]" 1
295 1 76 ARG H 1 76 ARG HG3 3.687 2.397 4.424 2.796 1.946 3.876 0.451 13 0 "[ . 1 .]" 1
296 1 8 ASP H 1 10 LEU H 4.172 2.712 5.006 3.869 3.724 4.114 . 0 0 "[ . 1 .]" 1
297 1 21 ARG H 1 22 GLY H 4.522 2.939 5.426 2.793 2.711 2.872 0.228 6 0 "[ . 1 .]" 1
298 1 65 SER QB 1 67 ARG H 3.704 2.408 4.445 2.870 2.434 3.197 . 0 0 "[ . 1 .]" 1
299 1 38 LEU H 1 39 LEU H 3.075 . 3.690 2.631 2.512 2.724 . 0 0 "[ . 1 .]" 1
300 1 56 MET H 1 56 MET HB2 3.062 . 3.674 2.517 2.169 2.729 . 0 0 "[ . 1 .]" 1
301 1 30 ASP H 1 30 ASP HB2 2.901 . 3.481 2.518 2.239 2.659 . 0 0 "[ . 1 .]" 1
302 1 22 GLY H 1 23 HIS H 4.300 2.795 5.160 3.849 2.747 4.634 0.048 13 0 "[ . 1 .]" 1
303 1 79 MET H 1 80 VAL H 3.189 2.073 3.827 2.682 2.590 2.752 . 0 0 "[ . 1 .]" 1
304 1 30 ASP H 1 32 ILE H 4.479 2.911 5.375 4.272 3.943 4.718 . 0 0 "[ . 1 .]" 1
305 1 89 TRP HE1 1 90 MET H 5.610 3.647 6.500 5.248 4.751 5.655 . 0 0 "[ . 1 .]" 1
306 1 73 ASP HA 1 76 ARG H 4.058 2.638 4.870 3.505 3.361 3.667 . 0 0 "[ . 1 .]" 1
307 1 96 LEU H 1 96 LEU HB2 2.910 . 3.492 2.387 2.241 2.555 . 0 0 "[ . 1 .]" 1
308 1 88 GLN QB 1 89 TRP H 3.958 2.573 4.416 2.644 2.286 3.270 0.287 14 0 "[ . 1 .]" 1
309 1 29 CYS H 1 33 SER H 5.214 3.389 6.257 5.822 5.516 6.093 . 0 0 "[ . 1 .]" 1
310 1 78 LEU H 1 78 LEU QB 3.426 2.227 3.857 2.166 2.106 2.210 0.121 1 0 "[ . 1 .]" 1
311 1 85 GLU H 1 85 GLU HA 4.195 2.727 5.034 2.898 2.802 2.945 . 0 0 "[ . 1 .]" 1
312 1 7 GLU H 1 7 GLU HA 3.366 2.188 4.039 2.803 2.734 2.841 . 0 0 "[ . 1 .]" 1
313 1 104 PHE H 1 105 SER H 3.045 . 3.654 2.611 2.462 2.805 . 0 0 "[ . 1 .]" 1
314 1 25 ARG H 1 25 ARG HB3 3.426 2.227 4.111 3.291 2.281 3.675 . 0 0 "[ . 1 .]" 1
315 1 17 LEU H 1 17 LEU HA 3.400 2.210 4.080 2.831 2.786 2.860 . 0 0 "[ . 1 .]" 1
316 1 9 VAL H 1 10 LEU H 2.773 . 3.328 2.351 2.225 2.492 . 0 0 "[ . 1 .]" 1
317 1 40 GLN H 1 40 GLN QE 4.145 2.694 4.974 3.811 3.188 4.893 . 0 0 "[ . 1 .]" 1
318 1 88 GLN H 1 89 TRP HE1 5.709 3.711 6.500 6.531 6.194 6.640 0.140 10 0 "[ . 1 .]" 1
319 1 68 TRP HE1 1 100 LYS QG 4.828 3.138 5.794 4.827 3.492 5.470 . 0 0 "[ . 1 .]" 1
320 1 68 TRP H 1 69 ASP H 3.618 2.352 4.342 2.514 2.441 2.710 . 0 0 "[ . 1 .]" 1
321 1 94 LYS H 1 94 LYS QB 3.192 2.075 3.698 2.341 2.127 2.510 . 0 0 "[ . 1 .]" 1
322 1 80 VAL H 1 80 VAL HB 2.733 . 3.280 2.813 2.564 3.582 0.302 13 0 "[ . 1 .]" 1
323 1 28 VAL H 1 28 VAL MG2 3.587 2.331 4.304 2.115 1.957 2.324 0.374 12 0 "[ . 1 .]" 1
324 1 87 SER H 1 88 GLN QB 4.277 2.780 5.132 4.577 4.250 4.941 . 0 0 "[ . 1 .]" 1
325 1 66 HIS HB3 1 67 ARG H 4.565 2.967 5.478 4.453 4.372 4.620 . 0 0 "[ . 1 .]" 1
326 1 68 TRP H 1 71 ALA H 5.099 3.314 6.119 4.705 4.563 4.942 . 0 0 "[ . 1 .]" 1
327 1 83 VAL H 1 86 VAL MG2 4.174 2.713 5.009 4.670 3.611 5.139 0.130 4 0 "[ . 1 .]" 1
328 1 7 GLU H 1 11 ARG H 5.413 3.519 6.496 6.319 5.893 6.493 . 0 0 "[ . 1 .]" 1
329 1 73 ASP HB2 1 74 ILE H 3.622 2.354 4.346 3.966 3.823 4.067 . 0 0 "[ . 1 .]" 1
330 1 75 HIS H 1 77 SER H 3.956 2.572 4.747 4.035 3.618 4.367 . 0 0 "[ . 1 .]" 1
331 1 53 LYS H 1 56 MET HB2 5.195 3.377 6.234 5.462 4.854 5.942 . 0 0 "[ . 1 .]" 1
332 1 98 ALA H 1 100 LYS H 4.198 2.729 5.038 4.082 3.932 4.234 . 0 0 "[ . 1 .]" 1
333 1 10 LEU HB3 1 11 ARG H 3.170 2.061 3.804 3.057 2.372 3.898 0.094 7 0 "[ . 1 .]" 1
334 1 60 VAL H 1 61 GLN H 3.186 2.071 3.823 2.616 2.442 2.765 . 0 0 "[ . 1 .]" 1
335 1 79 MET H 1 86 VAL MG2 4.194 2.726 5.033 4.698 4.419 4.904 . 0 0 "[ . 1 .]" 1
336 1 29 CYS H 1 30 ASP H 3.377 2.195 4.052 2.543 2.276 2.790 . 0 0 "[ . 1 .]" 1
337 1 9 VAL H 1 10 LEU QD 4.187 2.722 5.024 4.561 4.082 4.846 . 0 0 "[ . 1 .]" 1
338 1 49 SER H 1 52 VAL QG 3.671 2.687 4.405 3.142 2.726 3.453 . 0 0 "[ . 1 .]" 1
339 1 52 VAL H 1 52 VAL HB 2.884 . 3.461 2.581 2.434 3.598 0.137 10 0 "[ . 1 .]" 1
340 1 56 MET HB2 1 59 LEU H 4.672 3.037 5.606 5.480 5.359 5.650 0.044 9 0 "[ . 1 .]" 1
341 1 66 HIS HE1 1 68 TRP HE1 5.472 3.557 6.500 6.056 4.778 6.561 0.061 9 0 "[ . 1 .]" 1
342 1 102 SER HB2 1 103 LEU H 3.457 2.247 4.148 3.620 2.346 4.174 0.026 14 0 "[ . 1 .]" 1
343 1 5 VAL QG 1 6 MET H 3.356 2.181 4.027 2.748 2.122 3.483 0.059 11 0 "[ . 1 .]" 1
344 1 93 VAL HB 1 94 LYS H 3.344 2.173 4.013 2.650 2.393 3.022 . 0 0 "[ . 1 .]" 1
345 1 12 PRO HA 1 13 LEU H 4.958 3.223 5.950 3.485 3.431 3.560 . 0 0 "[ . 1 .]" 1
346 1 82 HIS H 1 82 HIS QB 3.552 2.495 4.262 2.575 2.435 2.705 0.060 7 0 "[ . 1 .]" 1
347 1 60 VAL QG 1 61 GLN H 3.282 2.410 3.938 3.221 2.373 3.397 0.037 10 0 "[ . 1 .]" 1
348 1 31 ASP H 1 32 ILE H 3.270 2.125 3.924 2.717 2.542 2.900 . 0 0 "[ . 1 .]" 1
349 1 8 ASP H 1 8 ASP HA 3.537 2.299 4.244 2.848 2.821 2.864 . 0 0 "[ . 1 .]" 1
350 1 73 ASP HB3 1 74 ILE H 3.530 2.294 4.236 2.673 2.440 2.923 . 0 0 "[ . 1 .]" 1
351 1 70 ALA H 1 70 ALA HA 3.447 2.241 4.136 2.867 2.836 2.904 . 0 0 "[ . 1 .]" 1
352 1 24 THR H 1 25 ARG H 4.492 2.920 5.390 2.868 2.730 3.115 0.190 1 0 "[ . 1 .]" 1
353 1 75 HIS H 1 76 ARG QB 4.370 2.840 5.244 4.625 4.459 4.882 . 0 0 "[ . 1 .]" 1
354 1 15 GLN H 1 17 LEU H 4.348 2.826 5.218 4.034 3.748 4.515 . 0 0 "[ . 1 .]" 1
355 1 35 ARG H 1 35 ARG HA 3.742 2.432 4.490 2.847 2.824 2.879 . 0 0 "[ . 1 .]" 1
356 1 4 ALA MB 1 5 VAL H 3.088 2.007 3.706 3.052 2.647 3.366 . 0 0 "[ . 1 .]" 1
357 1 93 VAL H 1 93 VAL MG1 3.000 . 3.600 3.767 3.745 3.783 0.183 14 0 "[ . 1 .]" 1
358 1 85 GLU H 1 86 VAL MG2 3.937 2.559 4.724 3.759 3.296 4.176 . 0 0 "[ . 1 .]" 1
359 1 40 GLN HA 1 40 GLN QE 4.917 3.763 5.900 4.054 3.355 4.879 0.408 11 0 "[ . 1 .]" 1
360 1 74 ILE MG 1 77 SER H 4.487 2.917 5.384 5.110 4.891 5.389 0.005 12 0 "[ . 1 .]" 1
361 1 85 GLU QB 1 86 VAL H 3.622 2.439 4.346 2.644 2.298 3.060 0.141 7 0 "[ . 1 .]" 1
362 1 77 SER H 1 77 SER HB2 3.059 . 3.671 2.574 2.494 2.645 . 0 0 "[ . 1 .]" 1
363 1 66 HIS H 1 66 HIS HA 2.882 . 3.458 2.921 2.896 2.938 . 0 0 "[ . 1 .]" 1
364 1 36 LEU HA 1 38 LEU H 4.304 2.798 5.165 4.337 4.035 4.695 . 0 0 "[ . 1 .]" 1
365 1 41 GLU H 1 44 ALA MB 4.033 2.622 4.840 4.830 4.508 4.930 0.090 7 0 "[ . 1 .]" 1
366 1 40 GLN H 1 40 GLN HA 3.438 2.235 4.126 2.811 2.778 2.844 . 0 0 "[ . 1 .]" 1
367 1 58 LEU HB3 1 59 LEU H 3.309 2.151 3.971 3.469 2.500 3.834 . 0 0 "[ . 1 .]" 1
368 1 88 GLN H 1 88 GLN HG3 3.725 2.421 4.470 4.011 2.497 4.573 0.103 1 0 "[ . 1 .]" 1
369 1 11 ARG H 1 14 GLU H 4.795 3.117 5.754 5.020 4.682 5.458 . 0 0 "[ . 1 .]" 1
370 1 29 CYS H 1 29 CYS QB 3.470 2.393 4.164 2.631 2.356 2.843 0.037 4 0 "[ . 1 .]" 1
371 1 13 LEU MD1 1 14 GLU H 3.270 2.126 3.924 3.684 3.430 3.943 0.019 6 0 "[ . 1 .]" 1
372 1 34 ARG H 1 35 ARG H 3.108 2.020 3.730 2.571 2.418 2.834 . 0 0 "[ . 1 .]" 1
373 1 74 ILE HA 1 75 HIS H 4.273 2.777 5.128 3.433 3.408 3.474 . 0 0 "[ . 1 .]" 1
374 1 50 ILE HA 1 53 LYS H 3.829 2.489 4.595 3.575 3.383 3.731 . 0 0 "[ . 1 .]" 1
375 1 16 ALA H 1 19 ASP H 4.463 2.901 5.356 5.109 4.590 5.430 0.074 12 0 "[ . 1 .]" 1
376 1 63 LEU HG 1 64 SER H 3.952 2.569 4.742 4.283 4.116 4.385 . 0 0 "[ . 1 .]" 1
377 1 68 TRP H 1 68 TRP HD1 4.709 3.061 5.651 3.101 2.971 3.296 0.090 2 0 "[ . 1 .]" 1
378 1 73 ASP H 1 74 ILE MG 4.241 2.757 5.089 4.258 3.861 4.462 . 0 0 "[ . 1 .]" 1
379 1 111 GLU H 1 111 GLU HB2 3.510 2.281 4.212 3.257 2.547 3.717 . 0 0 "[ . 1 .]" 1
380 1 59 LEU H 1 61 GLN H 3.965 2.577 4.758 4.119 3.976 4.194 . 0 0 "[ . 1 .]" 1
381 1 25 ARG H 1 25 ARG HG3 3.194 2.076 3.833 2.984 2.032 4.100 0.267 12 0 "[ . 1 .]" 1
382 1 51 PRO HB3 1 52 VAL H 3.945 2.564 4.734 4.045 3.912 4.221 . 0 0 "[ . 1 .]" 1
383 1 55 ARG H 1 55 ARG HD2 4.255 2.766 5.106 4.414 2.767 5.505 0.399 5 0 "[ . 1 .]" 1
384 1 19 ASP HA 1 20 CYS H 4.161 2.705 4.993 3.560 3.459 3.594 . 0 0 "[ . 1 .]" 1
385 1 43 TRP HE1 1 53 LYS QD 4.018 2.612 4.822 3.029 2.549 4.339 0.063 4 0 "[ . 1 .]" 1
386 1 39 LEU MD2 1 44 ALA H 5.281 3.432 6.337 5.481 5.121 5.878 . 0 0 "[ . 1 .]" 1
387 1 59 LEU H 1 60 VAL QG 4.584 2.980 5.501 3.908 3.727 4.042 . 0 0 "[ . 1 .]" 1
388 1 34 ARG H 1 35 ARG QB 4.981 3.238 5.977 4.493 4.146 5.102 . 0 0 "[ . 1 .]" 1
389 1 32 ILE H 1 32 ILE MG 3.306 2.149 3.967 3.775 3.759 3.790 . 0 0 "[ . 1 .]" 1
390 1 33 SER H 1 34 ARG H 3.388 2.202 4.066 2.670 2.547 2.812 . 0 0 "[ . 1 .]" 1
391 1 52 VAL HA 1 54 LYS H 4.368 2.839 5.242 4.494 4.154 4.828 . 0 0 "[ . 1 .]" 1
392 1 115 ALA H 1 115 ALA MB 4.192 2.725 5.030 2.688 2.492 3.001 0.233 8 0 "[ . 1 .]" 1
393 1 39 LEU H 1 39 LEU HB3 3.110 2.021 3.732 2.644 2.568 2.739 . 0 0 "[ . 1 .]" 1
394 1 50 ILE H 1 50 ILE HG12 3.588 2.332 4.306 3.454 3.321 3.565 . 0 0 "[ . 1 .]" 1
395 1 69 ASP H 1 69 ASP HB3 3.196 2.077 3.835 2.883 2.456 3.612 . 0 0 "[ . 1 .]" 1
396 1 53 LYS H 1 56 MET H 4.982 3.238 5.978 4.697 4.496 4.755 . 0 0 "[ . 1 .]" 1
397 1 74 ILE H 1 74 ILE HA 3.445 2.239 4.134 2.817 2.792 2.836 . 0 0 "[ . 1 .]" 1
398 1 27 GLN HA 1 28 VAL H 4.188 2.722 5.026 3.387 3.264 3.586 . 0 0 "[ . 1 .]" 1
399 1 13 LEU H 1 13 LEU HA 3.447 2.241 4.136 2.828 2.795 2.858 . 0 0 "[ . 1 .]" 1
400 1 11 ARG H 1 11 ARG HB2 3.080 2.002 3.696 2.479 2.286 2.666 . 0 0 "[ . 1 .]" 1
401 1 95 ARG H 1 95 ARG HA 3.632 2.361 4.358 2.833 2.787 2.886 . 0 0 "[ . 1 .]" 1
402 1 41 GLU H 1 41 GLU HB3 2.480 . 2.976 3.107 2.621 3.611 0.635 10 7 "[ -**** + *]" 1
403 1 13 LEU H 1 14 GLU H 3.164 2.057 3.797 2.664 2.524 2.800 . 0 0 "[ . 1 .]" 1
404 1 63 LEU H 1 65 SER H 4.402 2.861 5.282 4.085 3.841 4.207 . 0 0 "[ . 1 .]" 1
405 1 56 MET HB2 1 57 ALA H 3.556 2.312 4.267 3.946 3.618 4.173 . 0 0 "[ . 1 .]" 1
406 1 80 VAL H 1 82 HIS H 3.856 2.506 4.627 4.097 3.790 4.414 . 0 0 "[ . 1 .]" 1
407 1 39 LEU H 1 42 GLN H 4.542 2.952 5.450 4.862 4.674 5.201 . 0 0 "[ . 1 .]" 1
408 1 31 ASP HA 1 34 ARG H 4.471 2.906 5.365 3.796 3.323 4.331 . 0 0 "[ . 1 .]" 1
409 1 10 LEU H 1 10 LEU QD 3.382 2.198 4.058 3.198 2.702 3.490 . 0 0 "[ . 1 .]" 1
410 1 59 LEU QD 1 60 VAL H 3.316 2.155 3.979 3.279 3.096 3.848 . 0 0 "[ . 1 .]" 1
411 1 49 SER QB 1 50 ILE H 3.924 2.551 4.709 2.720 2.126 3.256 0.425 11 0 "[ . 1 .]" 1
412 1 58 LEU H 1 58 LEU HB3 2.765 . 3.318 3.378 2.450 3.617 0.299 13 0 "[ . 1 .]" 1
413 1 78 LEU H 1 79 MET H 3.191 2.074 3.829 2.488 2.387 2.575 . 0 0 "[ . 1 .]" 1
414 1 49 SER HA 1 50 ILE H 3.404 2.213 4.085 2.349 2.210 2.575 0.003 13 0 "[ . 1 .]" 1
415 1 14 GLU H 1 15 GLN H 3.010 . 3.612 2.631 2.549 2.735 . 0 0 "[ . 1 .]" 1
416 1 60 VAL H 1 60 VAL HB 2.856 . 3.427 2.476 2.372 2.534 . 0 0 "[ . 1 .]" 1
417 1 36 LEU H 1 36 LEU HB2 3.499 2.274 4.199 2.251 2.085 2.526 0.189 8 0 "[ . 1 .]" 1
418 1 86 VAL HB 1 90 MET H 4.116 2.675 4.939 4.643 3.909 5.030 0.091 14 0 "[ . 1 .]" 1
419 1 74 ILE H 1 75 HIS H 3.292 2.147 3.950 2.648 2.593 2.729 . 0 0 "[ . 1 .]" 1
420 1 53 LYS H 1 54 LYS H 3.351 2.178 4.021 2.582 2.477 2.716 . 0 0 "[ . 1 .]" 1
421 1 75 HIS H 1 76 ARG H 2.935 . 3.522 2.545 2.425 2.710 . 0 0 "[ . 1 .]" 1
422 1 53 LYS H 1 53 LYS HA 3.516 2.285 4.219 2.835 2.804 2.862 . 0 0 "[ . 1 .]" 1
423 1 43 TRP HZ3 1 56 MET H 4.941 3.212 5.929 5.173 4.566 5.812 . 0 0 "[ . 1 .]" 1
424 1 88 GLN HA 1 89 TRP H 4.725 3.071 5.670 3.537 3.377 3.600 . 0 0 "[ . 1 .]" 1
425 1 76 ARG QB 1 77 SER H 3.192 2.075 3.830 2.920 2.487 3.572 . 0 0 "[ . 1 .]" 1
426 1 28 VAL H 1 29 CYS H 3.116 2.025 3.739 2.965 2.619 3.140 . 0 0 "[ . 1 .]" 1
427 1 38 LEU H 1 38 LEU HB2 2.972 . 3.566 2.223 2.079 2.515 . 0 0 "[ . 1 .]" 1
428 1 35 ARG H 1 36 LEU H 3.257 2.117 3.908 2.471 2.378 2.603 . 0 0 "[ . 1 .]" 1
429 1 106 GLU H 1 106 GLU HG3 3.562 2.315 4.274 3.773 2.516 4.619 0.345 15 0 "[ . 1 .]" 1
430 1 83 VAL HA 1 84 THR H 4.633 3.012 5.560 3.465 3.237 3.612 . 0 0 "[ . 1 .]" 1
431 1 74 ILE MD 1 77 SER H 4.378 2.846 5.254 4.963 4.685 5.297 0.043 4 0 "[ . 1 .]" 1
432 1 6 MET H 1 6 MET QB 3.222 2.123 3.866 2.327 2.216 2.625 . 0 0 "[ . 1 .]" 1
433 1 44 ALA H 1 44 ALA MB 2.722 . 3.266 2.257 2.220 2.288 . 0 0 "[ . 1 .]" 1
434 1 42 GLN H 1 42 GLN HE22 4.790 3.114 5.748 5.290 4.082 5.812 0.064 13 0 "[ . 1 .]" 1
435 1 110 ASN HB3 1 112 GLU H 5.276 3.429 6.331 5.212 4.368 6.091 . 0 0 "[ . 1 .]" 1
436 1 83 VAL HB 1 84 THR H 4.007 2.604 4.808 4.085 3.902 4.367 . 0 0 "[ . 1 .]" 1
437 1 63 LEU MD2 1 64 SER H 3.960 2.574 4.752 4.464 4.195 4.654 . 0 0 "[ . 1 .]" 1
438 1 21 ARG HA 1 22 GLY H 3.602 2.341 4.322 3.469 3.382 3.567 . 0 0 "[ . 1 .]" 1
439 1 48 LEU MD1 1 49 SER H 4.409 2.866 5.291 4.581 4.229 4.973 . 0 0 "[ . 1 .]" 1
440 1 102 SER H 1 105 SER H 4.792 3.115 5.750 5.330 4.786 5.758 0.008 6 0 "[ . 1 .]" 1
441 1 85 GLU QB 1 87 SER H 4.303 2.797 5.164 4.523 4.231 4.751 . 0 0 "[ . 1 .]" 1
442 1 87 SER H 1 88 GLN H 4.480 2.912 5.376 2.839 2.767 2.920 0.145 9 0 "[ . 1 .]" 1
443 1 76 ARG HA 1 77 SER H 4.054 2.635 4.865 3.489 3.428 3.531 . 0 0 "[ . 1 .]" 1
444 1 104 PHE H 1 104 PHE HB2 3.102 2.016 3.722 2.337 2.269 2.426 . 0 0 "[ . 1 .]" 1
445 1 63 LEU H 1 63 LEU HB2 2.953 . 3.544 2.446 2.402 2.531 . 0 0 "[ . 1 .]" 1
446 1 13 LEU MD1 1 15 GLN H 4.431 2.880 5.317 4.813 4.649 4.978 . 0 0 "[ . 1 .]" 1
447 1 11 ARG H 1 11 ARG HB3 2.962 . 3.554 3.322 2.411 3.634 0.080 7 0 "[ . 1 .]" 1
448 1 32 ILE HA 1 36 LEU H 4.452 2.894 5.342 4.109 3.994 4.273 . 0 0 "[ . 1 .]" 1
449 1 87 SER HB3 1 88 GLN H 4.915 3.195 5.898 4.130 3.263 4.567 . 0 0 "[ . 1 .]" 1
450 1 17 LEU QD 1 20 CYS H 3.721 2.419 4.465 4.237 3.546 4.509 0.044 7 0 "[ . 1 .]" 1
451 1 16 ALA H 1 16 ALA HA 3.525 2.291 4.230 2.861 2.783 2.901 . 0 0 "[ . 1 .]" 1
452 1 5 VAL H 1 43 TRP HZ2 4.042 2.627 4.850 4.179 3.682 4.871 0.021 11 0 "[ . 1 .]" 1
453 1 47 LYS HB2 1 48 LEU H 3.764 2.447 4.517 3.870 2.408 4.481 0.039 11 0 "[ . 1 .]" 1
454 1 34 ARG HA 1 35 ARG H 3.870 2.516 4.644 3.513 3.471 3.582 . 0 0 "[ . 1 .]" 1
455 1 68 TRP H 1 70 ALA H 3.865 2.512 4.638 4.047 3.820 4.272 . 0 0 "[ . 1 .]" 1
456 1 16 ALA H 1 16 ALA MB 2.744 . 3.293 2.257 2.191 2.281 . 0 0 "[ . 1 .]" 1
457 1 8 ASP QB 1 9 VAL H 3.966 2.578 4.759 2.825 2.689 3.022 . 0 0 "[ . 1 .]" 1
458 1 45 GLY H 1 46 GLY H 3.514 2.284 4.217 2.496 2.293 2.925 . 0 0 "[ . 1 .]" 1
459 1 33 SER H 1 35 ARG H 4.340 2.821 5.208 4.066 3.801 4.538 . 0 0 "[ . 1 .]" 1
460 1 13 LEU HB2 1 14 GLU H 3.508 2.280 4.210 3.543 3.450 3.644 . 0 0 "[ . 1 .]" 1
461 1 30 ASP H 1 31 ASP H 3.332 2.166 3.998 2.665 2.446 2.823 . 0 0 "[ . 1 .]" 1
462 1 73 ASP H 1 73 ASP HB2 3.202 2.081 3.842 2.588 2.500 2.656 . 0 0 "[ . 1 .]" 1
463 1 10 LEU QD 1 13 LEU H 4.917 3.196 5.900 4.994 4.860 5.137 . 0 0 "[ . 1 .]" 1
464 1 107 GLU HB2 1 108 ALA H 3.358 2.183 4.030 3.415 2.348 4.235 0.205 7 0 "[ . 1 .]" 1
465 1 79 MET H 1 80 VAL QG 3.451 2.243 4.141 3.782 3.480 3.974 . 0 0 "[ . 1 .]" 1
466 1 14 GLU HA 1 16 ALA H 4.744 3.084 5.693 4.034 3.655 4.362 . 0 0 "[ . 1 .]" 1
467 1 48 LEU MD1 1 89 TRP HE1 3.915 2.545 4.698 4.384 4.008 4.717 0.019 4 0 "[ . 1 .]" 1
468 1 17 LEU H 1 17 LEU QD 3.057 . 3.668 2.830 1.881 3.382 0.106 8 0 "[ . 1 .]" 1
469 1 103 LEU H 1 103 LEU HB2 3.043 . 3.652 2.429 2.153 3.596 . 0 0 "[ . 1 .]" 1
470 1 36 LEU MD2 1 37 ALA H 3.680 2.392 4.416 4.075 3.626 4.628 0.212 3 0 "[ . 1 .]" 1
471 1 28 VAL MG2 1 29 CYS H 3.719 2.417 4.463 3.189 2.300 3.905 0.117 7 0 "[ . 1 .]" 1
472 1 39 LEU MD1 1 89 TRP HE1 5.294 3.441 6.353 3.349 3.282 3.442 0.159 3 0 "[ . 1 .]" 1
473 1 80 VAL H 1 81 ASP H 3.080 2.002 3.696 2.335 2.210 2.509 . 0 0 "[ . 1 .]" 1
474 1 101 ARG H 1 101 ARG HA 3.412 2.218 4.094 2.808 2.778 2.839 . 0 0 "[ . 1 .]" 1
475 1 113 LYS H 1 113 LYS HD3 3.619 2.352 4.343 3.773 1.689 4.904 0.663 6 2 "[ - .+ 1 .]" 1
476 1 62 GLU HB3 1 63 LEU H 3.505 2.278 4.206 3.948 3.550 4.156 . 0 0 "[ . 1 .]" 1
477 1 95 ARG H 1 98 ALA H 4.249 2.762 5.099 4.686 4.503 4.957 . 0 0 "[ . 1 .]" 1
478 1 37 ALA MB 1 38 LEU H 3.069 . 3.683 2.620 2.388 2.783 . 0 0 "[ . 1 .]" 1
479 1 28 VAL H 1 30 ASP H 4.210 2.737 5.052 4.290 3.951 5.028 . 0 0 "[ . 1 .]" 1
480 1 25 ARG H 1 29 CYS H 5.797 3.768 6.500 5.566 4.566 6.299 . 0 0 "[ . 1 .]" 1
481 1 27 GLN H 1 28 VAL H 3.937 2.559 4.724 2.791 2.484 3.249 0.075 3 0 "[ . 1 .]" 1
482 1 58 LEU H 1 59 LEU QB 3.960 2.574 4.752 4.250 4.145 4.357 . 0 0 "[ . 1 .]" 1
483 1 67 ARG H 1 67 ARG HD3 3.926 2.552 4.711 4.421 3.675 5.092 0.381 7 0 "[ . 1 .]" 1
484 1 52 VAL H 1 52 VAL HA 3.434 2.232 4.121 2.823 2.791 2.865 . 0 0 "[ . 1 .]" 1
485 1 44 ALA H 1 48 LEU MD1 4.246 2.760 5.095 5.128 5.018 5.210 0.115 15 0 "[ . 1 .]" 1
486 1 52 VAL QG 1 54 LYS H 5.321 3.459 6.385 4.617 4.447 4.896 . 0 0 "[ . 1 .]" 1
487 1 43 TRP QB 1 44 ALA H 3.393 2.206 4.072 2.610 2.269 3.028 . 0 0 "[ . 1 .]" 1
488 1 63 LEU H 1 63 LEU HB3 2.992 . 3.590 2.485 2.420 2.521 . 0 0 "[ . 1 .]" 1
489 1 49 SER H 1 53 LYS H 5.099 3.314 6.119 5.235 4.465 5.938 . 0 0 "[ . 1 .]" 1
490 1 18 GLU H 1 18 GLU HG3 3.145 2.044 3.774 2.820 2.080 4.206 0.432 3 0 "[ . 1 .]" 1
491 1 59 LEU H 1 74 ILE MG 3.265 2.122 3.918 3.516 3.057 3.926 0.008 11 0 "[ . 1 .]" 1
492 1 59 LEU H 1 59 LEU QB 3.201 2.081 3.732 2.222 2.148 2.254 . 0 0 "[ . 1 .]" 1
493 1 43 TRP H 1 47 LYS H 5.010 3.257 6.012 5.530 5.051 6.091 0.079 4 0 "[ . 1 .]" 1
494 1 54 LYS QE 1 55 ARG H 4.689 3.048 5.627 4.959 4.064 5.534 . 0 0 "[ . 1 .]" 1
495 1 7 GLU H 1 8 ASP H 3.505 2.278 4.206 2.632 2.475 2.914 . 0 0 "[ . 1 .]" 1
496 1 54 LYS HG2 1 55 ARG H 4.090 2.659 4.908 4.773 4.204 5.284 0.376 7 0 "[ . 1 .]" 1
497 1 47 LYS HA 1 48 LEU H 3.944 2.564 4.733 2.808 2.435 3.600 0.129 15 0 "[ . 1 .]" 1
498 1 100 LYS HA 1 102 SER H 4.007 2.605 4.808 4.087 3.683 4.417 . 0 0 "[ . 1 .]" 1
499 1 29 CYS H 1 31 ASP H 3.737 2.429 4.484 4.168 3.686 4.500 0.016 3 0 "[ . 1 .]" 1
500 1 67 ARG QB 1 68 TRP H 3.788 2.462 4.546 3.895 3.867 3.999 . 0 0 "[ . 1 .]" 1
501 1 105 SER H 1 106 GLU H 3.909 2.541 4.691 2.503 2.392 2.728 0.149 4 0 "[ . 1 .]" 1
502 1 59 LEU QD 1 61 GLN H 3.856 2.506 4.627 4.542 4.457 4.592 . 0 0 "[ . 1 .]" 1
503 1 66 HIS H 1 66 HIS HB2 3.938 2.560 4.726 2.661 2.463 3.691 0.097 1 0 "[ . 1 .]" 1
504 1 35 ARG HA 1 36 LEU H 4.460 2.899 5.352 3.470 3.409 3.525 . 0 0 "[ . 1 .]" 1
505 1 103 LEU H 1 104 PHE HB3 4.847 3.151 5.816 5.826 4.913 5.923 0.107 6 0 "[ . 1 .]" 1
506 1 31 ASP H 1 33 SER H 4.191 2.724 5.029 4.112 3.903 4.392 . 0 0 "[ . 1 .]" 1
507 1 51 PRO HA 1 52 VAL H 3.992 2.595 4.790 3.572 3.530 3.612 . 0 0 "[ . 1 .]" 1
508 1 58 LEU H 1 59 LEU H 3.190 2.074 3.828 2.538 2.416 2.647 . 0 0 "[ . 1 .]" 1
509 1 44 ALA H 1 46 GLY H 4.583 2.979 5.500 4.139 3.490 5.428 . 0 0 "[ . 1 .]" 1
510 1 57 ALA H 1 57 ALA HA 3.377 2.195 4.052 2.816 2.796 2.837 . 0 0 "[ . 1 .]" 1
511 1 27 GLN HA 1 30 ASP H 3.792 2.465 4.550 3.627 3.258 4.200 . 0 0 "[ . 1 .]" 1
512 1 53 LYS H 1 53 LYS QB 3.210 2.206 3.852 2.403 2.161 2.522 0.045 8 0 "[ . 1 .]" 1
513 1 28 VAL H 1 31 ASP H 4.926 3.202 5.911 4.910 4.646 5.468 . 0 0 "[ . 1 .]" 1
514 1 76 ARG H 1 76 ARG QB 2.906 . 3.487 2.470 2.281 2.594 . 0 0 "[ . 1 .]" 1
515 1 80 VAL H 1 80 VAL QG 2.758 . 3.310 1.928 1.793 2.078 0.000 15 0 "[ . 1 .]" 1
516 1 100 LYS H 1 101 ARG H 3.344 2.173 4.013 2.691 2.461 2.947 . 0 0 "[ . 1 .]" 1
517 1 94 LYS H 1 97 ILE H 4.266 2.773 5.119 5.007 4.796 5.140 0.021 13 0 "[ . 1 .]" 1
518 1 11 ARG HA 1 14 GLU H 4.140 2.691 4.968 3.867 3.389 4.339 . 0 0 "[ . 1 .]" 1
519 1 24 THR HG1 1 28 VAL H 3.788 2.462 4.546 4.631 4.549 4.755 0.209 14 0 "[ . 1 .]" 1
520 1 126 GLY HA2 1 127 PHE H 3.736 2.428 4.483 3.406 2.596 3.560 . 0 0 "[ . 1 .]" 1
521 1 67 ARG H 1 68 TRP HD1 4.702 3.056 5.642 5.624 5.246 5.720 0.078 13 0 "[ . 1 .]" 1
522 1 6 MET H 1 43 TRP HE1 4.718 3.067 5.662 3.162 2.971 3.586 0.096 10 0 "[ . 1 .]" 1
523 1 87 SER H 1 87 SER HB3 3.302 2.146 3.962 3.144 2.539 3.621 . 0 0 "[ . 1 .]" 1
524 1 36 LEU H 1 38 LEU H 4.224 2.746 5.069 4.060 3.827 4.234 . 0 0 "[ . 1 .]" 1
525 1 11 ARG H 1 11 ARG HD3 4.332 2.816 5.198 4.235 3.192 5.130 . 0 0 "[ . 1 .]" 1
526 1 131 SER H 1 131 SER HB2 4.694 3.051 5.633 3.095 2.938 3.431 0.113 8 0 "[ . 1 .]" 1
527 1 46 GLY HA2 1 47 LYS H 3.593 2.335 4.312 3.426 3.297 3.579 . 0 0 "[ . 1 .]" 1
528 1 83 VAL MG1 1 84 THR H 2.983 . 3.580 2.398 1.861 3.089 0.078 9 0 "[ . 1 .]" 1
529 1 90 MET H 1 92 GLY H 4.669 3.035 5.603 4.247 3.851 4.545 . 0 0 "[ . 1 .]" 1
530 1 16 ALA HA 1 19 ASP H 3.489 2.268 4.187 3.734 3.331 4.209 0.022 12 0 "[ . 1 .]" 1
531 1 3 GLU H 1 3 GLU HB2 4.520 2.938 5.424 3.257 2.776 3.789 0.162 5 0 "[ . 1 .]" 1
532 1 54 LYS H 1 55 ARG H 3.276 2.129 3.931 2.779 2.542 2.993 . 0 0 "[ . 1 .]" 1
533 1 36 LEU HA 1 37 ALA H 3.911 2.542 4.693 3.527 3.497 3.550 . 0 0 "[ . 1 .]" 1
534 1 47 LYS H 1 47 LYS HD2 4.311 2.802 5.173 4.898 4.358 5.189 0.016 8 0 "[ . 1 .]" 1
535 1 25 ARG H 1 25 ARG HD2 4.210 2.736 5.052 4.531 3.888 5.916 0.864 12 1 "[ . 1 + .]" 1
536 1 94 LYS HA 1 95 ARG H 3.864 2.512 4.637 3.491 3.442 3.540 . 0 0 "[ . 1 .]" 1
537 1 11 ARG HA 1 13 LEU H 4.852 3.154 5.822 4.181 3.980 4.354 . 0 0 "[ . 1 .]" 1
538 1 43 TRP H 1 44 ALA H 3.236 2.103 3.883 2.541 2.384 2.663 . 0 0 "[ . 1 .]" 1
539 1 51 PRO HA 1 54 LYS H 3.959 2.573 4.751 3.637 3.301 3.853 . 0 0 "[ . 1 .]" 1
540 1 72 ASP H 1 72 ASP HB2 2.883 . 3.460 2.661 2.214 2.820 . 0 0 "[ . 1 .]" 1
541 1 49 SER H 1 49 SER QB 4.193 2.725 5.032 2.508 2.272 2.901 0.453 10 0 "[ . 1 .]" 1
542 1 39 LEU MD2 1 89 TRP HE1 3.953 2.570 4.744 4.753 4.618 4.882 0.138 13 0 "[ . 1 .]" 1
543 1 82 HIS QB 1 85 GLU H 4.454 3.139 5.345 3.330 3.000 3.682 0.139 10 0 "[ . 1 .]" 1
544 1 40 GLN HA 1 41 GLU H 4.045 2.629 4.854 3.539 3.469 3.578 . 0 0 "[ . 1 .]" 1
545 1 76 ARG H 1 77 SER H 3.050 . 3.660 2.626 2.529 2.741 . 0 0 "[ . 1 .]" 1
546 1 57 ALA MB 1 59 LEU H 4.129 2.684 4.955 4.557 4.382 4.733 . 0 0 "[ . 1 .]" 1
547 1 99 GLU H 1 101 ARG QG 4.159 2.703 4.991 4.477 3.838 4.979 . 0 0 "[ . 1 .]" 1
548 1 125 PRO HA 1 126 GLY H 4.908 3.190 5.890 3.305 3.010 3.534 0.180 14 0 "[ . 1 .]" 1
549 1 116 ALA H 1 116 ALA MB 3.829 2.489 4.595 2.559 2.327 2.883 0.162 4 0 "[ . 1 .]" 1
550 1 33 SER H 1 33 SER QB 3.377 2.195 4.052 2.341 2.217 2.597 . 0 0 "[ . 1 .]" 1
551 1 14 GLU HA 1 15 GLN H 4.075 2.649 4.890 3.467 3.396 3.523 . 0 0 "[ . 1 .]" 1
552 1 34 ARG H 1 34 ARG HG3 3.691 2.399 4.429 4.062 3.190 4.596 0.167 2 0 "[ . 1 .]" 1
553 1 70 ALA H 1 71 ALA H 3.108 2.020 3.730 2.434 2.320 2.568 . 0 0 "[ . 1 .]" 1
554 1 69 ASP H 1 71 ALA H 4.290 2.788 5.148 3.887 3.694 4.031 . 0 0 "[ . 1 .]" 1
555 1 76 ARG HG2 1 77 SER H 4.249 2.762 5.099 4.051 2.253 5.047 0.509 12 1 "[ . 1 + .]" 1
556 1 69 ASP HB3 1 70 ALA H 3.622 2.354 4.346 3.139 2.586 4.055 . 0 0 "[ . 1 .]" 1
557 1 93 VAL H 1 93 VAL HB 3.129 2.034 3.755 2.566 2.483 2.638 . 0 0 "[ . 1 .]" 1
558 1 7 GLU H 1 9 VAL H 4.594 2.986 5.513 4.031 3.845 4.247 . 0 0 "[ . 1 .]" 1
559 1 84 THR HA 1 85 GLU H 4.112 2.673 4.934 3.265 2.653 3.517 0.020 4 0 "[ . 1 .]" 1
560 1 90 MET H 1 90 MET HA 4.305 2.798 5.166 2.809 2.751 2.868 0.047 2 0 "[ . 1 .]" 1
561 1 27 GLN HG3 1 28 VAL H 4.150 2.698 4.980 4.258 3.054 4.980 0.000 14 0 "[ . 1 .]" 1
562 1 24 THR H 1 24 THR HB 3.180 2.067 3.816 3.152 2.618 3.700 . 0 0 "[ . 1 .]" 1
563 1 97 ILE H 1 98 ALA H 3.221 2.093 3.865 2.609 2.322 2.689 . 0 0 "[ . 1 .]" 1
564 1 61 GLN HB3 1 61 GLN HE22 3.845 2.499 4.614 4.487 3.758 4.766 0.152 3 0 "[ . 1 .]" 1
565 1 73 ASP H 1 73 ASP HA 3.537 2.299 4.244 2.804 2.772 2.853 . 0 0 "[ . 1 .]" 1
566 1 7 GLU H 1 7 GLU HG2 3.665 2.382 4.398 3.915 2.227 4.510 0.155 5 0 "[ . 1 .]" 1
567 1 25 ARG H 1 28 VAL MG2 4.311 2.802 5.173 3.349 2.571 4.287 0.231 12 0 "[ . 1 .]" 1
568 1 128 GLN H 1 129 GLN HA 4.704 3.058 5.645 4.872 3.823 5.282 . 0 0 "[ . 1 .]" 1
569 1 94 LYS H 1 94 LYS HA 3.509 2.281 4.211 2.837 2.793 2.871 . 0 0 "[ . 1 .]" 1
570 1 56 MET H 1 57 ALA H 3.013 . 3.616 2.523 2.367 2.631 . 0 0 "[ . 1 .]" 1
571 1 57 ALA H 1 57 ALA MB 2.681 . 3.217 2.243 2.232 2.256 . 0 0 "[ . 1 .]" 1
572 1 109 ALA H 1 110 ASN H 3.727 2.422 4.472 3.665 2.410 4.552 0.080 12 0 "[ . 1 .]" 1
573 1 57 ALA H 1 58 LEU H 3.128 2.033 3.754 2.613 2.543 2.661 . 0 0 "[ . 1 .]" 1
574 1 66 HIS H 1 66 HIS HD1 3.485 2.265 4.182 3.689 2.659 4.236 0.054 2 0 "[ . 1 .]" 1
575 1 36 LEU H 1 36 LEU HA 3.572 2.322 4.286 2.804 2.768 2.842 . 0 0 "[ . 1 .]" 1
576 1 31 ASP QB 1 32 ILE H 3.315 2.155 3.978 2.446 2.149 2.767 0.006 1 0 "[ . 1 .]" 1
577 1 41 GLU H 1 42 GLN H 3.157 2.052 3.788 2.556 2.350 2.793 . 0 0 "[ . 1 .]" 1
578 1 71 ALA H 1 71 ALA MB 2.718 . 3.262 2.240 2.228 2.255 . 0 0 "[ . 1 .]" 1
579 1 79 MET QG 1 80 VAL H 4.575 2.974 5.490 4.338 4.198 4.476 . 0 0 "[ . 1 .]" 1
580 1 107 GLU H 1 108 ALA MB 4.389 2.853 5.267 4.530 3.899 5.335 0.068 1 0 "[ . 1 .]" 1
581 1 83 VAL H 1 84 THR H 3.656 2.376 4.387 2.659 2.370 3.938 0.006 4 0 "[ . 1 .]" 1
582 1 83 VAL H 1 83 VAL MG1 2.687 . 3.224 2.144 1.893 3.232 0.008 9 0 "[ . 1 .]" 1
583 1 23 HIS H 1 23 HIS HB2 3.382 2.198 4.058 2.476 2.367 2.631 . 0 0 "[ . 1 .]" 1
584 1 50 ILE H 1 50 ILE HA 3.404 2.212 4.085 2.763 2.736 2.824 . 0 0 "[ . 1 .]" 1
585 1 11 ARG H 1 12 PRO HD2 3.291 2.139 3.949 2.518 2.154 3.115 . 0 0 "[ . 1 .]" 1
586 1 86 VAL HB 1 87 SER H 4.409 2.866 5.291 4.371 4.237 4.458 . 0 0 "[ . 1 .]" 1
587 1 86 VAL H 1 87 SER H 3.005 . 3.606 2.358 2.096 2.782 . 0 0 "[ . 1 .]" 1
588 1 29 CYS QB 1 30 ASP H 3.513 2.283 4.216 3.195 2.654 3.536 . 0 0 "[ . 1 .]" 1
589 1 39 LEU HB3 1 40 GLN H 3.555 2.311 4.266 2.493 2.361 2.737 . 0 0 "[ . 1 .]" 1
590 1 59 LEU H 1 60 VAL H 3.409 2.216 4.091 2.619 2.455 2.695 . 0 0 "[ . 1 .]" 1
591 1 52 VAL H 1 53 LYS H 3.179 2.066 3.815 2.656 2.493 2.807 . 0 0 "[ . 1 .]" 1
592 1 27 GLN H 1 29 CYS H 5.318 3.457 6.382 4.760 4.320 5.277 . 0 0 "[ . 1 .]" 1
593 1 6 MET HA 1 9 VAL H 4.108 2.670 4.930 3.331 3.052 3.722 . 0 0 "[ . 1 .]" 1
594 1 43 TRP H 1 45 GLY H 4.530 2.945 5.436 4.581 4.388 4.951 . 0 0 "[ . 1 .]" 1
595 1 73 ASP H 1 73 ASP HB3 2.845 . 3.414 2.477 2.395 2.583 . 0 0 "[ . 1 .]" 1
596 1 79 MET H 1 81 ASP H 4.391 2.854 5.269 4.053 3.746 4.288 . 0 0 "[ . 1 .]" 1
597 1 32 ILE HB 1 33 SER H 3.197 2.078 3.836 2.658 2.275 2.894 . 0 0 "[ . 1 .]" 1
598 1 94 LYS H 1 94 LYS HG3 4.141 2.692 4.969 3.618 2.201 4.563 0.491 5 0 "[ . 1 .]" 1
599 1 100 LYS H 1 102 SER H 4.525 2.941 5.430 4.287 4.105 4.582 . 0 0 "[ . 1 .]" 1
600 1 36 LEU H 1 37 ALA H 3.169 2.060 3.803 2.656 2.474 2.906 . 0 0 "[ . 1 .]" 1
601 1 114 SER HA 1 115 ALA H 4.290 2.788 5.148 3.210 2.565 3.556 0.223 9 0 "[ . 1 .]" 1
602 1 19 ASP QB 1 20 CYS H 4.059 2.638 4.871 2.475 2.148 2.877 0.490 8 0 "[ . 1 .]" 1
603 1 6 MET H 1 7 GLU H 3.867 2.513 4.640 2.607 2.456 2.862 0.057 13 0 "[ . 1 .]" 1
604 1 53 LYS H 1 55 ARG H 4.376 2.844 5.251 4.240 4.055 4.527 . 0 0 "[ . 1 .]" 1
605 1 73 ASP H 1 74 ILE MD 4.358 2.833 5.230 4.737 3.319 5.266 0.036 11 0 "[ . 1 .]" 1
606 1 4 ALA H 1 4 ALA MB 3.075 . 3.690 2.282 2.218 2.364 . 0 0 "[ . 1 .]" 1
607 1 53 LYS QG 1 56 MET H 5.323 3.460 6.388 5.473 5.353 5.606 . 0 0 "[ . 1 .]" 1
608 1 60 VAL H 1 61 GLN HG3 4.472 2.907 5.366 5.273 3.868 5.995 0.629 10 1 "[ . + .]" 1
609 1 13 LEU HA 1 14 GLU H 3.957 2.572 4.748 3.558 3.536 3.582 . 0 0 "[ . 1 .]" 1
610 1 41 GLU H 1 43 TRP H 4.307 2.800 5.168 4.048 3.823 4.227 . 0 0 "[ . 1 .]" 1
611 1 69 ASP HB2 1 70 ALA H 3.780 2.457 4.536 3.565 2.665 4.053 . 0 0 "[ . 1 .]" 1
612 1 38 LEU H 1 38 LEU HB3 2.908 . 3.490 2.904 2.496 3.437 . 0 0 "[ . 1 .]" 1
613 1 36 LEU HB3 1 37 ALA H 3.122 2.029 3.746 2.658 2.397 3.582 . 0 0 "[ . 1 .]" 1
614 1 77 SER H 1 79 MET H 3.663 2.381 4.396 4.024 3.874 4.239 . 0 0 "[ . 1 .]" 1
615 1 84 THR H 1 84 THR HG1 3.303 2.147 3.964 2.608 2.140 3.187 0.007 5 0 "[ . 1 .]" 1
616 1 53 LYS H 1 54 LYS HB2 3.958 2.573 4.750 4.521 4.379 4.859 0.109 8 0 "[ . 1 .]" 1
617 1 32 ILE HA 1 33 SER H 4.228 2.748 5.074 3.543 3.506 3.564 . 0 0 "[ . 1 .]" 1
618 1 93 VAL HB 1 95 ARG H 4.957 3.222 5.948 4.908 4.674 5.159 . 0 0 "[ . 1 .]" 1
619 1 111 GLU H 1 111 GLU HA 3.481 2.263 4.177 2.816 2.257 2.949 0.006 14 0 "[ . 1 .]" 1
620 1 89 TRP H 1 89 TRP QB 4.383 2.849 4.978 2.827 2.612 3.082 0.237 4 0 "[ . 1 .]" 1
621 1 47 LYS H 1 48 LEU H 3.017 . 3.620 3.008 2.819 3.202 . 0 0 "[ . 1 .]" 1
622 1 7 GLU HA 1 8 ASP H 3.913 2.543 4.696 3.507 3.463 3.561 . 0 0 "[ . 1 .]" 1
623 1 112 GLU H 1 112 GLU HB3 3.090 2.008 3.708 3.157 2.472 4.044 0.336 5 0 "[ . 1 .]" 1
624 1 99 GLU H 1 102 SER H 5.027 3.268 6.032 5.302 4.806 5.744 . 0 0 "[ . 1 .]" 1
625 1 106 GLU HB3 1 107 GLU H 3.424 2.225 4.109 3.750 2.491 4.387 0.278 15 0 "[ . 1 .]" 1
626 1 67 ARG H 1 69 ASP H 5.239 3.405 6.287 5.510 5.380 5.660 . 0 0 "[ . 1 .]" 1
627 1 3 GLU QG 1 4 ALA H 4.364 2.837 5.237 3.118 2.269 3.898 0.568 8 1 "[ . + 1 .]" 1
628 1 52 VAL H 1 56 MET H 4.963 3.226 5.956 5.938 5.827 6.033 0.077 9 0 "[ . 1 .]" 1
629 1 82 HIS H 1 83 VAL H 2.935 . 3.522 3.031 1.974 3.548 0.026 7 0 "[ . 1 .]" 1
630 1 41 GLU H 1 44 ALA H 5.007 3.255 6.008 4.748 4.628 4.876 . 0 0 "[ . 1 .]" 1
631 1 8 ASP H 1 8 ASP QB 3.309 2.151 3.971 2.260 2.220 2.300 . 0 0 "[ . 1 .]" 1
632 1 39 LEU H 1 39 LEU MD2 3.880 2.522 4.656 4.248 4.189 4.316 . 0 0 "[ . 1 .]" 1
633 1 93 VAL H 1 94 LYS H 3.276 2.130 3.931 2.650 2.566 2.802 . 0 0 "[ . 1 .]" 1
634 1 39 LEU MD2 1 42 GLN H 4.840 3.146 5.808 4.951 4.607 5.104 . 0 0 "[ . 1 .]" 1
635 1 101 ARG HB2 1 102 SER H 3.743 2.433 4.492 2.748 2.533 3.708 . 0 0 "[ . 1 .]" 1
636 1 43 TRP HE1 1 53 LYS QG 5.123 3.330 6.148 4.529 3.796 4.933 . 0 0 "[ . 1 .]" 1
637 1 65 SER H 1 67 ARG QB 4.404 2.863 5.285 4.253 3.649 4.654 . 0 0 "[ . 1 .]" 1
638 1 5 VAL H 1 5 VAL QG 2.763 . 3.316 2.062 1.841 2.288 . 0 0 "[ . 1 .]" 1
639 1 13 LEU MD2 1 17 LEU H 4.319 2.807 5.183 5.064 4.590 5.245 0.062 8 0 "[ . 1 .]" 1
640 1 39 LEU MD2 1 40 GLN H 4.212 2.738 5.054 3.385 3.142 3.831 . 0 0 "[ . 1 .]" 1
641 1 79 MET H 1 79 MET QG 3.331 2.352 3.997 2.512 2.150 2.800 0.202 13 0 "[ . 1 .]" 1
642 1 7 GLU H 1 10 LEU H 4.887 3.177 5.864 4.661 4.434 5.007 . 0 0 "[ . 1 .]" 1
643 1 40 GLN H 1 41 GLU H 3.102 2.016 3.722 2.711 2.530 2.827 . 0 0 "[ . 1 .]" 1
644 1 61 GLN H 1 61 GLN HG3 3.289 2.138 3.947 3.263 1.900 3.796 0.238 3 0 "[ . 1 .]" 1
645 1 52 VAL H 1 55 ARG H 4.877 3.170 5.852 4.746 4.580 5.000 . 0 0 "[ . 1 .]" 1
646 1 18 GLU HA 1 19 ASP H 3.656 2.376 4.387 3.466 3.403 3.523 . 0 0 "[ . 1 .]" 1
647 1 32 ILE H 1 35 ARG H 3.970 2.580 4.764 4.750 4.487 4.916 0.152 9 0 "[ . 1 .]" 1
648 1 47 LYS H 1 47 LYS HA 3.480 2.262 4.176 2.399 2.250 2.840 0.012 6 0 "[ . 1 .]" 1
649 1 7 GLU HA 1 11 ARG H 3.719 2.417 4.463 4.291 3.805 4.557 0.094 12 0 "[ . 1 .]" 1
650 1 125 PRO QG 1 127 PHE H 3.299 2.145 3.959 3.116 2.534 3.966 0.007 10 0 "[ . 1 .]" 1
651 1 78 LEU H 1 80 VAL H 3.521 2.289 4.225 4.200 4.047 4.291 0.066 3 0 "[ . 1 .]" 1
652 1 62 GLU H 1 62 GLU HB3 2.945 . 3.534 3.607 3.474 3.658 0.124 6 0 "[ . 1 .]" 1
653 1 19 ASP H 1 19 ASP QB 3.348 2.176 4.018 2.321 2.233 2.464 . 0 0 "[ . 1 .]" 1
654 1 6 MET H 1 7 GLU QB 4.171 2.711 5.005 4.438 4.146 4.829 . 0 0 "[ . 1 .]" 1
655 1 86 VAL H 1 86 VAL MG1 3.205 2.083 3.846 2.618 2.191 2.847 . 0 0 "[ . 1 .]" 1
656 1 10 LEU H 1 10 LEU HB3 2.722 . 3.266 3.083 2.783 3.607 0.341 7 0 "[ . 1 .]" 1
657 1 56 MET H 1 57 ALA MB 3.905 2.538 4.686 4.216 4.066 4.333 . 0 0 "[ . 1 .]" 1
658 1 65 SER H 1 67 ARG H 3.855 2.506 4.626 3.708 3.432 3.854 . 0 0 "[ . 1 .]" 1
659 1 5 VAL H 1 7 GLU H 5.390 3.503 6.468 5.440 4.869 5.941 . 0 0 "[ . 1 .]" 1
660 1 78 LEU HA 1 82 HIS H 4.045 2.629 4.854 3.412 2.908 4.190 . 0 0 "[ . 1 .]" 1
661 1 107 GLU H 1 107 GLU HG3 3.244 2.109 3.893 2.939 2.055 3.874 0.054 9 0 "[ . 1 .]" 1
662 1 35 ARG HA 1 39 LEU H 3.896 2.533 4.675 4.307 3.711 4.670 . 0 0 "[ . 1 .]" 1
663 1 95 ARG H 1 95 ARG HB3 2.917 . 3.500 2.883 2.429 3.609 0.109 6 0 "[ . 1 .]" 1
664 1 36 LEU HA 1 39 LEU H 3.573 2.322 4.288 3.515 3.251 3.664 . 0 0 "[ . 1 .]" 1
665 1 50 ILE H 1 52 VAL H 4.745 3.084 5.694 4.501 4.318 4.765 . 0 0 "[ . 1 .]" 1
666 1 71 ALA H 1 72 ASP H 3.252 2.114 3.902 2.544 2.430 2.647 . 0 0 "[ . 1 .]" 1
667 1 82 HIS HA 1 85 GLU H 5.310 3.451 6.372 4.070 3.504 4.972 . 0 0 "[ . 1 .]" 1
668 1 34 ARG HB3 1 35 ARG H 3.233 2.102 3.880 3.096 2.353 4.052 0.172 4 0 "[ . 1 .]" 1
669 1 37 ALA H 1 37 ALA MB 2.663 . 3.196 2.232 2.216 2.246 . 0 0 "[ . 1 .]" 1
670 1 102 SER HA 1 103 LEU H 4.156 2.701 4.987 3.433 3.375 3.579 . 0 0 "[ . 1 .]" 1
671 1 131 SER H 1 131 SER HA 4.530 2.944 5.436 2.905 2.868 2.925 0.076 4 0 "[ . 1 .]" 1
672 1 11 ARG H 1 12 PRO HD3 3.303 2.147 3.964 3.050 2.504 3.469 . 0 0 "[ . 1 .]" 1
673 1 94 LYS H 1 94 LYS QE 4.911 3.192 5.893 4.653 4.129 5.612 . 0 0 "[ . 1 .]" 1
674 1 60 VAL H 1 60 VAL QG . 3.681 3.792 2.106 2.026 2.384 1.655 14 15 [*********-***+*] 1
675 1 45 GLY H 1 47 LYS H 4.319 2.807 5.183 3.932 3.579 4.516 . 0 0 "[ . 1 .]" 1
676 1 103 LEU H 1 105 SER H 4.194 2.726 5.033 4.000 3.694 4.340 . 0 0 "[ . 1 .]" 1
677 1 95 ARG H 1 97 ILE H 3.983 2.589 4.780 4.242 3.969 4.454 . 0 0 "[ . 1 .]" 1
678 1 39 LEU H 1 41 GLU H 4.326 2.812 5.191 4.315 4.046 4.522 . 0 0 "[ . 1 .]" 1
679 1 18 GLU H 1 19 ASP H 3.236 2.104 3.883 2.699 2.557 2.813 . 0 0 "[ . 1 .]" 1
680 1 83 VAL H 1 83 VAL HB 2.781 . 3.337 2.616 2.504 3.023 . 0 0 "[ . 1 .]" 1
681 1 79 MET H 1 79 MET QB 2.815 . 3.378 2.317 2.138 2.491 . 0 0 "[ . 1 .]" 1
682 1 39 LEU HA 1 40 GLN H 4.021 2.614 4.825 3.538 3.516 3.573 . 0 0 "[ . 1 .]" 1
683 1 88 GLN H 1 88 GLN HA 4.074 2.648 4.889 2.900 2.872 2.934 . 0 0 "[ . 1 .]" 1
684 1 93 VAL HB 1 96 LEU H 5.035 3.273 6.042 5.451 5.271 5.590 . 0 0 "[ . 1 .]" 1
685 1 107 GLU H 1 107 GLU HA 2.973 . 3.568 2.882 2.805 2.916 . 0 0 "[ . 1 .]" 1
686 1 109 ALA MB 1 110 ASN H 3.643 2.368 4.372 3.348 2.328 3.711 0.040 13 0 "[ . 1 .]" 1
687 1 50 ILE H 1 53 LYS QE 4.771 3.101 5.725 4.448 3.628 5.285 . 0 0 "[ . 1 .]" 1
688 1 28 VAL H 1 28 VAL HA 3.530 2.294 4.236 2.755 2.693 2.833 . 0 0 "[ . 1 .]" 1
689 1 118 ALA H 1 118 ALA MB 4.523 2.940 5.428 2.855 2.744 2.952 0.196 8 0 "[ . 1 .]" 1
690 1 52 VAL HB 1 53 LYS H 3.337 2.169 4.004 2.739 2.523 3.773 . 0 0 "[ . 1 .]" 1
691 1 48 LEU H 1 53 LYS QG 5.370 3.490 6.444 5.022 4.448 5.986 . 0 0 "[ . 1 .]" 1
692 1 82 HIS H 1 82 HIS HD1 4.739 3.080 5.687 4.700 4.154 5.540 . 0 0 "[ . 1 .]" 1
693 1 7 GLU H 1 8 ASP QB 5.196 3.377 6.235 4.413 4.238 4.705 . 0 0 "[ . 1 .]" 1
694 1 35 ARG H 1 37 ALA H 3.879 2.521 4.655 4.178 4.027 4.489 . 0 0 "[ . 1 .]" 1
695 1 6 MET QB 1 43 TRP HE1 3.814 2.479 4.577 2.791 2.445 3.148 0.034 3 0 "[ . 1 .]" 1
696 1 88 GLN H 1 89 TRP H 3.817 2.481 4.580 2.467 2.371 2.597 0.110 11 0 "[ . 1 .]" 1
697 1 32 ILE HA 1 35 ARG H 3.803 2.472 4.564 3.492 3.226 3.970 . 0 0 "[ . 1 .]" 1
698 1 112 GLU HB3 1 113 LYS H 4.331 2.815 5.197 3.683 2.160 4.520 0.655 15 1 "[ . 1 +]" 1
699 1 56 MET HB2 1 58 LEU H 4.857 3.157 5.828 5.564 5.485 5.700 . 0 0 "[ . 1 .]" 1
700 1 25 ARG H 1 28 VAL MG1 3.998 2.599 4.798 4.594 3.930 4.967 0.169 2 0 "[ . 1 .]" 1
701 1 73 ASP HB2 1 75 HIS H 4.940 3.211 5.928 5.548 5.387 5.670 . 0 0 "[ . 1 .]" 1
702 1 86 VAL MG2 1 90 MET H 4.218 2.742 5.062 4.560 3.806 5.076 0.014 4 0 "[ . 1 .]" 1
703 1 110 ASN HB3 1 111 GLU H 3.895 2.532 4.674 4.115 3.169 4.457 . 0 0 "[ . 1 .]" 1
704 1 108 ALA H 1 108 ALA MB 2.827 . 3.392 2.611 2.234 2.930 . 0 0 "[ . 1 .]" 1
705 1 81 ASP H 1 81 ASP QB 3.219 2.233 3.863 2.335 2.199 2.533 0.034 5 0 "[ . 1 .]" 1
706 1 92 GLY H 1 92 GLY HA3 3.566 2.318 4.279 2.297 2.286 2.313 0.032 3 0 "[ . 1 .]" 1
707 1 6 MET HA 1 8 ASP H 3.768 2.449 4.522 4.068 3.761 4.565 0.043 1 0 "[ . 1 .]" 1
708 1 80 VAL H 1 80 VAL HA 3.464 2.252 4.157 2.894 2.854 2.917 . 0 0 "[ . 1 .]" 1
709 1 9 VAL H 1 9 VAL HB 2.962 . 3.554 2.405 2.335 2.458 . 0 0 "[ . 1 .]" 1
710 1 31 ASP H 1 34 ARG H 3.936 2.558 4.723 4.745 4.690 4.811 0.088 14 0 "[ . 1 .]" 1
711 1 73 ASP H 1 74 ILE H 3.286 2.136 3.943 2.741 2.610 2.933 . 0 0 "[ . 1 .]" 1
712 1 31 ASP H 1 31 ASP QB 2.804 . 3.365 2.247 2.192 2.308 . 0 0 "[ . 1 .]" 1
713 1 63 LEU H 1 63 LEU MD1 3.790 2.464 4.548 4.090 4.042 4.169 . 0 0 "[ . 1 .]" 1
714 1 48 LEU H 1 48 LEU HB2 2.939 . 3.527 2.386 2.119 2.513 . 0 0 "[ . 1 .]" 1
715 1 5 VAL HA 1 6 MET H 3.260 2.119 3.912 2.203 2.126 2.329 . 0 0 "[ . 1 .]" 1
716 1 103 LEU QD 1 104 PHE H 4.167 2.708 5.000 3.872 2.688 4.267 0.020 9 0 "[ . 1 .]" 1
717 1 86 VAL H 1 86 VAL HA 3.544 2.304 4.253 2.941 2.867 2.956 . 0 0 "[ . 1 .]" 1
718 1 104 PHE H 1 104 PHE HB3 3.221 2.093 3.865 3.497 2.588 3.585 . 0 0 "[ . 1 .]" 1
719 1 54 LYS H 1 54 LYS QE 4.973 3.233 5.968 4.123 3.239 4.596 . 0 0 "[ . 1 .]" 1
720 1 32 ILE MD 1 33 SER H 3.993 2.595 4.792 4.625 4.286 4.831 0.039 7 0 "[ . 1 .]" 1
721 1 30 ASP HB2 1 33 SER H 4.929 3.204 5.915 5.756 5.444 6.290 0.375 1 0 "[ . 1 .]" 1
722 1 13 LEU H 1 13 LEU HB3 2.969 . 3.563 2.837 2.745 2.900 . 0 0 "[ . 1 .]" 1
723 1 27 GLN H 1 27 GLN HG3 3.896 2.532 4.675 4.114 2.907 4.846 0.171 11 0 "[ . 1 .]" 1
724 1 8 ASP H 1 9 VAL HB 3.827 2.487 4.592 4.618 4.530 4.655 0.063 12 0 "[ . 1 .]" 1
725 1 30 ASP HA 1 33 SER H 4.273 2.777 5.128 3.702 3.220 4.238 . 0 0 "[ . 1 .]" 1
726 1 12 PRO HB3 1 13 LEU H 3.707 2.410 4.448 4.268 3.849 4.404 . 0 0 "[ . 1 .]" 1
727 1 53 LYS HA 1 57 ALA H 4.591 2.984 5.509 4.207 3.836 4.746 . 0 0 "[ . 1 .]" 1
728 1 37 ALA H 1 39 LEU H 3.752 2.439 4.502 4.183 4.030 4.361 . 0 0 "[ . 1 .]" 1
729 1 47 LYS HB3 1 48 LEU H 3.783 2.459 4.540 4.088 3.271 4.436 . 0 0 "[ . 1 .]" 1
730 1 52 VAL HA 1 53 LYS H 3.879 2.521 4.655 3.537 3.505 3.571 . 0 0 "[ . 1 .]" 1
731 1 99 GLU H 1 99 GLU HB2 3.651 2.373 4.381 2.549 2.480 2.611 . 0 0 "[ . 1 .]" 1
732 1 127 PHE H 1 127 PHE HB3 4.172 2.712 5.006 3.360 2.444 4.117 0.268 14 0 "[ . 1 .]" 1
733 1 55 ARG H 1 55 ARG HB2 3.078 2.001 3.694 2.374 2.133 2.569 . 0 0 "[ . 1 .]" 1
734 1 50 ILE HA 1 54 LYS H 4.207 2.735 5.048 4.202 3.797 4.726 . 0 0 "[ . 1 .]" 1
735 1 7 GLU H 1 8 ASP HA 4.486 2.916 5.383 5.237 5.058 5.448 0.065 1 0 "[ . 1 .]" 1
736 1 130 ALA H 1 130 ALA HA 4.557 2.962 5.468 2.929 2.876 2.952 0.086 12 0 "[ . 1 .]" 1
737 1 110 ASN H 1 110 ASN HB3 3.432 2.231 4.118 3.268 2.479 4.115 . 0 0 "[ . 1 .]" 1
738 1 71 ALA H 1 71 ALA HA 3.414 2.219 4.097 2.834 2.810 2.863 . 0 0 "[ . 1 .]" 1
739 1 38 LEU H 1 39 LEU HB3 4.323 2.810 5.188 4.896 4.653 5.185 . 0 0 "[ . 1 .]" 1
740 1 77 SER H 1 77 SER HA 3.471 2.256 4.165 2.848 2.809 2.885 . 0 0 "[ . 1 .]" 1
741 1 22 GLY HA3 1 23 HIS H 4.225 2.746 5.070 2.796 2.131 3.227 0.615 9 2 "[ . - +1 .]" 1
742 1 76 ARG H 1 79 MET H 4.955 3.221 5.946 4.746 4.644 4.900 . 0 0 "[ . 1 .]" 1
743 1 3 GLU H 1 3 GLU QG 4.606 2.994 5.527 3.772 1.819 4.245 1.175 9 2 "[ -. +1 .]" 1
744 1 64 SER H 1 64 SER QB 3.289 2.138 3.947 2.533 2.248 2.832 . 0 0 "[ . 1 .]" 1
745 1 67 ARG H 1 68 TRP H 3.746 2.435 4.495 3.467 3.177 3.705 . 0 0 "[ . 1 .]" 1
746 1 121 ASN H 1 121 ASN HA 4.279 2.781 5.135 2.909 2.791 2.943 . 0 0 "[ . 1 .]" 1
747 1 100 LYS H 1 100 LYS HA 3.455 2.246 4.146 2.803 2.756 2.870 . 0 0 "[ . 1 .]" 1
748 1 27 GLN H 1 27 GLN HB2 3.361 2.184 4.033 3.357 2.539 3.643 . 0 0 "[ . 1 .]" 1
749 1 38 LEU H 1 40 GLN H 4.593 2.985 5.512 4.136 3.946 4.421 . 0 0 "[ . 1 .]" 1
750 1 81 ASP QB 1 82 HIS H 3.493 2.271 4.192 2.522 2.241 2.894 0.030 1 0 "[ . 1 .]" 1
751 1 47 LYS H 1 47 LYS QG 3.360 2.184 3.784 2.478 2.088 2.725 0.096 11 0 "[ . 1 .]" 1
752 1 102 SER H 1 102 SER HA 3.363 2.186 4.036 2.867 2.818 2.910 . 0 0 "[ . 1 .]" 1
753 1 38 LEU H 1 39 LEU MD1 5.670 3.685 6.500 5.995 5.764 6.157 . 0 0 "[ . 1 .]" 1
754 1 86 VAL MG2 1 89 TRP H 5.098 3.314 6.118 5.131 4.488 5.683 . 0 0 "[ . 1 .]" 1
755 1 63 LEU H 1 63 LEU MD2 3.488 2.267 4.186 4.195 4.172 4.218 0.032 11 0 "[ . 1 .]" 1
756 1 40 GLN H 1 40 GLN HB2 3.010 . 3.612 2.874 2.475 3.627 0.015 15 0 "[ . 1 .]" 1
757 1 80 VAL HA 1 81 ASP H 3.731 2.425 4.477 3.464 3.420 3.552 . 0 0 "[ . 1 .]" 1
758 1 63 LEU H 1 64 SER H 3.285 2.135 3.942 2.598 2.498 2.668 . 0 0 "[ . 1 .]" 1
759 1 31 ASP H 1 31 ASP HA 3.855 2.506 4.626 2.817 2.779 2.866 . 0 0 "[ . 1 .]" 1
760 1 63 LEU HA 1 64 SER H 3.585 2.330 4.302 3.419 3.379 3.468 . 0 0 "[ . 1 .]" 1
761 1 13 LEU H 1 13 LEU HB2 3.254 2.115 3.905 2.235 2.177 2.293 . 0 0 "[ . 1 .]" 1
762 1 85 GLU H 1 85 GLU QB 3.217 2.091 3.517 2.465 2.239 2.785 . 0 0 "[ . 1 .]" 1
763 1 49 SER H 1 49 SER HA 4.039 2.625 4.847 2.859 2.819 2.924 . 0 0 "[ . 1 .]" 1
764 1 97 ILE H 1 97 ILE HB 3.023 . 3.628 2.541 2.240 3.634 0.006 14 0 "[ . 1 .]" 1
765 1 2 SER HA 1 3 GLU H 4.899 3.184 5.879 3.414 3.014 3.569 0.170 4 0 "[ . 1 .]" 1
766 1 3 GLU H 1 3 GLU HB3 4.337 2.819 5.204 3.118 2.698 3.639 0.121 11 0 "[ . 1 .]" 1
767 1 57 ALA MB 1 61 GLN HE22 4.592 2.985 5.510 4.681 3.958 5.524 0.014 10 0 "[ . 1 .]" 1
768 1 66 HIS H 1 68 TRP H 5.348 3.476 6.418 5.578 5.370 5.768 . 0 0 "[ . 1 .]" 1
769 1 116 ALA H 1 116 ALA HA 3.865 2.512 4.638 2.842 2.306 2.946 0.206 1 0 "[ . 1 .]" 1
770 1 104 PHE HB3 1 105 SER H 3.745 2.434 4.494 3.755 3.324 4.115 . 0 0 "[ . 1 .]" 1
771 1 84 THR H 1 84 THR HB 3.809 2.476 4.571 3.418 2.604 3.742 . 0 0 "[ . 1 .]" 1
772 1 62 GLU HB3 1 65 SER H 4.630 3.010 5.556 4.944 4.628 5.155 . 0 0 "[ . 1 .]" 1
773 1 48 LEU H 1 48 LEU HG 3.610 2.347 4.332 2.466 2.286 2.898 0.061 1 0 "[ . 1 .]" 1
774 1 28 VAL MG2 1 31 ASP H 4.403 2.862 5.284 5.364 4.992 5.572 0.288 3 0 "[ . 1 .]" 1
775 1 15 GLN H 1 16 ALA H 3.092 2.010 3.710 2.561 2.402 2.712 . 0 0 "[ . 1 .]" 1
776 1 31 ASP QB 1 33 SER H 4.826 3.137 5.791 4.684 4.434 5.033 . 0 0 "[ . 1 .]" 1
777 1 94 LYS H 1 96 LEU H 4.342 2.822 5.210 4.048 3.865 4.205 . 0 0 "[ . 1 .]" 1
778 1 12 PRO HB2 1 13 LEU H 3.478 2.261 4.174 3.319 2.439 3.732 . 0 0 "[ . 1 .]" 1
779 1 53 LYS QG 1 54 LYS H 4.128 2.926 4.954 4.031 3.860 4.246 . 0 0 "[ . 1 .]" 1
780 1 9 VAL H 1 11 ARG H 3.863 2.511 4.636 4.122 3.878 4.387 . 0 0 "[ . 1 .]" 1
781 1 92 GLY H 1 93 VAL H 3.213 2.088 3.856 2.630 2.433 2.810 . 0 0 "[ . 1 .]" 1
782 1 46 GLY H 1 47 LYS QG 4.024 2.615 4.829 4.029 3.394 4.374 . 0 0 "[ . 1 .]" 1
783 1 69 ASP HA 1 72 ASP H 4.455 2.896 5.346 3.569 3.207 4.085 . 0 0 "[ . 1 .]" 1
784 1 61 GLN HB3 1 61 GLN HE21 3.822 2.484 4.586 4.089 2.774 4.489 . 0 0 "[ . 1 .]" 1
785 1 101 ARG HD3 1 102 SER H 5.026 3.267 6.031 5.617 4.735 6.211 0.180 10 0 "[ . 1 .]" 1
786 1 67 ARG H 1 67 ARG HA 3.682 2.393 4.418 2.923 2.896 2.939 . 0 0 "[ . 1 .]" 1
787 1 7 GLU QB 1 8 ASP H 3.458 2.248 4.150 2.668 2.413 2.879 . 0 0 "[ . 1 .]" 1
788 1 55 ARG H 1 55 ARG HD3 4.408 2.865 5.290 4.339 3.234 5.060 . 0 0 "[ . 1 .]" 1
789 1 10 LEU QD 1 11 ARG H 4.470 2.905 5.364 4.174 3.848 4.290 . 0 0 "[ . 1 .]" 1
790 1 43 TRP HE1 1 53 LYS QE 4.614 2.999 5.537 4.510 3.828 5.416 . 0 0 "[ . 1 .]" 1
791 1 77 SER H 1 80 VAL H 5.255 3.416 6.306 5.160 4.989 5.305 . 0 0 "[ . 1 .]" 1
792 1 89 TRP H 1 89 TRP HE1 4.875 3.169 5.850 5.167 5.039 5.349 . 0 0 "[ . 1 .]" 1
793 1 34 ARG H 1 36 LEU H 4.325 2.811 5.190 3.862 3.672 4.022 . 0 0 "[ . 1 .]" 1
794 1 102 SER H 1 103 LEU H 2.848 . 3.418 2.455 2.212 2.775 . 0 0 "[ . 1 .]" 1
795 1 40 GLN H 1 40 GLN HG3 3.575 2.324 4.290 3.133 1.811 4.424 0.513 3 1 "[ + . 1 .]" 1
796 1 102 SER H 1 102 SER HB2 2.929 . 3.515 2.637 2.498 3.531 0.016 7 0 "[ . 1 .]" 1
797 1 105 SER H 1 105 SER HA 3.536 2.298 4.243 2.877 2.808 2.931 . 0 0 "[ . 1 .]" 1
798 1 73 ASP HA 1 74 ILE H 4.316 2.806 5.179 3.548 3.494 3.589 . 0 0 "[ . 1 .]" 1
799 1 54 LYS H 1 54 LYS HB2 2.787 . 3.344 2.221 2.037 2.643 . 0 0 "[ . 1 .]" 1
800 1 39 LEU H 1 39 LEU HA 3.376 2.195 4.051 2.791 2.754 2.829 . 0 0 "[ . 1 .]" 1
801 1 56 MET HB3 1 57 ALA H 3.477 2.260 4.172 2.853 2.619 3.092 . 0 0 "[ . 1 .]" 1
802 1 15 GLN HB2 1 16 ALA H 3.010 . 3.612 3.814 2.939 4.183 0.571 1 3 "[+ * 1 -]" 1
803 1 53 LYS H 1 53 LYS QE 4.470 2.905 5.364 3.962 2.599 4.477 0.306 8 0 "[ . 1 .]" 1
804 1 123 THR HA 1 124 ILE H 4.126 2.682 4.951 3.253 2.586 3.560 0.096 3 0 "[ . 1 .]" 1
805 1 34 ARG H 1 34 ARG QD 4.138 2.690 4.966 4.357 3.923 4.746 . 0 0 "[ . 1 .]" 1
806 1 119 GLU H 1 119 GLU HA 3.617 2.351 4.340 2.811 2.268 2.943 0.083 7 0 "[ . 1 .]" 1
807 1 86 VAL H 1 86 VAL MG2 3.124 2.031 3.749 2.095 1.970 2.205 0.061 4 0 "[ . 1 .]" 1
808 1 98 ALA H 1 98 ALA HA 3.365 2.187 4.038 2.806 2.776 2.860 . 0 0 "[ . 1 .]" 1
809 1 105 SER H 1 105 SER HB2 3.095 2.012 3.714 2.690 2.424 3.588 . 0 0 "[ . 1 .]" 1
810 1 50 ILE H 1 50 ILE HG13 3.288 2.137 3.946 2.060 1.974 2.117 0.163 9 0 "[ . 1 .]" 1
811 1 9 VAL H 1 9 VAL HA 3.577 2.325 4.292 2.881 2.854 2.893 . 0 0 "[ . 1 .]" 1
812 1 62 GLU H 1 62 GLU HG3 3.200 2.080 3.840 3.609 2.457 4.242 0.402 4 0 "[ . 1 .]" 1
813 1 80 VAL H 1 81 ASP QB 4.014 2.609 4.817 4.182 4.007 4.471 . 0 0 "[ . 1 .]" 1
814 1 28 VAL H 1 28 VAL MG1 3.026 . 3.631 3.045 1.934 3.783 0.152 12 0 "[ . 1 .]" 1
815 1 39 LEU H 1 39 LEU HB2 2.915 . 3.498 2.274 2.187 2.393 . 0 0 "[ . 1 .]" 1
816 1 68 TRP H 1 68 TRP HE3 3.843 2.498 4.612 4.353 4.115 4.686 0.074 14 0 "[ . 1 .]" 1
817 1 68 TRP H 1 71 ALA MB 4.206 2.734 5.047 4.660 4.385 5.083 0.036 14 0 "[ . 1 .]" 1
818 1 97 ILE MG 1 98 ALA H 3.411 2.911 4.093 3.339 2.897 4.154 0.061 14 0 "[ . 1 .]" 1
819 1 49 SER QB 1 53 LYS H 5.249 3.412 6.299 5.393 4.934 5.892 . 0 0 "[ . 1 .]" 1
820 1 100 LYS H 1 100 LYS HB2 3.096 2.012 3.715 2.271 2.117 2.450 . 0 0 "[ . 1 .]" 1
821 1 104 PHE H 1 104 PHE HA 3.803 2.472 4.564 2.818 2.755 2.865 . 0 0 "[ . 1 .]" 1
822 1 14 GLU H 1 14 GLU HG3 3.070 . 3.684 3.242 2.195 3.684 . 0 0 "[ . 1 .]" 1
823 1 77 SER H 1 79 MET QG 4.981 3.238 5.977 5.343 4.514 5.640 . 0 0 "[ . 1 .]" 1
824 1 103 LEU HB2 1 105 SER H 4.441 2.887 5.329 5.267 4.879 5.531 0.202 6 0 "[ . 1 .]" 1
825 1 76 ARG HA 1 79 MET H 3.793 2.465 4.552 3.728 3.437 4.219 . 0 0 "[ . 1 .]" 1
826 1 75 HIS H 1 75 HIS HA 3.953 2.569 4.744 2.844 2.824 2.867 . 0 0 "[ . 1 .]" 1
827 1 99 GLU HA 1 100 LYS H 3.551 2.308 4.261 3.498 3.420 3.534 . 0 0 "[ . 1 .]" 1
828 1 25 ARG H 1 25 ARG HB2 2.870 . 3.444 2.849 2.436 3.654 0.210 1 0 "[ . 1 .]" 1
829 1 73 ASP H 1 75 HIS H 4.497 2.923 5.396 4.072 3.801 4.289 . 0 0 "[ . 1 .]" 1
830 1 19 ASP H 1 21 ARG H 4.280 2.782 5.136 3.879 3.650 4.483 . 0 0 "[ . 1 .]" 1
831 1 108 ALA H 1 108 ALA HA 2.915 . 3.498 2.690 2.259 2.948 . 0 0 "[ . 1 .]" 1
832 1 32 ILE H 1 32 ILE HB 2.764 . 3.317 2.517 2.438 2.708 . 0 0 "[ . 1 .]" 1
833 1 103 LEU QD 1 105 SER H 5.221 3.393 6.265 4.885 4.123 5.207 . 0 0 "[ . 1 .]" 1
834 1 15 GLN QG 1 18 GLU H 4.986 3.241 5.983 5.036 4.565 5.562 . 0 0 "[ . 1 .]" 1
835 1 69 ASP H 1 69 ASP HB2 3.342 2.172 4.010 2.582 2.388 3.601 . 0 0 "[ . 1 .]" 1
836 1 16 ALA H 1 17 LEU QD 3.829 2.489 4.595 4.287 3.250 4.663 0.068 1 0 "[ . 1 .]" 1
837 1 98 ALA H 1 98 ALA MB 2.729 . 3.275 2.229 2.218 2.248 . 0 0 "[ . 1 .]" 1
838 1 62 GLU HA 1 65 SER H 5.168 3.359 6.202 3.629 3.355 3.853 0.004 5 0 "[ . 1 .]" 1
839 1 35 ARG HA 1 38 LEU H 3.184 2.069 3.821 3.246 3.059 3.581 . 0 0 "[ . 1 .]" 1
840 1 100 LYS HA 1 101 ARG H 4.059 2.638 4.871 3.492 3.408 3.569 . 0 0 "[ . 1 .]" 1
841 1 47 LYS H 1 47 LYS HB3 3.264 2.122 3.917 3.870 3.573 3.997 0.080 8 0 "[ . 1 .]" 1
842 1 97 ILE MD 1 98 ALA H 3.686 2.396 4.423 4.084 2.281 4.422 0.115 14 0 "[ . 1 .]" 1
843 1 109 ALA H 1 109 ALA MB 2.871 . 3.445 2.355 2.239 2.726 . 0 0 "[ . 1 .]" 1
844 1 113 LYS H 1 113 LYS HG3 4.086 2.656 4.903 3.483 1.711 4.498 0.945 5 1 "[ + 1 .]" 1
845 1 33 SER HA 1 35 ARG H 4.019 2.612 4.823 4.352 4.198 4.643 . 0 0 "[ . 1 .]" 1
846 1 84 THR HB 1 85 GLU H 4.319 2.807 5.183 3.869 2.775 4.394 0.032 13 0 "[ . 1 .]" 1
847 1 32 ILE HA 1 34 ARG H 4.987 3.241 5.984 4.443 4.162 4.689 . 0 0 "[ . 1 .]" 1
848 1 66 HIS HB3 1 68 TRP HE1 4.415 2.870 5.298 2.930 2.781 3.835 0.089 10 0 "[ . 1 .]" 1
849 1 39 LEU MD1 1 43 TRP HZ3 5.156 3.351 5.196 4.864 4.667 5.059 . 0 0 "[ . 1 .]" 1
850 1 106 GLU HA 1 106 GLU HG2 3.431 2.230 4.117 3.098 2.344 3.775 . 0 0 "[ . 1 .]" 1
851 1 113 LYS HA 1 113 LYS HD3 4.408 2.865 5.290 4.241 2.844 4.838 0.021 15 0 "[ . 1 .]" 1
852 1 39 LEU MD2 1 43 TRP QB 4.391 3.067 5.269 2.807 2.673 2.969 0.394 5 0 "[ . 1 .]" 1
853 1 68 TRP HZ3 1 100 LYS HB3 . 3.722 5.423 5.528 5.353 5.788 0.365 7 0 "[ . 1 .]" 1
854 1 72 ASP HA 1 72 ASP HB3 4.428 2.878 5.314 3.001 2.676 3.028 0.202 6 0 "[ . 1 .]" 1
855 1 110 ASN HA 1 113 LYS HB2 4.900 3.185 5.880 4.781 3.283 5.613 . 0 0 "[ . 1 .]" 1
856 1 94 LYS QE 1 94 LYS HG3 4.087 2.657 4.904 2.808 2.267 3.507 0.390 2 0 "[ . 1 .]" 1
857 1 63 LEU MD1 1 64 SER HA 4.403 2.862 5.284 5.284 5.070 5.352 0.068 2 0 "[ . 1 .]" 1
858 1 76 ARG QB 1 76 ARG HG2 3.786 2.461 4.543 2.334 2.293 2.417 0.168 6 0 "[ . 1 .]" 1
859 1 58 LEU HA 1 58 LEU HB3 3.623 2.355 4.348 2.617 2.402 3.026 . 0 0 "[ . 1 .]" 1
860 1 20 CYS QB 1 103 LEU QD 5.891 4.026 6.500 3.970 3.551 4.962 0.475 3 0 "[ . 1 .]" 1
861 1 62 GLU HA 1 62 GLU HG3 5.193 3.375 6.232 3.589 2.603 3.850 0.772 5 2 "[ -+ 1 .]" 1
862 1 43 TRP HE3 1 48 LEU MD1 . 3.498 5.024 3.495 3.331 3.643 0.167 4 0 "[ . 1 .]" 1
863 1 3 GLU QG 1 4 ALA MB 4.394 2.856 5.273 4.069 2.799 4.803 0.057 8 0 "[ . 1 .]" 1
864 1 113 LYS HB2 1 113 LYS HG3 3.860 2.509 4.632 2.610 2.342 3.020 0.167 6 0 "[ . 1 .]" 1
865 1 29 CYS HA 1 32 ILE MD 3.841 2.497 4.609 3.315 2.450 4.417 0.047 12 0 "[ . 1 .]" 1
866 1 52 VAL QG 1 82 HIS QB 4.270 2.776 5.124 2.869 2.172 3.567 0.604 3 1 "[ + . 1 .]" 1
867 1 88 GLN QB 1 89 TRP HA 5.869 3.815 6.500 4.162 3.724 4.437 0.091 3 0 "[ . 1 .]" 1
868 1 81 ASP HA 1 81 ASP QB 3.924 2.627 4.709 2.389 2.337 2.500 0.290 6 0 "[ . 1 .]" 1
869 1 9 VAL MG2 1 56 MET QG 5.307 3.450 6.368 4.455 3.384 5.118 0.066 6 0 "[ . 1 .]" 1
870 1 7 GLU HA 1 8 ASP HA 5.623 3.655 6.500 4.758 4.683 4.823 . 0 0 "[ . 1 .]" 1
871 1 17 LEU HB2 1 17 LEU QD 3.812 2.478 4.574 2.153 2.079 2.423 0.399 13 0 "[ . 1 .]" 1
872 1 10 LEU QD 1 40 GLN HA 4.243 2.758 5.092 3.898 2.697 4.675 0.061 3 0 "[ . 1 .]" 1
873 1 55 ARG HA 1 58 LEU QD 3.444 2.239 4.133 2.497 2.032 3.558 0.207 12 0 "[ . 1 .]" 1
874 1 39 LEU MD1 1 43 TRP HE3 . 4.051 5.785 4.454 4.344 4.599 . 0 0 "[ . 1 .]" 1
875 1 12 PRO HB2 1 13 LEU HA 5.137 3.339 6.164 4.025 3.842 4.275 . 0 0 "[ . 1 .]" 1
876 1 68 TRP HZ3 1 100 LYS HB2 5.623 3.655 6.500 5.436 5.133 5.814 . 0 0 "[ . 1 .]" 1
877 1 43 TRP HA 1 48 LEU HB2 3.853 2.504 4.624 2.725 2.417 3.377 0.087 2 0 "[ . 1 .]" 1
878 1 63 LEU MD2 1 68 TRP HZ3 5.289 3.438 6.347 4.953 4.455 5.403 . 0 0 "[ . 1 .]" 1
879 1 100 LYS HE2 1 100 LYS QG 4.419 2.872 5.303 2.724 2.308 3.494 0.564 14 1 "[ . 1 +.]" 1
880 1 97 ILE HB 1 97 ILE MD 3.934 2.557 4.721 2.725 2.401 3.251 0.156 14 0 "[ . 1 .]" 1
881 1 36 LEU HB2 1 36 LEU MD1 3.955 2.571 4.746 2.488 2.248 3.194 0.323 8 0 "[ . 1 .]" 1
882 1 56 MET HA 1 56 MET HB3 3.791 2.464 4.549 3.012 2.937 3.032 . 0 0 "[ . 1 .]" 1
883 1 6 MET HA 1 6 MET QB 3.911 2.542 4.511 2.302 2.179 2.377 0.363 11 0 "[ . 1 .]" 1
884 1 82 HIS HA 1 86 VAL MG2 6.077 3.950 6.500 4.818 4.504 5.891 . 0 0 "[ . 1 .]" 1
885 1 59 LEU HA 1 74 ILE MG 3.924 2.551 4.709 3.370 2.686 3.822 . 0 0 "[ . 1 .]" 1
886 1 17 LEU HA 1 17 LEU HG 4.064 2.642 4.877 3.063 2.591 4.000 0.051 5 0 "[ . 1 .]" 1
887 1 59 LEU HA 1 59 LEU QD 4.454 2.895 5.345 2.969 2.037 3.150 0.858 14 1 "[ . 1 +.]" 1
888 1 7 GLU QB 1 7 GLU HG3 3.519 2.287 4.223 2.308 2.154 2.462 0.133 5 0 "[ . 1 .]" 1
889 1 78 LEU QB 1 78 LEU QD 3.707 2.474 4.448 1.956 1.930 1.976 0.544 3 14 "[**+**** *-*****]" 1
890 1 6 MET ME 1 43 TRP QB 6.043 3.928 6.175 3.675 3.207 4.665 0.721 1 5 "[+ *-* *1 .]" 1
891 1 49 SER HA 1 50 ILE MD 4.886 3.176 5.863 5.013 4.497 5.284 . 0 0 "[ . 1 .]" 1
892 1 50 ILE HA 1 50 ILE HG13 4.154 2.700 4.985 2.875 2.677 3.003 0.023 4 0 "[ . 1 .]" 1
893 1 120 LYS QE 1 120 LYS QG 3.454 2.245 4.145 2.370 2.093 2.741 0.152 6 0 "[ . 1 .]" 1
894 1 21 ARG HD3 1 21 ARG HG3 3.570 2.320 4.284 2.792 2.420 3.015 . 0 0 "[ . 1 .]" 1
895 1 83 VAL HB 1 83 VAL MG1 3.236 2.103 3.883 2.124 2.117 2.126 . 0 0 "[ . 1 .]" 1
896 1 48 LEU HB2 1 53 LYS QE 4.309 2.801 5.171 2.870 2.061 4.048 0.740 3 2 "[- + . 1 .]" 1
897 1 37 ALA HA 1 40 GLN HB2 3.945 2.564 4.734 3.545 2.501 5.073 0.339 15 0 "[ . 1 .]" 1
898 1 125 PRO QG 1 127 PHE HB3 4.601 2.991 5.521 4.352 2.870 5.718 0.197 1 0 "[ . 1 .]" 1
899 1 13 LEU HA 1 13 LEU HB3 4.612 2.998 5.534 2.991 2.975 3.011 0.023 6 0 "[ . 1 .]" 1
900 1 66 HIS HB2 1 68 TRP HD1 . 3.358 5.160 4.947 3.350 5.230 0.070 6 0 "[ . 1 .]" 1
901 1 101 ARG HA 1 101 ARG HD3 5.325 3.461 6.390 4.093 3.202 4.892 0.259 9 0 "[ . 1 .]" 1
902 1 36 LEU HB2 1 36 LEU MD2 3.523 2.290 4.228 3.004 2.342 3.223 . 0 0 "[ . 1 .]" 1
903 1 120 LYS QG 1 121 ASN HB2 5.315 3.455 6.378 5.606 4.155 6.307 . 0 0 "[ . 1 .]" 1
904 1 80 VAL HA 1 80 VAL QG 3.214 2.567 3.857 2.320 2.270 2.385 0.297 5 0 "[ . 1 .]" 1
905 1 59 LEU QD 1 71 ALA HA 4.120 2.678 4.944 3.333 1.922 4.238 0.756 14 1 "[ . 1 +.]" 1
906 1 94 LYS HA 1 94 LYS QE 5.286 3.436 6.343 4.455 2.393 5.691 1.043 15 2 "[ -. 1 +]" 1
907 1 6 MET ME 1 43 TRP HA 4.850 3.153 5.820 5.734 5.366 5.917 0.097 2 0 "[ . 1 .]" 1
908 1 5 VAL HA 1 8 ASP QB 5.575 3.624 6.500 4.877 4.187 5.577 . 0 0 "[ . 1 .]" 1
909 1 34 ARG QD 1 35 ARG HA 4.406 2.864 5.287 4.521 2.874 5.078 . 0 0 "[ . 1 .]" 1
910 1 78 LEU HA 1 82 HIS QB 5.115 3.325 6.138 3.908 2.952 4.540 0.373 12 0 "[ . 1 .]" 1
911 1 33 SER QB 1 34 ARG HG3 5.591 3.634 6.500 6.066 5.536 6.480 . 0 0 "[ . 1 .]" 1
912 1 39 LEU HA 1 39 LEU MD1 4.852 3.154 5.822 3.638 3.498 3.703 . 0 0 "[ . 1 .]" 1
913 1 97 ILE HA 1 97 ILE MG 3.677 2.390 4.412 2.499 2.293 2.668 0.097 14 0 "[ . 1 .]" 1
914 1 76 ARG QB 1 76 ARG HD3 . 2.556 3.792 2.713 2.324 3.305 0.232 2 0 "[ . 1 .]" 1
915 1 38 LEU HB2 1 89 TRP HA 4.774 3.103 5.729 5.814 5.743 5.966 0.237 7 0 "[ . 1 .]" 1
916 1 43 TRP HZ3 1 57 ALA MB 5.117 3.326 6.140 4.844 3.989 6.100 . 0 0 "[ . 1 .]" 1
917 1 51 PRO HA 1 51 PRO HG2 4.038 2.625 4.846 3.894 3.867 3.924 . 0 0 "[ . 1 .]" 1
918 1 43 TRP QB 1 48 LEU MD1 4.421 3.148 5.305 2.922 2.759 3.151 0.389 2 0 "[ . 1 .]" 1
919 1 12 PRO HA 1 60 VAL QG 5.360 3.484 6.432 4.755 4.438 5.202 . 0 0 "[ . 1 .]" 1
920 1 51 PRO HB2 1 52 VAL HA 5.522 3.589 6.500 3.851 3.709 3.998 . 0 0 "[ . 1 .]" 1
921 1 115 ALA HA 1 115 ALA MB 3.173 2.062 3.808 2.130 2.124 2.133 . 0 0 "[ . 1 .]" 1
922 1 10 LEU HA 1 10 LEU QD 3.909 2.541 4.691 2.362 2.318 2.440 0.223 6 0 "[ . 1 .]" 1
923 1 14 GLU HB2 1 14 GLU HG3 3.324 2.161 3.989 2.447 2.326 2.525 . 0 0 "[ . 1 .]" 1
924 1 111 GLU HA 1 111 GLU HB2 3.227 2.097 3.872 2.541 2.388 3.025 . 0 0 "[ . 1 .]" 1
925 1 61 GLN HA 1 61 GLN HG3 4.000 2.600 4.800 3.722 3.116 3.852 . 0 0 "[ . 1 .]" 1
926 1 6 MET QB 1 6 MET ME . 3.036 3.523 2.536 2.011 3.427 1.025 2 10 "[*+* *-* *1 ***]" 1
927 1 39 LEU MD1 1 56 MET ME 3.667 2.383 4.400 2.304 2.198 2.409 0.185 11 0 "[ . 1 .]" 1
928 1 63 LEU HG 1 64 SER HA 4.189 2.723 5.027 4.028 3.917 4.160 . 0 0 "[ . 1 .]" 1
929 1 74 ILE HB 1 75 HIS HA 4.515 2.935 5.418 4.664 4.542 4.897 . 0 0 "[ . 1 .]" 1
930 1 49 SER QB 1 50 ILE MD 4.523 2.940 5.428 5.021 4.208 5.224 . 0 0 "[ . 1 .]" 1
931 1 59 LEU MD1 1 59 LEU MD2 2.974 . 3.569 2.068 2.062 2.076 . 0 0 "[ . 1 .]" 1
932 1 48 LEU HB3 1 53 LYS HA 6.099 3.964 6.500 5.407 4.802 6.182 . 0 0 "[ . 1 .]" 1
933 1 67 ARG QB 1 67 ARG HD2 3.440 2.236 4.128 2.860 2.326 3.423 . 0 0 "[ . 1 .]" 1
934 1 62 GLU HB2 1 62 GLU HG3 3.804 2.473 4.565 2.487 2.332 3.000 0.141 9 0 "[ . 1 .]" 1
935 1 30 ASP HB2 1 31 ASP QB 5.295 3.442 6.354 4.638 3.694 5.497 . 0 0 "[ . 1 .]" 1
936 1 43 TRP QB 1 48 LEU HG 5.466 3.553 6.500 4.603 4.102 4.858 . 0 0 "[ . 1 .]" 1
937 1 12 PRO HB3 1 12 PRO HD3 4.826 3.137 5.791 3.462 3.070 4.039 0.067 3 0 "[ . 1 .]" 1
938 1 48 LEU HB2 1 48 LEU MD1 3.604 2.343 4.325 2.323 2.299 2.392 0.044 12 0 "[ . 1 .]" 1
939 1 99 GLU HA 1 99 GLU HG3 5.919 3.847 6.500 3.671 3.132 3.843 0.715 15 3 "[ - . * 1 +]" 1
940 1 53 LYS QB 1 53 LYS QD 4.349 2.839 4.873 2.206 2.124 2.704 0.715 7 13 "[******+ *1-****]" 1
941 1 36 LEU MD2 1 37 ALA HA 5.288 3.437 6.346 4.217 3.389 5.760 0.048 5 0 "[ . 1 .]" 1
942 1 21 ARG HA 1 21 ARG QB 3.451 2.243 4.141 2.355 2.156 2.493 0.087 1 0 "[ . 1 .]" 1
943 1 110 ASN HA 1 110 ASN HB3 3.472 2.257 4.166 2.771 2.327 3.031 . 0 0 "[ . 1 .]" 1
944 1 27 GLN HB2 1 27 GLN HG3 3.286 2.136 3.943 2.549 2.354 3.000 . 0 0 "[ . 1 .]" 1
945 1 17 LEU QD 1 17 LEU HG 3.194 2.076 3.833 1.890 1.885 1.894 0.191 7 0 "[ . 1 .]" 1
946 1 93 VAL HB 1 96 LEU HB2 5.161 3.354 6.193 5.908 5.273 6.234 0.041 6 0 "[ . 1 .]" 1
947 1 56 MET ME 1 59 LEU QB 4.201 2.731 5.041 3.406 3.053 4.463 . 0 0 "[ . 1 .]" 1
948 1 60 VAL QG 1 63 LEU MD2 3.408 2.554 4.090 2.928 2.434 3.269 0.120 10 0 "[ . 1 .]" 1
949 1 74 ILE MD 1 75 HIS QB 4.482 2.913 5.378 3.482 2.681 3.984 0.232 1 0 "[ . 1 .]" 1
950 1 56 MET ME 1 59 LEU QD 3.461 2.250 3.985 2.466 2.057 3.325 0.193 4 0 "[ . 1 .]" 1
951 1 56 MET QG 1 59 LEU QD 5.283 3.434 6.340 2.989 2.369 3.854 1.065 4 7 "[** +. ** - *.]" 1
952 1 62 GLU HA 1 65 SER QB 4.577 2.975 5.338 3.380 2.848 4.031 0.127 8 0 "[ . 1 .]" 1
953 1 4 ALA MB 1 5 VAL HA 5.169 3.360 6.203 4.308 4.186 4.430 . 0 0 "[ . 1 .]" 1
954 1 56 MET ME 1 60 VAL QG 3.458 2.248 4.150 2.961 2.442 4.033 . 0 0 "[ . 1 .]" 1
955 1 9 VAL HB 1 43 TRP HZ2 . 3.511 4.910 4.925 4.644 5.021 0.111 14 0 "[ . 1 .]" 1
956 1 9 VAL MG1 1 10 LEU QD 3.646 2.370 4.375 3.405 1.927 4.194 0.443 12 0 "[ . 1 .]" 1
957 1 32 ILE HB 1 32 ILE MG 3.359 2.183 4.031 2.135 2.123 2.137 0.060 14 0 "[ . 1 .]" 1
958 1 15 GLN HA 1 15 GLN HB3 3.254 2.115 3.905 2.905 2.417 3.027 . 0 0 "[ . 1 .]" 1
959 1 37 ALA HA 1 37 ALA MB 3.083 2.004 3.700 2.125 2.121 2.128 . 0 0 "[ . 1 .]" 1
960 1 71 ALA MB 1 72 ASP HA 4.894 3.181 5.873 3.980 3.937 4.042 . 0 0 "[ . 1 .]" 1
961 1 12 PRO HD3 1 60 VAL QG 4.943 3.329 5.932 3.770 3.430 4.073 . 0 0 "[ . 1 .]" 1
962 1 17 LEU QD 1 29 CYS HA 3.602 2.341 4.322 3.927 2.716 4.362 0.040 3 0 "[ . 1 .]" 1
963 1 95 ARG HA 1 95 ARG HD3 4.044 2.629 4.853 4.422 1.924 4.880 0.705 6 1 "[ .+ 1 .]" 1
964 1 36 LEU HB3 1 36 LEU MD1 3.468 2.254 4.162 2.462 2.246 3.211 0.008 9 0 "[ . 1 .]" 1
965 1 75 HIS HD1 1 86 VAL HB 6.027 3.918 6.500 6.405 5.876 6.602 0.102 11 0 "[ . 1 .]" 1
966 1 50 ILE HA 1 50 ILE HB 4.361 2.835 5.233 3.021 3.016 3.028 . 0 0 "[ . 1 .]" 1
967 1 43 TRP QB 1 43 TRP HD1 . 3.156 4.601 2.896 2.790 2.989 0.366 1 0 "[ . 1 .]" 1
968 1 50 ILE HG12 1 51 PRO HD3 5.664 3.682 6.500 5.147 4.780 5.344 . 0 0 "[ . 1 .]" 1
969 1 48 LEU HB2 1 52 VAL QG 5.431 3.530 6.500 3.922 3.584 4.273 . 0 0 "[ . 1 .]" 1
970 1 60 VAL QG 1 63 LEU HB2 5.175 3.364 6.210 4.042 3.830 4.485 . 0 0 "[ . 1 .]" 1
971 1 6 MET HA 1 6 MET ME 4.889 3.178 5.867 4.621 3.724 5.299 . 0 0 "[ . 1 .]" 1
972 1 90 MET ME 1 94 LYS QE 5.450 3.543 6.500 4.240 2.266 5.932 1.277 10 1 "[ . + .]" 1
973 1 100 LYS HB2 1 100 LYS HE2 4.576 2.974 5.491 4.963 4.438 5.507 0.016 12 0 "[ . 1 .]" 1
974 1 54 LYS HB2 1 54 LYS HG2 3.665 2.382 4.398 2.770 2.514 3.000 . 0 0 "[ . 1 .]" 1
975 1 47 LYS HA 1 47 LYS QG 3.990 2.856 4.788 2.546 2.381 2.760 0.475 2 0 "[ . 1 .]" 1
976 1 11 ARG HB2 1 11 ARG HD3 4.485 2.915 5.382 3.124 2.322 4.247 0.593 1 2 "[+ . 1 - .]" 1
977 1 50 ILE HA 1 53 LYS QD 5.137 3.339 6.007 3.729 3.258 4.173 0.081 5 0 "[ . 1 .]" 1
978 1 4 ALA HA 1 4 ALA MB 2.831 . 3.397 2.129 2.123 2.134 . 0 0 "[ . 1 .]" 1
979 1 77 SER HA 1 80 VAL QG 4.082 2.653 4.898 2.685 2.564 2.873 0.089 10 0 "[ . 1 .]" 1
980 1 6 MET QG 1 40 GLN HA 5.108 3.320 6.130 3.858 2.863 5.659 0.457 11 0 "[ . 1 .]" 1
981 1 56 MET HA 1 78 LEU QD 5.470 3.555 6.500 3.842 3.326 4.813 0.229 15 0 "[ . 1 .]" 1
982 1 65 SER QB 1 67 ARG QB 4.159 3.290 4.991 3.166 2.185 3.941 1.105 12 1 "[ . 1 + .]" 1
983 1 54 LYS HA 1 54 LYS HG2 3.517 2.286 4.220 3.190 2.577 3.699 . 0 0 "[ . 1 .]" 1
984 1 100 LYS HE2 1 103 LEU QD 4.016 2.610 4.757 3.241 2.262 5.174 0.417 10 0 "[ . 1 .]" 1
985 1 38 LEU HB2 1 89 TRP HE3 5.370 3.490 6.444 5.066 4.584 6.146 . 0 0 "[ . 1 .]" 1
986 1 54 LYS QE 1 54 LYS HG2 3.797 2.468 4.556 2.787 2.209 3.453 0.259 2 0 "[ . 1 .]" 1
987 1 52 VAL HB 1 86 VAL MG1 3.277 2.130 3.932 3.925 3.114 4.087 0.155 13 0 "[ . 1 .]" 1
988 1 79 MET QB 1 83 VAL HB 5.311 3.452 6.373 3.875 3.064 4.630 0.388 9 0 "[ . 1 .]" 1
989 1 49 SER HA 1 51 PRO HD2 4.359 2.833 5.231 3.855 3.673 4.185 . 0 0 "[ . 1 .]" 1
990 1 52 VAL HA 1 52 VAL QG 3.577 2.359 4.292 2.131 2.111 2.190 0.248 2 0 "[ . 1 .]" 1
991 1 17 LEU HA 1 17 LEU HB3 3.787 2.462 4.544 2.751 2.350 2.958 0.112 7 0 "[ . 1 .]" 1
992 1 62 GLU HG3 1 71 ALA HA 5.288 3.437 6.346 4.543 3.394 5.911 0.043 2 0 "[ . 1 .]" 1
993 1 7 GLU HA 1 10 LEU HB3 3.881 2.523 4.657 3.353 2.742 4.183 . 0 0 "[ . 1 .]" 1
994 1 28 VAL HA 1 28 VAL MG1 3.061 . 3.673 2.410 2.355 2.458 . 0 0 "[ . 1 .]" 1
995 1 58 LEU HA 1 61 GLN HB3 3.864 2.512 4.637 4.569 4.295 4.817 0.180 3 0 "[ . 1 .]" 1
996 1 82 HIS QB 1 85 GLU QB 5.026 3.366 6.023 2.154 1.807 3.229 1.559 14 13 "[****** - ****+*]" 1
997 1 52 VAL QG 1 89 TRP HZ2 3.759 2.443 4.511 3.148 2.572 4.027 . 0 0 "[ . 1 .]" 1
998 1 48 LEU HA 1 52 VAL QG 5.421 3.524 5.687 4.081 3.283 4.884 0.241 2 0 "[ . 1 .]" 1
999 1 93 VAL MG2 1 96 LEU HB3 5.384 3.500 6.461 5.032 4.547 6.459 . 0 0 "[ . 1 .]" 1
1000 1 113 LYS HA 1 113 LYS HB2 3.702 2.406 4.442 2.622 2.388 3.032 0.018 6 0 "[ . 1 .]" 1
1001 1 86 VAL HB 1 89 TRP HD1 . 4.116 5.989 5.103 4.356 5.921 . 0 0 "[ . 1 .]" 1
1002 1 5 VAL HA 1 5 VAL HB 3.883 2.524 4.660 2.736 2.456 3.032 0.068 12 0 "[ . 1 .]" 1
1003 1 59 LEU QD 1 72 ASP HA 5.573 3.623 6.500 4.792 3.801 5.690 . 0 0 "[ . 1 .]" 1
1004 1 59 LEU HA 1 71 ALA HA 4.339 2.820 5.207 3.675 3.106 4.416 . 0 0 "[ . 1 .]" 1
1005 1 78 LEU HA 1 80 VAL QG 4.602 2.991 5.522 4.180 3.780 4.419 . 0 0 "[ . 1 .]" 1
1006 1 43 TRP HZ2 1 53 LYS QD . 3.471 4.100 3.297 3.088 4.146 0.383 3 0 "[ . 1 .]" 1
1007 1 61 GLN HA 1 64 SER QB 3.902 2.536 4.682 3.954 3.336 4.546 . 0 0 "[ . 1 .]" 1
1008 1 43 TRP HE3 1 53 LYS QB 6.500 4.225 6.500 4.923 4.576 5.673 . 0 0 "[ . 1 .]" 1
1009 1 71 ALA HA 1 71 ALA MB 3.339 2.170 4.007 2.133 2.127 2.136 0.043 6 0 "[ . 1 .]" 1
1010 1 15 GLN HB2 1 15 GLN QG . 2.663 3.887 2.320 2.141 2.390 0.522 6 1 "[ .+ 1 .]" 1
1011 1 10 LEU HA 1 10 LEU HB3 4.136 2.688 4.963 2.865 2.435 2.991 0.253 7 0 "[ . 1 .]" 1
1012 1 96 LEU HB2 1 96 LEU MD2 3.815 2.480 4.578 2.854 2.405 3.224 0.075 7 0 "[ . 1 .]" 1
1013 1 39 LEU MD2 1 43 TRP HA 5.463 3.551 6.500 5.024 4.923 5.123 . 0 0 "[ . 1 .]" 1
1014 1 124 ILE HA 1 124 ILE QG 4.384 2.852 5.261 2.653 2.553 2.942 0.299 13 0 "[ . 1 .]" 1
1015 1 99 GLU HA 1 99 GLU HB3 4.114 2.674 4.937 2.563 2.422 3.036 0.252 10 0 "[ . 1 .]" 1
1016 1 59 LEU QB 1 74 ILE MD 4.056 2.636 4.867 2.917 2.173 3.624 0.463 10 0 "[ . 1 .]" 1
1017 1 47 LYS HA 1 47 LYS HB3 3.777 2.455 4.532 2.466 2.429 2.510 0.026 6 0 "[ . 1 .]" 1
1018 1 120 LYS HA 1 120 LYS QE 5.107 3.320 6.128 4.368 3.953 4.710 . 0 0 "[ . 1 .]" 1
1019 1 51 PRO HA 1 54 LYS HB2 3.933 2.556 4.720 2.860 2.518 3.308 0.038 1 0 "[ . 1 .]" 1
1020 1 56 MET HA 1 74 ILE MD 5.583 3.629 6.500 3.884 3.551 4.916 0.078 2 0 "[ . 1 .]" 1
1021 1 6 MET HA 1 9 VAL MG2 4.354 2.830 5.225 3.151 2.763 4.760 0.067 11 0 "[ . 1 .]" 1
1022 1 30 ASP HA 1 30 ASP HB2 3.970 2.581 4.764 2.787 2.408 3.030 0.173 12 0 "[ . 1 .]" 1
1023 1 108 ALA HA 1 108 ALA MB 3.157 2.052 3.788 2.129 2.124 2.133 . 0 0 "[ . 1 .]" 1
1024 1 101 ARG HB2 1 101 ARG HD2 4.276 2.779 5.131 3.704 2.627 4.176 0.152 3 0 "[ . 1 .]" 1
1025 1 12 PRO HA 1 12 PRO HD2 4.986 3.241 5.983 4.004 3.852 4.086 . 0 0 "[ . 1 .]" 1
1026 1 17 LEU QD 1 21 ARG QB 3.121 2.029 3.745 2.944 2.176 3.550 . 0 0 "[ . 1 .]" 1
1027 1 97 ILE HA 1 97 ILE MD 3.771 2.451 4.525 2.565 2.314 3.690 0.137 1 0 "[ . 1 .]" 1
1028 1 107 GLU HA 1 107 GLU HG3 5.104 3.318 6.125 3.631 3.178 3.788 0.140 1 0 "[ . 1 .]" 1
1029 1 9 VAL MG2 1 60 VAL QG 3.817 2.481 4.580 2.352 1.854 2.488 0.627 12 1 "[ . 1 + .]" 1
1030 1 39 LEU MD1 1 89 TRP QB 5.494 3.571 6.500 3.521 3.345 3.844 0.226 4 0 "[ . 1 .]" 1
1031 1 75 HIS QB 1 90 MET HB2 4.048 2.631 4.858 4.513 3.761 4.832 . 0 0 "[ . 1 .]" 1
1032 1 43 TRP HA 1 48 LEU HA 5.623 3.655 6.500 5.206 4.780 5.539 . 0 0 "[ . 1 .]" 1
1033 1 6 MET QB 1 43 TRP QB 5.465 3.552 6.500 3.675 2.864 4.158 0.688 11 1 "[ . 1+ .]" 1
1034 1 59 LEU HG 1 71 ALA HA 3.792 2.465 4.550 3.194 2.424 4.619 0.069 14 0 "[ . 1 .]" 1
1035 1 78 LEU QB 1 86 VAL MG2 5.572 3.622 6.500 2.493 2.095 3.512 1.527 15 13 "[** ****-*****+]" 1
1036 1 125 PRO HB3 1 125 PRO QD 5.028 3.424 6.034 3.212 3.152 3.341 0.272 10 0 "[ . 1 .]" 1
1037 1 96 LEU HA 1 96 LEU HB2 3.438 2.235 4.126 2.585 2.419 3.027 . 0 0 "[ . 1 .]" 1
1038 1 101 ARG HB2 1 104 PHE QD 6.181 4.018 6.500 5.044 4.236 6.137 . 0 0 "[ . 1 .]" 1
1039 1 93 VAL HA 1 93 VAL MG2 3.676 2.389 4.411 2.405 2.353 2.432 0.036 13 0 "[ . 1 .]" 1
1040 1 7 GLU HG2 1 10 LEU HB3 5.266 3.423 6.319 5.496 4.313 7.087 0.768 7 2 "[ . + 1 -.]" 1
1041 1 38 LEU HB3 1 89 TRP HE3 . 3.401 4.798 3.668 3.256 4.568 0.145 2 0 "[ . 1 .]" 1
1042 1 38 LEU HB2 1 38 LEU QD 3.543 2.303 4.252 2.230 2.119 2.313 0.184 9 0 "[ . 1 .]" 1
1043 1 17 LEU HB2 1 20 CYS QB 6.162 4.005 6.500 5.518 4.211 6.335 . 0 0 "[ . 1 .]" 1
1044 1 29 CYS QB 1 33 SER QB . 4.051 4.577 3.989 3.541 4.347 0.510 3 1 "[ + . 1 .]" 1
1045 1 124 ILE HB 1 125 PRO QD 5.583 3.629 6.322 3.756 3.603 3.933 0.026 5 0 "[ . 1 .]" 1
1046 1 32 ILE MD 1 32 ILE MG 3.103 2.017 3.724 1.993 1.941 2.023 0.076 14 0 "[ . 1 .]" 1
1047 1 39 LEU HB2 1 89 TRP QB 4.875 3.169 5.850 3.517 3.067 4.181 0.102 14 0 "[ . 1 .]" 1
1048 1 38 LEU QD 1 89 TRP QB 4.418 3.187 5.302 2.839 2.653 3.119 0.534 1 2 "[+ . - 1 .]" 1
1049 1 17 LEU HG 1 21 ARG QB 4.150 2.698 4.980 3.142 1.885 4.900 0.813 12 3 "[ -* 1 + .]" 1
1050 1 35 ARG QB 1 38 LEU QD 4.032 2.621 4.838 4.233 3.619 4.527 . 0 0 "[ . 1 .]" 1
1051 1 47 LYS HB2 1 47 LYS QE 5.491 3.569 6.500 4.086 3.371 4.540 0.198 13 0 "[ . 1 .]" 1
1052 1 70 ALA HA 1 70 ALA MB 3.251 2.113 3.901 2.126 2.123 2.129 . 0 0 "[ . 1 .]" 1
1053 1 25 ARG HA 1 25 ARG HB3 3.536 2.298 4.243 2.481 2.369 3.008 . 0 0 "[ . 1 .]" 1
1054 1 17 LEU HA 1 20 CYS QB 4.663 3.347 5.596 3.045 2.750 3.532 0.597 7 1 "[ . + 1 .]" 1
1055 1 75 HIS HD1 1 86 VAL MG2 5.528 3.593 6.500 4.893 4.248 5.386 . 0 0 "[ . 1 .]" 1
1056 1 62 GLU HA 1 62 GLU HB3 4.037 2.624 4.844 2.478 2.418 2.666 0.206 8 0 "[ . 1 .]" 1
1057 1 47 LYS HB3 1 47 LYS QE 5.384 3.500 6.461 3.715 2.089 4.147 1.411 13 2 "[ . 1 + -]" 1
1058 1 125 PRO HB2 1 125 PRO QD 5.032 3.271 5.731 3.510 3.425 3.548 . 0 0 "[ . 1 .]" 1
1059 1 24 THR HA 1 24 THR HG1 3.507 2.280 4.208 3.078 2.204 4.108 0.076 15 0 "[ . 1 .]" 1
1060 1 12 PRO HB2 1 12 PRO HD3 4.633 3.012 5.560 3.937 3.898 3.976 . 0 0 "[ . 1 .]" 1
1061 1 35 ARG HA 1 38 LEU HB2 3.966 2.578 4.759 2.751 2.490 3.187 0.088 6 0 "[ . 1 .]" 1
1062 1 10 LEU QD 1 39 LEU MD2 4.356 2.831 5.227 3.470 2.774 4.642 0.057 6 0 "[ . 1 .]" 1
1063 1 6 MET QB 1 10 LEU QD 5.185 3.370 6.222 3.671 2.576 4.397 0.794 10 3 "[ -* . + .]" 1
1064 1 17 LEU QD 1 19 ASP QB 6.500 4.225 6.500 5.415 4.891 5.896 . 0 0 "[ . 1 .]" 1
1065 1 58 LEU HB3 1 58 LEU QD 3.498 2.309 4.198 2.170 2.094 2.322 0.215 6 0 "[ . 1 .]" 1
1066 1 12 PRO HB2 1 12 PRO HD2 4.601 2.991 5.521 3.608 2.978 4.008 0.013 1 0 "[ . 1 .]" 1
1067 1 56 MET HA 1 74 ILE MG 4.288 2.787 5.146 4.501 3.003 5.162 0.016 3 0 "[ . 1 .]" 1
1068 1 54 LYS HD3 1 54 LYS HG2 3.617 2.351 4.340 2.909 2.215 3.002 0.136 9 0 "[ . 1 .]" 1
1069 1 21 ARG QB 1 21 ARG HD3 2.896 2.140 3.475 2.577 2.331 3.301 . 0 0 "[ . 1 .]" 1
1070 1 6 MET QB 1 6 MET QG 3.546 2.305 4.255 2.061 1.998 2.090 0.307 11 0 "[ . 1 .]" 1
1071 1 3 GLU HA 1 3 GLU HB2 3.887 2.527 4.664 2.482 2.422 2.540 0.105 8 0 "[ . 1 .]" 1
1072 1 68 TRP HD1 1 100 LYS QG 6.195 4.027 6.500 5.622 3.839 6.222 0.188 14 0 "[ . 1 .]" 1
1073 1 58 LEU HB3 1 59 LEU HA 6.241 4.057 6.500 4.457 4.114 4.657 . 0 0 "[ . 1 .]" 1
1074 1 117 THR HB 1 117 THR HG1 3.909 2.541 4.691 2.667 2.493 2.847 0.048 1 0 "[ . 1 .]" 1
1075 1 35 ARG QB 1 38 LEU HB3 5.680 3.692 6.500 4.624 3.771 5.571 . 0 0 "[ . 1 .]" 1
1076 1 12 PRO HA 1 12 PRO HD3 5.151 3.348 6.181 3.678 3.462 3.979 . 0 0 "[ . 1 .]" 1
1077 1 7 GLU HA 1 7 GLU HG2 4.265 2.772 5.118 3.108 2.482 3.784 0.290 8 0 "[ . 1 .]" 1
1078 1 39 LEU HA 1 39 LEU HB3 4.062 2.640 4.874 3.011 2.994 3.018 . 0 0 "[ . 1 .]" 1
1079 1 50 ILE HG13 1 51 PRO HD3 5.436 3.533 6.500 4.441 3.990 4.739 . 0 0 "[ . 1 .]" 1
1080 1 4 ALA MB 1 5 VAL QG 4.634 3.012 5.561 4.049 3.537 4.347 . 0 0 "[ . 1 .]" 1
1081 1 13 LEU HB3 1 16 ALA MB 5.161 3.355 6.193 5.035 4.835 5.728 . 0 0 "[ . 1 .]" 1
1082 1 79 MET HA 1 79 MET QB 3.657 2.377 4.388 2.425 2.351 2.482 0.026 13 0 "[ . 1 .]" 1
1083 1 35 ARG HA 1 89 TRP HA 4.805 3.123 5.766 4.741 3.882 5.271 . 0 0 "[ . 1 .]" 1
1084 1 50 ILE MD 1 50 ILE HG13 3.401 2.211 4.081 2.124 2.122 2.127 0.089 13 0 "[ . 1 .]" 1
1085 1 43 TRP HE3 1 56 MET HB2 5.808 3.775 6.500 5.482 4.877 5.897 . 0 0 "[ . 1 .]" 1
1086 1 88 GLN QB 1 88 GLN HG2 3.704 2.407 4.445 2.239 2.153 2.359 0.254 4 0 "[ . 1 .]" 1
1087 1 9 VAL HA 1 9 VAL HB 4.165 2.707 4.998 2.994 2.580 3.033 0.127 12 0 "[ . 1 .]" 1
1088 1 48 LEU HA 1 48 LEU HB3 3.921 2.549 4.705 2.538 2.460 2.708 0.089 4 0 "[ . 1 .]" 1
1089 1 101 ARG HB2 1 101 ARG QG 4.093 2.660 4.912 2.180 2.124 2.350 0.536 6 11 "[** *+**-*** *]" 1
1090 1 84 THR HA 1 84 THR HG1 3.430 2.230 4.116 3.659 2.429 4.061 . 0 0 "[ . 1 .]" 1
1091 1 101 ARG QG 1 104 PHE QD 5.573 3.622 6.500 4.680 4.026 6.107 . 0 0 "[ . 1 .]" 1
1092 1 6 MET ME 1 43 TRP HD1 4.778 3.106 5.734 3.432 2.919 4.028 0.187 2 0 "[ . 1 .]" 1
1093 1 43 TRP QB 1 53 LYS QE 5.343 3.473 6.412 4.883 4.118 5.666 . 0 0 "[ . 1 .]" 1
1094 1 99 GLU HB2 1 99 GLU HG3 3.278 2.131 3.934 2.546 2.379 3.016 . 0 0 "[ . 1 .]" 1
1095 1 53 LYS QE 1 53 LYS QG 4.462 3.092 5.354 2.295 2.125 2.680 0.967 5 13 "[****+** *-*** *]" 1
1096 1 28 VAL HA 1 28 VAL MG2 3.787 2.461 4.544 2.702 2.306 3.226 0.155 5 0 "[ . 1 .]" 1
1097 1 14 GLU HB3 1 14 GLU HG3 3.777 2.455 4.532 2.896 2.422 3.011 0.033 10 0 "[ . 1 .]" 1
1098 1 111 GLU HA 1 111 GLU HG2 4.044 2.629 4.853 3.439 2.602 3.770 0.027 7 0 "[ . 1 .]" 1
1099 1 113 LYS HD3 1 113 LYS HE2 3.366 2.188 4.039 2.615 2.361 3.018 . 0 0 "[ . 1 .]" 1
1100 1 52 VAL HA 1 56 MET HA 6.500 4.225 6.500 6.049 5.749 6.332 . 0 0 "[ . 1 .]" 1
1101 1 39 LEU MD2 1 56 MET ME 3.883 2.524 4.660 3.052 2.510 3.725 0.014 3 0 "[ . 1 .]" 1
1102 1 5 VAL QG 1 8 ASP QB 4.791 3.114 5.749 2.596 1.913 3.873 1.201 12 7 "[-** . **1 +* .]" 1
1103 1 48 LEU HA 1 52 VAL HB 5.177 3.365 6.212 4.835 3.892 6.230 0.018 10 0 "[ . 1 .]" 1
1104 1 15 GLN HB2 1 16 ALA HA 5.254 3.415 6.305 5.370 4.248 5.694 . 0 0 "[ . 1 .]" 1
1105 1 39 LEU HG 1 89 TRP HE3 6.248 4.061 6.500 5.725 5.212 6.010 . 0 0 "[ . 1 .]" 1
1106 1 9 VAL MG1 1 9 VAL MG2 3.061 . 3.673 2.081 2.072 2.090 . 0 0 "[ . 1 .]" 1
1107 1 66 HIS HA 1 66 HIS HB2 4.254 2.765 5.105 2.963 2.538 3.031 0.227 9 0 "[ . 1 .]" 1
1108 1 39 LEU HG 1 48 LEU MD1 4.586 2.981 5.503 4.090 3.618 4.462 . 0 0 "[ . 1 .]" 1
1109 1 6 MET QG 1 43 TRP QB 5.844 3.799 6.500 3.676 2.958 4.736 0.841 1 5 "[+ **- *1 .]" 1
1110 1 60 VAL HA 1 60 VAL HB 4.188 2.722 5.026 2.992 2.574 3.026 0.148 10 0 "[ . 1 .]" 1
1111 1 54 LYS HA 1 54 LYS HD3 3.408 2.215 4.090 3.501 2.056 4.454 0.364 8 0 "[ . 1 .]" 1
1112 1 38 LEU HB3 1 38 LEU QD 3.351 2.178 4.014 2.159 2.095 2.356 0.083 4 0 "[ . 1 .]" 1
1113 1 63 LEU MD1 1 63 LEU MD2 3.099 2.014 3.719 2.083 2.075 2.088 . 0 0 "[ . 1 .]" 1
1114 1 36 LEU HA 1 36 LEU MD2 3.549 2.307 4.259 2.494 1.893 3.888 0.414 13 0 "[ . 1 .]" 1
1115 1 76 ARG QB 1 76 ARG HG3 3.975 2.584 4.770 2.331 2.175 2.396 0.409 8 0 "[ . 1 .]" 1
1116 1 48 LEU HB2 1 53 LYS QG 5.267 3.424 6.320 3.245 2.745 4.852 0.679 3 2 "[- + . 1 .]" 1
1117 1 101 ARG HA 1 104 PHE HB3 5.062 3.290 6.074 5.027 2.966 5.788 0.324 9 0 "[ . 1 .]" 1
1118 1 48 LEU HA 1 49 SER HA 5.294 3.441 6.353 4.291 4.245 4.346 . 0 0 "[ . 1 .]" 1
1119 1 49 SER HA 1 50 ILE HG12 6.236 4.053 6.500 5.178 5.035 5.538 . 0 0 "[ . 1 .]" 1
1120 1 100 LYS HB3 1 103 LEU HB2 5.367 3.488 6.440 4.759 3.453 6.482 0.042 9 0 "[ . 1 .]" 1
1121 1 54 LYS HB2 1 54 LYS HD3 3.717 2.416 4.460 2.430 2.016 3.113 0.400 8 0 "[ . 1 .]" 1
1122 1 32 ILE HA 1 32 ILE HG13 4.412 2.868 5.294 3.028 2.890 3.889 . 0 0 "[ . 1 .]" 1
1123 1 7 GLU QB 1 7 GLU HG2 3.714 2.414 4.457 2.298 2.141 2.416 0.273 7 0 "[ . 1 .]" 1
1124 1 56 MET QG 1 59 LEU QB 4.742 3.082 5.690 3.140 2.775 3.739 0.307 4 0 "[ . 1 .]" 1
1125 1 89 TRP HA 1 89 TRP HE3 5.222 3.394 5.326 4.217 4.023 4.399 . 0 0 "[ . 1 .]" 1
1126 1 75 HIS HA 1 86 VAL MG2 5.196 3.377 6.235 5.048 4.641 5.358 . 0 0 "[ . 1 .]" 1
1127 1 125 PRO HA 1 125 PRO QG 5.279 3.431 5.740 3.525 3.478 3.541 . 0 0 "[ . 1 .]" 1
1128 1 53 LYS HA 1 56 MET HB3 4.458 2.898 5.350 2.911 2.751 3.415 0.147 6 0 "[ . 1 .]" 1
1129 1 101 ARG HA 1 101 ARG HB2 4.533 2.947 5.440 2.973 2.538 3.032 0.409 3 0 "[ . 1 .]" 1
1130 1 39 LEU HA 1 39 LEU MD2 3.781 2.457 4.537 3.177 3.110 3.237 . 0 0 "[ . 1 .]" 1
1131 1 35 ARG QB 1 89 TRP QB 5.511 3.632 6.362 3.191 2.289 3.907 1.343 1 7 "[+ -** 1* **]" 1
1132 1 18 GLU HA 1 18 GLU HB2 3.612 2.348 4.334 2.871 2.485 3.027 . 0 0 "[ . 1 .]" 1
1133 1 86 VAL MG2 1 89 TRP HZ2 4.959 3.223 5.951 4.443 4.262 4.611 . 0 0 "[ . 1 .]" 1
1134 1 38 LEU HB3 1 38 LEU HG 4.326 2.812 5.191 2.897 2.363 3.021 0.449 7 0 "[ . 1 .]" 1
1135 1 5 VAL HB 1 5 VAL QG 3.319 2.157 3.983 1.896 1.892 1.899 0.265 3 0 "[ . 1 .]" 1
1136 1 17 LEU QD 1 20 CYS QB 4.773 3.102 5.662 3.281 2.789 4.694 0.313 1 0 "[ . 1 .]" 1
1137 1 65 SER HA 1 65 SER QB 3.604 2.506 4.325 2.356 2.207 2.418 0.299 11 0 "[ . 1 .]" 1
1138 1 18 GLU HA 1 18 GLU HG3 3.550 2.308 4.260 3.334 2.661 3.795 . 0 0 "[ . 1 .]" 1
1139 1 27 GLN HG3 1 28 VAL HA 4.334 2.817 5.201 4.384 3.144 5.310 0.109 13 0 "[ . 1 .]" 1
1140 1 101 ARG HA 1 102 SER HA 5.804 3.773 6.500 4.710 4.641 4.774 . 0 0 "[ . 1 .]" 1
1141 1 28 VAL MG1 1 31 ASP QB 4.715 3.065 5.658 4.457 3.703 5.254 . 0 0 "[ . 1 .]" 1
1142 1 43 TRP QB 1 53 LYS QD 5.265 3.422 6.318 4.272 3.995 4.649 . 0 0 "[ . 1 .]" 1
1143 1 100 LYS HA 1 100 LYS HE2 4.737 3.079 5.684 4.263 3.719 5.099 . 0 0 "[ . 1 .]" 1
1144 1 63 LEU HB3 1 63 LEU HG 3.790 2.464 4.548 2.612 2.550 2.653 . 0 0 "[ . 1 .]" 1
1145 1 5 VAL QG 1 7 GLU HG2 4.997 3.248 5.996 4.156 2.235 5.519 1.013 11 1 "[ . 1+ .]" 1
1146 1 53 LYS QG 1 56 MET HB3 5.993 3.896 6.500 4.774 4.444 5.064 . 0 0 "[ . 1 .]" 1
1147 1 72 ASP HB3 1 97 ILE MD 5.571 3.621 6.500 5.948 4.738 6.422 . 0 0 "[ . 1 .]" 1
1148 1 25 ARG HA 1 25 ARG HD2 4.357 2.832 5.228 4.472 3.083 5.515 0.287 13 0 "[ . 1 .]" 1
1149 1 72 ASP HA 1 72 ASP HB2 3.664 2.382 4.397 2.473 2.379 2.969 0.003 2 0 "[ . 1 .]" 1
1150 1 20 CYS HA 1 20 CYS QB 3.924 2.551 4.550 2.380 2.338 2.482 0.213 9 0 "[ . 1 .]" 1
1151 1 63 LEU HB3 1 63 LEU MD1 3.828 2.488 4.594 3.160 3.137 3.192 . 0 0 "[ . 1 .]" 1
1152 1 98 ALA HA 1 101 ARG HD2 4.797 3.118 5.756 4.053 3.032 4.943 0.086 4 0 "[ . 1 .]" 1
1153 1 113 LYS HA 1 113 LYS HB3 3.750 2.437 4.500 2.521 2.339 3.021 0.098 5 0 "[ . 1 .]" 1
1154 1 96 LEU HB2 1 96 LEU MD1 3.788 2.462 4.546 2.447 2.261 3.218 0.201 13 0 "[ . 1 .]" 1
1155 1 74 ILE HB 1 74 ILE MG 3.301 2.146 3.961 2.121 2.120 2.125 0.026 13 0 "[ . 1 .]" 1
1156 1 94 LYS QB 1 94 LYS QE 5.124 3.331 6.149 2.999 1.919 3.783 1.412 5 5 "[ -+ * 1* *.]" 1
1157 1 103 LEU QD 1 106 GLU HG3 4.577 2.975 5.492 3.972 3.062 5.011 . 0 0 "[ . 1 .]" 1
1158 1 76 ARG HD2 1 76 ARG HG3 3.882 2.523 4.658 2.596 2.361 3.022 0.162 11 0 "[ . 1 .]" 1
1159 1 76 ARG HA 1 79 MET QG 5.664 3.682 6.467 3.789 3.351 4.741 0.331 4 0 "[ . 1 .]" 1
1160 1 131 SER HA 1 131 SER HB2 4.608 2.995 5.530 2.808 2.490 3.040 0.505 4 1 "[ +. 1 .]" 1
1161 1 48 LEU HB2 1 48 LEU HG 3.282 2.133 3.938 2.468 2.422 2.501 . 0 0 "[ . 1 .]" 1
1162 1 38 LEU HB3 1 89 TRP QB 4.836 3.144 5.563 3.066 2.956 3.585 0.188 9 0 "[ . 1 .]" 1
1163 1 86 VAL HB 1 89 TRP HZ3 . 3.691 5.226 5.282 4.766 5.416 0.190 12 0 "[ . 1 .]" 1
1164 1 94 LYS HA 1 94 LYS HG3 4.897 3.183 5.876 3.447 2.565 3.792 0.618 11 1 "[ . 1+ .]" 1
1165 1 81 ASP QB 1 82 HIS HA 6.500 4.225 6.500 4.366 3.970 4.590 0.255 5 0 "[ . 1 .]" 1
1166 1 13 LEU HA 1 13 LEU MD1 3.618 2.352 4.342 2.665 2.459 2.880 . 0 0 "[ . 1 .]" 1
1167 1 7 GLU HA 1 10 LEU QD 5.563 3.616 6.500 3.055 2.004 3.678 1.612 7 9 "[ * *- +**1* * *]" 1
1168 1 75 HIS HA 1 78 LEU QB 5.697 3.703 6.500 2.700 2.160 3.430 1.543 10 14 "[***-**** +*****]" 1
1169 1 51 PRO HD2 1 51 PRO HG3 3.959 2.573 4.751 2.695 2.662 2.951 . 0 0 "[ . 1 .]" 1
1170 1 16 ALA MB 1 19 ASP QB 5.394 3.506 6.473 4.354 3.804 5.042 . 0 0 "[ . 1 .]" 1
1171 1 21 ARG QB 1 29 CYS QB 5.090 3.309 5.974 3.694 3.082 4.226 0.227 13 0 "[ . 1 .]" 1
1172 1 14 GLU HA 1 14 GLU HB3 3.412 2.218 4.094 2.449 2.354 2.541 . 0 0 "[ . 1 .]" 1
1173 1 106 GLU HA 1 106 GLU HB3 3.527 2.293 4.232 2.580 2.421 3.018 . 0 0 "[ . 1 .]" 1
1174 1 93 VAL MG1 1 93 VAL MG2 3.072 . 3.686 2.085 2.077 2.090 . 0 0 "[ . 1 .]" 1
1175 1 54 LYS HA 1 54 LYS HB2 3.447 2.240 4.136 2.827 2.592 3.008 . 0 0 "[ . 1 .]" 1
1176 1 52 VAL QG 1 82 HIS HD1 4.906 3.189 5.887 2.620 2.306 3.061 0.883 7 9 "[* **-*+ *1 ** .]" 1
1177 1 75 HIS HD1 1 79 MET QG . 3.492 5.112 3.760 3.479 4.083 0.013 3 0 "[ . 1 .]" 1
1178 1 63 LEU HG 1 68 TRP HZ3 . 3.592 4.946 4.042 3.559 4.955 0.033 4 0 "[ . 1 .]" 1
1179 1 85 GLU QB 1 86 VAL MG1 4.022 2.614 4.826 2.635 2.304 3.063 0.310 12 0 "[ . 1 .]" 1
1180 1 43 TRP HZ3 1 56 MET ME 4.230 2.772 5.076 3.926 3.457 4.487 . 0 0 "[ . 1 .]" 1
1181 1 72 ASP HA 1 75 HIS QB 4.540 2.951 5.448 3.421 2.789 4.311 0.162 1 0 "[ . 1 .]" 1
1182 1 60 VAL HA 1 63 LEU MD2 4.043 2.628 4.852 2.900 2.700 3.081 . 0 0 "[ . 1 .]" 1
1183 1 82 HIS HA 1 85 GLU QB . 4.036 6.170 3.907 3.405 4.948 0.631 2 2 "[ + . 1- .]" 1
1184 1 10 LEU HA 1 10 LEU HG 3.656 2.376 4.387 2.562 2.370 3.143 0.006 12 0 "[ . 1 .]" 1
1185 1 48 LEU HA 1 48 LEU HG 3.624 2.356 4.349 2.994 2.670 3.126 . 0 0 "[ . 1 .]" 1
1186 1 120 LYS HA 1 120 LYS QG 4.742 3.082 5.690 3.029 2.400 3.352 0.682 4 4 "[ +*- 1 *.]" 1
1187 1 98 ALA MB 1 101 ARG HD3 5.179 3.366 6.215 5.311 4.359 5.815 . 0 0 "[ . 1 .]" 1
1188 1 80 VAL QG 1 81 ASP QB 5.208 3.385 6.250 2.943 2.297 3.340 1.088 8 5 "[ -. +*1* * .]" 1
1189 1 60 VAL QG 1 61 GLN HA 4.631 3.010 5.557 3.367 3.027 3.547 . 0 0 "[ . 1 .]" 1
1190 1 48 LEU HB3 1 53 LYS QG 4.529 2.944 5.435 3.476 2.922 5.015 0.022 5 0 "[ . 1 .]" 1
1191 1 12 PRO HA 1 15 GLN HB2 4.007 2.605 4.808 3.178 2.639 3.961 . 0 0 "[ . 1 .]" 1
1192 1 48 LEU HA 1 48 LEU HB2 4.006 2.604 4.807 3.005 2.951 3.019 . 0 0 "[ . 1 .]" 1
1193 1 59 LEU QB 1 59 LEU QD 4.074 2.651 4.889 1.908 1.888 2.006 0.763 11 15 [**********+**-*] 1
1194 1 56 MET HA 1 74 ILE HB 6.500 4.225 6.500 4.583 4.119 5.232 0.106 6 0 "[ . 1 .]" 1
1195 1 23 HIS HA 1 23 HIS HB2 3.599 2.339 4.319 2.893 2.452 3.035 . 0 0 "[ . 1 .]" 1
1196 1 60 VAL HA 1 60 VAL QG 3.890 2.529 4.668 2.145 2.118 2.269 0.411 4 0 "[ . 1 .]" 1
1197 1 39 LEU HA 1 42 GLN HB2 4.583 2.979 5.500 3.268 2.779 4.062 0.200 1 0 "[ . 1 .]" 1
1198 1 36 LEU HA 1 36 LEU HB3 3.687 2.397 4.424 2.930 2.504 3.030 . 0 0 "[ . 1 .]" 1
1199 1 53 LYS HA 1 56 MET QG 5.489 3.568 5.594 4.452 4.010 4.679 . 0 0 "[ . 1 .]" 1
1200 1 12 PRO HD2 1 60 VAL QG 4.981 3.401 5.977 3.534 3.141 3.952 0.260 8 0 "[ . 1 .]" 1
1201 1 93 VAL HA 1 93 VAL MG1 3.711 2.412 4.453 2.392 2.369 2.426 0.043 9 0 "[ . 1 .]" 1
1202 1 88 GLN HA 1 88 GLN HG3 3.987 2.592 4.784 3.107 2.413 3.719 0.179 8 0 "[ . 1 .]" 1
1203 1 68 TRP HB2 1 68 TRP HE3 . 3.325 4.715 4.219 4.186 4.234 . 0 0 "[ . 1 .]" 1
1204 1 104 PHE HA 1 104 PHE HB3 3.888 2.527 4.666 2.602 2.515 3.022 0.012 14 0 "[ . 1 .]" 1
1205 1 71 ALA HA 1 74 ILE MD 3.936 2.558 4.723 3.803 2.485 4.747 0.073 10 0 "[ . 1 .]" 1
1206 1 55 ARG HB3 1 58 LEU QD 3.817 2.481 4.580 4.129 3.047 4.801 0.221 4 0 "[ . 1 .]" 1
1207 1 83 VAL HB 1 86 VAL MG2 5.267 3.423 6.320 5.262 4.395 5.967 . 0 0 "[ . 1 .]" 1
1208 1 16 ALA HA 1 16 ALA MB 3.419 2.222 4.103 2.140 2.136 2.143 0.086 15 0 "[ . 1 .]" 1
1209 1 104 PHE HB3 1 105 SER HB2 6.116 3.975 6.500 5.739 4.762 6.681 0.181 13 0 "[ . 1 .]" 1
1210 1 6 MET HA 1 9 VAL HB 3.769 2.450 4.523 2.834 2.369 3.610 0.081 15 0 "[ . 1 .]" 1
1211 1 100 LYS QG 1 103 LEU QD 6.067 3.944 6.500 3.425 1.994 4.345 1.950 9 6 "[ -* **+1 *]" 1
1212 1 12 PRO HG2 1 60 VAL QG 3.910 2.541 4.692 2.241 1.797 2.738 0.744 10 7 "[* -* * +** .]" 1
1213 1 101 ARG HA 1 101 ARG QG 4.614 2.999 5.537 2.836 2.368 3.343 0.631 4 2 "[ +. 1 -.]" 1
1214 1 48 LEU MD1 1 48 LEU HG 3.374 2.193 4.049 2.130 2.125 2.135 0.068 5 0 "[ . 1 .]" 1
1215 1 15 GLN HA 1 17 LEU H 6.500 4.225 6.500 4.275 4.168 4.747 0.057 9 0 "[ . 1 .]" 1
1216 1 57 ALA HA 1 60 VAL HB 3.865 2.512 4.638 2.910 2.518 3.343 . 0 0 "[ . 1 .]" 1
1217 1 11 ARG HA 1 11 ARG HD3 4.121 2.679 4.945 4.172 2.653 4.935 0.026 14 0 "[ . 1 .]" 1
1218 1 67 ARG QB 1 67 ARG HD3 3.603 2.342 4.324 2.615 2.201 3.372 0.141 12 0 "[ . 1 .]" 1
1219 1 69 ASP HA 1 69 ASP HB3 3.397 2.208 4.076 2.823 2.501 3.030 . 0 0 "[ . 1 .]" 1
1220 1 125 PRO HB2 1 125 PRO QG 3.300 2.145 3.960 2.170 2.156 2.182 . 0 0 "[ . 1 .]" 1
1221 1 11 ARG HD3 1 12 PRO HD3 5.560 3.614 6.500 4.735 3.603 6.185 0.011 12 0 "[ . 1 .]" 1
1222 1 39 LEU HA 1 40 GLN HA 6.071 3.946 6.500 4.786 4.697 4.845 . 0 0 "[ . 1 .]" 1
1223 1 47 LYS QE 1 47 LYS QG 3.308 2.715 3.970 2.260 2.112 2.430 0.603 1 6 "[+ -* *1 * *.]" 1
1224 1 11 ARG HA 1 12 PRO HD3 4.978 3.236 5.974 4.055 3.755 4.251 . 0 0 "[ . 1 .]" 1
1225 1 89 TRP QB 1 93 VAL H 5.445 3.539 6.500 4.425 3.466 4.948 0.073 13 0 "[ . 1 .]" 1
1226 1 38 LEU QD 1 88 GLN QB 3.507 2.279 4.208 2.448 1.812 3.121 0.467 14 0 "[ . 1 .]" 1
1227 1 78 LEU HA 1 78 LEU QD 4.449 2.892 5.339 2.202 1.861 2.743 1.031 9 12 "[*** ****+** *-.]" 1
1228 1 95 ARG HB3 1 95 ARG HD3 3.488 2.267 4.186 3.198 2.452 4.152 . 0 0 "[ . 1 .]" 1
1229 1 104 PHE HA 1 104 PHE HB2 3.797 2.468 4.556 2.973 2.512 3.019 . 0 0 "[ . 1 .]" 1
1230 1 86 VAL MG1 1 86 VAL MG2 3.264 2.122 3.917 2.095 2.082 2.103 0.040 14 0 "[ . 1 .]" 1
1231 1 59 LEU QD 1 60 VAL HA 4.080 2.652 4.896 2.843 2.579 4.015 0.073 11 0 "[ . 1 .]" 1
1232 1 47 LYS HA 1 47 LYS QE 4.428 2.878 5.314 4.217 1.943 5.019 0.935 15 1 "[ . 1 +]" 1
1233 1 37 ALA MB 1 40 GLN HG3 4.282 2.783 5.138 4.419 3.997 6.007 0.869 7 1 "[ . + 1 .]" 1
1234 1 38 LEU QD 1 89 TRP HA 5.109 3.321 6.131 3.842 3.256 4.156 0.065 14 0 "[ . 1 .]" 1
1235 1 20 CYS HA 1 103 LEU QD 4.139 2.813 4.967 3.101 2.609 4.246 0.204 13 0 "[ . 1 .]" 1
1236 1 8 ASP HA 1 8 ASP QB 4.101 2.666 4.254 2.376 2.319 2.455 0.347 1 0 "[ . 1 .]" 1
1237 1 68 TRP HB2 1 97 ILE MD 5.768 3.749 6.500 5.291 4.408 6.304 . 0 0 "[ . 1 .]" 1
1238 1 113 LYS HA 1 113 LYS HE2 6.223 4.045 6.500 5.645 4.310 6.767 0.267 9 0 "[ . 1 .]" 1
1239 1 6 MET ME 1 10 LEU QD 4.274 2.778 5.129 3.949 2.793 4.814 . 0 0 "[ . 1 .]" 1
1240 1 40 GLN HA 1 40 GLN HG3 4.424 2.876 5.309 3.523 2.569 3.840 0.307 7 0 "[ . 1 .]" 1
1241 1 78 LEU QD 1 89 TRP HZ2 5.273 3.427 6.328 4.584 4.058 5.151 . 0 0 "[ . 1 .]" 1
1242 1 51 PRO HB2 1 51 PRO HD2 4.941 3.212 5.929 3.962 3.172 4.045 0.040 5 0 "[ . 1 .]" 1
1243 1 43 TRP HE3 1 53 LYS QG . 4.225 4.430 3.592 3.303 4.114 0.922 5 12 "[ * *+** ******-]" 1
1244 1 28 VAL MG2 1 31 ASP QB 5.081 3.303 6.097 4.910 4.163 5.538 . 0 0 "[ . 1 .]" 1
1245 1 36 LEU MD2 1 39 LEU MD2 5.208 3.385 6.250 3.753 3.169 5.630 0.216 9 0 "[ . 1 .]" 1
1246 1 101 ARG HB3 1 101 ARG HD2 3.834 2.492 4.601 3.123 2.224 3.668 0.268 12 0 "[ . 1 .]" 1
1247 1 63 LEU HA 1 63 LEU HG 4.406 2.864 5.287 2.898 2.837 3.086 0.027 15 0 "[ . 1 .]" 1
1248 1 70 ALA MB 1 73 ASP HB2 4.175 2.714 5.010 4.201 3.767 4.692 . 0 0 "[ . 1 .]" 1
1249 1 6 MET QB 1 43 TRP HZ2 5.402 3.511 6.482 4.192 3.480 5.005 0.031 14 0 "[ . 1 .]" 1
1250 1 56 MET HA 1 59 LEU QD 4.863 3.161 5.682 3.595 3.352 3.869 . 0 0 "[ . 1 .]" 1
1251 1 36 LEU HB3 1 37 ALA MB 5.497 3.573 6.500 3.933 3.608 4.795 . 0 0 "[ . 1 .]" 1
1252 1 43 TRP HE3 1 56 MET QG . 3.882 4.846 4.329 3.896 4.750 . 0 0 "[ . 1 .]" 1
1253 1 82 HIS QB 1 86 VAL MG2 4.727 3.072 5.672 2.972 2.377 3.789 0.695 11 4 "[ * * 1+ -.]" 1
1254 1 88 GLN HA 1 88 GLN QB 3.688 2.508 4.426 2.367 2.315 2.402 0.193 2 0 "[ . 1 .]" 1
1255 1 12 PRO HB3 1 12 PRO HD2 4.855 3.156 5.826 3.907 3.850 3.970 . 0 0 "[ . 1 .]" 1
1256 1 93 VAL HA 1 96 LEU HG 4.948 3.216 5.938 4.889 3.191 5.707 0.025 9 0 "[ . 1 .]" 1
1257 1 28 VAL HB 1 31 ASP QB 5.082 3.303 6.098 5.336 4.677 5.924 . 0 0 "[ . 1 .]" 1
1258 1 21 ARG HD3 1 21 ARG HG2 3.446 2.240 4.135 2.539 2.368 3.013 . 0 0 "[ . 1 .]" 1
1259 1 99 GLU HB3 1 100 LYS QG 4.819 3.132 5.783 4.899 3.596 6.259 0.476 14 0 "[ . 1 .]" 1
1260 1 43 TRP HA 1 43 TRP QB 4.077 2.650 4.892 2.359 2.316 2.396 0.334 11 0 "[ . 1 .]" 1
1261 1 124 ILE HA 1 125 PRO QD 3.885 2.525 4.662 1.920 1.870 1.990 0.655 14 15 [******-******+*] 1
1262 1 88 GLN QB 1 89 TRP HE3 . 3.569 4.344 2.326 2.199 2.558 1.370 4 15 [***+****-******] 1
1263 1 94 LYS QB 1 94 LYS HD3 3.719 2.417 4.463 2.628 2.263 3.428 0.154 15 0 "[ . 1 .]" 1
1264 1 120 LYS QB 1 120 LYS QE . 3.171 3.794 2.280 1.906 3.436 1.265 11 11 "[***** * *-+ * *]" 1
1265 1 17 LEU HB2 1 17 LEU HG 3.840 2.496 4.608 2.873 2.397 3.031 0.099 1 0 "[ . 1 .]" 1
1266 1 96 LEU HB2 1 96 LEU HG 3.798 2.469 4.558 2.682 2.361 3.028 0.108 3 0 "[ . 1 .]" 1
1267 1 83 VAL MG1 1 84 THR HG1 3.376 2.194 4.051 3.452 2.176 4.078 0.027 11 0 "[ . 1 .]" 1
1268 1 63 LEU HB2 1 63 LEU MD1 3.524 2.291 4.229 2.256 2.237 2.274 0.054 3 0 "[ . 1 .]" 1
1269 1 62 GLU HG3 1 70 ALA MB 4.433 2.881 5.320 2.804 2.025 4.589 0.856 10 5 "[ . ** + *-.]" 1
1270 1 13 LEU HA 1 13 LEU HB2 4.068 2.644 4.882 2.641 2.592 2.672 0.052 7 0 "[ . 1 .]" 1
1271 1 101 ARG HD3 1 104 PHE QD 5.928 3.853 6.500 5.921 4.856 6.506 0.006 14 0 "[ . 1 .]" 1
1272 1 93 VAL HA 1 96 LEU HB2 4.032 2.621 4.838 3.097 2.603 3.608 0.018 10 0 "[ . 1 .]" 1
1273 1 99 GLU HA 1 99 GLU HB2 3.239 2.105 3.887 2.922 2.460 3.039 . 0 0 "[ . 1 .]" 1
1274 1 49 SER HA 1 50 ILE HG13 4.612 2.998 5.534 3.778 3.613 3.965 . 0 0 "[ . 1 .]" 1
1275 1 113 LYS HA 1 113 LYS HG2 4.058 2.638 4.870 3.659 2.862 4.233 . 0 0 "[ . 1 .]" 1
1276 1 79 MET QG 1 90 MET ME 3.708 2.465 4.450 2.870 2.339 3.539 0.126 15 0 "[ . 1 .]" 1
1277 1 113 LYS HB2 1 113 LYS HE2 5.255 3.416 6.306 4.709 4.297 5.511 . 0 0 "[ . 1 .]" 1
1278 1 63 LEU HA 1 63 LEU MD1 3.747 2.436 4.496 2.365 2.304 2.418 0.132 1 0 "[ . 1 .]" 1
1279 1 51 PRO HB3 1 53 LYS H 5.737 3.729 6.500 5.998 5.851 6.152 . 0 0 "[ . 1 .]" 1
1280 1 13 LEU HB2 1 13 LEU MD1 3.448 2.241 4.138 3.206 3.198 3.214 . 0 0 "[ . 1 .]" 1
1281 1 60 VAL QG 1 64 SER QB 3.811 2.477 4.573 4.064 3.232 4.421 . 0 0 "[ . 1 .]" 1
1282 1 43 TRP HZ2 1 53 LYS QG . 4.039 4.987 4.030 2.623 4.413 1.416 8 2 "[ . + - .]" 1
1283 1 68 TRP HD1 1 100 LYS HB3 5.981 3.888 6.500 4.664 3.742 5.258 0.146 6 0 "[ . 1 .]" 1
1284 1 50 ILE HB 1 50 ILE MD 3.580 2.327 4.296 2.345 2.258 2.397 0.069 10 0 "[ . 1 .]" 1
1285 1 7 GLU HA 1 7 GLU HG3 3.904 2.537 4.685 2.904 2.481 3.758 0.056 12 0 "[ . 1 .]" 1
1286 1 39 LEU MD2 1 48 LEU MD1 3.922 2.549 4.706 4.116 3.840 4.363 . 0 0 "[ . 1 .]" 1
1287 1 14 GLU HB2 1 14 GLU HG2 4.403 2.862 5.284 2.895 2.431 3.007 0.431 10 0 "[ . 1 .]" 1
1288 1 41 GLU HB3 1 41 GLU HG2 3.610 2.346 4.332 2.541 2.211 3.010 0.135 1 0 "[ . 1 .]" 1
1289 1 11 ARG HA 1 11 ARG HB3 4.417 2.871 5.300 2.651 2.429 3.025 0.442 12 0 "[ . 1 .]" 1
1290 1 89 TRP QB 1 89 TRP HD1 5.116 3.326 6.139 2.632 2.580 2.681 0.746 2 15 [*+******-******] 1
1291 1 68 TRP HH2 1 100 LYS QG 5.823 3.785 6.500 3.707 3.094 4.064 0.691 10 1 "[ . + .]" 1
1292 1 63 LEU MD1 1 68 TRP HE3 4.273 2.777 5.128 3.860 2.876 4.386 . 0 0 "[ . 1 .]" 1
1293 1 69 ASP HA 1 97 ILE MG 5.858 3.808 6.500 3.999 3.732 4.657 0.076 2 0 "[ . 1 .]" 1
1294 1 36 LEU MD2 1 40 GLN HG3 4.626 3.007 5.551 4.392 2.644 5.424 0.363 6 0 "[ . 1 .]" 1
1295 1 98 ALA HA 1 101 ARG QG 4.885 3.175 5.862 2.576 2.137 3.722 1.038 2 10 "[*+ **** -* * *]" 1
1296 1 11 ARG HB2 1 12 PRO HD2 3.935 2.558 4.722 3.195 2.429 4.709 0.129 10 0 "[ . 1 .]" 1
1297 1 72 ASP HA 1 97 ILE MG 4.965 3.227 5.958 4.676 4.032 5.381 . 0 0 "[ . 1 .]" 1
1298 1 39 LEU MD1 1 93 VAL MG1 4.319 2.808 5.183 4.853 3.684 5.519 0.336 14 0 "[ . 1 .]" 1
1299 1 51 PRO HD3 1 52 VAL QG 6.500 4.225 6.500 5.291 4.933 5.507 . 0 0 "[ . 1 .]" 1
1300 1 6 MET ME 1 6 MET QG 4.615 3.000 5.538 2.351 2.169 2.624 0.831 10 14 "[* *******+**-**]" 1
1301 1 43 TRP HA 1 53 LYS QE 4.622 3.004 5.546 3.697 2.718 4.911 0.286 4 0 "[ . 1 .]" 1
1302 1 32 ILE HA 1 32 ILE HB 4.022 2.614 4.826 3.025 3.020 3.030 . 0 0 "[ . 1 .]" 1
1303 1 17 LEU QD 1 29 CYS QB 4.406 2.864 5.275 4.041 2.952 4.568 . 0 0 "[ . 1 .]" 1
1304 1 43 TRP HA 1 43 TRP HD1 4.774 3.103 5.729 3.665 3.495 3.784 . 0 0 "[ . 1 .]" 1
1305 1 40 GLN HA 1 43 TRP QB 5.166 3.358 5.672 2.916 2.759 3.081 0.599 1 4 "[+ . * -* .]" 1
1306 1 58 LEU HA 1 58 LEU QD 3.473 2.257 4.168 2.370 2.047 3.006 0.210 2 0 "[ . 1 .]" 1
1307 1 5 VAL HA 1 43 TRP HZ2 5.220 3.393 6.264 3.926 3.368 4.516 0.025 8 0 "[ . 1 .]" 1
1308 1 32 ILE MG 1 36 LEU HB3 4.767 3.099 5.720 4.684 3.777 5.204 . 0 0 "[ . 1 .]" 1
1309 1 63 LEU HA 1 63 LEU HB3 3.936 2.559 4.723 3.016 3.010 3.021 . 0 0 "[ . 1 .]" 1
1310 1 27 GLN HG3 1 31 ASP QB 5.407 3.515 6.488 3.548 2.606 4.948 0.909 1 4 "[+ . * 1* -]" 1
1311 1 113 LYS HB2 1 113 LYS HD3 3.378 2.196 4.054 3.082 2.301 4.226 0.172 12 0 "[ . 1 .]" 1
1312 1 53 LYS HA 1 53 LYS QE 5.343 3.473 6.412 4.756 3.997 5.036 . 0 0 "[ . 1 .]" 1
1313 1 111 GLU HB2 1 111 GLU HG3 2.944 . 3.533 2.525 2.330 3.009 . 0 0 "[ . 1 .]" 1
1314 1 4 ALA MB 1 8 ASP QB 5.119 3.327 6.143 4.414 3.355 4.930 . 0 0 "[ . 1 .]" 1
1315 1 101 ARG HB3 1 101 ARG QG 3.650 2.373 4.380 2.472 2.378 2.537 . 0 0 "[ . 1 .]" 1
1316 1 6 MET QG 1 43 TRP HD1 . 3.707 4.991 4.051 3.428 4.760 0.279 7 0 "[ . 1 .]" 1
1317 1 43 TRP HH2 1 56 MET HB2 5.504 3.578 6.500 5.578 5.007 6.510 0.010 5 0 "[ . 1 .]" 1
1318 1 113 LYS HB3 1 113 LYS HE2 5.415 3.520 6.498 4.556 3.389 5.448 0.131 7 0 "[ . 1 .]" 1
1319 1 76 ARG QB 1 76 ARG HD2 3.791 2.464 4.549 2.532 2.259 3.298 0.205 13 0 "[ . 1 .]" 1
1320 1 43 TRP HZ3 1 53 LYS QG . 3.952 4.520 3.729 3.289 4.176 0.663 10 2 "[ .- + .]" 1
1321 1 12 PRO HB3 1 63 LEU HG 5.237 3.404 6.284 5.310 4.148 6.304 0.020 10 0 "[ . 1 .]" 1
1322 1 6 MET HA 1 43 TRP HZ3 5.401 3.511 5.882 5.181 4.630 5.646 . 0 0 "[ . 1 .]" 1
1323 1 26 LYS HD3 1 26 LYS HE3 4.232 2.751 5.078 2.716 2.423 3.017 0.328 8 0 "[ . 1 .]" 1
1324 1 74 ILE HA 1 74 ILE HB 3.859 2.508 4.631 2.459 2.342 2.521 0.166 6 0 "[ . 1 .]" 1
1325 1 10 LEU QD 1 10 LEU HG 3.120 2.028 3.744 1.892 1.887 1.897 0.141 8 0 "[ . 1 .]" 1
1326 1 40 GLN HA 1 40 GLN HB2 3.405 2.213 4.086 2.818 2.386 3.026 . 0 0 "[ . 1 .]" 1
1327 1 61 GLN HA 1 61 GLN HB3 3.382 2.198 4.058 2.410 2.350 2.539 . 0 0 "[ . 1 .]" 1
1328 1 43 TRP HZ2 1 53 LYS QB . 3.987 4.859 3.177 2.770 3.878 1.217 4 13 "[***+* * *****-*]" 1
1329 1 16 ALA MB 1 17 LEU QD 3.314 2.154 3.977 3.319 2.573 4.615 0.638 1 1 "[+ . 1 .]" 1
1330 1 9 VAL MG2 1 39 LEU MD2 5.106 3.319 6.127 4.333 3.352 5.036 . 0 0 "[ . 1 .]" 1
1331 1 68 TRP HZ3 1 100 LYS QG 6.061 3.939 6.500 3.797 3.240 4.231 0.699 10 1 "[ . + .]" 1
1332 1 36 LEU MD2 1 39 LEU MD1 3.423 2.225 4.108 3.553 2.194 5.002 0.894 4 1 "[ +. 1 .]" 1
1333 1 44 ALA HA 1 44 ALA MB 3.171 2.061 3.805 2.123 2.116 2.127 . 0 0 "[ . 1 .]" 1
1334 1 32 ILE HB 1 32 ILE MD 3.350 2.177 4.020 2.473 2.373 3.270 . 0 0 "[ . 1 .]" 1
1335 1 26 LYS HA 1 26 LYS HB2 3.527 2.293 4.232 2.632 2.450 3.022 . 0 0 "[ . 1 .]" 1
1336 1 3 GLU HA 1 3 GLU QG 3.831 2.490 4.597 2.676 2.346 3.510 0.144 2 0 "[ . 1 .]" 1
1337 1 48 LEU HA 1 85 GLU QB 5.865 3.812 6.500 5.409 4.500 5.869 . 0 0 "[ . 1 .]" 1
1338 1 11 ARG HB3 1 11 ARG HD3 4.806 3.124 5.767 3.396 2.321 3.773 0.803 8 1 "[ . + 1 .]" 1
1339 1 39 LEU MD2 1 43 TRP HZ3 3.907 2.737 4.688 3.662 3.336 4.031 . 0 0 "[ . 1 .]" 1
1340 1 39 LEU HA 1 89 TRP QB 5.578 3.626 6.500 4.229 3.591 4.902 0.035 4 0 "[ . 1 .]" 1
1341 1 95 ARG HD3 1 95 ARG HG2 4.106 2.669 4.927 2.445 2.252 3.015 0.417 3 0 "[ . 1 .]" 1
1342 1 80 VAL HB 1 80 VAL QG 3.187 2.169 3.824 1.894 1.892 1.895 0.277 7 0 "[ . 1 .]" 1
1343 1 35 ARG HA 1 35 ARG QB 3.635 2.363 4.362 2.347 2.169 2.507 0.194 9 0 "[ . 1 .]" 1
1344 1 23 HIS HB3 1 24 THR HA 6.305 4.098 6.500 4.937 4.708 5.258 . 0 0 "[ . 1 .]" 1
1345 1 50 ILE HA 1 53 LYS HA 5.717 3.716 6.500 5.666 5.427 5.984 . 0 0 "[ . 1 .]" 1
1346 1 13 LEU MD2 1 16 ALA MB 4.372 2.842 5.246 3.132 2.952 3.895 . 0 0 "[ . 1 .]" 1
1347 1 103 LEU HA 1 103 LEU HB3 3.589 2.333 4.307 2.807 2.332 3.021 0.001 9 0 "[ . 1 .]" 1
1348 1 43 TRP HZ3 1 56 MET HB2 5.596 3.637 6.500 4.087 3.628 4.721 0.009 3 0 "[ . 1 .]" 1
1349 1 5 VAL QG 1 7 GLU QB 3.325 2.161 3.990 2.490 2.113 3.422 0.048 10 0 "[ . 1 .]" 1
1350 1 75 HIS HD1 1 78 LEU QD 5.511 3.582 6.500 4.601 3.499 5.672 0.083 8 0 "[ . 1 .]" 1
1351 1 32 ILE HA 1 32 ILE MG 3.888 2.527 4.666 2.449 2.379 2.492 0.148 14 0 "[ . 1 .]" 1
1352 1 43 TRP HA 1 43 TRP HE3 6.500 4.225 6.500 4.165 4.028 4.287 0.197 1 0 "[ . 1 .]" 1
1353 1 6 MET QB 1 43 TRP HD1 . 3.519 4.445 2.924 2.648 3.314 0.871 3 11 "[* +********- .]" 1
1354 1 17 LEU HB3 1 18 GLU HG3 5.685 3.695 6.500 5.282 4.177 6.488 . 0 0 "[ . 1 .]" 1
1355 1 51 PRO HB3 1 52 VAL QG 5.978 3.886 6.500 4.672 4.384 4.856 . 0 0 "[ . 1 .]" 1
1356 1 9 VAL HA 1 9 VAL MG1 3.677 2.390 4.412 2.518 2.432 3.208 . 0 0 "[ . 1 .]" 1
1357 1 17 LEU HB3 1 17 LEU QD 3.770 2.451 4.524 2.351 2.117 2.531 0.334 2 0 "[ . 1 .]" 1
1358 1 36 LEU HA 1 39 LEU MD1 4.723 3.070 5.668 3.474 3.086 3.834 . 0 0 "[ . 1 .]" 1
1359 1 113 LYS HE2 1 113 LYS HG3 3.877 2.520 4.652 3.062 2.499 3.790 0.021 5 0 "[ . 1 .]" 1
1360 1 56 MET HA 1 59 LEU HA 5.332 3.466 6.398 5.169 4.914 5.397 . 0 0 "[ . 1 .]" 1
1361 1 124 ILE QG 1 125 PRO QG 4.230 2.750 5.076 4.106 3.643 4.631 . 0 0 "[ . 1 .]" 1
1362 1 35 ARG HA 1 89 TRP QB . 3.593 5.518 3.869 3.168 4.436 0.425 15 0 "[ . 1 .]" 1
1363 1 93 VAL HA 1 96 LEU HB3 4.428 2.878 5.314 3.338 2.824 5.074 0.054 10 0 "[ . 1 .]" 1
1364 1 60 VAL HA 1 63 LEU HB2 4.010 2.607 4.812 2.883 2.622 3.484 . 0 0 "[ . 1 .]" 1
1365 1 54 LYS HA 1 54 LYS QE 4.973 3.233 5.968 4.148 3.247 4.935 . 0 0 "[ . 1 .]" 1
1366 1 50 ILE HB 1 50 ILE HG12 4.261 2.770 5.113 3.016 2.956 3.035 . 0 0 "[ . 1 .]" 1
1367 1 124 ILE HA 1 124 ILE MG 4.245 2.759 5.094 3.200 3.190 3.220 . 0 0 "[ . 1 .]" 1
1368 1 13 LEU HA 1 13 LEU HG 4.623 3.005 5.548 3.694 3.662 3.721 . 0 0 "[ . 1 .]" 1
1369 1 50 ILE HB 1 51 PRO HA 5.316 3.455 6.379 4.358 4.152 4.525 . 0 0 "[ . 1 .]" 1
1370 1 74 ILE HB 1 78 LEU QD 3.872 2.517 4.646 3.369 2.426 4.436 0.091 6 0 "[ . 1 .]" 1
1371 1 107 GLU HB2 1 107 GLU HG3 2.974 . 3.569 2.517 2.358 3.017 . 0 0 "[ . 1 .]" 1
1372 1 50 ILE HA 1 53 LYS QG 5.374 3.493 6.449 3.498 3.274 4.344 0.219 9 0 "[ . 1 .]" 1
1373 1 62 GLU HA 1 70 ALA MB 4.747 3.086 5.696 4.703 4.167 5.606 . 0 0 "[ . 1 .]" 1
1374 1 18 GLU HA 1 18 GLU HG2 4.214 2.739 5.057 2.972 2.299 3.777 0.440 1 0 "[ . 1 .]" 1
1375 1 14 GLU HA 1 14 GLU HB2 3.399 2.209 4.079 2.602 2.360 3.026 . 0 0 "[ . 1 .]" 1
1376 1 9 VAL HB 1 10 LEU QD 4.962 3.225 5.954 3.876 3.113 4.415 0.112 3 0 "[ . 1 .]" 1
1377 1 68 TRP HA 1 97 ILE MG 4.377 2.845 5.252 3.411 2.827 3.983 0.018 12 0 "[ . 1 .]" 1
1378 1 79 MET QG 1 86 VAL MG2 5.595 3.637 6.500 4.198 3.466 4.834 0.171 4 0 "[ . 1 .]" 1
1379 1 36 LEU HA 1 36 LEU HB2 3.990 2.594 4.788 2.674 2.422 3.023 0.172 4 0 "[ . 1 .]" 1
1380 1 72 ASP HB2 1 97 ILE MD 5.304 3.448 6.365 4.793 3.418 5.571 0.030 14 0 "[ . 1 .]" 1
1381 1 29 CYS QB 1 32 ILE MD 5.873 3.818 6.500 4.602 3.813 5.566 0.005 12 0 "[ . 1 .]" 1
1382 1 48 LEU HA 1 48 LEU MD1 4.440 2.886 5.328 3.841 3.790 3.880 . 0 0 "[ . 1 .]" 1
1383 1 74 ILE HA 1 74 ILE HG12 4.534 2.947 5.441 4.126 3.643 4.257 . 0 0 "[ . 1 .]" 1
1384 1 48 LEU HA 1 53 LYS QE 6.314 4.104 6.500 4.645 4.049 5.978 0.055 3 0 "[ . 1 .]" 1
1385 1 78 LEU QD 1 86 VAL MG2 3.264 2.122 3.917 2.289 1.905 3.016 0.217 4 0 "[ . 1 .]" 1
1386 1 62 GLU HB3 1 71 ALA MB 4.234 2.752 5.081 3.789 2.276 4.957 0.476 5 0 "[ . 1 .]" 1
1387 1 60 VAL HA 1 63 LEU MD1 4.574 2.973 5.489 4.244 3.880 4.790 . 0 0 "[ . 1 .]" 1
1388 1 52 VAL HA 1 52 VAL HB 4.078 2.651 4.894 2.997 2.609 3.031 0.042 10 0 "[ . 1 .]" 1
1389 1 80 VAL QG 1 82 HIS HA 5.354 3.480 6.425 5.895 5.742 6.150 . 0 0 "[ . 1 .]" 1
1390 1 43 TRP HZ3 1 53 LYS QB . 3.977 4.518 4.039 3.746 4.491 0.231 6 0 "[ . 1 .]" 1
1391 1 39 LEU HB3 1 89 TRP QB 5.528 3.593 6.500 5.031 4.556 5.720 . 0 0 "[ . 1 .]" 1
1392 1 60 VAL MG1 1 60 VAL MG2 2.828 . 3.394 2.083 2.062 2.092 . 0 0 "[ . 1 .]" 1
1393 1 17 LEU HB3 1 17 LEU HG 4.374 2.843 5.249 2.458 2.316 3.016 0.527 15 3 "[ *. - 1 +]" 1
1394 1 99 GLU HB3 1 100 LYS HA 4.357 2.832 5.228 4.445 4.023 4.734 . 0 0 "[ . 1 .]" 1
1395 1 10 LEU HA 1 13 LEU HB3 4.387 2.851 5.264 2.840 2.776 3.119 0.075 2 0 "[ . 1 .]" 1
1396 1 2 SER HA 1 2 SER HB3 3.514 2.284 4.217 2.655 2.320 3.033 . 0 0 "[ . 1 .]" 1
1397 1 8 ASP QB 1 9 VAL MG2 5.016 3.260 6.019 3.287 2.919 4.953 0.341 7 0 "[ . 1 .]" 1
1398 1 59 LEU HA 1 62 GLU HG3 5.243 3.408 6.292 4.107 3.380 6.108 0.028 11 0 "[ . 1 .]" 1
1399 1 62 GLU HA 1 62 GLU HB2 3.861 2.510 4.633 3.024 2.972 3.037 . 0 0 "[ . 1 .]" 1
1400 1 11 ARG HD3 1 12 PRO HD2 5.572 3.622 6.500 5.513 4.443 6.548 0.048 11 0 "[ . 1 .]" 1
1401 1 100 LYS HA 1 100 LYS QG 4.866 3.163 5.839 2.578 2.135 3.013 1.028 9 11 "[ ******+1*-* *]" 1
1402 1 103 LEU HB3 1 103 LEU QD 3.201 2.081 3.840 2.159 2.077 2.228 0.004 3 0 "[ . 1 .]" 1
1403 1 85 GLU HA 1 85 GLU QB 3.840 2.496 3.968 2.379 2.347 2.425 0.149 1 0 "[ . 1 .]" 1
1404 1 5 VAL HA 1 6 MET QB 6.301 4.096 6.500 4.123 3.989 4.397 0.107 8 0 "[ . 1 .]" 1
1405 1 79 MET HA 1 79 MET QG 4.353 2.830 5.224 2.621 2.341 3.040 0.489 10 0 "[ . 1 .]" 1
1406 1 82 HIS QB 1 86 VAL MG1 4.449 2.943 5.339 2.955 2.699 3.675 0.244 3 0 "[ . 1 .]" 1
1407 1 27 GLN HA 1 27 GLN HG3 3.725 2.421 4.470 3.157 2.578 4.258 . 0 0 "[ . 1 .]" 1
1408 1 113 LYS HA 1 113 LYS HG3 5.179 3.366 6.215 3.537 2.508 4.265 0.858 2 3 "[ + -. 1 * .]" 1
1409 1 6 MET HA 1 43 TRP HE3 6.500 4.225 6.500 5.199 4.860 5.537 . 0 0 "[ . 1 .]" 1
1410 1 68 TRP HD1 1 100 LYS HB2 5.664 3.682 6.500 5.471 4.499 6.569 0.069 8 0 "[ . 1 .]" 1
1411 1 50 ILE HB 1 51 PRO HD3 3.781 2.458 4.537 2.176 1.842 2.360 0.616 5 1 "[ + 1 .]" 1
1412 1 50 ILE MD 1 51 PRO HD2 4.490 2.918 5.388 4.035 3.528 4.720 . 0 0 "[ . 1 .]" 1
1413 1 48 LEU HB2 1 52 VAL HB 5.010 3.257 6.012 4.293 3.957 5.547 . 0 0 "[ . 1 .]" 1
1414 1 50 ILE HG13 1 51 PRO HD2 5.504 3.577 6.500 3.780 3.508 4.394 0.069 14 0 "[ . 1 .]" 1
1415 1 51 PRO HA 1 51 PRO HB2 3.879 2.521 4.655 2.846 2.774 2.974 . 0 0 "[ . 1 .]" 1
1416 1 94 LYS HA 1 94 LYS HD3 3.674 2.388 4.409 3.975 2.092 4.867 0.458 1 0 "[ . 1 .]" 1
1417 1 54 LYS HD3 1 54 LYS QE 3.148 2.046 3.778 2.203 2.164 2.359 . 0 0 "[ . 1 .]" 1
1418 1 50 ILE HA 1 53 LYS QB 4.570 2.971 5.484 2.995 2.620 3.460 0.351 5 0 "[ . 1 .]" 1
1419 1 8 ASP QB 1 57 ALA MB 5.046 3.280 6.055 5.333 4.643 5.841 . 0 0 "[ . 1 .]" 1
1420 1 52 VAL QG 1 85 GLU QB 4.917 3.196 5.860 3.532 2.703 4.238 0.493 13 0 "[ . 1 .]" 1
1421 1 66 HIS HA 1 68 TRP HD1 4.322 2.809 5.074 4.269 3.517 4.636 . 0 0 "[ . 1 .]" 1
1422 1 103 LEU QD 1 106 GLU HB2 4.418 2.872 5.302 3.765 2.232 5.690 0.640 6 1 "[ .+ 1 .]" 1
1423 1 97 ILE MG 1 101 ARG HD2 4.284 2.785 5.141 3.735 2.777 4.939 0.008 7 0 "[ . 1 .]" 1
1424 1 31 ASP HA 1 31 ASP QB 4.067 2.644 4.880 2.353 2.290 2.474 0.354 7 0 "[ . 1 .]" 1
1425 1 57 ALA HA 1 57 ALA MB 2.780 . 3.336 2.128 2.126 2.131 . 0 0 "[ . 1 .]" 1
1426 1 24 THR HG1 1 28 VAL MG2 3.463 2.251 4.156 3.517 2.417 4.585 0.429 15 0 "[ . 1 .]" 1
1427 1 51 PRO HB2 1 52 VAL QG 4.831 3.140 5.797 3.305 3.042 3.588 0.098 10 0 "[ . 1 .]" 1
1428 1 60 VAL QG 1 63 LEU HB3 4.844 3.148 5.663 3.413 3.081 3.684 0.067 10 0 "[ . 1 .]" 1
1429 1 103 LEU HB2 1 103 LEU QD 3.905 2.538 4.686 2.147 2.079 2.418 0.459 11 0 "[ . 1 .]" 1
1430 1 21 ARG HA 1 21 ARG HD3 3.924 2.551 4.709 4.626 3.622 5.497 0.788 1 1 "[+ . 1 .]" 1
1431 1 74 ILE HB 1 74 ILE HG12 3.852 2.504 4.622 2.578 2.473 2.617 0.031 6 0 "[ . 1 .]" 1
1432 1 38 LEU QD 1 88 GLN HG2 4.117 2.676 4.940 2.898 2.086 4.580 0.590 15 6 "[ ** -*1 * +]" 1
1433 1 63 LEU MD1 1 68 TRP HH2 5.652 3.674 6.500 3.981 3.628 4.598 0.046 12 0 "[ . 1 .]" 1
1434 1 24 THR HB 1 24 THR HG1 3.568 2.319 4.282 2.718 2.412 2.852 . 0 0 "[ . 1 .]" 1
1435 1 51 PRO HD2 1 52 VAL QG 6.188 4.022 6.500 4.387 4.014 4.800 0.008 10 0 "[ . 1 .]" 1
1436 1 110 ASN HA 1 111 GLU HA 5.780 3.757 6.500 4.547 4.371 4.766 . 0 0 "[ . 1 .]" 1
1437 1 56 MET HA 1 60 VAL QG 6.500 4.225 6.500 4.616 4.377 5.282 . 0 0 "[ . 1 .]" 1
1438 1 98 ALA HA 1 101 ARG HD3 4.895 3.182 5.874 4.107 3.027 4.696 0.155 13 0 "[ . 1 .]" 1
1439 1 11 ARG HA 1 11 ARG HB2 3.811 2.477 4.573 2.868 2.392 3.027 0.085 1 0 "[ . 1 .]" 1
1440 1 26 LYS HA 1 26 LYS HE3 5.424 3.526 6.500 5.268 4.483 6.129 . 0 0 "[ . 1 .]" 1
1441 1 96 LEU HA 1 96 LEU HB3 4.171 2.711 5.005 2.958 2.549 3.027 0.162 12 0 "[ . 1 .]" 1
1442 1 127 PHE HA 1 127 PHE HB3 3.782 2.458 4.538 2.688 2.412 3.031 0.046 3 0 "[ . 1 .]" 1
1443 1 6 MET QG 1 10 LEU QD 4.032 2.621 4.838 2.618 1.892 3.569 0.729 14 1 "[ . 1 +.]" 1
1444 1 62 GLU HB3 1 63 LEU HA 5.980 3.887 6.500 4.630 4.164 4.883 . 0 0 "[ . 1 .]" 1
1445 1 52 VAL QG 1 56 MET HB2 4.825 3.136 5.790 3.393 3.094 4.578 0.042 12 0 "[ . 1 .]" 1
1446 1 99 GLU HB3 1 99 GLU HG2 3.378 2.196 4.054 2.899 2.434 3.019 . 0 0 "[ . 1 .]" 1
1447 1 19 ASP QB 1 103 LEU QD 5.221 3.394 5.628 3.649 2.208 4.749 1.186 15 4 "[ . *1 - *+]" 1
1448 1 67 ARG HA 1 67 ARG QB 3.990 2.594 4.788 2.379 2.343 2.468 0.251 2 0 "[ . 1 .]" 1
1449 1 18 GLU HB3 1 18 GLU HG3 2.987 . 3.584 2.885 2.372 3.011 . 0 0 "[ . 1 .]" 1
1450 1 12 PRO HB2 1 12 PRO HG3 4.016 2.611 4.819 2.805 2.684 2.984 . 0 0 "[ . 1 .]" 1
1451 1 48 LEU MD1 1 52 VAL QG 3.564 2.317 4.277 2.461 2.244 2.934 0.073 3 0 "[ . 1 .]" 1
1452 1 32 ILE MG 1 36 LEU HB2 3.989 2.593 4.787 3.387 2.727 3.922 . 0 0 "[ . 1 .]" 1
1453 1 110 ASN HA 1 113 LYS HB3 4.912 3.193 5.894 4.070 3.142 5.896 0.051 4 0 "[ . 1 .]" 1
1454 1 39 LEU MD1 1 89 TRP HZ2 4.976 3.234 5.971 4.987 4.776 5.160 . 0 0 "[ . 1 .]" 1
1455 1 53 LYS QB 1 53 LYS QE 4.850 3.671 5.820 3.165 1.983 3.642 1.688 10 6 "[ -* * + **.]" 1
1456 1 93 VAL HA 1 96 LEU HA 5.186 3.371 6.223 5.352 4.997 5.759 . 0 0 "[ . 1 .]" 1
1457 1 43 TRP HA 1 48 LEU MD1 3.964 2.577 4.757 2.545 2.496 2.653 0.081 15 0 "[ . 1 .]" 1
1458 1 98 ALA MB 1 101 ARG HD2 4.299 2.794 5.159 5.281 4.364 5.929 0.770 14 4 "[ . -* * +.]" 1
1459 1 15 GLN HA 1 15 GLN QG 4.320 2.808 4.405 2.646 2.508 3.087 0.300 3 0 "[ . 1 .]" 1
1460 1 89 TRP QB 1 89 TRP HE3 5.256 3.416 6.307 2.520 2.455 2.591 0.961 11 15 [*-********+****] 1
1461 1 100 LYS HA 1 104 PHE QD 6.347 4.126 6.500 4.939 4.120 5.955 0.006 12 0 "[ . 1 .]" 1
1462 1 96 LEU HA 1 96 LEU MD2 3.574 2.323 4.289 3.064 2.163 3.935 0.160 7 0 "[ . 1 .]" 1
1463 1 43 TRP QB 1 44 ALA MB 4.740 3.081 5.688 3.640 3.473 3.864 . 0 0 "[ . 1 .]" 1
1464 1 53 LYS HA 1 56 MET HA 6.254 4.065 6.500 5.549 5.434 5.676 . 0 0 "[ . 1 .]" 1
1465 1 79 MET QB 1 80 VAL QG 3.664 2.382 4.397 3.724 3.005 4.083 . 0 0 "[ . 1 .]" 1
1466 1 43 TRP HZ3 1 53 LYS HA . 3.095 4.338 3.129 3.012 3.479 0.083 3 0 "[ . 1 .]" 1
1467 1 96 LEU HA 1 96 LEU MD1 3.533 2.297 4.240 3.172 2.204 3.909 0.093 5 0 "[ . 1 .]" 1
1468 1 52 VAL HA 1 82 HIS HD1 . 4.140 5.645 5.270 4.541 5.723 0.078 7 0 "[ . 1 .]" 1
1469 1 25 ARG HA 1 25 ARG HB2 3.371 2.191 4.045 2.834 2.351 3.032 . 0 0 "[ . 1 .]" 1
1470 1 43 TRP HE3 1 53 LYS HA 5.297 3.443 6.356 4.293 4.037 4.753 . 0 0 "[ . 1 .]" 1
1471 1 69 ASP HA 1 69 ASP HB2 4.084 2.655 4.901 2.649 2.427 3.026 0.228 10 0 "[ . 1 .]" 1
1472 1 25 ARG HB2 1 25 ARG HD2 3.353 2.179 4.024 3.195 2.379 4.206 0.182 11 0 "[ . 1 .]" 1
1473 1 94 LYS HA 1 97 ILE MD 4.062 2.640 4.874 3.399 2.587 4.669 0.053 14 0 "[ . 1 .]" 1
1474 1 35 ARG HA 1 38 LEU HB3 3.964 2.577 4.757 3.331 2.530 3.890 0.047 1 0 "[ . 1 .]" 1
1475 1 43 TRP HA 1 53 LYS QD 4.647 3.021 5.576 3.891 3.462 4.281 . 0 0 "[ . 1 .]" 1
1476 1 52 VAL QG 1 53 LYS QG 5.694 3.701 6.500 3.496 3.233 4.533 0.468 12 0 "[ . 1 .]" 1
1477 1 111 GLU HA 1 111 GLU HG3 4.389 2.853 5.267 3.333 2.535 4.263 0.318 4 0 "[ . 1 .]" 1
1478 1 101 ARG HA 1 101 ARG HD2 5.274 3.428 6.329 4.248 3.371 4.873 0.057 12 0 "[ . 1 .]" 1
1479 1 13 LEU MD1 1 16 ALA MB 3.928 2.553 4.714 3.046 2.591 3.484 . 0 0 "[ . 1 .]" 1
1480 1 11 ARG HA 1 11 ARG HG3 4.267 2.773 5.120 3.086 2.492 3.738 0.281 15 0 "[ . 1 .]" 1
1481 1 52 VAL QG 1 89 TRP HH2 3.949 2.567 4.739 4.072 3.256 4.565 . 0 0 "[ . 1 .]" 1
1482 1 60 VAL HA 1 63 LEU HB3 3.936 2.559 4.723 2.500 2.427 2.557 0.132 4 0 "[ . 1 .]" 1
1483 1 63 LEU HB2 1 63 LEU HG 4.066 2.643 4.879 2.993 2.981 3.011 . 0 0 "[ . 1 .]" 1
1484 1 39 LEU HB2 1 39 LEU MD2 4.849 3.152 5.819 3.149 3.099 3.174 0.053 2 0 "[ . 1 .]" 1
1485 1 63 LEU HA 1 68 TRP HE3 5.524 3.591 6.500 4.503 4.057 5.061 . 0 0 "[ . 1 .]" 1
1486 1 47 LYS HA 1 47 LYS HB2 3.566 2.318 4.279 3.015 3.012 3.023 . 0 0 "[ . 1 .]" 1
1487 1 107 GLU HA 1 107 GLU HB2 3.288 2.137 3.946 2.664 2.430 3.035 . 0 0 "[ . 1 .]" 1
1488 1 49 SER QB 1 51 PRO HD2 4.357 2.832 5.228 2.615 1.916 2.801 0.916 11 2 "[ -. 1+ .]" 1
1489 1 66 HIS HB3 1 68 TRP HD1 . 3.376 4.967 3.778 3.509 5.001 0.034 12 0 "[ . 1 .]" 1
1490 1 51 PRO HA 1 52 VAL QG 6.352 4.129 6.500 4.782 4.505 4.884 . 0 0 "[ . 1 .]" 1
1491 1 3 GLU HB2 1 4 ALA MB 4.691 3.049 5.629 5.620 4.608 6.009 0.380 5 0 "[ . 1 .]" 1
1492 1 7 GLU HG3 1 10 LEU HB3 5.263 3.421 6.316 5.270 4.132 6.882 0.566 3 1 "[ + . 1 .]" 1
1493 1 9 VAL HA 1 12 PRO HD3 4.952 3.219 5.942 4.151 3.608 4.483 . 0 0 "[ . 1 .]" 1
1494 1 113 LYS HB3 1 113 LYS HG3 3.496 2.272 4.195 2.715 2.454 3.014 . 0 0 "[ . 1 .]" 1
1495 1 50 ILE HB 1 54 LYS QE 4.600 2.990 5.520 4.609 3.252 5.246 . 0 0 "[ . 1 .]" 1
1496 1 14 GLU HA 1 14 GLU HG3 5.712 3.713 6.500 3.717 3.497 3.826 0.216 11 0 "[ . 1 .]" 1
1497 1 56 MET HA 1 56 MET QG 5.340 3.471 6.408 2.446 2.287 3.142 1.184 14 13 "[****. ****-**+*]" 1
1498 1 49 SER QB 1 52 VAL QG 5.815 3.780 6.500 3.415 2.471 4.193 1.309 13 3 "[ - . * + .]" 1
1499 1 27 GLN HA 1 30 ASP HB2 4.232 2.751 5.078 3.283 2.222 5.189 0.529 10 1 "[ . + .]" 1
1500 1 35 ARG QB 1 38 LEU HB2 4.278 2.781 5.134 4.612 4.199 5.141 0.007 7 0 "[ . 1 .]" 1
1501 1 97 ILE MG 1 101 ARG HD3 4.107 2.670 4.928 4.190 3.070 5.138 0.210 14 0 "[ . 1 .]" 1
1502 1 40 GLN HA 1 48 LEU MD1 5.333 3.466 6.400 5.926 5.717 6.214 . 0 0 "[ . 1 .]" 1
1503 1 51 PRO HB2 1 51 PRO HD3 5.088 3.307 6.106 3.883 3.859 3.930 . 0 0 "[ . 1 .]" 1
1504 1 43 TRP HZ3 1 56 MET QG . 3.514 4.926 3.235 2.948 3.336 0.566 6 2 "[ -+ 1 .]" 1
1505 1 101 ARG HB2 1 101 ARG HD3 4.288 2.787 5.146 3.444 2.672 4.079 0.115 14 0 "[ . 1 .]" 1
1506 1 100 LYS HA 1 100 LYS HB3 3.819 2.483 4.583 2.677 2.502 3.013 . 0 0 "[ . 1 .]" 1
1507 1 43 TRP HZ2 1 57 ALA MB 5.195 3.377 6.234 4.977 4.187 6.221 . 0 0 "[ . 1 .]" 1
1508 1 43 TRP HE3 1 56 MET ME . 3.184 4.663 4.646 3.705 4.922 0.259 6 0 "[ . 1 .]" 1
1509 1 59 LEU QD 1 71 ALA MB 4.349 2.827 5.219 2.731 2.331 3.490 0.496 3 0 "[ . 1 .]" 1
1510 1 83 VAL HA 1 83 VAL HB 3.751 2.438 4.501 2.465 2.393 2.513 0.045 9 0 "[ . 1 .]" 1
1511 1 103 LEU QD 1 106 GLU HG2 4.746 3.085 5.695 4.177 3.586 4.929 . 0 0 "[ . 1 .]" 1
1512 1 101 ARG HA 1 104 PHE HB2 4.587 2.982 5.504 3.626 2.959 4.386 0.023 3 0 "[ . 1 .]" 1
1513 1 26 LYS HB2 1 26 LYS HD2 3.982 2.588 4.778 2.823 2.409 3.705 0.179 8 0 "[ . 1 .]" 1
1514 1 100 LYS HA 1 100 LYS HB2 3.730 2.424 4.476 2.926 2.492 3.024 . 0 0 "[ . 1 .]" 1
1515 1 77 SER HA 1 77 SER HB2 3.395 2.207 4.074 2.876 2.455 3.027 . 0 0 "[ . 1 .]" 1
1516 1 63 LEU HB2 1 68 TRP HZ3 . 4.225 5.382 5.118 4.897 5.437 0.055 14 0 "[ . 1 .]" 1
1517 1 48 LEU HB3 1 52 VAL HB 3.412 2.218 4.094 2.906 2.464 4.137 0.043 10 0 "[ . 1 .]" 1
1518 1 26 LYS HA 1 26 LYS HD2 4.312 2.803 5.174 4.571 4.227 4.899 . 0 0 "[ . 1 .]" 1
1519 1 6 MET ME 1 44 ALA HA 4.518 2.937 5.422 3.416 2.856 4.169 0.081 4 0 "[ . 1 .]" 1
1520 1 38 LEU HB2 1 89 TRP QB 4.826 3.202 5.791 4.207 3.937 4.618 . 0 0 "[ . 1 .]" 1
1521 1 43 TRP HH2 1 56 MET QG 5.786 3.761 6.500 5.020 4.518 5.238 . 0 0 "[ . 1 .]" 1
1522 1 47 LYS HB2 1 47 LYS HD2 4.721 3.069 5.665 3.203 2.503 4.153 0.566 1 2 "[+ . 1 -.]" 1
1523 1 26 LYS HA 1 26 LYS HB3 3.751 2.438 4.501 2.855 2.378 3.034 0.060 9 0 "[ . 1 .]" 1
1524 1 130 ALA HA 1 130 ALA MB 3.066 . 3.679 2.131 2.124 2.134 . 0 0 "[ . 1 .]" 1
1525 1 47 LYS HA 1 47 LYS HD2 5.254 3.415 6.305 4.243 3.357 4.885 0.058 5 0 "[ . 1 .]" 1
1526 1 116 ALA HA 1 116 ALA MB 3.316 2.156 3.979 2.131 2.126 2.135 0.030 6 0 "[ . 1 .]" 1
1527 1 32 ILE HA 1 32 ILE MD 4.254 2.765 5.105 3.743 2.483 3.873 0.282 14 0 "[ . 1 .]" 1
1528 1 56 MET HA 1 59 LEU QB 4.981 3.238 5.977 2.765 2.584 3.005 0.654 8 8 "[ ***.*-+ * *.]" 1
1529 1 14 GLU HA 1 17 LEU HB3 4.309 2.801 5.171 3.809 2.652 4.740 0.149 10 0 "[ . 1 .]" 1
1530 1 71 ALA HA 1 72 ASP HA 5.856 3.806 6.500 4.708 4.667 4.764 . 0 0 "[ . 1 .]" 1
1531 1 56 MET HA 1 56 MET ME 4.177 2.715 5.012 4.322 4.206 4.740 . 0 0 "[ . 1 .]" 1
1532 1 63 LEU HA 1 68 TRP HZ3 . 3.431 4.975 3.620 3.378 4.235 0.053 11 0 "[ . 1 .]" 1
1533 1 12 PRO HD3 1 12 PRO HG3 3.998 2.599 4.798 2.300 2.272 2.333 0.327 11 0 "[ . 1 .]" 1
1534 1 49 SER HA 1 49 SER QB 3.379 2.196 4.055 2.229 2.170 2.398 0.026 11 0 "[ . 1 .]" 1
1535 1 60 VAL HB 1 63 LEU MD2 4.550 2.958 5.460 5.158 4.217 5.494 0.034 14 0 "[ . 1 .]" 1
1536 1 36 LEU HA 1 39 LEU HB3 4.991 3.244 5.989 3.161 3.061 3.218 0.183 7 0 "[ . 1 .]" 1
1537 1 29 CYS HA 1 32 ILE HB 4.048 2.631 4.858 3.001 2.604 3.888 0.027 3 0 "[ . 1 .]" 1
1538 1 63 LEU HA 1 63 LEU MD2 4.292 2.790 5.150 3.934 3.920 3.955 . 0 0 "[ . 1 .]" 1
1539 1 74 ILE HA 1 74 ILE MG 3.348 2.176 4.018 2.331 2.237 2.525 . 0 0 "[ . 1 .]" 1
1540 1 125 PRO HB2 1 127 PHE HB3 5.147 3.346 6.176 5.132 3.266 6.666 0.490 11 0 "[ . 1 .]" 1
1541 1 82 HIS HA 1 82 HIS HD1 5.561 3.615 6.500 4.174 3.532 4.637 0.083 12 0 "[ . 1 .]" 1
1542 1 67 ARG HA 1 67 ARG HD3 4.043 2.628 4.852 3.681 2.053 4.735 0.575 11 2 "[ . 1+ -.]" 1
1543 1 53 LYS HA 1 54 LYS HA 6.078 3.951 6.500 4.808 4.694 4.916 . 0 0 "[ . 1 .]" 1
1544 1 54 LYS HB2 1 54 LYS QE 4.405 2.863 5.286 2.555 2.074 3.892 0.789 13 7 "[-** ** 1* + .]" 1
1545 1 48 LEU MD1 1 53 LYS QE 4.632 3.011 5.558 4.209 3.469 4.954 . 0 0 "[ . 1 .]" 1
1546 1 64 SER HA 1 64 SER QB 3.488 2.267 4.186 2.285 2.182 2.429 0.085 14 0 "[ . 1 .]" 1
1547 1 103 LEU HA 1 103 LEU HB2 4.118 2.677 4.942 2.737 2.409 2.994 0.268 3 0 "[ . 1 .]" 1
1548 1 72 ASP HA 1 74 ILE MD 4.117 2.676 4.940 4.014 2.743 4.517 . 0 0 "[ . 1 .]" 1
1549 1 75 HIS HA 1 78 LEU QD 4.134 2.687 4.961 3.397 2.481 4.447 0.206 10 0 "[ . 1 .]" 1
1550 1 105 SER HA 1 105 SER HB2 3.639 2.365 4.367 2.788 2.432 3.030 . 0 0 "[ . 1 .]" 1
1551 1 11 ARG HB3 1 11 ARG HG3 4.205 2.733 5.046 2.817 2.389 3.014 0.344 3 0 "[ . 1 .]" 1
1552 1 75 HIS HA 1 90 MET HB2 5.790 3.763 6.500 5.149 4.203 6.070 . 0 0 "[ . 1 .]" 1
1553 1 56 MET ME 1 56 MET QG 4.001 2.601 4.801 2.230 2.130 2.268 0.471 6 0 "[ . 1 .]" 1
1554 1 49 SER QB 1 51 PRO HD3 4.560 2.964 5.472 4.099 3.322 4.327 . 0 0 "[ . 1 .]" 1
1555 1 63 LEU MD1 1 68 TRP HZ3 . 2.660 4.030 2.549 2.476 2.625 0.184 1 0 "[ . 1 .]" 1
1556 1 10 LEU HB3 1 10 LEU QD 3.247 2.111 3.896 2.181 2.096 2.222 0.015 7 0 "[ . 1 .]" 1
1557 1 48 LEU MD1 1 52 VAL HB 5.612 3.648 6.500 3.716 3.601 4.122 0.047 2 0 "[ . 1 .]" 1
1558 1 12 PRO HB2 1 13 LEU MD2 4.882 3.173 5.858 4.615 4.256 4.944 . 0 0 "[ . 1 .]" 1
1559 1 101 ARG HD2 1 104 PHE QD 6.460 4.199 6.500 6.095 5.072 6.574 0.074 3 0 "[ . 1 .]" 1
1560 1 6 MET HA 1 43 TRP HZ2 . 3.394 4.829 3.492 3.321 3.926 0.073 4 0 "[ . 1 .]" 1
1561 1 6 MET QB 1 43 TRP HE3 5.961 3.875 6.500 5.067 4.133 5.928 . 0 0 "[ . 1 .]" 1
1562 1 66 HIS HA 1 68 TRP HH2 6.145 3.994 6.500 4.637 3.955 5.905 0.039 9 0 "[ . 1 .]" 1
1563 1 111 GLU HB2 1 111 GLU HG2 3.293 2.140 3.952 2.861 2.410 3.009 . 0 0 "[ . 1 .]" 1
1564 1 86 VAL MG1 1 89 TRP HZ3 4.045 2.629 4.854 4.448 4.007 4.807 . 0 0 "[ . 1 .]" 1
1565 1 65 SER QB 1 67 ARG HD2 4.295 2.792 5.154 3.751 2.169 5.644 0.623 8 1 "[ . + 1 .]" 1
1566 1 28 VAL MG2 1 29 CYS QB 4.817 3.131 5.780 4.472 2.944 5.637 0.187 4 0 "[ . 1 .]" 1
1567 1 9 VAL MG2 1 43 TRP HE3 4.405 2.863 5.286 4.385 3.974 5.148 . 0 0 "[ . 1 .]" 1
1568 1 63 LEU HB2 1 63 LEU MD2 3.470 2.255 4.164 2.581 2.498 2.631 . 0 0 "[ . 1 .]" 1
1569 1 62 GLU HB3 1 71 ALA HA 4.769 3.100 5.723 4.519 3.093 5.254 0.007 4 0 "[ . 1 .]" 1
1570 1 10 LEU QD 1 13 LEU HG 3.831 2.490 4.597 3.878 3.483 4.458 . 0 0 "[ . 1 .]" 1
1571 1 90 MET HA 1 90 MET ME 5.742 3.732 6.500 4.651 3.991 5.432 . 0 0 "[ . 1 .]" 1
1572 1 21 ARG HD3 1 22 GLY HA2 6.271 4.076 6.500 6.076 5.479 6.952 0.452 7 0 "[ . 1 .]" 1
1573 1 97 ILE HA 1 97 ILE HB 4.405 2.863 5.286 2.977 2.577 3.015 0.286 14 0 "[ . 1 .]" 1
1574 1 48 LEU MD1 1 53 LYS QG 4.819 3.132 5.783 3.562 3.269 4.924 . 0 0 "[ . 1 .]" 1
1575 1 36 LEU HA 1 39 LEU MD2 5.630 3.659 6.500 4.486 4.296 4.615 . 0 0 "[ . 1 .]" 1
1576 1 50 ILE MG 1 54 LYS HA 4.272 2.777 5.126 4.873 4.474 5.282 0.156 8 0 "[ . 1 .]" 1
1577 1 3 GLU HA 1 3 GLU HB3 3.675 2.389 4.410 2.905 2.379 3.036 0.010 9 0 "[ . 1 .]" 1
1578 1 89 TRP QB 1 93 VAL MG1 5.861 3.810 6.500 5.876 4.786 6.173 . 0 0 "[ . 1 .]" 1
1579 1 83 VAL HA 1 86 VAL MG2 3.720 2.418 4.464 3.364 2.429 4.025 . 0 0 "[ . 1 .]" 1
1580 1 84 THR HA 1 85 GLU HA 5.190 3.373 6.228 4.564 4.318 4.818 . 0 0 "[ . 1 .]" 1
1581 1 9 VAL HB 1 43 TRP HZ3 . 3.396 4.716 4.597 4.060 4.814 0.098 2 0 "[ . 1 .]" 1
1582 1 52 VAL MG1 1 52 VAL MG2 3.050 . 3.660 2.080 2.067 2.086 . 0 0 "[ . 1 .]" 1
1583 1 53 LYS HA 1 56 MET HB2 5.648 3.671 6.500 3.671 2.843 4.119 0.828 14 1 "[ . 1 +.]" 1
1584 1 9 VAL MG2 1 56 MET ME 3.610 2.347 4.332 3.777 1.998 4.423 0.349 12 0 "[ . 1 .]" 1
1585 1 100 LYS HB3 1 100 LYS HE2 4.309 2.801 5.171 4.527 3.391 4.915 . 0 0 "[ . 1 .]" 1
1586 1 59 LEU QB 1 74 ILE MG 4.279 2.781 5.135 3.178 2.095 3.793 0.686 6 1 "[ .+ 1 .]" 1
1587 1 70 ALA MB 1 73 ASP HB3 4.594 2.986 5.513 3.710 3.377 4.137 . 0 0 "[ . 1 .]" 1
1588 1 5 VAL QG 1 43 TRP HZ2 5.889 3.828 6.500 4.648 4.380 5.018 . 0 0 "[ . 1 .]" 1
1589 1 106 GLU HA 1 106 GLU HG3 3.783 2.459 4.540 3.375 2.493 3.834 . 0 0 "[ . 1 .]" 1
1590 1 24 THR HG1 1 29 CYS QB 4.354 2.830 5.225 3.824 2.772 4.972 0.058 7 0 "[ . 1 .]" 1
1591 1 71 ALA HA 1 74 ILE MG 4.371 2.841 5.245 3.711 3.338 4.074 . 0 0 "[ . 1 .]" 1
1592 1 84 THR HB 1 84 THR HG1 3.287 2.137 3.944 2.482 2.134 2.833 0.003 2 0 "[ . 1 .]" 1
1593 1 38 LEU HA 1 38 LEU HB3 4.507 2.930 5.408 2.962 2.750 3.037 0.180 2 0 "[ . 1 .]" 1
1594 1 51 PRO HB3 1 51 PRO HD3 5.035 3.273 6.042 3.107 2.950 3.967 0.323 1 0 "[ . 1 .]" 1
1595 1 94 LYS QB 1 94 LYS HG3 3.312 2.153 3.974 2.301 2.139 2.462 0.014 7 0 "[ . 1 .]" 1
1596 1 63 LEU HB2 1 68 TRP HE3 6.500 4.225 6.500 6.107 5.581 6.482 . 0 0 "[ . 1 .]" 1
1597 1 79 MET HA 1 86 VAL MG2 3.633 2.361 4.360 3.862 3.310 4.391 0.031 8 0 "[ . 1 .]" 1
1598 1 66 HIS HA 1 68 TRP HE3 6.083 3.954 6.500 5.168 4.394 6.016 . 0 0 "[ . 1 .]" 1
1599 1 99 GLU HA 1 99 GLU HG2 5.002 3.251 6.002 3.321 3.144 3.787 0.107 5 0 "[ . 1 .]" 1
1600 1 32 ILE HG13 1 32 ILE MG 4.449 2.892 5.339 3.157 2.425 3.212 0.467 14 0 "[ . 1 .]" 1
1601 1 53 LYS HA 1 53 LYS QD 5.106 3.319 6.127 3.831 2.302 4.029 1.017 8 1 "[ . + 1 .]" 1
1602 1 98 ALA HA 1 98 ALA MB 3.325 2.161 3.990 2.126 2.116 2.134 0.045 7 0 "[ . 1 .]" 1
1603 1 89 TRP HH2 1 89 TRP HZ3 3.680 2.392 4.416 2.440 2.433 2.451 . 0 0 "[ . 1 .]" 1
1604 1 39 LEU MD2 1 89 TRP HZ2 4.313 2.803 5.176 5.282 5.207 5.373 0.197 6 0 "[ . 1 .]" 1
1605 1 4 ALA MB 1 43 TRP HZ2 3.471 2.256 4.165 2.341 2.179 2.795 0.077 2 0 "[ . 1 .]" 1
1606 1 82 HIS HD1 1 85 GLU QB 3.919 2.547 4.703 4.220 2.863 4.631 . 0 0 "[ . 1 .]" 1
1607 1 68 TRP HA 1 68 TRP HZ3 4.872 3.167 5.846 4.588 4.404 4.860 . 0 0 "[ . 1 .]" 1
1608 1 38 LEU QD 1 89 TRP HZ3 3.356 2.181 4.027 3.147 2.558 3.944 . 0 0 "[ . 1 .]" 1
1609 1 38 LEU QD 1 89 TRP HE3 3.571 2.685 4.285 2.451 2.165 2.710 0.520 8 2 "[ . + 1 -]" 1
1610 1 88 GLN HG2 1 89 TRP HE3 4.303 2.797 5.164 4.311 3.527 5.217 0.053 14 0 "[ . 1 .]" 1
1611 1 82 HIS HD1 1 86 VAL MG2 5.108 3.320 6.130 5.276 4.608 6.159 0.029 10 0 "[ . 1 .]" 1
1612 1 68 TRP HE3 1 71 ALA MB 4.474 2.908 5.369 3.239 2.863 4.014 0.045 6 0 "[ . 1 .]" 1
1613 1 68 TRP HB2 1 68 TRP HD1 3.965 2.577 4.758 2.558 2.548 2.580 0.029 9 0 "[ . 1 .]" 1
1614 1 42 GLN HB2 1 89 TRP HZ3 4.468 2.904 5.362 3.732 3.265 4.111 . 0 0 "[ . 1 .]" 1
1615 1 4 ALA HA 1 43 TRP HZ2 4.184 2.720 5.021 4.272 3.865 4.885 . 0 0 "[ . 1 .]" 1
1616 1 42 GLN HA 1 89 TRP HZ3 5.260 3.419 6.312 5.542 5.259 6.065 . 0 0 "[ . 1 .]" 1
1617 1 39 LEU HG 1 43 TRP HE3 3.241 2.107 3.889 4.009 3.909 4.098 0.209 1 0 "[ . 1 .]" 1
1618 1 52 VAL QG 1 82 HIS HE1 5.364 3.487 6.437 3.650 3.351 4.139 0.136 7 0 "[ . 1 .]" 1
1619 1 86 VAL HA 1 89 TRP HZ3 3.713 2.413 4.456 3.367 2.764 3.640 . 0 0 "[ . 1 .]" 1
1620 1 68 TRP HD1 1 101 ARG HA 4.768 3.099 5.722 5.073 4.061 5.760 0.038 8 0 "[ . 1 .]" 1
1621 1 48 LEU MD1 1 89 TRP HZ3 4.360 2.834 5.232 3.946 3.152 4.366 . 0 0 "[ . 1 .]" 1
1622 1 68 TRP HZ3 1 97 ILE HA 5.060 3.289 6.072 4.986 4.441 5.802 . 0 0 "[ . 1 .]" 1
1623 1 78 LEU HG 1 82 HIS HD1 4.715 3.065 5.658 5.539 4.407 5.789 0.131 1 0 "[ . 1 .]" 1
1624 1 68 TRP HE3 1 97 ILE HA 4.870 3.165 5.844 3.815 3.374 4.497 . 0 0 "[ . 1 .]" 1
1625 1 43 TRP QB 1 43 TRP HE3 4.496 2.923 5.395 2.391 2.332 2.447 0.591 15 11 "[ **-.** ** ***+]" 1
1626 1 39 LEU MD1 1 89 TRP HE3 4.883 3.174 5.860 5.649 5.380 5.957 0.097 11 0 "[ . 1 .]" 1
1627 1 39 LEU MD2 1 43 TRP HE3 4.145 2.694 4.974 2.609 2.522 2.701 0.172 2 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 56
_Distance_constraint_stats_list.Viol_count 59
_Distance_constraint_stats_list.Viol_total 30.207
_Distance_constraint_stats_list.Viol_max 0.185
_Distance_constraint_stats_list.Viol_rms 0.0124
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0024
_Distance_constraint_stats_list.Viol_average_violations_only 0.0341
_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 9 VAL 0.285 0.079 2 0 "[ . 1 .]"
1 10 LEU 0.001 0.001 12 0 "[ . 1 .]"
1 12 PRO 0.255 0.116 8 0 "[ . 1 .]"
1 13 LEU 0.304 0.079 2 0 "[ . 1 .]"
1 14 GLU 0.051 0.036 15 0 "[ . 1 .]"
1 16 ALA 0.255 0.116 8 0 "[ . 1 .]"
1 17 LEU 0.018 0.018 15 0 "[ . 1 .]"
1 18 GLU 0.051 0.036 15 0 "[ . 1 .]"
1 30 ASP 0.000 0.000 . 0 "[ . 1 .]"
1 31 ASP 0.009 0.009 9 0 "[ . 1 .]"
1 32 ILE 0.000 0.000 . 0 "[ . 1 .]"
1 33 SER 0.075 0.072 6 0 "[ . 1 .]"
1 34 ARG 0.049 0.049 11 0 "[ . 1 .]"
1 35 ARG 0.009 0.009 9 0 "[ . 1 .]"
1 36 LEU 0.000 0.000 . 0 "[ . 1 .]"
1 37 ALA 0.122 0.072 6 0 "[ . 1 .]"
1 38 LEU 0.049 0.049 11 0 "[ . 1 .]"
1 39 LEU 0.000 0.000 . 0 "[ . 1 .]"
1 40 GLN 0.000 0.000 . 0 "[ . 1 .]"
1 41 GLU 0.047 0.034 4 0 "[ . 1 .]"
1 43 TRP 0.000 0.000 . 0 "[ . 1 .]"
1 51 PRO 0.000 0.000 . 0 "[ . 1 .]"
1 52 VAL 0.000 0.000 . 0 "[ . 1 .]"
1 53 LYS 0.000 0.000 . 0 "[ . 1 .]"
1 54 LYS 0.302 0.185 14 0 "[ . 1 .]"
1 55 ARG 0.397 0.089 4 0 "[ . 1 .]"
1 56 MET 0.000 0.000 . 0 "[ . 1 .]"
1 57 ALA 0.189 0.075 4 0 "[ . 1 .]"
1 58 LEU 0.373 0.185 14 0 "[ . 1 .]"
1 59 LEU 0.470 0.089 4 0 "[ . 1 .]"
1 60 VAL 0.000 0.000 . 0 "[ . 1 .]"
1 61 GLN 0.189 0.075 4 0 "[ . 1 .]"
1 62 GLU 0.071 0.033 12 0 "[ . 1 .]"
1 63 LEU 0.073 0.073 14 0 "[ . 1 .]"
1 91 VAL 0.015 0.015 9 0 "[ . 1 .]"
1 92 GLY 0.001 0.001 2 0 "[ . 1 .]"
1 93 VAL 0.064 0.032 13 0 "[ . 1 .]"
1 94 LYS 0.000 0.000 . 0 "[ . 1 .]"
1 95 ARG 0.126 0.110 14 0 "[ . 1 .]"
1 96 LEU 0.001 0.001 2 0 "[ . 1 .]"
1 97 ILE 0.064 0.032 13 0 "[ . 1 .]"
1 98 ALA 0.000 0.000 . 0 "[ . 1 .]"
1 99 GLU 0.110 0.110 14 0 "[ . 1 .]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 9 VAL O 1 13 LEU H 2.200 . 2.700 2.667 2.495 2.779 0.079 2 0 "[ . 1 .]" 2
2 1 10 LEU O 1 14 GLU H 2.200 . 2.700 2.194 1.815 2.701 0.001 12 0 "[ . 1 .]" 2
3 1 12 PRO O 1 16 ALA H 2.200 . 2.700 2.524 1.928 2.816 0.116 8 0 "[ . 1 .]" 2
4 1 13 LEU O 1 17 LEU H 2.200 . 2.700 2.332 2.066 2.718 0.018 15 0 "[ . 1 .]" 2
5 1 14 GLU O 1 18 GLU H 2.200 . 2.700 2.216 1.858 2.736 0.036 15 0 "[ . 1 .]" 2
6 1 30 ASP O 1 34 ARG H 2.200 . 2.700 2.097 1.800 2.527 . 0 0 "[ . 1 .]" 2
7 1 31 ASP O 1 35 ARG H 2.200 . 2.700 2.200 1.854 2.709 0.009 9 0 "[ . 1 .]" 2
8 1 32 ILE O 1 36 LEU H 2.200 . 2.700 1.955 1.813 2.189 . 0 0 "[ . 1 .]" 2
9 1 33 SER O 1 37 ALA H 2.200 . 2.700 2.323 1.944 2.772 0.072 6 0 "[ . 1 .]" 2
10 1 34 ARG O 1 38 LEU H 2.200 . 2.700 2.465 2.030 2.749 0.049 11 0 "[ . 1 .]" 2
11 1 35 ARG O 1 39 LEU H 2.200 . 2.700 2.202 1.838 2.489 . 0 0 "[ . 1 .]" 2
12 1 36 LEU O 1 40 GLN H 2.200 . 2.700 2.236 1.884 2.592 . 0 0 "[ . 1 .]" 2
13 1 37 ALA O 1 41 GLU H 2.200 . 2.700 2.255 1.740 2.734 0.034 4 0 "[ . 1 .]" 2
14 1 39 LEU O 1 43 TRP H 2.200 . 2.700 2.119 2.008 2.297 . 0 0 "[ . 1 .]" 2
15 1 51 PRO O 1 55 ARG H 2.200 . 2.700 1.896 1.751 2.232 . 0 0 "[ . 1 .]" 2
16 1 52 VAL O 1 56 MET H 2.200 . 2.700 2.097 1.937 2.409 . 0 0 "[ . 1 .]" 2
17 1 53 LYS O 1 57 ALA H 2.200 . 2.700 2.160 1.839 2.695 . 0 0 "[ . 1 .]" 2
18 1 54 LYS O 1 58 LEU H 2.200 . 2.700 2.554 1.961 2.885 0.185 14 0 "[ . 1 .]" 2
19 1 55 ARG O 1 59 LEU H 2.200 . 2.700 2.670 2.281 2.789 0.089 4 0 "[ . 1 .]" 2
20 1 56 MET O 1 60 VAL H 2.200 . 2.700 2.359 2.087 2.696 . 0 0 "[ . 1 .]" 2
21 1 57 ALA O 1 61 GLN H 2.200 . 2.700 2.633 2.341 2.775 0.075 4 0 "[ . 1 .]" 2
22 1 58 LEU O 1 62 GLU H 2.200 . 2.700 2.556 2.194 2.733 0.033 12 0 "[ . 1 .]" 2
23 1 59 LEU O 1 63 LEU H 2.200 . 2.700 1.941 1.657 2.119 0.073 14 0 "[ . 1 .]" 2
24 1 91 VAL O 1 95 ARG H 2.200 . 2.700 2.210 1.851 2.715 0.015 9 0 "[ . 1 .]" 2
25 1 92 GLY O 1 96 LEU H 2.200 . 2.700 2.220 1.815 2.701 0.001 2 0 "[ . 1 .]" 2
26 1 93 VAL O 1 97 ILE H 2.200 . 2.700 2.417 2.131 2.732 0.032 13 0 "[ . 1 .]" 2
27 1 94 LYS O 1 98 ALA H 2.200 . 2.700 2.155 1.820 2.695 . 0 0 "[ . 1 .]" 2
28 1 95 ARG O 1 99 GLU H 2.200 . 2.700 2.096 1.786 2.810 0.110 14 0 "[ . 1 .]" 2
29 1 36 LEU O 1 40 GLN N 3.200 2.516 3.927 3.136 2.810 3.407 . 0 0 "[ . 1 .]" 2
30 1 30 ASP O 1 34 ARG N 3.200 2.516 3.927 3.003 2.731 3.354 . 0 0 "[ . 1 .]" 2
31 1 55 ARG O 1 59 LEU N 3.200 2.516 3.927 3.520 3.170 3.644 . 0 0 "[ . 1 .]" 2
32 1 33 SER O 1 37 ALA N 3.200 2.516 3.927 3.221 2.846 3.654 . 0 0 "[ . 1 .]" 2
33 1 95 ARG O 1 99 GLU N 3.200 2.516 3.927 2.971 2.751 3.603 . 0 0 "[ . 1 .]" 2
34 1 35 ARG O 1 39 LEU N 3.200 2.516 3.927 3.118 2.753 3.391 . 0 0 "[ . 1 .]" 2
35 1 58 LEU O 1 62 GLU N 3.200 2.516 3.927 3.413 3.065 3.648 . 0 0 "[ . 1 .]" 2
36 1 93 VAL O 1 97 ILE N 3.200 2.516 3.927 3.350 3.103 3.643 . 0 0 "[ . 1 .]" 2
37 1 57 ALA O 1 61 GLN N 3.200 2.516 3.927 3.412 3.133 3.602 . 0 0 "[ . 1 .]" 2
38 1 9 VAL O 1 13 LEU N 3.200 2.516 3.927 3.463 3.251 3.586 . 0 0 "[ . 1 .]" 2
39 1 39 LEU O 1 43 TRP N 3.200 2.516 3.927 3.009 2.920 3.153 . 0 0 "[ . 1 .]" 2
40 1 94 LYS O 1 98 ALA N 3.200 2.516 3.927 3.045 2.750 3.477 . 0 0 "[ . 1 .]" 2
41 1 32 ILE O 1 36 LEU N 3.200 2.516 3.927 2.764 2.596 2.969 . 0 0 "[ . 1 .]" 2
42 1 37 ALA O 1 41 GLU N 3.200 2.516 3.927 3.174 2.712 3.608 . 0 0 "[ . 1 .]" 2
43 1 13 LEU O 1 17 LEU N 3.200 2.516 3.927 3.219 2.921 3.575 . 0 0 "[ . 1 .]" 2
44 1 34 ARG O 1 38 LEU N 3.200 2.516 3.927 3.346 2.955 3.608 . 0 0 "[ . 1 .]" 2
45 1 91 VAL O 1 95 ARG N 3.200 2.516 3.927 3.047 2.782 3.469 . 0 0 "[ . 1 .]" 2
46 1 92 GLY O 1 96 LEU N 3.200 2.516 3.927 3.065 2.709 3.519 . 0 0 "[ . 1 .]" 2
47 1 31 ASP O 1 35 ARG N 3.200 2.516 3.927 3.094 2.683 3.658 . 0 0 "[ . 1 .]" 2
48 1 53 LYS O 1 57 ALA N 3.200 2.516 3.927 2.994 2.749 3.424 . 0 0 "[ . 1 .]" 2
49 1 59 LEU O 1 63 LEU N 3.200 2.516 3.927 2.748 2.610 2.986 . 0 0 "[ . 1 .]" 2
50 1 51 PRO O 1 55 ARG N 3.200 2.516 3.927 2.856 2.719 3.182 . 0 0 "[ . 1 .]" 2
51 1 54 LYS O 1 58 LEU N 3.200 2.516 3.927 3.332 2.829 3.730 . 0 0 "[ . 1 .]" 2
52 1 12 PRO O 1 16 ALA N 3.200 2.516 3.927 3.265 2.758 3.627 . 0 0 "[ . 1 .]" 2
53 1 14 GLU O 1 18 GLU N 3.200 2.516 3.927 3.089 2.785 3.569 . 0 0 "[ . 1 .]" 2
54 1 56 MET O 1 60 VAL N 3.200 2.516 3.927 3.205 2.968 3.480 . 0 0 "[ . 1 .]" 2
55 1 52 VAL O 1 56 MET N 3.200 2.516 3.927 2.974 2.846 3.189 . 0 0 "[ . 1 .]" 2
56 1 10 LEU O 1 14 GLU N 3.200 2.516 3.927 3.130 2.776 3.589 . 0 0 "[ . 1 .]" 2
stop_
save_
Contact the webmaster for help, if required. Monday, May 20, 2024 6:24:17 AM GMT (wattos1)