NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
604925 |
2n05   |
25515 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2n05
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 1253
_Distance_constraint_stats_list.Viol_count 22748
_Distance_constraint_stats_list.Viol_total 2023664.500
_Distance_constraint_stats_list.Viol_max 13.546
_Distance_constraint_stats_list.Viol_rms 2.6212
_Distance_constraint_stats_list.Viol_average_all_restraints 4.0376
_Distance_constraint_stats_list.Viol_average_violations_only 4.4480
_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 ARG 272.830 11.610 2 20 [*+*******-**********]
1 3 SER 940.743 13.546 3 20 [**+******-**********]
1 4 PRO 1640.683 12.288 8 20 [*******+*********-**]
1 5 GLY 204.745 13.033 1 20 [+*********-*********]
1 6 MET 2151.293 12.637 8 20 [*******+*********-**]
1 7 ALA 1845.655 12.922 19 20 [**-***************+*]
1 8 ASP 2212.958 11.610 2 20 [*+*************-****]
1 9 GLN 2804.958 13.546 3 20 [**+-****************]
1 10 ARG 1451.730 13.033 1 20 [+*************-*****]
1 11 GLN 2663.346 12.637 8 20 [**-****+************]
1 12 ARG 2987.317 12.745 11 20 [**********+**-******]
1 13 SER 956.411 11.568 17 20 [**-*************+***]
1 14 LEU 1611.019 10.082 16 20 [***-***********+****]
1 15 SER 802.345 12.922 19 20 [**************-***+*]
1 16 THR 1061.245 12.879 5 20 [****+********-******]
1 17 SER 2225.066 9.713 3 20 [**+****************-]
1 18 GLY 640.594 7.554 7 20 [******+*********-***]
1 19 GLU 1660.129 10.082 16 20 [*************-*+****]
1 20 SER 941.310 7.327 1 20 [+*******************]
1 21 LEU 2003.269 12.879 5 20 [*-**+***************]
1 22 TYR 1340.611 10.268 5 20 [-***+***************]
1 23 HIS 893.628 5.978 19 20 [*************-****+*]
1 24 VAL 2440.985 9.300 12 20 [**********-+********]
1 25 LEU 2648.448 10.912 13 20 [*********-**+*******]
1 26 GLY 1582.680 9.285 2 20 [*+**********-*******]
1 27 LEU 1050.762 6.851 11 20 [**********+*-*******]
1 28 ASP 2991.779 10.725 5 20 [****+*****-*********]
1 29 LYS 2683.041 11.482 1 20 [+***********-*******]
1 30 ASN 3617.058 10.912 13 20 [*********-**+*******]
1 31 ALA 968.219 7.626 12 20 [*********-*+********]
1 32 THR 2061.709 6.722 9 20 [**-*****+***********]
1 33 SER 2807.235 10.438 13 20 [*****-******+*******]
1 34 ASP 3004.425 11.482 1 20 [+*-*****************]
1 35 ASP 2318.485 7.850 1 20 [+******************-]
1 36 ILE 4748.181 7.715 15 20 [**************+****-]
1 37 LYS 4541.971 10.725 5 20 [****+*****-*********]
1 38 LYS 3345.047 9.208 13 20 [*****-******+*******]
1 39 SER 2779.981 7.737 4 20 [***+******-*********]
1 40 TYR 3261.631 6.872 3 20 [**+***********-*****]
1 41 ARG 4349.893 8.505 18 20 [-****************+**]
1 42 LYS 6170.846 12.082 19 20 [**************-***+*]
1 43 LEU 3320.576 8.069 20 20 [**************-****+]
1 44 ALA 2144.994 7.013 4 20 [***+**********-*****]
1 45 LEU 2259.361 7.657 20 20 [***********-*******+]
1 46 LYS 4654.339 8.505 18 20 [*****************+**]
1 47 TYR 2840.575 7.504 8 20 [*******+*********-**]
1 48 HIS 3903.712 10.770 18 20 [****-************+**]
1 49 PRO 1636.942 8.450 20 20 [**************-****+]
1 50 ASP 2737.516 10.609 8 20 [****-**+************]
1 51 LYS 4937.153 11.360 9 20 [********+*******-***]
1 52 ASN 2117.781 8.328 13 20 [************+****-**]
1 53 PRO 2146.989 10.770 18 20 [*****************+**]
1 54 ASP 2395.581 9.877 16 20 [************-**+****]
1 55 ASN 4113.603 11.359 19 20 [************-*****+*]
1 56 PRO 4486.737 11.360 9 20 [********+****-******]
1 57 GLU 2680.007 9.021 13 20 [************+****-**]
1 58 ALA 3025.308 12.082 19 20 [****-*************+*]
1 59 ALA 2459.042 8.187 16 20 [***-***********+****]
1 60 ASP 1679.488 8.984 13 20 [************+****-**]
1 61 LYS 3598.846 9.034 8 20 [****-**+************]
1 62 PHE 2093.809 9.085 17 20 [****************+-**]
1 63 LYS 3070.593 9.877 16 20 [*-*************+****]
1 64 GLU 1464.217 7.528 18 20 [**************-**+**]
1 65 ILE 2738.861 8.104 18 20 [******-**********+**]
1 66 ASN 1413.361 7.544 18 20 [***-*************+**]
1 67 ASN 1737.859 7.883 10 20 [-********+**********]
1 68 ALA 1306.592 7.446 4 20 [***+***********-****]
1 69 HIS 1669.242 7.161 6 20 [*****+*************-]
1 70 ALA 1592.723 8.239 2 20 [*+*************-****]
1 71 ILE 2767.830 7.294 12 20 [**********-+********]
1 72 LEU 1547.670 6.861 3 20 [**+**-**************]
1 73 THR 2277.334 8.862 10 20 [*********+-*********]
1 74 ASP 2286.545 7.346 17 20 [**-*************+***]
1 75 ALA 2013.801 8.239 2 20 [*+**-***************]
1 76 THR 1827.452 7.294 12 20 [***********+***-****]
1 77 LYS 1556.417 7.513 17 20 [****************+***]
1 78 ARG 2303.563 7.255 17 20 [****************+***]
1 79 ASN 1761.214 6.593 19 20 [**********-*******+*]
1 80 ILE 1874.359 7.492 2 20 [*+**************-***]
1 81 TYR 833.465 6.334 11 20 [*****-****+*********]
1 82 ASP 1150.610 8.156 3 20 [**+*******-*********]
1 83 LYS 2818.671 7.255 17 20 [*********-******+***]
1 84 TYR 756.386 6.593 19 20 [******************+*]
1 85 GLY 711.455 5.418 3 20 [**+**-**************]
1 86 SER 753.220 7.094 13 20 [***-********+*******]
1 87 LEU 1977.505 8.156 3 20 [**+**************-**]
1 88 GLY 699.834 7.834 11 20 [**********+*********]
1 89 LEU 1377.019 8.389 15 20 [**-***********+*****]
1 90 TYR 1420.015 6.538 11 20 [**********+-********]
1 91 VAL 1065.405 7.094 13 20 [************+**-****]
1 92 ALA 769.189 6.994 7 20 [*****-+*************]
1 93 GLU 2334.059 8.883 13 20 [**-*********+*******]
1 94 GLN 2249.340 8.973 12 20 [*-*********+********]
1 95 PHE 1285.993 6.538 11 20 [**********+******-**]
1 96 GLY 888.267 6.935 15 20 [*-************+*****]
1 97 GLU 1009.782 7.258 16 20 [***************+-***]
1 98 GLU 2267.715 8.883 13 20 [*****-******+*******]
1 99 ASN 1019.354 7.189 14 20 [*-***********+******]
1 100 VAL 1405.157 9.214 20 20 [******-************+]
1 101 ASN 817.539 7.493 20 20 [*-*****************+]
1 102 THR 1153.894 8.973 12 20 [*-*********+********]
1 103 TYR 209.430 6.149 17 20 [****************+**-]
1 104 PHE 501.222 6.031 2 20 [*+***************-**]
1 105 VAL 789.366 9.214 20 20 [******-************+]
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 ARG HA 1 8 ASP H 2.180 . 2.774 10.800 4.883 14.384 11.610 2 20 [*+*******-**********] 1
2 1 2 ARG HA 1 8 ASP QB 3.166 . 4.419 10.035 5.328 13.901 9.482 13 20 [*********-**+*******] 1
3 1 3 SER H 1 8 ASP HA 2.828 . 3.828 10.208 6.602 13.783 9.955 3 20 [**+**********-******] 1
4 1 3 SER H 1 8 ASP QB 2.689 . 3.081 9.446 5.139 12.545 9.464 13 20 [*********-**+*******] 1
5 1 3 SER HA 1 8 ASP QB 1.898 . 2.348 10.888 7.496 13.671 11.323 1 20 [+********-**********] 1
6 1 3 SER HA 1 9 GLN H 2.209 . 2.819 13.378 9.742 16.365 13.546 3 20 [**+*****-***********] 1
7 1 3 SER HA 1 9 GLN QB 3.082 . 7.000 13.502 10.100 16.262 9.262 3 20 [**+*****-***********] 1
8 1 3 SER HA 1 9 GLN QG 2.981 . 4.092 12.782 9.078 17.026 12.934 3 20 [**+*****-***********] 1
9 1 4 PRO HA 1 9 GLN QB 2.131 . 2.699 11.100 9.355 12.795 10.096 8 20 [*******+*********-**] 1
10 1 4 PRO HA 1 9 GLN H 2.667 . 3.556 12.312 8.986 13.362 9.806 15 20 [********-*****+*****] 1
11 1 4 PRO HA 1 9 GLN QB 2.113 . 2.671 12.627 10.217 14.339 11.668 8 20 [*******+-***********] 1
12 1 4 PRO HA 1 9 GLN QB 2.106 . 2.660 6.402 5.836 7.323 4.663 13 20 [*********-**+*******] 1
13 1 4 PRO HA 1 9 GLN QB 2.037 . 2.556 9.467 8.293 10.085 7.529 6 20 [*****+**-***********] 1
14 1 4 PRO QB 1 9 GLN QG 1.880 . 2.322 10.438 7.197 11.728 9.406 8 20 [*******+*-**********] 1
15 1 4 PRO QB 1 9 GLN QB 1.759 . 2.146 12.888 11.088 14.434 12.288 8 20 [*******+-***********] 1
16 1 4 PRO QB 1 9 GLN QG 1.862 . 2.295 6.728 5.352 7.064 4.769 11 20 [**********+******-**] 1
17 1 4 PRO QB 1 10 ARG H 3.177 . 4.439 15.408 13.409 16.600 12.161 16 20 [***************+*-**] 1
18 1 4 PRO QG 1 9 GLN H 2.710 . 3.628 13.636 10.165 14.644 11.016 8 20 [*******+-***********] 1
19 1 5 GLY H 1 10 ARG QG 2.352 . 3.043 13.280 10.092 16.076 13.033 1 20 [+*********-*********] 1
20 1 6 MET H 1 10 ARG HA 2.157 . 2.739 12.831 11.667 13.914 11.175 15 20 [**************+*-***] 1
21 1 6 MET H 1 10 ARG QB 2.656 . 3.538 13.048 9.923 14.856 11.318 4 20 [***+************-***] 1
22 1 6 MET H 1 10 ARG QG 3.021 . 4.162 12.066 8.853 15.364 11.202 4 20 [***+************-***] 1
23 1 6 MET H 1 11 GLN QB 2.375 . 3.080 14.021 10.529 15.717 12.637 8 20 [*******+****-*******] 1
24 1 6 MET QB 1 11 GLN H 2.631 . 7.000 10.954 7.450 12.807 5.807 15 19 "[**************+*- **]" 1
25 1 6 MET QB 1 11 GLN HA 2.155 . 2.736 12.548 9.836 15.147 12.411 15 20 [**************+**-**] 1
26 1 6 MET QB 1 11 GLN HA 2.077 . 2.616 10.396 9.299 11.044 8.428 8 20 [*******+*********-**] 1
27 1 6 MET QG 1 11 GLN H 2.546 . 3.356 11.000 7.837 13.444 10.088 3 20 [**+*********-*******] 1
28 1 6 MET QG 1 11 GLN HA 2.056 . 2.584 12.540 9.146 14.878 12.294 5 20 [****+*******-*******] 1
29 1 6 MET QG 1 11 GLN QE 2.589 . 3.427 12.656 5.588 15.936 12.509 7 20 [******+*****-*******] 1
30 1 6 MET QG 1 14 LEU QD 3.149 . 4.389 8.563 3.352 11.989 7.600 3 19 "[**+********* ****-**]" 1
31 1 7 ALA H 1 12 ARG HG3 2.815 . 3.806 10.928 4.986 14.183 10.377 5 20 [**-*+***************] 1
32 1 7 ALA H 1 12 ARG HA 2.280 . 2.930 10.077 6.254 14.067 11.137 19 20 [***************-**+*] 1
33 1 7 ALA H 1 11 GLN HA 2.178 . 2.771 12.696 9.846 14.203 11.432 11 20 [*********-+*********] 1
34 1 7 ALA H 1 11 GLN HA 2.248 . 2.880 10.770 6.925 12.898 10.018 11 20 [**********+****-****] 1
35 1 7 ALA H 1 11 GLN QG 3.335 . 4.725 11.539 7.028 13.382 8.657 12 20 [*********-*+********] 1
36 1 7 ALA H 1 12 ARG QB 2.730 . 3.225 11.925 6.195 15.473 12.248 14 20 [*************+*-****] 1
37 1 7 ALA H 1 12 ARG QG 2.637 . 3.507 12.759 7.290 16.252 12.745 11 20 [***-******+*********] 1
38 1 7 ALA HA 1 12 ARG QB 2.175 . 2.857 11.490 6.850 15.251 12.394 5 20 [****+**********-****] 1
39 1 7 ALA HA 1 12 ARG QG 2.200 . 7.000 12.453 6.761 16.579 9.579 5 18 "[** +**********-****]" 1
40 1 7 ALA HA 1 15 SER QB 2.920 . 3.986 10.469 6.362 16.908 12.922 19 20 [**************-***+*] 1
41 1 7 ALA MB 1 12 ARG QB 1.745 . 2.126 9.360 5.843 11.950 9.824 5 20 [****+**********-****] 1
42 1 7 ALA MB 1 12 ARG QG 2.029 . 2.544 10.162 6.258 13.055 10.511 5 20 [**-*+***************] 1
43 1 8 ASP H 1 11 GLN HA 2.646 . 3.521 9.230 6.942 11.287 7.766 19 20 [***************-**+*] 1
44 1 8 ASP H 1 12 ARG QB 3.363 . 4.777 10.388 5.666 13.745 8.968 5 20 [***-+***************] 1
45 1 8 ASP H 1 12 ARG QG 3.364 . 4.778 11.456 5.003 15.238 10.460 5 19 "[** -+***************]" 1
46 1 8 ASP HA 1 13 SER QB 1.891 . 2.338 8.472 5.897 10.567 8.229 11 20 [**********+*****-***] 1
47 1 8 ASP HA 1 12 ARG QG 2.634 . 3.501 9.911 2.753 13.843 10.342 17 18 "[** ***********-+***]" 1
48 1 8 ASP HA 1 13 SER QB 1.834 . 2.254 10.977 6.266 13.822 11.568 17 20 [**-*************+***] 1
49 1 8 ASP HA 1 14 LEU QD 2.929 . 7.000 6.372 2.230 8.799 1.799 20 5 "[ **. 1 .- *+]" 1
50 1 8 ASP QB 1 12 ARG HG2 2.753 . 3.701 9.850 2.165 13.628 9.927 5 17 "[ * +**********-****]" 1
51 1 8 ASP QB 1 12 ARG QB 3.135 . 4.364 8.395 2.507 11.599 7.235 5 16 "[ - +********** ****]" 1
52 1 8 ASP QB 1 13 SER H 2.454 . 3.207 10.089 5.198 12.535 9.328 5 20 [**-*+***************] 1
53 1 8 ASP QB 1 14 LEU QB 3.224 . 4.523 8.962 5.465 11.287 6.764 20 20 [************-******+] 1
54 1 9 GLN H 1 13 SER HA 2.257 . 7.000 10.592 7.363 14.224 7.224 17 19 "[**- ************+***]" 1
55 1 9 GLN H 1 13 SER HA 2.555 . 3.371 8.959 6.587 11.527 8.156 17 20 [************-***+***] 1
56 1 9 GLN H 1 13 SER QB 2.612 . 3.465 9.618 6.136 12.321 8.856 17 20 [**-*************+***] 1
57 1 9 GLN H 1 14 LEU HA 2.924 . 3.992 10.097 6.760 12.865 8.873 20 20 [************-******+] 1
58 1 9 GLN H 1 14 LEU QB 2.625 . 3.486 8.111 4.300 10.642 7.156 20 20 [************-******+] 1
59 1 9 GLN H 1 14 LEU QD 2.915 . 3.977 5.236 1.843 7.581 3.604 20 13 "[*-**.****1 .****+]" 1
60 1 9 GLN HA 1 13 SER QB 2.989 . 7.000 8.931 6.605 10.319 3.319 2 18 "[*+ **************- *]" 1
61 1 9 GLN HA 1 14 LEU QB 2.243 . 2.872 7.225 5.105 10.590 7.718 16 20 [***********-***+****] 1
62 1 9 GLN HA 1 14 LEU QD 1.996 . 7.000 4.319 1.907 7.523 0.523 4 1 "[ +. 1 . 2]" 1
63 1 9 GLN HA 1 15 SER H 2.598 . 3.442 7.730 4.262 10.431 6.989 19 20 [********-*********+*] 1
64 1 9 GLN QB 1 14 LEU H 3.031 . 4.179 6.273 4.910 8.036 3.857 17 20 [*****-**********+***] 1
65 1 9 GLN QB 1 14 LEU QB 2.239 . 2.866 6.104 3.657 8.535 5.669 20 20 [*************-*****+] 1
66 1 10 ARG H 1 15 SER HA 2.574 . 3.402 6.657 4.044 8.542 5.140 19 20 [********-*********+*] 1
67 1 10 ARG H 1 14 LEU QB 3.140 . 4.372 6.426 4.787 9.391 5.019 16 18 "[**********- **.+****]" 1
68 1 10 ARG H 1 14 LEU QD 2.842 . 3.851 3.540 1.708 6.283 2.432 1 5 "[+ -*. 1 .* *]" 1
69 1 10 ARG H 1 15 SER HA 3.328 . 4.712 8.183 4.353 11.049 6.337 4 19 "[***+**** *****-*****]" 1
70 1 10 ARG HA 1 16 THR MG 2.910 . 7.000 10.122 7.631 13.317 6.317 6 20 [*****+*******-******] 1
71 1 10 ARG QB 1 15 SER H 2.595 . 3.436 5.329 3.184 7.470 4.034 13 19 "[******** **-+*******]" 1
72 1 10 ARG QB 1 14 LEU QD 2.865 . 3.891 3.322 1.756 6.008 2.117 16 5 "[* *.- 1 * .+ 2]" 1
73 1 10 ARG QB 1 15 SER H 2.440 . 3.184 7.076 5.130 9.565 6.381 16 20 [***************+-***] 1
74 1 10 ARG QB 1 15 SER HA 2.260 . 2.886 8.158 5.383 11.007 8.121 16 20 [***************+-***] 1
75 1 11 GLN H 1 15 SER HA 2.865 . 3.891 6.983 4.774 8.736 4.845 13 20 [********-***+*******] 1
76 1 11 GLN H 1 15 SER QB 3.181 . 4.446 5.662 3.206 7.878 3.432 13 15 "[**-***** 1* +*.** **]" 1
77 1 11 GLN HA 1 17 SER H 2.855 . 3.874 11.236 7.873 13.110 9.236 13 20 [**-*********+*******] 1
78 1 12 ARG H 1 16 THR HB 3.036 . 4.188 8.423 6.626 9.865 5.677 11 20 [**********+*****-***] 1
79 1 12 ARG H 1 17 SER HA 2.517 . 3.309 10.242 7.000 12.781 9.472 11 20 [**********+*****-***] 1
80 1 12 ARG H 1 17 SER QB 2.784 . 3.753 10.665 7.856 12.449 8.696 11 20 [**-*******+*********] 1
81 1 12 ARG HA 1 18 GLY H 2.487 . 7.000 9.552 7.191 11.135 4.135 6 18 "[*** *+*******-** ***]" 1
82 1 12 ARG QB 1 17 SER HA 2.105 . 2.659 9.209 5.903 11.364 8.705 11 20 [**********+*****-***] 1
83 1 12 ARG QB 1 18 GLY H 3.102 . 4.305 9.517 6.566 11.274 6.969 20 20 [*************-*****+] 1
84 1 12 ARG QB 1 19 GLU QG 3.352 . 4.406 11.243 9.805 13.173 8.767 5 20 [****+********-******] 1
85 1 13 SER H 1 17 SER H 3.592 . 5.204 8.418 6.650 9.387 4.183 13 20 [************+***-***] 1
86 1 13 SER H 1 18 GLY QA 2.900 . 3.539 9.106 6.964 11.093 7.554 7 20 [******+******-******] 1
87 1 14 LEU H 1 19 GLU HA 2.836 . 3.841 12.555 10.560 13.923 10.082 16 20 [***************+-***] 1
88 1 14 LEU H 1 19 GLU QB 2.690 . 3.595 11.091 9.151 12.889 9.294 10 20 [*********+******-***] 1
89 1 14 LEU HA 1 19 GLU QB 2.616 . 3.472 9.418 7.980 11.167 7.695 18 20 [********-********+**] 1
90 1 14 LEU QB 1 19 GLU H 3.069 . 4.246 9.506 8.299 10.700 6.454 18 20 [*****-***********+**] 1
91 1 14 LEU QB 1 19 GLU QB 2.147 . 2.723 9.912 7.991 11.674 8.951 14 20 [*****-*******+******] 1
92 1 14 LEU QB 1 19 GLU QG 2.223 . 2.841 9.416 7.320 11.401 8.560 4 20 [**-+****************] 1
93 1 15 SER H 1 19 GLU HA 3.281 . 4.627 11.778 10.350 12.548 7.921 18 20 [**********-******+**] 1
94 1 16 THR H 1 21 LEU HA 2.956 . 4.048 14.773 11.493 16.927 12.879 5 20 [****+*****-*********] 1
95 1 16 THR H 1 21 LEU HG 2.736 . 7.000 16.822 13.837 18.289 11.289 3 20 [**+*******-*********] 1
96 1 16 THR H 1 22 TYR H 3.043 . 4.200 13.281 11.239 14.468 10.268 5 20 [****+*****-*********] 1
97 1 16 THR HA 1 19 GLU QG 3.152 . 7.000 5.832 4.172 7.277 0.277 4 0 "[ . 1 . 2]" 1
98 1 16 THR HA 1 21 LEU QB 2.955 . 4.046 11.814 10.571 13.241 9.195 15 20 [******-*******+*****] 1
99 1 16 THR HA 1 21 LEU QB 2.961 . 4.057 9.242 7.667 11.392 7.335 5 20 [****+**********-****] 1
100 1 17 SER H 1 21 LEU QB 2.963 . 4.060 10.556 9.456 11.368 7.308 15 20 [**************+***-*] 1
101 1 17 SER H 1 21 LEU HG 3.276 . 4.617 13.416 12.330 14.330 9.713 3 20 [**+***************-*] 1
102 1 17 SER H 1 22 TYR HA 2.861 . 3.884 10.651 9.152 11.594 7.710 15 20 [**************+***-*] 1
103 1 17 SER H 1 23 HIS QB 3.317 . 4.692 6.106 4.662 8.518 3.826 5 13 "[ **+* **1 ** * ***-]" 1
104 1 17 SER H 1 24 VAL H 3.357 . 4.766 10.148 8.493 12.442 7.676 5 20 [****+********-******] 1
105 1 17 SER HA 1 21 LEU QB 2.914 . 3.975 9.309 8.243 9.916 5.941 11 20 [**-*******+*********] 1
106 1 17 SER HA 1 22 TYR QB 2.810 . 3.797 8.281 6.892 9.136 5.339 4 20 [**-+****************] 1
107 1 17 SER HA 1 22 TYR QD 2.702 . 3.615 8.780 7.417 9.842 6.227 14 20 [****-********+******] 1
108 1 17 SER HA 1 25 LEU QB 3.075 . 4.257 13.201 11.705 13.943 9.686 9 20 [**-*****+***********] 1
109 1 17 SER HA 1 27 LEU QB 3.254 . 7.000 12.694 10.672 13.851 6.851 11 20 [**-*******+*********] 1
110 1 17 SER HA 1 72 LEU QD 2.493 . 3.270 8.628 8.045 8.919 5.649 4 20 [***+-***************] 1
111 1 17 SER HA 1 72 LEU QD 2.990 . 4.107 10.182 8.743 10.928 6.821 16 20 [****-**********+****] 1
112 1 18 GLY H 1 19 GLU QG 3.183 . 4.450 4.000 3.472 5.302 0.852 4 2 "[ +. 1 . - 2]" 1
113 1 18 GLY H 1 22 TYR H 2.608 . 3.458 8.968 8.642 9.301 5.843 9 20 [********+-**********] 1
114 1 18 GLY H 1 22 TYR QB 2.709 . 3.626 7.320 6.931 8.007 4.381 4 20 [***+**************-*] 1
115 1 18 GLY H 1 23 HIS QB 2.409 . 3.135 6.029 5.287 7.128 3.993 5 20 [****+**********-****] 1
116 1 18 GLY H 1 24 VAL H 2.604 . 3.452 9.948 9.167 10.981 7.529 5 20 [-***+***************] 1
117 1 19 GLU H 1 21 LEU HA 3.098 . 4.297 8.915 8.791 9.075 4.778 9 20 [**-*****+***********] 1
118 1 19 GLU H 1 23 HIS QB 2.779 . 3.744 4.818 4.252 5.357 1.613 19 20 [*************-****+*] 1
119 1 19 GLU H 1 24 VAL HA 2.513 . 3.302 10.421 9.967 10.822 7.520 5 20 [****+********-******] 1
120 1 19 GLU H 1 24 VAL HB 2.464 . 7.000 11.407 11.049 11.730 4.730 9 20 [********+****-******] 1
121 1 19 GLU HA 1 24 VAL HB 2.491 . 3.266 10.537 9.919 10.752 7.486 18 20 [***-*************+**] 1
122 1 20 SER H 1 21 LEU HA 2.943 . 4.025 4.896 4.802 5.009 0.984 1 20 [+***********-*******] 1
123 1 20 SER H 1 23 HIS H 2.884 . 3.924 3.889 3.552 4.434 0.510 1 1 "[+ . 1 . 2]" 1
124 1 20 SER H 1 22 TYR HA 2.805 . 3.789 5.964 5.730 6.441 2.652 1 20 [+*-*****************] 1
125 1 20 SER H 1 24 VAL H 2.602 . 3.448 5.861 5.632 6.163 2.715 1 20 [+**-****************] 1
126 1 20 SER H 1 24 VAL H 2.512 . 3.300 5.777 5.551 6.088 2.788 1 20 [+**-****************] 1
127 1 20 SER H 1 24 VAL HA 2.926 . 3.997 8.414 8.099 8.566 4.569 18 20 [***-*************+**] 1
128 1 20 SER H 1 24 VAL HB 2.823 . 7.000 8.589 8.432 8.744 1.744 18 20 [****-************+**] 1
129 1 20 SER H 1 25 LEU HA 2.756 . 3.706 10.534 10.231 11.033 7.327 1 20 [+*********-*********] 1
130 1 20 SER H 1 25 LEU QB 2.342 . 3.027 8.165 7.596 8.811 5.784 1 20 [+*********-*********] 1
131 1 20 SER H 1 26 GLY H 2.546 . 3.356 8.761 8.393 9.468 6.112 1 20 [+**-****************] 1
132 1 20 SER HA 1 24 VAL QG 2.583 . 3.417 3.982 3.725 4.234 0.817 3 13 "[ +** **-***** * *]" 1
133 1 20 SER HA 1 25 LEU QD 2.362 . 3.060 7.969 7.818 8.122 5.062 18 20 [*****-***********+**] 1
134 1 20 SER HA 1 25 LEU QD 2.290 . 2.946 7.445 7.319 7.598 4.652 10 20 [*******-*+**********] 1
135 1 20 SER HA 1 43 LEU QD 2.450 . 3.200 8.935 8.723 9.183 5.983 10 20 [*******-*+**********] 1
136 1 21 LEU H 1 23 HIS HA 2.981 . 4.092 6.807 6.609 7.169 3.077 1 20 [+**-****************] 1
137 1 21 LEU H 1 23 HIS HA 2.719 . 3.643 6.638 6.473 6.963 3.320 1 20 [+**-****************] 1
138 1 21 LEU H 1 24 VAL QG 2.627 . 3.490 3.840 3.698 3.937 0.447 4 0 "[ . 1 . 2]" 1
139 1 21 LEU H 1 25 LEU HA 3.217 . 4.510 9.225 8.844 9.449 4.939 1 20 [+*********-*********] 1
140 1 21 LEU H 1 25 LEU QB 2.775 . 3.738 7.046 6.388 7.411 3.673 1 20 [+*********-*********] 1
141 1 21 LEU H 1 26 GLY QA . . 2.770 9.219 9.034 9.511 6.741 1 20 [+*******-***********] 1
142 1 21 LEU H 1 43 LEU QD 3.141 . 4.374 8.859 8.744 9.004 4.630 16 20 [****-**********+****] 1
143 1 21 LEU QB 1 63 LYS HA 3.250 . 4.570 9.900 9.783 10.070 5.500 4 20 [-**+****************] 1
144 1 21 LEU QD 1 63 LYS H 3.097 . 7.000 7.566 7.351 7.731 0.731 4 16 "[ - +*** ***********2]" 1
145 1 21 LEU QD 1 63 LYS H 3.404 . 4.852 7.361 7.178 7.511 2.659 4 20 [***+***-************] 1
146 1 21 LEU QD 1 67 ASN H 3.257 . 4.583 4.143 4.010 4.235 . 0 0 "[ . 1 . 2]" 1
147 1 21 LEU HG 1 63 LYS HA 2.568 . 3.393 10.516 10.338 10.713 7.320 4 20 [***+***-************] 1
148 1 22 TYR H 1 23 HIS HA 2.753 . 7.000 5.372 5.338 5.437 . 0 0 "[ . 1 . 2]" 1
149 1 22 TYR H 1 25 LEU H 3.120 . 4.337 5.117 4.895 5.344 1.007 1 20 [+*********-*********] 1
150 1 22 TYR H 1 26 GLY H 2.345 . 3.032 6.438 6.126 6.920 3.888 1 20 [+***********-*******] 1
151 1 22 TYR H 1 26 GLY QA 3.255 . 3.321 7.567 7.379 7.921 4.600 1 20 [+***********-*******] 1
152 1 22 TYR H 1 27 LEU HA 2.782 . 3.750 8.510 8.310 8.712 4.962 10 20 [**-******+**********] 1
153 1 22 TYR H 1 27 LEU QB 2.342 . 3.686 7.268 7.053 7.442 3.756 19 20 [**-***************+*] 1
154 1 22 TYR QB 1 24 VAL HA 3.126 . 4.347 6.845 6.769 6.917 2.570 19 20 [-*****************+*] 1
155 1 22 TYR QB 1 28 ASP H 3.191 . 4.464 4.729 4.250 5.097 0.633 19 3 "[ . *- . +2]" 1
156 1 22 TYR QD 1 23 HIS H 3.461 . 4.958 4.087 3.785 4.346 . 0 0 "[ . 1 . 2]" 1
157 1 22 TYR QE 1 24 VAL HA 2.784 . 3.753 10.240 10.094 10.361 6.608 1 20 [+****************-**] 1
158 1 22 TYR QE 1 26 GLY H 2.996 . 4.118 8.190 7.831 8.573 4.455 1 20 [+***********-*******] 1
159 1 23 HIS H 1 27 LEU HA 2.327 . 3.004 7.716 7.011 7.957 4.953 11 20 [-*********+*********] 1
160 1 23 HIS H 1 27 LEU QB 2.364 . 3.062 7.242 6.650 7.480 4.418 9 20 [-*******+***********] 1
161 1 23 HIS H 1 27 LEU QD 2.269 . 7.000 4.726 4.389 4.940 . 0 0 "[ . 1 . 2]" 1
162 1 23 HIS H 1 28 ASP HA 2.633 . 3.500 6.333 5.107 6.944 3.444 19 20 [-*****************+*] 1
163 1 23 HIS H 1 28 ASP QB 2.822 . 3.818 7.894 6.881 8.427 4.609 19 20 [-*****************+*] 1
164 1 23 HIS H 1 29 LYS H 2.640 . 7.000 7.410 6.627 7.798 0.798 13 6 "[ . *1 -+ . ***]" 1
165 1 23 HIS HA 1 28 ASP QB 2.393 . 3.109 7.141 6.245 7.697 4.588 16 20 [-**************+****] 1
166 1 23 HIS QB 1 28 ASP HA 2.285 . 2.937 6.454 5.337 7.431 4.494 19 20 [-*****************+*] 1
167 1 23 HIS QB 1 28 ASP QB 2.076 . 2.615 7.705 6.651 8.593 5.978 19 20 [-*****************+*] 1
168 1 23 HIS QB 1 29 LYS H 2.478 . 3.245 7.907 7.071 8.819 5.574 19 20 [*****-************+*] 1
169 1 24 VAL H 1 28 ASP HA 2.224 . 2.842 8.120 7.102 8.711 5.869 19 20 [-*****************+*] 1
170 1 24 VAL H 1 28 ASP QB 2.283 . 2.934 9.419 8.681 9.835 6.901 11 20 [-*********+*********] 1
171 1 24 VAL H 1 29 LYS QB 2.345 . 3.032 9.288 8.674 10.234 7.202 12 20 [**********-+********] 1
172 1 24 VAL H 1 29 LYS QG 2.641 . 3.259 9.628 7.638 10.926 7.667 9 20 [***-****+***********] 1
173 1 24 VAL HA 1 28 ASP QB 3.201 . 7.000 10.950 10.419 11.386 4.386 8 20 [*-*****+************] 1
174 1 24 VAL HA 1 29 LYS H 2.534 . 3.336 11.214 10.697 11.662 8.326 13 20 [-***********+*******] 1
175 1 24 VAL HA 1 29 LYS QB 2.445 . 3.192 11.604 10.917 12.492 9.300 12 20 [**********-+********] 1
176 1 24 VAL HA 1 29 LYS QG 3.078 . 4.262 11.819 9.883 13.071 8.809 17 20 [***-************+***] 1
177 1 24 VAL QG 1 59 ALA HA 2.995 . 4.116 8.494 8.350 8.633 4.517 13 20 [************+*-*****] 1
178 1 24 VAL QG 1 59 ALA MB 2.936 . 3.788 8.101 8.022 8.199 4.411 13 20 [**********-*+*******] 1
179 1 24 VAL QG 1 63 LYS H 2.713 . 3.633 5.977 5.845 6.044 2.411 9 20 [**-*****+***********] 1
180 1 25 LEU H 1 31 ALA MB 2.439 . 3.183 3.732 3.626 3.900 0.717 6 12 "[** *+ *-*** * * *2]" 1
181 1 25 LEU H 1 30 ASN QB 2.034 . 2.551 11.652 10.904 12.407 9.856 13 20 [-***********+*******] 1
182 1 25 LEU H 1 30 ASN QD 2.983 . 4.095 11.456 10.345 11.892 7.797 19 20 [*****-************+*] 1
183 1 25 LEU H 1 31 ALA MB 2.787 . 3.758 7.224 6.910 7.387 3.629 3 20 [-*+*****************] 1
184 1 25 LEU HA 1 30 ASN H 2.398 . 3.117 11.774 11.524 12.304 9.187 13 20 [************+**-****] 1
185 1 25 LEU HA 1 37 LYS QD 2.614 . 7.000 10.329 9.243 11.151 4.151 13 20 [*-**********+*******] 1
186 1 25 LEU HA 1 30 ASN QB 2.093 . 2.640 12.660 12.042 13.552 10.912 13 20 [-***********+*******] 1
187 1 25 LEU QB 1 30 ASN QD 2.469 . 3.231 9.718 8.709 10.048 6.817 19 20 [*****-************+*] 1
188 1 25 LEU QB 1 34 ASP QB 2.722 . 3.648 9.318 8.920 9.822 6.174 7 20 [*****-+*************] 1
189 1 25 LEU QD 1 34 ASP H 2.665 . 3.553 6.069 5.984 6.140 2.587 3 20 [**+-****************] 1
190 1 25 LEU QD 1 30 ASN H 3.259 . 4.587 8.174 7.905 8.441 3.854 13 20 [************+**-****] 1
191 1 25 LEU QD 1 30 ASN QB 2.344 . 3.031 8.910 8.693 9.324 6.293 13 20 [************+****-**] 1
192 1 25 LEU QD 1 30 ASN QD 1.795 . 2.198 9.324 8.622 9.598 7.400 8 20 [*****-*+************] 1
193 1 25 LEU QD 1 34 ASP QB 2.467 . 3.228 7.498 7.296 7.667 4.439 13 20 [******-*****+*******] 1
194 1 25 LEU QD 1 35 ASP HA 2.478 . 3.246 5.855 5.773 6.004 2.758 3 20 [**+************-****] 1
195 1 25 LEU QD 1 36 ILE H 2.863 . 3.887 4.649 4.534 4.853 0.966 3 20 [**+***-*************] 1
196 1 25 LEU QD 1 37 LYS QD 2.625 . 7.000 5.686 4.677 6.486 . 0 0 "[ . 1 . 2]" 1
197 1 25 LEU QD 1 37 LYS HE2 2.331 . 7.000 6.644 6.076 7.296 0.296 16 0 "[ . 1 . 2]" 1
198 1 25 LEU QD 1 37 LYS QG 2.816 . 7.000 5.087 4.754 5.464 . 0 0 "[ . 1 . 2]" 1
199 1 25 LEU QD 1 64 GLU HA 2.711 . 3.630 6.088 5.837 6.291 2.661 7 20 [**-***+*************] 1
200 1 25 LEU QD 1 64 GLU HA 3.140 . 4.373 5.428 5.310 5.515 1.142 7 20 [**-***+*************] 1
201 1 26 GLY H 1 27 LEU QB 3.205 . 4.489 5.178 4.990 5.291 0.802 4 20 [***+********-*******] 1
202 1 26 GLY H 1 28 ASP H 3.257 . 4.583 6.848 6.662 6.950 2.367 4 20 [***+********-*******] 1
203 1 26 GLY H 1 29 LYS HA 2.991 . 4.109 9.075 8.599 9.729 5.620 1 20 [+*********-*********] 1
204 1 26 GLY H 1 29 LYS QB 3.228 . 4.531 9.069 8.459 9.617 5.086 12 20 [**********-+********] 1
205 1 26 GLY H 1 30 ASN H 2.199 . 2.804 9.913 9.656 10.253 7.449 12 20 [*********-*+********] 1
206 1 26 GLY H 1 30 ASN HA 2.664 . 3.551 12.519 12.269 12.836 9.285 2 20 [*+********-*********] 1
207 1 26 GLY H 1 30 ASN QB 2.621 . 3.480 11.060 10.508 11.635 8.155 6 20 [-****+**************] 1
208 1 26 GLY H 1 31 ALA HA 2.434 . 3.174 10.633 10.463 10.800 7.626 12 20 [*******-***+********] 1
209 1 26 GLY H 1 32 THR H 2.965 . 7.000 11.614 11.436 11.843 4.843 16 20 [************-**+****] 1
210 1 26 GLY H 1 36 ILE MD 3.338 . 4.730 8.751 8.479 8.920 4.190 1 20 [+***********-*******] 1
211 1 27 LEU H 1 27 LEU QD 3.102 . 4.305 2.644 2.518 2.864 . 0 0 "[ . 1 . 2]" 1
212 1 27 LEU H 1 31 ALA HA 2.239 . 2.866 8.145 8.016 8.269 5.403 6 20 [*****+*******-******] 1
213 1 27 LEU H 1 32 THR HA 3.045 . 4.204 10.139 9.999 10.236 6.032 20 20 [**************-****+] 1
214 1 27 LEU H 1 35 ASP QB 2.810 . 3.704 6.469 6.066 6.901 3.197 18 20 [*******-*********+**] 1
215 1 27 LEU H 1 36 ILE H 3.329 . 4.714 8.186 8.027 8.373 3.659 1 20 [+*****************-*] 1
216 1 27 LEU QD 1 30 ASN HA 2.960 . 4.055 5.980 5.847 6.064 2.009 17 20 [***************-+***] 1
217 1 27 LEU QD 1 30 ASN QB 2.909 . 3.967 5.660 5.331 6.076 2.109 13 20 [-***********+*******] 1
218 1 28 ASP H 1 32 THR HA 2.730 . 3.662 9.042 8.893 9.207 5.545 4 20 [-**+****************] 1
219 1 28 ASP H 1 32 THR MG 3.100 . 4.301 8.081 7.856 8.350 4.049 6 20 [*****+*-************] 1
220 1 28 ASP HA 1 36 ILE H 2.497 . 3.276 9.594 9.418 9.729 6.453 10 20 [*****-***+**********] 1
221 1 28 ASP HA 1 32 THR HA 3.081 . 4.268 10.331 10.028 10.520 6.252 4 20 [***+*-**************] 1
222 1 28 ASP HA 1 33 SER H 2.681 . 3.579 12.468 12.196 12.608 9.029 10 20 [*********+*-********] 1
223 1 28 ASP HA 1 33 SER QB 2.207 . 2.816 12.994 12.677 13.254 10.438 13 20 [*****-******+*******] 1
224 1 28 ASP HA 1 33 SER QB 2.201 . 2.807 11.461 11.199 11.669 8.862 10 20 [*****-***+**********] 1
225 1 28 ASP HA 1 34 ASP HA 3.001 . 7.000 14.372 14.220 14.524 7.524 4 20 [***+*-**************] 1
226 1 28 ASP HA 1 34 ASP QB 2.874 . 7.000 12.246 11.925 12.510 5.510 4 20 [***+*-**************] 1
227 1 28 ASP HA 1 35 ASP H 3.239 . 4.550 10.974 10.821 11.118 6.568 10 20 [*********+*-********] 1
228 1 28 ASP HA 1 36 ILE HB 2.834 . 3.838 10.841 10.505 11.106 7.268 10 20 [*****-***+**********] 1
229 1 28 ASP HA 1 36 ILE MD 2.515 . 3.306 7.693 7.326 7.970 4.664 10 20 [*********+*-********] 1
230 1 28 ASP HA 1 37 LYS QE 2.899 . 3.949 13.997 13.525 14.674 10.725 5 20 [****+*****-*********] 1
231 1 28 ASP HA 1 37 LYS QG 2.804 . 3.787 12.988 12.594 13.331 9.544 10 20 [*****-***+**********] 1
232 1 28 ASP HA 1 73 THR MG 2.706 . 3.621 11.908 11.504 12.201 8.580 10 20 [-********+**********] 1
233 1 28 ASP QB 1 36 ILE HB 2.790 . 7.000 9.059 8.779 9.450 2.450 14 20 [**-**********+******] 1
234 1 29 LYS H 1 35 ASP H 2.328 . 3.005 8.502 8.344 8.658 5.653 1 20 [+******************-] 1
235 1 29 LYS H 1 33 SER H 3.190 . 4.462 11.862 11.645 12.054 7.592 14 20 [***********-*+******] 1
236 1 29 LYS H 1 33 SER HA 2.570 . 3.396 12.089 11.765 12.399 9.003 15 20 [**************+-****] 1
237 1 29 LYS H 1 34 ASP HA 2.526 . 3.323 14.663 14.484 14.805 11.482 1 20 [+*****************-*] 1
238 1 29 LYS H 1 34 ASP QB 2.165 . 2.751 12.339 11.829 12.672 9.921 10 20 [*********+**-*******] 1
239 1 29 LYS H 1 35 ASP H 2.650 . 3.528 11.215 10.926 11.378 7.850 1 20 [+***********-*******] 1
240 1 29 LYS HA 1 32 THR MG 2.854 . 3.872 8.637 8.434 8.808 4.936 14 20 [*****-*******+******] 1
241 1 29 LYS HA 1 32 THR MG 2.987 . 4.102 8.515 8.325 8.686 4.584 14 20 [*****-*******+******] 1
242 1 29 LYS HA 1 34 ASP QB 2.213 . 2.825 11.240 10.804 11.497 8.672 10 20 [*****-***+**********] 1
243 1 29 LYS HA 1 37 LYS QG 2.434 . 7.000 11.501 11.017 11.825 4.825 8 20 [*****-*+************] 1
244 1 29 LYS QB 1 32 THR H 3.287 . 4.637 8.406 8.120 8.612 3.975 5 20 [****+******-********] 1
245 1 30 ASN H 1 31 ALA MB 2.624 . 3.485 3.744 3.636 3.918 0.433 6 0 "[ . 1 . 2]" 1
246 1 30 ASN H 1 32 THR H 2.880 . 3.917 6.500 6.338 6.754 2.837 6 20 [***-*+**************] 1
247 1 30 ASN H 1 32 THR HA 3.046 . 4.206 6.735 6.607 6.856 2.650 1 20 [+**************-****] 1
248 1 30 ASN H 1 34 ASP HA 2.374 . 3.078 9.629 9.355 9.914 6.836 12 20 [***********+*-******] 1
249 1 30 ASN H 1 34 ASP HA 2.743 . 3.684 6.787 6.655 6.962 3.278 10 20 [*********+****-*****] 1
250 1 30 ASN H 1 34 ASP QB 2.290 . 2.946 10.279 9.983 10.530 7.584 10 20 [*********+**-*******] 1
251 1 30 ASN H 1 35 ASP HA 2.812 . 3.800 9.993 9.657 10.339 6.539 12 20 [***********+*-******] 1
252 1 30 ASN H 1 35 ASP QB 2.618 . 3.475 6.596 6.329 6.859 3.384 12 20 [***********+*-******] 1
253 1 30 ASN H 1 36 ILE H 2.789 . 3.761 8.808 8.600 9.007 5.246 6 20 [*****+*************-] 1
254 1 30 ASN H 1 36 ILE HB 2.918 . 7.000 9.734 9.427 9.983 2.983 1 20 [+******************-] 1
255 1 30 ASN HA 1 39 SER H 2.956 . 4.049 8.153 7.946 8.433 4.384 4 20 [***+*********-******] 1
256 1 30 ASN HA 1 35 ASP QB 2.864 . 3.889 7.273 7.099 7.515 3.626 4 20 [***+***************-] 1
257 1 30 ASN HA 1 38 LYS QB 2.690 . 3.594 12.621 12.337 12.802 9.208 13 20 [**-*********+*******] 1
258 1 30 ASN HA 1 42 LYS QD 2.696 . 7.000 14.068 13.874 14.321 7.321 4 20 [***+*************-**] 1
259 1 30 ASN QB 1 34 ASP QB 2.535 . 7.000 9.069 8.627 9.280 2.280 10 20 [*********+****-*****] 1
260 1 30 ASN QB 1 35 ASP HA 2.823 . 3.819 9.556 9.113 10.231 6.412 13 20 [-***********+*******] 1
261 1 30 ASN QB 1 35 ASP QB 2.805 . 3.788 6.541 6.317 7.033 3.245 13 20 [-***********+*******] 1
262 1 31 ALA H 1 35 ASP HA 2.974 . 4.080 8.241 8.017 8.543 4.463 4 20 [***+*********-******] 1
263 1 31 ALA H 1 35 ASP QB 2.990 . 4.107 4.999 4.809 5.277 1.170 4 20 [***+*********-******] 1
264 1 31 ALA H 1 36 ILE HA 2.878 . 3.913 7.254 7.158 7.372 3.459 1 20 [+**************-****] 1
265 1 31 ALA H 1 36 ILE HB 2.500 . 3.281 7.725 7.533 7.880 4.599 1 20 [+******************-] 1
266 1 31 ALA H 1 36 ILE MD 2.283 . 2.934 4.541 4.314 4.692 1.758 6 20 [*****+*************-] 1
267 1 31 ALA H 1 37 LYS HA 2.938 . 7.000 7.614 7.368 7.766 0.766 6 18 "[*****+***1-**** ****]" 1
268 1 31 ALA HA 1 39 SER H 2.910 . 3.968 6.041 5.814 6.285 2.317 16 20 [**-************+****] 1
269 1 31 ALA HA 1 36 ILE HB 3.015 . 4.151 7.116 6.917 7.248 3.097 1 20 [+***********-*******] 1
270 1 31 ALA HA 1 36 ILE MG 2.497 . 3.276 7.116 7.017 7.192 3.916 3 20 [**+*********-*******] 1
271 1 31 ALA HA 1 37 LYS HA 3.081 . 4.267 7.625 7.127 7.885 3.618 4 20 [***+*****-**********] 1
272 1 32 THR H 1 38 LYS H 2.288 . 2.942 7.361 7.175 7.553 4.611 4 20 [***+**-*************] 1
273 1 32 THR H 1 37 LYS QB 2.601 . 3.447 6.579 6.300 6.749 3.302 4 20 [***+***************-] 1
274 1 32 THR H 1 37 LYS QE 2.554 . 7.000 8.130 7.866 8.447 1.447 19 20 [***********-******+*] 1
275 1 32 THR H 1 34 ASP HA 3.030 . 4.177 6.394 6.217 6.635 2.458 16 20 [*****-*********+****] 1
276 1 32 THR H 1 36 ILE HA 3.549 . 5.123 6.161 5.908 6.443 1.320 16 20 [**-************+****] 1
277 1 32 THR H 1 36 ILE HB 2.255 . 2.891 5.625 5.404 5.850 2.959 16 20 [**-************+****] 1
278 1 32 THR H 1 36 ILE MG 2.523 . 3.319 6.416 6.218 6.624 3.305 16 20 [**************-+****] 1
279 1 32 THR H 1 37 LYS HA 2.618 . 3.475 9.290 9.070 9.563 6.088 4 20 [***+*-**************] 1
280 1 32 THR H 1 37 LYS QE 3.408 . 4.860 8.321 7.996 8.721 3.861 4 20 [***+*******-********] 1
281 1 32 THR H 1 37 LYS QG 2.312 . 2.980 7.464 7.145 7.795 4.815 16 20 [**-************+****] 1
282 1 32 THR H 1 38 LYS H 2.625 . 3.486 7.656 7.407 7.879 4.393 16 20 [**-************+****] 1
283 1 32 THR HA 1 37 LYS QB 2.580 . 3.412 8.388 8.145 8.583 5.171 3 20 [**+****************-] 1
284 1 32 THR HA 1 37 LYS QG 2.652 . 3.531 7.286 7.061 7.514 3.983 18 20 [************-****+**] 1
285 1 32 THR HA 1 38 LYS QG 2.779 . 7.000 8.711 8.516 8.890 1.890 12 20 [********-**+********] 1
286 1 32 THR HA 1 40 TYR QB 2.974 . 4.080 10.582 10.309 10.802 6.722 9 20 [*****-**+***********] 1
287 1 32 THR HA 1 73 THR MG 2.985 . 7.000 6.871 6.669 7.049 0.049 9 0 "[ . 1 . 2]" 1
288 1 33 SER H 1 34 ASP HA 2.889 . 3.932 5.248 5.203 5.280 1.348 7 20 [****-*+*************] 1
289 1 33 SER H 1 35 ASP HA 3.146 . 4.383 7.295 7.166 7.439 3.056 15 20 [*-************+*****] 1
290 1 33 SER H 1 37 LYS QB 2.071 . 2.607 6.753 6.449 6.985 4.378 3 20 [**+****************-] 1
291 1 33 SER H 1 38 LYS HA 2.456 . 3.210 10.859 10.526 10.985 7.775 11 20 [**********+********-] 1
292 1 33 SER H 1 38 LYS QB 2.563 . 3.384 9.006 8.680 9.155 5.771 11 20 [**********+********-] 1
293 1 33 SER H 1 38 LYS QE 2.664 . 7.000 7.886 7.547 8.955 1.955 12 20 [*****-*****+********] 1
294 1 33 SER H 1 38 LYS QE 3.514 . 5.058 7.585 7.299 8.294 3.236 12 20 [*****-*****+********] 1
295 1 33 SER H 1 38 LYS QG 2.330 . 3.008 8.023 7.689 8.227 5.219 12 20 [***********+*******-] 1
296 1 33 SER H 1 39 SER H 2.477 . 3.244 9.554 9.410 9.783 6.539 4 20 [***+********-*******] 1
297 1 33 SER HA 1 42 LYS QD 2.465 . 3.225 7.802 7.762 7.847 4.622 2 20 [*+-*****************] 1
298 1 33 SER HA 1 42 LYS QD 2.244 . 7.000 7.042 6.878 7.344 0.344 7 0 "[ . 1 . 2]" 1
299 1 33 SER HA 1 38 LYS QB 2.178 . 2.771 7.098 6.909 7.432 4.661 4 20 [***+**********-*****] 1
300 1 33 SER HA 1 38 LYS QB 2.179 . 2.773 6.533 6.465 6.617 3.844 4 20 [***+***************-] 1
301 1 33 SER HA 1 38 LYS QG 2.550 . 3.363 7.067 6.763 7.252 3.889 10 20 [*********+*********-] 1
302 1 33 SER HA 1 38 LYS QG 2.584 . 3.418 6.835 6.590 6.980 3.562 10 20 [*********+*********-] 1
303 1 33 SER QB 1 38 LYS QG 2.689 . 3.593 6.614 6.121 7.045 3.452 4 20 [***+***************-] 1
304 1 33 SER QB 1 38 LYS QG 2.620 . 3.478 5.402 4.830 5.663 2.185 4 20 [***+*********-******] 1
305 1 33 SER QB 1 38 LYS QG 2.252 . 2.886 6.408 5.996 6.758 3.872 4 20 [***+***************-] 1
306 1 33 SER HG 1 36 ILE HB 2.384 . 7.000 5.344 4.647 6.666 . 0 0 "[ . 1 . 2]" 1
307 1 33 SER HG 1 38 LYS H 2.797 . 3.775 8.644 7.845 9.044 5.269 16 20 [*************-*+****] 1
308 1 33 SER HG 1 38 LYS QG 1.949 . 2.424 8.750 8.113 9.212 6.788 16 20 [*************-*+****] 1
309 1 33 SER HG 1 39 SER H 3.107 . 4.314 10.455 9.638 10.861 6.547 9 20 [****-***+***********] 1
310 1 34 ASP H 1 41 ARG H 3.179 . 4.442 9.540 9.406 9.653 5.211 4 20 [***+************-***] 1
311 1 34 ASP H 1 38 LYS QB 2.263 . 2.903 7.023 6.634 7.232 4.329 11 20 [**********+********-] 1
312 1 34 ASP H 1 38 LYS QG 2.659 . 3.543 5.715 5.361 5.940 2.397 12 20 [***********+*******-] 1
313 1 34 ASP H 1 39 SER HA 2.417 . 3.147 10.687 10.478 10.884 7.737 4 20 [***+***************-] 1
314 1 34 ASP H 1 39 SER QB 2.194 . 2.796 8.587 7.982 8.980 6.184 18 20 [*********-*******+**] 1
315 1 34 ASP H 1 40 TYR H 2.544 . 3.353 9.308 9.131 9.442 6.089 3 20 [**+*************-***] 1
316 1 34 ASP H 1 40 TYR QB 3.126 . 4.348 8.696 8.520 8.895 4.547 15 20 [**************+-****] 1
317 1 34 ASP H 1 41 ARG H 3.293 . 4.649 10.821 10.573 10.991 6.342 15 20 [**************+*-***] 1
318 1 34 ASP H 1 42 LYS QD 2.600 . 3.445 10.049 9.859 10.449 7.004 4 20 [***+********-*******] 1
319 1 34 ASP HA 1 42 LYS QB 2.585 . 3.421 10.602 10.295 11.343 7.922 4 20 [***+************-***] 1
320 1 34 ASP HA 1 42 LYS QG 3.173 . 4.432 9.479 8.637 9.852 5.420 11 20 [**********+********-] 1
321 1 34 ASP QB 1 36 ILE HB 2.793 . 7.000 5.879 5.772 6.001 . 0 0 "[ . 1 . 2]" 1
322 1 34 ASP QB 1 39 SER HA 2.429 . 3.139 9.008 8.389 9.598 6.459 4 20 [***+***************-] 1
323 1 34 ASP QB 1 42 LYS QD 2.573 . 7.000 7.995 7.431 8.759 1.759 4 19 [**-+***************2] 1
324 1 35 ASP H 1 36 ILE HA 3.279 . 4.623 5.021 4.839 5.130 0.507 20 1 "[ . 1 . +]" 1
325 1 35 ASP H 1 37 LYS HA 2.477 . 3.244 5.930 5.524 6.089 2.845 3 20 [**+************-****] 1
326 1 35 ASP H 1 39 SER QB 2.899 . 3.950 6.474 5.808 6.766 2.816 3 20 [**+*********-*******] 1
327 1 35 ASP H 1 40 TYR HA 2.712 . 3.632 10.298 10.019 10.504 6.872 3 20 [**+************-****] 1
328 1 35 ASP H 1 40 TYR QB 2.483 . 3.254 8.083 7.840 8.270 5.016 15 20 [**************+-****] 1
329 1 35 ASP H 1 41 ARG QG 2.730 . 7.000 9.017 8.754 9.242 2.242 13 20 [************+****-**] 1
330 1 35 ASP HA 1 40 TYR QB 3.023 . 4.150 7.233 6.880 7.481 3.331 14 20 [**********-**+******] 1
331 1 35 ASP HA 1 40 TYR QE 3.226 . 7.000 11.176 10.813 11.446 4.446 14 20 [**********-**+******] 1
332 1 35 ASP HA 1 41 ARG QG 2.999 . 7.000 7.653 7.201 8.040 1.040 1 15 "[+** **** * -***** *]" 1
333 1 35 ASP HA 1 43 LEU H 3.409 . 4.862 9.845 9.579 10.129 5.267 8 20 [*******+*********-**] 1
334 1 35 ASP HA 1 43 LEU QB 3.025 . 4.169 10.133 9.910 10.332 6.163 8 20 [*******+*******-****] 1
335 1 35 ASP HA 1 44 ALA H 3.530 . 5.087 11.420 11.131 11.658 6.571 8 20 [*******+*******-****] 1
336 1 35 ASP QB 1 37 LYS QB 2.914 . 3.976 6.139 5.952 6.295 2.319 13 20 [**********-*+*******] 1
337 1 35 ASP QB 1 40 TYR QB 1.972 . 2.458 5.802 5.625 5.928 3.470 15 20 [**********-***+*****] 1
338 1 36 ILE H 1 38 LYS HA 2.769 . 3.727 6.658 6.568 6.748 3.021 2 20 [*+***************-**] 1
339 1 36 ILE H 1 40 TYR H 2.656 . 3.538 5.971 5.832 6.062 2.524 3 20 [**+************-****] 1
340 1 36 ILE H 1 40 TYR HA 3.184 . 4.452 8.373 8.169 8.559 4.107 3 20 [**+************-****] 1
341 1 36 ILE H 1 40 TYR QB 2.667 . 3.556 6.432 6.265 6.619 3.063 15 20 [**********-***+*****] 1
342 1 36 ILE H 1 40 TYR QD 2.774 . 3.736 8.391 8.199 8.616 4.880 15 20 [******-*******+*****] 1
343 1 36 ILE H 1 41 ARG HA 2.553 . 3.367 10.985 10.856 11.082 7.715 15 20 [**************+*-***] 1
344 1 36 ILE H 1 41 ARG QG 2.060 . 2.590 8.218 8.041 8.397 5.807 13 20 [************+***-***] 1
345 1 36 ILE H 1 42 LYS H 2.570 . 3.395 9.551 9.396 9.716 6.321 4 20 [***+*************-**] 1
346 1 36 ILE H 1 44 ALA MB 3.075 . 4.257 10.524 10.357 10.711 6.454 4 20 [***+******-*********] 1
347 1 36 ILE H 1 65 ILE MG 2.844 . 7.000 8.546 8.426 8.753 1.753 3 20 [**+************-****] 1
348 1 36 ILE HA 1 38 LYS HA 3.148 . 7.000 6.769 6.687 6.810 . 0 0 "[ . 1 . 2]" 1
349 1 36 ILE HA 1 40 TYR HA 3.280 . 4.624 5.589 5.463 5.726 1.102 3 20 [**+***-*************] 1
350 1 36 ILE HA 1 40 TYR QD 3.036 . 4.189 6.947 6.739 7.157 2.968 15 20 [**********-***+*****] 1
351 1 36 ILE HA 1 40 TYR QE 3.324 . 4.705 9.007 8.772 9.246 4.541 15 20 [**********-***+*****] 1
352 1 36 ILE HA 1 41 ARG QB 2.305 . 2.969 8.331 8.164 8.470 5.501 9 20 [********+********-**] 1
353 1 36 ILE HA 1 42 LYS H 3.045 . 4.204 8.212 8.079 8.369 4.165 9 20 [********+*********-*] 1
354 1 36 ILE HA 1 44 ALA H 3.153 . 4.395 9.686 9.525 9.803 5.408 20 20 [***************-***+] 1
355 1 36 ILE HA 1 45 LEU H 3.417 . 4.876 12.400 12.277 12.533 7.657 20 20 [****************-**+] 1
356 1 36 ILE MD 1 38 LYS HA 2.739 . 7.000 8.596 8.500 8.687 1.687 2 20 [*+******-***********] 1
357 1 36 ILE MD 1 40 TYR QD 3.184 . 4.451 8.059 7.910 8.243 3.792 13 20 [******-*****+*******] 1
358 1 36 ILE MD 1 40 TYR QE 3.411 . 4.865 9.555 9.369 9.787 4.922 13 20 [******-*****+*******] 1
359 1 36 ILE MD 1 41 ARG H 2.855 . 3.874 9.017 8.858 9.119 5.245 12 20 [***********+****-***] 1
360 1 36 ILE MD 1 41 ARG HA 2.747 . 3.690 11.180 11.027 11.288 7.598 12 20 [***********+****-***] 1
361 1 36 ILE MD 1 41 ARG QB 2.843 . 3.853 9.871 9.735 9.987 6.134 9 20 [********+*******-***] 1
362 1 36 ILE MD 1 41 ARG QB 2.081 . 2.622 8.291 8.143 8.377 5.755 13 20 [************+***-***] 1
363 1 36 ILE MD 1 41 ARG QG 2.438 . 2.593 8.912 8.733 9.049 6.456 13 20 [************+***-***] 1
364 1 36 ILE MD 1 42 LYS H 3.210 . 7.000 10.434 10.307 10.577 3.577 4 20 [***+************-***] 1
365 1 36 ILE MD 1 44 ALA MB 3.274 . 4.614 10.040 9.872 10.202 5.588 20 20 [****************-**+] 1
366 1 36 ILE MD 1 45 LEU QD 2.953 . 4.043 10.641 10.478 10.731 6.688 12 20 [***********+****-***] 1
367 1 36 ILE QG 1 38 LYS HA 2.889 . 3.932 8.035 7.955 8.092 4.160 2 20 [*+*-****************] 1
368 1 36 ILE QG 1 40 TYR QD 2.926 . 7.000 7.744 7.579 7.914 0.914 15 20 [**********-***+*****] 1
369 1 36 ILE QG 1 41 ARG HA 2.435 . 7.000 10.707 10.595 10.824 3.824 15 20 [**********-***+*****] 1
370 1 36 ILE QG 1 41 ARG QD 2.194 . 2.861 9.909 9.396 10.286 7.425 13 20 [************+***-***] 1
371 1 36 ILE QG 1 41 ARG QG 1.967 . 2.451 8.634 8.504 8.777 6.326 13 20 [************+***-***] 1
372 1 36 ILE QG 1 42 LYS H 3.008 . 7.000 9.583 9.456 9.742 2.742 9 20 [********+*********-*] 1
373 1 36 ILE MG 1 67 ASN H 3.008 . 4.139 7.305 7.117 7.444 3.305 11 20 [-*********+*********] 1
374 1 36 ILE MG 1 67 ASN H 2.814 . 3.804 6.937 6.790 7.059 3.255 11 20 [-*********+*********] 1
375 1 37 LYS H 1 39 SER HA 3.180 . 4.444 6.889 6.682 7.030 2.586 4 20 [***+********-*******] 1
376 1 37 LYS H 1 41 ARG QB 1.984 . 2.476 7.417 7.162 7.634 5.158 9 20 [**-*****+***********] 1
377 1 37 LYS H 1 42 LYS HA 2.334 . 3.015 10.846 10.657 11.150 8.135 4 20 [***+*************-**] 1
378 1 37 LYS H 1 42 LYS QB 2.444 . 3.190 8.677 8.375 9.442 6.252 4 20 [***+**********-*****] 1
379 1 37 LYS H 1 43 LEU H 2.522 . 3.317 9.514 9.346 9.658 6.341 20 20 [*****************-*+] 1
380 1 37 LYS H 1 44 ALA MB 2.823 . 3.819 8.190 8.007 8.349 4.530 4 20 [***+************-***] 1
381 1 37 LYS H 1 45 LEU QD 2.968 . 4.069 9.490 9.267 9.646 5.577 20 20 [****************-**+] 1
382 1 37 LYS HA 1 43 LEU QD 3.081 . 7.000 5.467 5.319 5.580 . 0 0 "[ . 1 . 2]" 1
383 1 37 LYS HA 1 45 LEU H 3.211 . 7.000 10.444 10.092 10.645 3.645 20 20 [****************-**+] 1
384 1 37 LYS HA 1 45 LEU QD 2.667 . 3.556 8.055 7.765 8.266 4.710 20 20 [****************-**+] 1
385 1 37 LYS QB 1 42 LYS QD 2.203 . 2.810 6.794 6.487 7.253 4.443 9 20 [-*******+***********] 1
386 1 37 LYS HD2 1 45 LEU MD1 2.748 . 7.000 9.522 8.747 10.214 3.214 20 20 [******************-+] 1
387 1 37 LYS QD 1 38 LYS H 2.637 . 7.000 4.729 4.515 4.851 . 0 0 "[ . 1 . 2]" 1
388 1 37 LYS QD 1 39 SER HA 2.594 . 3.435 8.721 8.059 9.245 5.810 7 20 [******+**-**********] 1
389 1 37 LYS QD 1 41 ARG H 3.066 . 7.000 6.534 5.729 7.344 0.344 20 0 "[ . 1 . 2]" 1
390 1 37 LYS QD 1 42 LYS H 2.644 . 3.518 8.780 8.122 9.487 5.969 9 20 [**-*****+***********] 1
391 1 37 LYS QD 1 42 LYS QG 2.045 . 2.568 8.930 7.950 9.300 6.732 6 20 [***-*+**************] 1
392 1 37 LYS QD 1 43 LEU H 2.973 . 7.000 10.085 9.182 10.902 3.902 20 20 [*-*****************+] 1
393 1 37 LYS HE2 1 42 LYS HD2 1.544 . 7.000 10.272 9.994 10.679 3.679 9 20 [*-******+***********] 1
394 1 37 LYS QE 1 39 SER HA 2.510 . 3.298 10.043 9.621 10.406 7.108 20 20 [**********-********+] 1
395 1 37 LYS QE 1 42 LYS H 2.817 . 7.000 10.423 9.982 11.078 4.078 20 20 [**********-********+] 1
396 1 37 LYS QE 1 42 LYS QB 2.026 . 2.539 11.001 10.466 11.928 9.389 20 20 [**********-********+] 1
397 1 37 LYS QE 1 42 LYS QG 2.173 . 2.763 10.402 9.617 10.801 8.038 5 20 [***-+***************] 1
398 1 37 LYS QE 1 43 LEU H 3.025 . 4.169 11.545 10.936 12.238 8.069 20 20 [**********-********+] 1
399 1 37 LYS QG 1 39 SER HA 3.312 . 4.683 8.082 7.872 8.298 3.615 4 20 [***+********-*******] 1
400 1 37 LYS QG 1 42 LYS H 2.700 . 3.612 8.488 8.168 8.887 5.275 4 20 [***+************-***] 1
401 1 37 LYS QG 1 42 LYS HA 2.585 . 3.333 10.875 10.569 11.282 7.949 4 20 [***+************-***] 1
402 1 37 LYS QG 1 42 LYS QB 2.302 . 2.964 9.223 8.868 9.974 7.010 4 20 [***+**********-*****] 1
403 1 37 LYS QG 1 42 LYS QD 2.051 . 2.577 8.133 7.923 8.476 5.899 4 20 [-**+****************] 1
404 1 37 LYS QG 1 42 LYS QE 2.572 . 3.399 9.356 8.656 9.651 6.252 8 20 [*******+-***********] 1
405 1 37 LYS QG 1 42 LYS QG 1.991 . 2.487 8.590 7.978 8.862 6.375 8 20 [******-+************] 1
406 1 37 LYS QG 1 43 LEU H 3.158 . 4.404 9.721 9.286 10.095 5.691 4 20 [***+************-***] 1
407 1 38 LYS H 1 39 SER HA 2.936 . 7.000 5.355 5.304 5.439 . 0 0 "[ . 1 . 2]" 1
408 1 38 LYS H 1 42 LYS HA 3.089 . 4.282 8.763 8.546 9.146 4.864 9 20 [**-*****+***********] 1
409 1 38 LYS H 1 42 LYS HA 2.541 . 3.348 8.434 8.249 8.759 5.411 9 20 [**-*****+***********] 1
410 1 38 LYS H 1 43 LEU HA 3.024 . 4.167 10.986 10.871 11.205 7.038 9 20 [**-*****+***********] 1
411 1 38 LYS H 1 43 LEU QD 2.672 . 3.565 7.562 7.409 7.663 4.098 13 20 [************+******-] 1
412 1 38 LYS H 1 43 LEU QD 2.238 . 2.864 6.420 6.357 6.469 3.605 5 20 [****+************-**] 1
413 1 38 LYS H 1 44 ALA MB 2.855 . 3.874 8.195 8.083 8.406 4.532 4 20 [***+************-***] 1
414 1 38 LYS H 1 65 ILE MG 3.024 . 4.167 7.499 7.429 7.553 3.386 5 20 [****+************-**] 1
415 1 38 LYS HA 1 41 ARG HB2 2.741 . 7.000 3.080 2.893 3.453 . 0 0 "[ . 1 . 2]" 1
416 1 38 LYS HA 1 44 ALA HA 2.955 . 4.047 5.325 5.225 5.488 1.441 7 20 [******+**********-**] 1
417 1 38 LYS HA 1 43 LEU HG 2.246 . 2.876 7.633 7.476 7.756 4.880 9 20 [********+****-******] 1
418 1 38 LYS HA 1 43 LEU QD 2.222 . 2.839 7.222 7.114 7.347 4.508 9 20 [********+*********-*] 1
419 1 38 LYS QB 1 40 TYR HA 3.083 . 7.000 6.758 6.671 6.814 . 0 0 "[ . 1 . 2]" 1
420 1 38 LYS QB 1 43 LEU HA 2.389 . 3.102 7.975 7.857 8.082 4.980 7 20 [**-***+*************] 1
421 1 38 LYS QB 1 43 LEU H 3.293 . 4.649 6.669 6.465 6.874 2.225 9 20 [**-*****+***********] 1
422 1 38 LYS QB 1 43 LEU HA 3.330 . 4.716 8.957 8.710 9.198 4.482 9 20 [**-*****+***********] 1
423 1 38 LYS QB 1 43 LEU QB 2.980 . 7.000 7.657 7.469 7.805 0.805 5 18 "[** +*************-*]" 1
424 1 38 LYS QB 1 43 LEU QD 2.550 . 3.363 6.010 5.825 6.133 2.770 5 20 [***-+***************] 1
425 1 38 LYS QB 1 65 ILE MG 2.628 . 3.491 7.212 7.063 7.299 3.808 5 20 [***-+***************] 1
426 1 39 SER H 1 42 LYS H 3.246 . 4.563 4.902 4.791 5.085 0.522 9 1 "[ . +1 . 2]" 1
427 1 39 SER H 1 43 LEU H 2.526 . 3.323 6.209 6.097 6.392 3.069 9 20 [********+********-**] 1
428 1 39 SER H 1 43 LEU HA 2.649 . 3.526 8.854 8.752 9.021 5.495 9 20 [********+********-**] 1
429 1 39 SER H 1 43 LEU QB 2.666 . 3.283 6.849 6.736 6.974 3.691 13 20 [************+****-**] 1
430 1 39 SER H 1 44 ALA HA 2.465 . 3.225 10.067 9.971 10.238 7.013 4 20 [***+*************-**] 1
431 1 39 SER H 1 44 ALA MB 2.031 . 2.547 7.498 7.418 7.705 5.158 4 20 [*-*+****************] 1
432 1 39 SER H 1 45 LEU QD 3.082 . 4.230 7.431 7.335 7.526 3.296 9 20 [********+*********-*] 1
433 1 39 SER H 1 45 LEU QD 2.691 . 3.596 6.977 6.909 7.085 3.489 9 20 [********+*********-*] 1
434 1 39 SER H 1 46 LYS H 3.121 . 4.338 11.041 10.907 11.194 6.856 8 20 [*******+**********-*] 1
435 1 39 SER H 1 65 ILE MD 2.743 . 3.684 8.462 8.344 8.642 4.958 9 20 [********+********-**] 1
436 1 39 SER HA 1 41 ARG HA 3.123 . 4.342 6.494 6.321 6.611 2.269 8 20 [*******+***********-] 1
437 1 39 SER HA 1 45 LEU QB 2.800 . 7.000 8.732 8.611 8.884 1.884 8 20 [******-+************] 1
438 1 39 SER HA 1 45 LEU QD 2.808 . 7.000 6.193 6.085 6.337 . 0 0 "[ . 1 . 2]" 1
439 1 39 SER HA 1 47 TYR H 3.185 . 4.453 9.983 9.812 10.278 5.825 8 20 [**-****+************] 1
440 1 39 SER HA 1 62 PHE QD 2.814 . 3.804 10.314 10.100 10.739 6.935 17 20 [***********-****+***] 1
441 1 39 SER HA 1 62 PHE QE 2.915 . 3.977 10.225 9.940 10.622 6.645 17 20 [************-***+***] 1
442 1 39 SER HA 1 65 ILE HB 3.051 . 4.215 8.799 8.666 8.882 4.667 17 20 [***-************+***] 1
443 1 40 TYR H 1 43 LEU H 3.371 . 4.791 4.970 4.880 5.088 0.297 9 0 "[ . 1 . 2]" 1
444 1 40 TYR H 1 44 ALA H 2.492 . 3.269 5.814 5.765 5.877 2.608 4 20 [***+*******-********] 1
445 1 40 TYR H 1 44 ALA HA 2.749 . 3.693 7.816 7.737 7.936 4.243 4 20 [*-*+****************] 1
446 1 40 TYR H 1 45 LEU QB 2.066 . 7.000 10.148 10.058 10.213 3.213 20 20 [******************-+] 1
447 1 40 TYR H 1 45 LEU QD 2.296 . 2.955 6.608 6.514 6.671 3.716 20 20 [******************-+] 1
448 1 40 TYR H 1 46 LYS H 2.432 . 3.171 9.731 9.600 9.861 6.690 18 20 [**********-******+**] 1
449 1 40 TYR HA 1 45 LEU H 2.563 . 3.384 6.779 6.689 6.910 3.526 20 20 [*****************-*+] 1
450 1 40 TYR HA 1 45 LEU QB 2.284 . 2.936 8.947 8.871 9.056 6.120 20 20 [******************-+] 1
451 1 40 TYR HA 1 48 HIS HA 2.788 . 3.759 10.139 9.882 10.332 6.573 4 20 [***+*************-**] 1
452 1 40 TYR HA 1 48 HIS QB 3.041 . 4.197 9.895 9.671 10.039 5.842 7 20 [******+**********-**] 1
453 1 40 TYR QB 1 44 ALA H 3.266 . 7.000 5.153 5.099 5.272 . 0 0 "[ . 1 . 2]" 1
454 1 40 TYR QB 1 45 LEU QB 1.983 . 2.475 8.779 8.673 8.887 6.412 6 20 [*****+************-*] 1
455 1 40 TYR QB 1 45 LEU QD 2.226 . 7.000 5.871 5.758 5.948 . 0 0 "[ . 1 . 2]" 1
456 1 40 TYR QB 1 46 LYS H 2.733 . 3.667 8.842 8.696 8.974 5.307 18 20 [**********-******+**] 1
457 1 40 TYR QB 1 46 LYS H 2.732 . 7.000 8.434 8.327 8.520 1.520 6 20 [*****+****-*********] 1
458 1 40 TYR QD 1 64 GLU H 3.294 . 4.650 7.657 7.479 7.810 3.160 11 20 [**********+*-*******] 1
459 1 40 TYR QD 1 64 GLU HA 3.355 . 4.762 7.452 7.301 7.686 2.924 11 20 [***-******+*********] 1
460 1 40 TYR QE 1 61 LYS H 3.280 . 4.625 10.297 10.116 10.519 5.894 20 20 [***************-***+] 1
461 1 40 TYR QE 1 61 LYS HA 2.530 . 3.330 9.226 9.029 9.426 6.096 20 20 [***************-***+] 1
462 1 40 TYR QE 1 61 LYS QB 2.783 . 3.751 8.283 7.968 8.852 5.101 3 20 [**+************-****] 1
463 1 40 TYR QE 1 64 GLU H 3.560 . 7.000 7.458 7.271 7.705 0.705 17 8 "[* * .* * 1* - + *]" 1
464 1 41 ARG H 1 46 LYS QG 3.035 . 4.187 9.253 9.073 9.447 5.260 18 20 [**********-******+**] 1
465 1 41 ARG H 1 44 ALA MB 2.592 . 7.000 3.580 3.549 3.640 . 0 0 "[ . 1 . 2]" 1
466 1 41 ARG H 1 45 LEU HA 2.576 . 3.406 6.913 6.829 6.967 3.561 11 20 [******-***+*********] 1
467 1 41 ARG H 1 43 LEU HA 2.515 . 3.306 6.878 6.793 6.953 3.647 18 20 [******-**********+**] 1
468 1 41 ARG H 1 44 ALA MB 2.621 . 3.480 3.895 3.829 4.019 0.539 4 1 "[ +. 1 . 2]" 1
469 1 41 ARG H 1 45 LEU QD 2.576 . 7.000 4.825 4.739 4.894 . 0 0 "[ . 1 . 2]" 1
470 1 41 ARG H 1 46 LYS HA 2.405 . 3.128 10.797 10.601 11.052 7.924 18 20 [**********-******+**] 1
471 1 41 ARG H 1 46 LYS QB 2.084 . 2.627 8.055 7.807 8.399 5.772 18 20 [**********-******+**] 1
472 1 41 ARG H 1 46 LYS QG 3.196 . 4.473 10.134 9.866 10.480 6.007 18 20 [**********-******+**] 1
473 1 41 ARG HA 1 45 LEU QB 3.180 . 4.444 5.701 5.579 5.832 1.388 1 20 [+*********-*********] 1
474 1 41 ARG HA 1 46 LYS QB 2.459 . 3.215 6.928 6.646 7.214 3.999 18 20 [**********-******+**] 1
475 1 41 ARG QB 1 43 LEU QD 2.884 . 3.923 6.064 5.962 6.146 2.223 16 20 [***-***********+****] 1
476 1 41 ARG QB 1 46 LYS QG 2.613 . 3.466 8.815 8.498 9.046 5.580 18 20 [**********-******+**] 1
477 1 41 ARG QD 1 43 LEU HA 3.217 . 4.509 7.997 7.884 8.183 3.674 18 20 [******-**********+**] 1
478 1 41 ARG QD 1 43 LEU QD 2.638 . 3.508 7.049 6.925 7.176 3.668 18 20 [*****************+*-] 1
479 1 41 ARG QD 1 46 LYS H 3.149 . 7.000 7.509 7.176 7.883 0.883 18 8 "[-* .* * * *+*2]" 1
480 1 41 ARG QD 1 46 LYS HA 2.993 . 7.000 9.909 9.565 10.304 3.304 18 20 [****-************+**] 1
481 1 41 ARG QD 1 46 LYS QB 2.723 . 3.650 8.045 7.708 8.451 4.801 18 20 [****-************+**] 1
482 1 41 ARG QD 1 46 LYS QD 2.088 . 2.633 9.384 8.906 9.904 7.271 18 20 [****-************+**] 1
483 1 41 ARG QD 1 46 LYS QG 2.506 . 3.291 9.933 9.603 10.326 7.035 18 20 [****-************+**] 1
484 1 41 ARG QD 1 47 TYR QD 3.259 . 4.587 9.539 9.308 9.955 5.368 19 20 [******************+-] 1
485 1 41 ARG QD 1 47 TYR QE 2.862 . 7.000 11.057 10.733 11.606 4.606 19 20 [*****-************+*] 1
486 1 41 ARG QD 1 61 LYS QE 2.592 . 7.000 10.723 10.384 11.581 4.581 3 20 [**+******-**********] 1
487 1 41 ARG QG 1 43 LEU HA 3.337 . 4.729 8.107 8.050 8.144 3.415 18 20 [******-**********+**] 1
488 1 41 ARG QG 1 46 LYS H 2.958 . 7.000 8.255 8.047 8.430 1.430 18 20 [**********-******+**] 1
489 1 41 ARG QG 1 46 LYS HA 2.744 . 3.468 10.637 10.400 10.821 7.353 18 20 [**********-******+**] 1
490 1 41 ARG QG 1 46 LYS QB 2.674 . 3.568 8.404 8.121 8.653 5.085 18 20 [**********-******+**] 1
491 1 41 ARG QG 1 46 LYS QE 2.349 . 3.039 11.241 10.689 11.544 8.505 18 20 [**********-******+**] 1
492 1 41 ARG QG 1 46 LYS QG 2.222 . 2.839 10.319 10.029 10.566 7.727 18 20 [**********-******+**] 1
493 1 41 ARG QG 1 47 TYR H 3.332 . 4.720 9.589 9.457 9.707 4.987 6 20 [****-+**************] 1
494 1 41 ARG QG 1 47 TYR QD 3.191 . 4.464 10.051 9.859 10.368 5.904 19 20 [***-**************+*] 1
495 1 42 LYS H 1 43 LEU HA 2.859 . 3.881 5.396 5.362 5.411 1.530 5 20 [***-+***************] 1
496 1 42 LYS H 1 43 LEU QD 2.836 . 7.000 4.276 4.224 4.322 . 0 0 "[ . 1 . 2]" 1
497 1 42 LYS H 1 44 ALA MB 3.063 . 7.000 4.651 4.516 4.778 . 0 0 "[ . 1 . 2]" 1
498 1 42 LYS H 1 46 LYS H 2.485 . 3.257 6.545 6.384 6.728 3.471 18 20 [**********-******+**] 1
499 1 42 LYS H 1 46 LYS H 2.171 . 2.760 6.466 6.315 6.636 3.876 18 20 [**********-******+**] 1
500 1 42 LYS H 1 46 LYS HA 2.651 . 3.530 9.002 8.773 9.257 5.727 18 20 [**********-******+**] 1
501 1 42 LYS H 1 46 LYS QB 2.390 . 3.104 6.392 6.108 6.681 3.577 18 20 [**********-******+**] 1
502 1 42 LYS H 1 47 TYR HA 2.769 . 3.728 11.125 11.021 11.232 7.504 8 20 [*******+**-*********] 1
503 1 42 LYS H 1 47 TYR QB 2.762 . 3.312 8.814 8.623 8.981 5.669 7 20 [******+*****-*******] 1
504 1 42 LYS H 1 48 HIS H 2.545 . 3.354 10.078 9.945 10.156 6.802 19 20 [************-*****+*] 1
505 1 42 LYS H 1 48 HIS HA 3.355 . 4.762 10.895 10.803 10.967 6.205 19 20 [**************-***+*] 1
506 1 42 LYS HA 1 47 TYR QB 2.927 . 3.998 8.419 8.285 8.588 4.590 8 20 [*******+****-*******] 1
507 1 42 LYS HA 1 48 HIS H 3.070 . 4.248 8.933 8.628 9.078 4.830 2 20 [*+*-****************] 1
508 1 42 LYS QB 1 47 TYR HA 3.290 . 4.643 9.499 9.393 9.639 4.996 7 20 [******+***-*********] 1
509 1 42 LYS QB 1 47 TYR QB 3.126 . 7.000 7.717 7.585 8.002 1.002 7 20 [******+********-****] 1
510 1 42 LYS QB 1 47 TYR QD 2.895 . 3.943 6.776 6.592 7.024 3.081 7 20 [******+****-********] 1
511 1 42 LYS QD 1 43 LEU QD 3.157 . 4.403 4.856 4.680 5.026 0.623 3 5 "[ + * * 1 -* 2]" 1
512 1 42 LYS QD 1 46 LYS QD 3.273 . 4.612 7.232 6.789 7.779 3.167 13 20 [**********-*+*******] 1
513 1 42 LYS QD 1 47 TYR H 2.486 . 3.259 9.793 9.649 9.940 6.681 15 20 [************-*+*****] 1
514 1 42 LYS QD 1 47 TYR QB 2.877 . 3.912 9.992 9.805 10.192 6.280 7 20 [******+*****-*******] 1
515 1 42 LYS QD 1 58 ALA HA 2.364 . 3.063 14.807 14.577 15.145 12.082 19 20 [**********-*******+*] 1
516 1 42 LYS QD 1 58 ALA MB 2.232 . 2.855 12.900 12.646 13.226 10.371 19 20 [*****************-+*] 1
517 1 42 LYS QD 1 65 ILE MD 2.312 . 2.980 7.649 7.506 7.774 4.794 3 20 [**+*******-*********] 1
518 1 42 LYS QE 1 43 LEU QD 3.036 . 4.188 3.677 3.158 3.963 . 0 0 "[ . 1 . 2]" 1
519 1 42 LYS QE 1 46 LYS QD 2.643 . 3.516 5.776 5.304 6.409 2.893 13 20 [************+******-] 1
520 1 42 LYS QE 1 46 LYS QD 2.292 . 2.949 5.762 5.294 6.388 3.439 13 20 [************+******-] 1
521 1 42 LYS QE 1 46 LYS QE 2.516 . 3.308 7.155 6.286 7.677 4.369 8 20 [*******+***********-] 1
522 1 42 LYS QE 1 46 LYS QE 2.430 . 3.168 6.789 6.059 7.237 4.069 16 20 [***************+***-] 1
523 1 42 LYS QE 1 46 LYS QG 2.724 . 7.000 7.503 7.123 7.775 0.775 18 11 "[ ** .* **- ** ** + 2]" 1
524 1 42 LYS QE 1 47 TYR HA 2.631 . 7.000 11.053 10.718 11.249 4.249 8 20 [***-***+************] 1
525 1 42 LYS QE 1 47 TYR QB 2.641 . 7.000 9.022 8.698 9.263 2.263 8 20 [*******+-***********] 1
526 1 42 LYS QE 1 58 ALA HA 2.400 . 3.120 13.391 12.786 14.006 10.886 13 20 [************+******-] 1
527 1 42 LYS QE 1 58 ALA MB 2.835 . 3.840 11.778 11.330 12.327 8.487 13 20 [************+******-] 1
528 1 42 LYS QE 1 61 LYS QE 2.310 . 2.977 8.498 7.933 8.881 5.904 13 20 [************+******-] 1
529 1 43 LEU H 1 44 ALA HA 3.369 . 4.788 4.804 4.771 4.832 0.044 13 0 "[ . 1 . 2]" 1
530 1 43 LEU H 1 44 ALA MB 3.446 . 4.930 3.431 3.365 3.499 . 0 0 "[ . 1 . 2]" 1
531 1 43 LEU H 1 45 LEU HA 2.908 . 3.965 7.206 7.093 7.292 3.327 11 20 [***-******+*********] 1
532 1 43 LEU H 1 45 LEU QD 3.455 . 4.947 3.487 3.402 3.540 . 0 0 "[ . 1 . 2]" 1
533 1 43 LEU H 1 48 HIS HA 2.183 . 2.779 9.169 9.097 9.279 6.500 13 20 [**-*********+*******] 1
534 1 43 LEU H 1 48 HIS QB 2.355 . 3.048 8.255 8.112 8.344 5.296 16 20 [***-***********+****] 1
535 1 43 LEU H 1 49 PRO QD 3.259 . 4.587 9.853 9.698 10.058 5.471 5 20 [****+*-*************] 1
536 1 43 LEU H 1 49 PRO QD 2.682 . 3.581 8.484 8.223 8.891 5.310 5 20 [***-+***************] 1
537 1 43 LEU H 1 51 LYS QD 2.850 . 3.865 9.276 8.809 9.905 6.040 5 20 [***-+***************] 1
538 1 43 LEU HA 1 49 PRO QD 2.773 . 7.000 9.177 9.031 9.374 2.374 5 20 [-***+***************] 1
539 1 43 LEU QB 1 48 HIS HA 2.815 . 3.806 7.520 7.368 7.643 3.837 20 20 [**-****************+] 1
540 1 43 LEU QB 1 57 GLU HA 3.152 . 7.000 4.962 4.944 4.986 . 0 0 "[ . 1 . 2]" 1
541 1 44 ALA HA 1 48 HIS HA 3.123 . 7.000 4.810 4.674 4.926 . 0 0 "[ . 1 . 2]" 1
542 1 44 ALA HA 1 48 HIS QB 2.844 . 7.000 5.247 5.104 5.348 . 0 0 "[ . 1 . 2]" 1
543 1 44 ALA HA 1 49 PRO QB 2.305 . 2.969 8.669 8.513 8.928 5.959 5 20 [-***+***************] 1
544 1 44 ALA HA 1 49 PRO QG 2.382 . 7.000 7.669 7.505 7.935 0.935 5 20 [****+*********-*****] 1
545 1 44 ALA HA 1 50 ASP HA 3.014 . 7.000 11.822 11.644 11.919 4.919 13 20 [************+****-**] 1
546 1 44 ALA HA 1 52 ASN H 2.857 . 7.000 10.834 10.407 11.493 4.493 16 20 [********-******+****] 1
547 1 44 ALA HA 1 52 ASN QB 2.737 . 7.000 9.883 9.127 10.500 3.500 16 20 [************-**+****] 1
548 1 44 ALA HA 1 52 ASN QD 3.053 . 4.218 7.200 6.819 7.703 3.485 16 20 [********-******+****] 1
549 1 44 ALA MB 1 48 HIS HA 3.246 . 7.000 4.837 4.638 5.004 . 0 0 "[ . 1 . 2]" 1
550 1 44 ALA MB 1 48 HIS HE1 3.428 . 4.897 6.223 5.933 6.611 1.714 16 20 [***************+*-**] 1
551 1 44 ALA MB 1 49 PRO QB 2.146 . 2.722 7.898 7.712 8.109 5.387 5 20 [****+*********-*****] 1
552 1 44 ALA MB 1 49 PRO QD 2.855 . 3.874 5.262 5.052 5.461 1.587 16 20 [**************-+****] 1
553 1 44 ALA MB 1 49 PRO QG 2.319 . 2.991 6.704 6.464 6.946 3.955 16 20 [**************-+****] 1
554 1 44 ALA MB 1 50 ASP H 3.256 . 4.309 8.396 8.158 8.639 4.330 13 20 [************+****-**] 1
555 1 44 ALA MB 1 50 ASP HA 3.126 . 4.348 10.721 10.539 10.898 6.550 13 20 [************+****-**] 1
556 1 44 ALA MB 1 50 ASP QB 3.274 . 4.614 8.818 8.545 9.143 4.529 9 20 [********+*******-***] 1
557 1 44 ALA MB 1 57 GLU HA 2.598 . 7.000 10.597 10.432 10.783 3.783 18 20 [***************-*+**] 1
558 1 45 LEU H 1 49 PRO QD 3.251 . 4.572 6.803 6.704 6.914 2.342 13 20 [******-*****+*******] 1
559 1 45 LEU HA 1 46 LYS QD 2.859 . 7.000 7.183 7.031 7.291 0.291 2 0 "[ . 1 . 2]" 1
560 1 45 LEU HA 1 50 ASP QB 2.112 . 2.669 6.925 6.592 7.303 4.634 9 20 [********+*******-***] 1
561 1 45 LEU HA 1 49 PRO QB 3.255 . 7.000 7.713 7.627 7.819 0.819 19 20 [*************-****+*] 1
562 1 45 LEU HA 1 49 PRO QG 2.934 . 7.000 6.422 6.334 6.555 . 0 0 "[ . 1 . 2]" 1
563 1 45 LEU HA 1 50 ASP H 2.560 . 3.379 6.719 6.473 6.954 3.575 13 20 [************+-******] 1
564 1 45 LEU HA 1 50 ASP QB 2.061 . 2.592 7.049 6.654 7.549 4.957 9 20 [********+*******-***] 1
565 1 45 LEU HA 1 51 LYS H 2.717 . 3.640 6.662 6.440 6.974 3.334 6 20 [*****+*******-******] 1
566 1 45 LEU HA 1 52 ASN QD 3.049 . 4.211 6.458 5.882 6.750 2.539 16 20 [************-**+****] 1
567 1 45 LEU QB 1 46 LYS QG 2.104 . 7.000 5.879 5.776 5.939 . 0 0 "[ . 1 . 2]" 1
568 1 45 LEU QB 1 48 HIS HE1 2.821 . 7.000 5.950 5.649 6.318 . 0 0 "[ . 1 . 2]" 1
569 1 45 LEU QB 1 49 PRO QB 3.197 . 4.475 4.901 4.838 5.046 0.571 4 3 "[ +. 1*- . 2]" 1
570 1 45 LEU QB 1 50 ASP H 2.661 . 3.546 7.296 7.048 7.498 3.952 9 20 [********+****-******] 1
571 1 45 LEU QB 1 51 LYS QG 3.027 . 7.000 4.558 4.214 4.841 . 0 0 "[ . 1 . 2]" 1
572 1 45 LEU QD 1 46 LYS QE 2.597 . 7.000 5.797 5.695 5.937 . 0 0 "[ . 1 . 2]" 1
573 1 46 LYS H 1 51 LYS QD 2.591 . 7.000 4.821 4.468 5.410 . 0 0 "[ . 1 . 2]" 1
574 1 46 LYS H 1 46 LYS QE 2.935 . 4.012 5.654 5.551 5.783 1.771 13 20 [*****-******+*******] 1
575 1 46 LYS H 1 49 PRO QD 3.445 . 4.929 7.316 7.238 7.390 2.461 16 20 [*********-*****+****] 1
576 1 46 LYS H 1 49 PRO QD 2.403 . 3.125 5.919 5.642 6.125 3.000 19 20 [****-*************+*] 1
577 1 46 LYS H 1 50 ASP H 2.611 . 3.463 9.211 8.968 9.427 5.964 19 20 [***************-**+*] 1
578 1 46 LYS H 1 50 ASP QB 2.539 . 3.345 9.240 8.810 9.747 6.402 9 20 [********+*******-***] 1
579 1 46 LYS H 1 51 LYS HA 2.395 . 3.112 9.099 8.550 9.526 6.414 19 20 [****-*************+*] 1
580 1 46 LYS H 1 51 LYS QB 2.855 . 3.456 6.259 5.861 6.602 3.146 7 20 [****-*+*************] 1
581 1 46 LYS H 1 52 ASN QD 3.282 . 4.628 7.323 6.365 7.644 3.016 16 20 [************-**+****] 1
582 1 46 LYS HA 1 46 LYS QD 3.026 . 4.171 4.070 4.030 4.108 . 0 0 "[ . 1 . 2]" 1
583 1 46 LYS HA 1 46 LYS QE 2.911 . 3.613 4.955 4.726 5.184 1.571 20 20 [-******************+] 1
584 1 46 LYS HA 1 53 PRO QD 3.163 . 7.000 6.629 6.311 7.109 0.109 18 0 "[ . 1 . 2]" 1
585 1 46 LYS HA 1 51 LYS QB 2.435 . 3.176 4.635 4.225 5.077 1.901 7 20 [****-*+*************] 1
586 1 46 LYS HA 1 53 PRO QD 3.232 . 7.000 9.259 8.940 9.509 2.509 1 20 [+***-***************] 1
587 1 46 LYS QB 1 48 HIS QB 3.201 . 4.482 5.426 5.327 5.508 1.026 19 20 [************-*****+*] 1
588 1 46 LYS QB 1 51 LYS HA 2.665 . 3.553 8.456 7.867 8.991 5.438 19 20 [****-*************+*] 1
589 1 46 LYS QB 1 51 LYS QB 2.188 . 2.786 5.731 5.323 6.106 3.320 19 20 [****-*************+*] 1
590 1 46 LYS QB 1 51 LYS QG 2.699 . 3.609 5.767 4.947 6.171 2.562 6 20 [*****+*******-******] 1
591 1 46 LYS QB 1 51 LYS QG 2.267 . 2.909 5.678 4.918 6.040 3.131 6 20 [*****+*******-******] 1
592 1 46 LYS QB 1 52 ASN QD 3.030 . 4.178 6.764 5.722 7.019 2.841 16 20 [************-**+****] 1
593 1 46 LYS QD 1 48 HIS QB 2.666 . 7.000 7.219 6.852 7.345 0.345 14 0 "[ . 1 . 2]" 1
594 1 46 LYS QD 1 51 LYS HA 2.111 . 7.000 9.637 9.014 10.315 3.315 19 20 [****-*************+*] 1
595 1 46 LYS QD 1 51 LYS QB 2.273 . 2.919 6.719 6.252 7.199 4.280 19 20 [************-*****+*] 1
596 1 46 LYS QD 1 51 LYS QG 1.947 . 2.421 7.215 6.411 7.623 5.202 19 20 [****-*************+*] 1
597 1 46 LYS QD 1 52 ASN QD 2.920 . 7.000 7.708 6.125 8.055 1.055 1 17 "[+******* *** ****- *]" 1
598 1 46 LYS QE 1 51 LYS HA 2.358 . 7.000 9.386 8.812 10.319 3.319 19 20 [*-****************+*] 1
599 1 46 LYS QE 1 51 LYS QB 3.210 . 4.498 6.551 6.157 7.175 2.677 19 20 [*-****************+*] 1
600 1 46 LYS QE 1 51 LYS QD 1.823 . 2.238 6.410 5.502 7.809 5.571 9 20 [*-******+***********] 1
601 1 46 LYS QG 1 48 HIS H 3.197 . 4.475 4.908 4.754 5.072 0.597 11 4 "[ - 1+ *. *]" 1
602 1 46 LYS QG 1 48 HIS HA 3.007 . 7.000 7.190 7.057 7.313 0.313 11 0 "[ . 1 . 2]" 1
603 1 46 LYS QG 1 48 HIS QB 2.829 . 3.828 6.049 5.873 6.219 2.391 11 20 [*****-****+*********] 1
604 1 46 LYS QG 1 50 ASP H 3.516 . 4.780 9.307 8.986 9.634 4.854 20 20 [*****************-*+] 1
605 1 46 LYS QG 1 51 LYS H 2.686 . 3.566 7.666 7.351 7.968 4.402 20 20 [************-******+] 1
606 1 46 LYS QG 1 51 LYS HA 2.498 . 3.197 7.533 6.931 8.230 5.033 19 20 [****-*************+*] 1
607 1 46 LYS QG 1 51 LYS QB 2.495 . 3.273 4.894 4.478 5.357 2.084 19 20 [****-*************+*] 1
608 1 46 LYS QG 1 51 LYS QE 2.803 . 3.785 4.344 3.530 5.004 1.219 18 14 "[****.*** * ** **-+ 2]" 1
609 1 46 LYS QG 1 51 LYS QG 1.982 . 2.473 5.530 4.753 5.972 3.499 19 20 [*************-****+*] 1
610 1 46 LYS QG 1 52 ASN QD 3.153 . 4.396 6.162 5.025 6.469 2.073 7 20 [******+*****-*******] 1
611 1 47 TYR H 1 50 ASP H 3.210 . 4.498 7.963 7.681 8.232 3.734 9 20 [********+******-****] 1
612 1 47 TYR H 1 51 LYS HA 2.525 . 3.322 8.094 7.485 8.698 5.376 19 20 [****-*************+*] 1
613 1 47 TYR H 1 51 LYS QB 2.845 . 7.000 5.005 4.519 5.580 . 0 0 "[ . 1 . 2]" 1
614 1 47 TYR H 1 51 LYS QB 2.752 . 3.699 4.697 4.399 5.156 1.457 19 20 [****-*************+*] 1
615 1 47 TYR H 1 52 ASN HA 2.719 . 3.643 8.612 8.236 8.984 5.341 18 20 [****-************+**] 1
616 1 47 TYR H 1 52 ASN QB 2.629 . 3.493 8.143 7.165 8.630 5.137 16 20 [************-**+****] 1
617 1 47 TYR H 1 52 ASN QD 2.984 . 4.097 5.288 4.496 5.665 1.568 16 19 "[********-*** **+****]" 1
618 1 47 TYR H 1 53 PRO QD 2.794 . 7.000 9.035 8.650 9.642 2.642 18 20 [****-************+**] 1
619 1 47 TYR H 1 58 ALA MB 3.303 . 4.667 5.748 5.214 6.118 1.451 9 20 [********+********-**] 1
620 1 47 TYR QB 1 52 ASN HA 2.793 . 3.768 6.588 6.060 7.467 3.699 18 20 [****-************+**] 1
621 1 47 TYR QB 1 52 ASN QB 2.554 . 3.370 5.880 5.185 6.427 3.057 16 20 [********-******+****] 1
622 1 47 TYR QB 1 52 ASN QD 2.882 . 3.920 3.815 3.505 4.291 0.371 18 0 "[ . 1 . 2]" 1
623 1 47 TYR QB 1 53 PRO HA 3.376 . 4.801 9.803 9.447 10.251 5.450 16 20 [************-**+****] 1
624 1 47 TYR QB 1 57 GLU H 3.243 . 4.558 8.287 7.980 8.690 4.132 13 20 [***********-+*******] 1
625 1 47 TYR QB 1 57 GLU HA 3.002 . 4.128 7.907 7.592 8.314 4.186 13 20 [***********-+*******] 1
626 1 47 TYR QD 1 56 PRO QB 3.201 . 4.453 8.638 8.414 8.938 4.485 13 20 [************+******-] 1
627 1 47 TYR QD 1 56 PRO QD 3.145 . 7.000 9.371 9.178 9.611 2.611 8 20 [*******+***-********] 1
628 1 47 TYR QD 1 56 PRO QG 2.936 . 4.013 9.521 9.316 9.727 5.714 13 20 [***********-+*******] 1
629 1 47 TYR QD 1 57 GLU H 2.861 . 3.884 7.114 6.860 7.361 3.477 9 20 [********+**-********] 1
630 1 47 TYR QE 1 56 PRO QB 3.289 . 4.641 9.393 9.157 9.584 4.943 14 20 [****-********+******] 1
631 1 47 TYR QE 1 56 PRO QD 2.955 . 4.046 9.637 9.301 10.001 5.955 10 20 [****-****+**********] 1
632 1 47 TYR QE 1 56 PRO QG 2.905 . 3.960 9.901 9.661 10.101 6.141 8 20 [*****-*+************] 1
633 1 48 HIS HA 1 54 ASP QB 2.938 . 7.000 10.427 10.086 10.836 3.836 19 20 [****************-*+*] 1
634 1 48 HIS HA 1 52 ASN HA 3.072 . 7.000 8.063 7.785 8.745 1.745 18 20 [*-***************+**] 1
635 1 48 HIS HA 1 53 PRO QB 2.277 . 2.732 11.626 11.215 11.890 9.158 16 20 [************-**+****] 1
636 1 48 HIS HA 1 54 ASP QB 3.176 . 4.437 13.734 12.606 14.103 9.666 17 20 [************-***+***] 1
637 1 48 HIS HA 1 55 ASN H 2.735 . 7.000 13.443 12.642 14.000 7.000 1 20 [+***********-*******] 1
638 1 48 HIS QB 1 53 PRO QB 2.184 . 2.780 10.479 10.238 10.659 7.879 16 20 [***************+***-] 1
639 1 48 HIS QB 1 53 PRO QD 2.995 . 4.066 8.131 7.853 8.527 4.461 18 20 [*****************+*-] 1
640 1 48 HIS HD1 1 52 ASN HA 2.599 . 3.443 9.655 9.282 10.087 6.644 18 20 [**************-**+**] 1
641 1 48 HIS HD1 1 52 ASN QB 3.263 . 4.594 8.105 7.680 8.832 4.238 18 20 [**************-**+**] 1
642 1 48 HIS HD1 1 53 PRO HA 2.762 . 7.000 12.347 11.868 12.709 5.709 8 20 [*******+***********-] 1
643 1 48 HIS HD1 1 53 PRO QB 2.911 . 3.970 12.631 12.205 12.949 8.979 14 20 [*************+*****-] 1
644 1 48 HIS HD1 1 53 PRO QG 2.344 . 3.031 11.949 11.295 12.473 9.442 18 20 [*****************+*-] 1
645 1 48 HIS HD2 1 52 ASN HA 2.483 . 3.253 10.717 10.503 11.278 8.025 18 20 [**********-******+**] 1
646 1 48 HIS HD2 1 52 ASN QB 3.086 . 4.277 9.050 8.667 9.502 5.225 16 20 [************-**+****] 1
647 1 48 HIS HD2 1 53 PRO HA 2.746 . 7.000 14.311 14.009 14.835 7.835 16 20 [************-**+****] 1
648 1 48 HIS HD2 1 53 PRO QB 2.901 . 3.953 13.996 13.706 14.355 10.402 16 20 [************-**+****] 1
649 1 48 HIS HD2 1 53 PRO QD 2.295 . 2.954 11.292 11.094 11.845 8.891 18 20 [*-***************+**] 1
650 1 48 HIS HD2 1 53 PRO QG 2.302 . 2.964 13.112 12.810 13.734 10.770 18 20 [*****************+*-] 1
651 1 48 HIS HD2 1 54 ASP H 3.350 . 7.000 16.300 15.530 16.768 9.768 16 20 [************-**+****] 1
652 1 49 PRO HA 1 54 ASP QB 2.196 . 7.000 10.344 8.957 10.838 3.838 20 20 [************-******+] 1
653 1 49 PRO HA 1 55 ASN H 2.382 . 7.000 10.019 8.854 10.687 3.687 8 20 [*******+****-*******] 1
654 1 49 PRO QB 1 53 PRO QB 3.161 . 4.410 9.145 8.336 9.385 4.975 11 20 [**********+*-*******] 1
655 1 49 PRO QB 1 54 ASP H 2.607 . 3.457 10.094 8.769 10.521 7.064 20 20 [************-******+] 1
656 1 49 PRO QB 1 54 ASP HA 2.126 . 2.691 9.050 7.058 9.862 7.171 20 20 [************-******+] 1
657 1 49 PRO QB 1 54 ASP QB 1.768 . 2.159 9.987 8.348 10.609 8.450 20 20 [************-******+] 1
658 1 49 PRO QB 1 55 ASN H 2.865 . 3.891 10.278 8.951 10.922 7.031 8 20 [*******+****-*******] 1
659 1 50 ASP H 1 53 PRO QB 3.152 . 4.228 9.842 9.436 10.099 5.871 16 20 [************-**+****] 1
660 1 50 ASP H 1 54 ASP H 2.336 . 3.018 11.384 10.359 11.709 8.691 1 20 [+***********-*******] 1
661 1 50 ASP H 1 54 ASP QB 2.222 . 2.839 10.586 9.618 10.913 8.074 1 20 [+***********-*******] 1
662 1 50 ASP H 1 55 ASN HA 2.452 . 3.204 13.294 12.481 13.813 10.609 8 20 [*******+*********-**] 1
663 1 50 ASP H 1 55 ASN QB 2.663 . 3.013 12.168 11.576 12.634 9.621 8 20 [*******+*********-**] 1
664 1 50 ASP H 1 56 PRO QD 3.022 . 7.000 12.275 11.717 12.675 5.675 8 20 [*******+*******-****] 1
665 1 50 ASP H 1 58 ALA MB 2.876 . 7.000 6.807 6.287 7.122 0.122 9 0 "[ . 1 . 2]" 1
666 1 50 ASP QB 1 55 ASN HA 2.727 . 3.657 12.950 12.094 13.365 9.708 1 20 [+****************-**] 1
667 1 50 ASP QB 1 55 ASN QB 2.308 . 2.974 11.845 11.254 12.226 9.252 2 20 [*+***************-**] 1
668 1 50 ASP QB 1 56 PRO QD 3.065 . 4.160 12.095 11.581 12.458 8.298 3 20 [**+**************-**] 1
669 1 50 ASP QB 1 57 GLU QG 3.219 . 7.000 12.425 11.841 12.738 5.738 9 20 [********+********-**] 1
670 1 50 ASP QB 1 58 ALA H 3.220 . 7.000 10.755 10.067 11.029 4.029 9 20 [********+********-**] 1
671 1 50 ASP QB 1 58 ALA MB 2.884 . 7.000 7.415 7.100 7.719 0.719 9 5 "[ ** - +1 . *2]" 1
672 1 51 LYS HA 1 55 ASN HA 3.013 . 7.000 12.483 12.040 13.145 6.145 19 20 [***********-******+*] 1
673 1 51 LYS HA 1 56 PRO QB 2.063 . 2.595 11.890 11.241 13.318 10.723 13 20 [************+******-] 1
674 1 51 LYS HA 1 56 PRO QD 2.752 . 7.000 12.117 11.634 12.983 5.983 13 20 [************+******-] 1
675 1 51 LYS HA 1 56 PRO QG 2.408 . 7.000 13.091 12.544 14.222 7.222 13 20 [************+******-] 1
676 1 51 LYS HA 1 57 GLU H 2.744 . 3.685 11.412 10.931 12.706 9.021 13 20 [***********-+*******] 1
677 1 51 LYS HA 1 57 GLU HA 3.101 . 7.000 12.992 12.595 14.193 7.193 13 20 [************+******-] 1
678 1 51 LYS HA 1 58 ALA H 3.059 . 4.229 9.502 9.109 10.706 6.477 13 20 [************+******-] 1
679 1 51 LYS HA 1 60 ASP H 3.098 . 4.298 12.083 11.689 13.282 8.984 13 20 [************+**-****] 1
680 1 51 LYS QB 1 55 ASN HA 2.953 . 7.000 10.954 10.485 11.578 4.578 19 20 [******************+-] 1
681 1 51 LYS QB 1 56 PRO QB 1.845 . 2.270 9.991 9.285 11.301 9.031 13 20 [************+******-] 1
682 1 51 LYS QB 1 56 PRO QD 2.650 . 3.475 10.456 9.940 11.276 7.801 13 20 [************+******-] 1
683 1 51 LYS QB 1 56 PRO QG 2.206 . 2.814 11.090 10.491 12.159 9.345 13 20 [************+******-] 1
684 1 51 LYS QB 1 57 GLU H 2.776 . 7.000 9.330 8.844 10.529 3.529 13 20 [************+******-] 1
685 1 51 LYS QB 1 59 ALA MB 2.547 . 3.358 7.058 6.605 8.151 4.793 13 20 [************+-******] 1
686 1 51 LYS QD 1 55 ASN HA 2.347 . 3.035 13.317 12.658 14.394 11.359 19 20 [******-***********+*] 1
687 1 51 LYS QD 1 55 ASN QB 3.244 . 4.255 11.357 10.558 12.509 8.254 19 20 [******-***********+*] 1
688 1 51 LYS QD 1 56 PRO QD 2.252 . 2.886 12.569 11.951 13.587 10.701 19 20 [******-***********+*] 1
689 1 51 LYS QD 1 56 PRO QG 2.337 . 2.999 13.172 12.555 14.359 11.360 9 20 [********+**-********] 1
690 1 51 LYS QG 1 55 ASN HA 2.710 . 7.000 12.592 12.141 12.909 5.909 13 20 [************+-******] 1
691 1 51 LYS QG 1 56 PRO HA 2.540 . 7.000 10.548 9.866 11.624 4.624 13 20 [************+******-] 1
692 1 51 LYS QG 1 56 PRO QB 2.324 . 2.999 11.142 10.478 12.205 9.206 13 20 [************+******-] 1
693 1 51 LYS QG 1 56 PRO QD 2.410 . 3.136 11.848 11.382 12.429 9.293 13 20 [************+-******] 1
694 1 51 LYS QG 1 56 PRO QG 1.915 . 2.373 12.399 11.828 13.250 10.877 13 20 [************+******-] 1
695 1 51 LYS QG 1 57 GLU H 2.866 . 7.000 11.048 10.415 12.000 5.000 13 20 [************+-******] 1
696 1 52 ASN H 1 56 PRO QD 2.561 . 7.000 9.709 9.309 10.195 3.195 13 20 [***********-+*******] 1
697 1 52 ASN H 1 56 PRO QG 2.750 . 7.000 10.582 10.093 11.354 4.354 13 20 [***********-+*******] 1
698 1 52 ASN H 1 57 GLU HA 2.297 . 2.956 10.831 10.146 11.284 8.328 13 20 [************+****-**] 1
699 1 52 ASN H 1 57 GLU QB 1.925 . 2.388 8.732 7.668 9.078 6.690 9 20 [********+********-**] 1
700 1 52 ASN H 1 58 ALA H 2.222 . 2.839 7.455 6.640 7.804 4.965 13 20 [************+****-**] 1
701 1 52 ASN HA 1 56 PRO QD 3.143 . 4.378 5.912 5.546 6.720 2.342 19 20 [****-*************+*] 1
702 1 52 ASN HA 1 57 GLU QB 2.201 . 2.807 6.429 5.844 7.469 4.662 9 20 [********+-**********] 1
703 1 52 ASN HA 1 58 ALA MB 3.007 . 7.000 3.055 2.722 3.893 . 0 0 "[ . 1 . 2]" 1
704 1 52 ASN HA 1 59 ALA H 3.108 . 4.315 5.909 5.403 7.523 3.208 13 20 [************+*-*****] 1
705 1 52 ASN HA 1 60 ASP QB 2.699 . 3.610 9.175 8.786 10.301 6.691 13 20 [*******-****+*******] 1
706 1 52 ASN QB 1 53 PRO HA 2.745 . 7.000 4.481 4.356 4.588 . 0 0 "[ . 1 . 2]" 1
707 1 53 PRO HA 1 57 GLU QB 2.264 . 7.000 8.064 7.476 8.424 1.424 9 19 [********+1*******-**] 1
708 1 53 PRO HA 1 61 LYS QB 2.694 . 3.568 10.780 10.477 11.310 7.742 18 20 [*-***************+**] 1
709 1 54 ASP H 1 56 PRO HA 2.563 . 3.384 7.337 7.121 7.599 4.215 9 20 [-*******+***********] 1
710 1 54 ASP H 1 58 ALA HA 2.849 . 3.864 10.246 9.701 10.593 6.729 7 20 [******+*****-*******] 1
711 1 54 ASP H 1 59 ALA HA 2.392 . 3.107 10.792 10.313 11.294 8.187 16 20 [********-******+****] 1
712 1 54 ASP H 1 59 ALA MB 1.902 . 2.354 8.030 7.734 8.457 6.103 17 20 [*******-********+***] 1
713 1 54 ASP HA 1 62 PHE QB 2.957 . 4.005 11.255 10.213 11.994 7.989 16 20 [************-**+****] 1
714 1 54 ASP HA 1 62 PHE QD 3.055 . 4.222 12.306 10.750 13.307 9.085 17 20 [************-***+***] 1
715 1 54 ASP HA 1 63 LYS H 3.168 . 4.423 13.610 12.828 14.300 9.877 16 20 [************-**+****] 1
716 1 55 ASN H 1 56 PRO QB 3.073 . 4.254 6.227 6.119 6.368 2.114 13 20 [************+******-] 1
717 1 55 ASN H 1 57 GLU HA 2.825 . 3.823 7.684 7.479 7.807 3.984 9 20 [********+-**********] 1
718 1 55 ASN H 1 57 GLU HA 2.535 . 3.338 7.387 7.251 7.483 4.145 5 20 [****+****-**********] 1
719 1 55 ASN H 1 58 ALA HA 3.134 . 4.362 8.685 8.219 9.116 4.754 18 20 [************-****+**] 1
720 1 55 ASN H 1 59 ALA H 2.269 . 2.912 7.192 6.799 7.365 4.453 10 20 [*********+**-*******] 1
721 1 55 ASN H 1 59 ALA H 2.153 . 2.732 7.065 6.702 7.229 4.497 10 20 [*********+**-*******] 1
722 1 55 ASN H 1 59 ALA HA 2.903 . 3.956 9.600 9.116 9.878 5.922 15 20 [********-*****+*****] 1
723 1 55 ASN H 1 59 ALA MB 2.163 . 2.748 6.911 6.661 7.172 4.424 17 20 [************-***+***] 1
724 1 55 ASN H 1 60 ASP HA 2.296 . 2.955 11.621 11.394 11.808 8.853 20 20 [**-****************+] 1
725 1 55 ASN H 1 60 ASP QB 2.068 . 2.603 9.109 8.964 9.270 6.667 20 20 [*-*****************+] 1
726 1 55 ASN H 1 61 LYS H 2.397 . 3.115 10.363 10.115 10.734 7.619 18 20 [********-********+**] 1
727 1 55 ASN H 1 62 PHE H 3.540 . 5.107 11.536 11.099 11.792 6.685 10 20 [*********+**-*******] 1
728 1 55 ASN H 1 63 LYS QB 3.112 . 7.000 12.135 11.859 12.305 5.305 12 20 [***********+-*******] 1
729 1 55 ASN HA 1 59 ALA MB 2.855 . 3.874 6.234 6.024 6.437 2.563 12 20 [***********+-*******] 1
730 1 55 ASN HA 1 60 ASP QB 2.349 . 2.913 7.657 7.537 7.804 4.891 14 20 [*****-*******+******] 1
731 1 55 ASN HA 1 61 LYS H 2.686 . 3.588 9.480 9.292 9.832 6.244 18 20 [*****-***********+**] 1
732 1 55 ASN HA 1 63 LYS QB 2.335 . 3.016 11.011 10.812 11.166 8.150 12 20 [***********+*****-**] 1
733 1 55 ASN QB 1 60 ASP H 2.407 . 7.000 6.789 6.660 6.913 . 0 0 "[ . 1 . 2]" 1
734 1 55 ASN QB 1 61 LYS H 2.766 . 3.536 7.860 7.621 8.305 4.769 18 20 [****************-+**] 1
735 1 55 ASN QB 1 61 LYS HA 3.306 . 4.673 10.041 9.806 10.634 5.961 18 20 [****************-+**] 1
736 1 55 ASN QB 1 61 LYS QB 3.381 . 4.810 7.799 7.526 8.305 3.495 18 20 [****-************+**] 1
737 1 55 ASN QB 1 61 LYS QB 3.193 . 4.467 7.496 7.265 7.919 3.452 18 20 [*****-***********+**] 1
738 1 55 ASN QB 1 63 LYS QB 3.182 . 4.448 9.973 9.833 10.072 5.624 4 20 [***+*********-******] 1
739 1 56 PRO HA 1 61 LYS QB 2.561 . 3.381 6.981 6.857 7.192 3.811 16 20 [**********-****+****] 1
740 1 56 PRO HA 1 61 LYS QD 2.507 . 3.293 9.418 9.161 9.902 6.609 3 20 [**+*****-***********] 1
741 1 56 PRO HA 1 64 GLU H 2.691 . 3.596 8.284 7.995 8.646 5.050 10 20 [*****-***+**********] 1
742 1 56 PRO QB 1 58 ALA MB 3.105 . 4.310 5.819 5.550 6.099 1.789 18 20 [****-************+**] 1
743 1 56 PRO QB 1 60 ASP H 3.479 . 7.000 3.849 3.674 4.027 . 0 0 "[ . 1 . 2]" 1
744 1 56 PRO QB 1 61 LYS HA 2.661 . 3.546 8.532 8.311 8.765 5.219 17 20 [*********-******+***] 1
745 1 56 PRO QB 1 61 LYS QB 2.295 . 2.953 7.135 6.870 7.358 4.405 14 20 [*********-***+******] 1
746 1 56 PRO QB 1 61 LYS QD 2.906 . 3.705 8.899 8.558 9.513 5.808 5 20 [****+-**************] 1
747 1 56 PRO QB 1 61 LYS QE 3.047 . 4.207 9.619 9.363 9.836 5.629 15 20 [*********-****+*****] 1
748 1 56 PRO QB 1 61 LYS QG 2.611 . 3.314 7.751 7.375 8.786 5.472 3 20 [**+**-**************] 1
749 1 56 PRO HD2 1 61 LYS HE2 1.858 . 2.289 11.033 10.767 11.323 9.034 8 20 [**-****+************] 1
750 1 56 PRO QD 1 61 LYS H 2.939 . 7.000 7.821 7.632 8.021 1.021 8 20 [*******+*****-******] 1
751 1 56 PRO QD 1 61 LYS QG 2.475 . 2.975 8.484 8.036 9.810 6.835 3 20 [**+**-**************] 1
752 1 56 PRO QG 1 61 LYS H 2.536 . 7.000 7.084 6.858 7.265 0.265 19 0 "[ . 1 . 2]" 1
753 1 56 PRO QG 1 61 LYS HA 2.521 . 3.315 9.358 9.093 9.558 6.243 19 20 [*****-************+*] 1
754 1 56 PRO QG 1 61 LYS HA 2.483 . 3.253 7.726 7.357 8.135 4.882 17 20 [***********-****+***] 1
755 1 56 PRO QG 1 61 LYS QB 2.388 . 3.101 7.952 7.734 8.205 5.104 14 20 [*****-*******+******] 1
756 1 56 PRO QG 1 62 PHE H 3.149 . 4.388 8.979 8.787 9.231 4.843 9 20 [********+**********-] 1
757 1 57 GLU H 1 59 ALA HA 2.980 . 4.090 6.530 6.416 6.649 2.559 15 20 [*************-+*****] 1
758 1 57 GLU H 1 61 LYS QB 2.657 . 3.540 6.315 6.102 6.483 2.943 14 20 [*****-*******+******] 1
759 1 57 GLU H 1 61 LYS QE 3.497 . 5.025 9.027 8.622 9.373 4.348 18 20 [****-************+**] 1
760 1 57 GLU H 1 62 PHE HA 2.538 . 3.343 10.540 10.380 10.681 7.338 9 20 [********+*******-***] 1
761 1 57 GLU H 1 62 PHE HA 2.831 . 3.833 9.217 9.138 9.323 5.490 11 20 [**********+******-**] 1
762 1 57 GLU H 1 62 PHE QB 2.536 . 3.340 8.124 7.816 8.316 4.976 5 20 [****+************-**] 1
763 1 57 GLU H 1 63 LYS H 2.597 . 3.440 8.927 8.795 9.066 5.626 9 20 [********+********-**] 1
764 1 57 GLU H 1 63 LYS QB 3.127 . 7.000 8.374 8.211 8.474 1.474 20 20 [*************-*****+] 1
765 1 57 GLU HA 1 61 LYS QD 3.134 . 7.000 6.373 5.819 7.614 0.614 3 2 "[ + - 1 . 2]" 1
766 1 57 GLU HA 1 62 PHE QB 2.983 . 4.095 7.713 7.501 7.902 3.807 9 20 [********+*******-***] 1
767 1 57 GLU HA 1 65 ILE HB 2.975 . 4.081 11.891 11.666 12.185 8.104 18 20 [***************-*+**] 1
768 1 57 GLU HA 1 66 ASN H 3.326 . 4.709 11.921 11.638 12.253 7.544 18 20 [****************-+**] 1
769 1 57 GLU QB 1 62 PHE H 3.165 . 4.417 7.089 6.909 7.237 2.820 9 20 [********+*******-***] 1
770 1 57 GLU QB 1 62 PHE QB 3.075 . 7.000 7.699 7.520 7.865 0.865 9 20 [********+********-**] 1
771 1 57 GLU QB 1 63 LYS H 3.397 . 4.839 8.479 8.304 8.640 3.801 9 20 [********+*******-***] 1
772 1 58 ALA H 1 60 ASP HA 3.072 . 4.252 6.815 6.679 6.996 2.744 10 20 [*********+****-*****] 1
773 1 58 ALA H 1 62 PHE HA 2.560 . 3.379 8.527 8.366 8.672 5.293 5 20 [****+**************-] 1
774 1 58 ALA H 1 62 PHE QB 3.213 . 4.504 6.458 6.144 6.663 2.159 5 20 [****+************-**] 1
775 1 58 ALA H 1 62 PHE QB 2.667 . 3.556 6.165 5.917 6.309 2.753 5 20 [****+************-**] 1
776 1 58 ALA H 1 62 PHE QD 3.116 . 4.330 8.332 8.061 8.554 4.224 5 20 [****+*******-*******] 1
777 1 58 ALA H 1 63 LYS HA 2.348 . 3.037 10.314 10.111 10.456 7.419 4 20 [***+*************-**] 1
778 1 58 ALA H 1 63 LYS QB 2.062 . 2.593 7.762 7.631 7.872 5.279 4 20 [***+**********-*****] 1
779 1 58 ALA H 1 63 LYS QE 2.666 . 3.555 7.814 7.681 8.007 4.452 10 20 [*********+*****-****] 1
780 1 58 ALA H 1 63 LYS QG 2.609 . 7.000 9.884 9.768 9.994 2.994 4 20 [***+**********-*****] 1
781 1 58 ALA HA 1 67 ASN H 2.901 . 3.953 6.619 6.548 6.689 2.736 11 20 [****-*****+*********] 1
782 1 58 ALA HA 1 63 LYS QG 2.449 . 3.199 9.088 9.022 9.193 5.994 4 20 [***+***********-****] 1
783 1 58 ALA HA 1 64 GLU H 2.957 . 4.050 7.435 7.303 7.588 3.538 18 20 [**-**************+**] 1
784 1 58 ALA HA 1 66 ASN QD 3.115 . 4.328 11.159 10.590 11.649 7.321 17 20 [******-*********+***] 1
785 1 58 ALA MB 1 63 LYS QG 2.397 . 2.936 8.611 8.462 8.693 5.757 4 20 [***+**-*************] 1
786 1 58 ALA MB 1 66 ASN QB 3.017 . 7.000 8.674 8.332 9.010 2.010 4 20 [***+***************-] 1
787 1 59 ALA H 1 61 LYS QD 3.016 . 4.153 6.644 6.503 6.844 2.691 3 20 [**+**********-******] 1
788 1 59 ALA H 1 63 LYS QB 2.204 . 2.811 6.006 5.916 6.120 3.309 3 20 [**+***-*************] 1
789 1 59 ALA H 1 63 LYS QG 3.081 . 7.000 8.072 7.893 8.180 1.180 16 20 [******-********+****] 1
790 1 59 ALA H 1 64 GLU HA 2.418 . 3.149 10.594 10.489 10.677 7.528 18 20 [****************-+**] 1
791 1 59 ALA H 1 64 GLU QB 2.728 . 3.658 9.079 8.892 9.295 5.637 18 20 [********-********+**] 1
792 1 59 ALA H 1 65 ILE H 2.631 . 3.497 9.072 8.942 9.214 5.717 19 20 [****************-*+*] 1
793 1 59 ALA H 1 67 ASN QB 3.283 . 4.630 11.085 10.880 11.356 6.726 19 20 [**************-***+*] 1
794 1 59 ALA HA 1 64 GLU QB 2.566 . 3.360 8.420 8.271 8.577 5.217 4 20 [***+************-***] 1
795 1 59 ALA HA 1 66 ASN QB 2.758 . 7.000 7.206 6.779 7.583 0.583 9 2 "[ -. +1 . 2]" 1
796 1 59 ALA HA 1 67 ASN QB 2.605 . 3.453 9.564 9.236 9.832 6.379 5 20 [****+*********-*****] 1
797 1 59 ALA HA 1 67 ASN QD 3.147 . 4.385 11.897 11.374 12.268 7.883 10 20 [*********+******-***] 1
798 1 59 ALA HA 1 68 ALA H 3.346 . 4.746 11.700 11.367 11.970 7.224 4 20 [***+**********-*****] 1
799 1 59 ALA MB 1 61 LYS HA 2.948 . 7.000 6.497 6.434 6.573 . 0 0 "[ . 1 . 2]" 1
800 1 59 ALA MB 1 64 GLU QG 2.667 . 3.556 6.640 6.552 6.713 3.157 13 20 [************+*-*****] 1
801 1 59 ALA MB 1 65 ILE H 3.200 . 4.480 7.849 7.688 7.923 3.443 8 20 [*******+******-*****] 1
802 1 59 ALA MB 1 67 ASN QB 3.146 . 4.383 8.740 8.495 8.950 4.567 5 20 [****+*********-*****] 1
803 1 60 ASP H 1 62 PHE HA 3.322 . 4.701 6.947 6.760 7.079 2.378 1 20 [+****************-**] 1
804 1 60 ASP H 1 62 PHE HA 2.893 . 3.939 6.684 6.557 6.777 2.838 1 20 [+****************-**] 1
805 1 60 ASP H 1 64 GLU HA 3.184 . 4.451 8.701 8.594 8.837 4.386 18 20 [*****-***********+**] 1
806 1 60 ASP H 1 64 GLU QB 2.731 . 3.664 7.290 7.060 7.539 3.875 18 20 [********-********+**] 1
807 1 60 ASP H 1 65 ILE HA 2.932 . 4.007 10.661 10.566 10.717 6.710 14 20 [*****-*******+******] 1
808 1 60 ASP H 1 65 ILE HB 2.704 . 3.618 9.437 9.295 9.618 6.000 11 20 [**********+******-**] 1
809 1 60 ASP H 1 65 ILE QG 2.776 . 3.740 7.632 7.523 7.770 4.030 13 20 [*********-**+*******] 1
810 1 60 ASP H 1 65 ILE MG 2.469 . 7.000 9.600 9.503 9.696 2.696 9 20 [********+********-**] 1
811 1 60 ASP HA 1 65 ILE HB 2.932 . 4.007 8.562 8.393 8.741 4.734 11 20 [*****-****+*********] 1
812 1 60 ASP HA 1 66 ASN H 2.997 . 4.120 7.046 6.925 7.178 3.058 3 20 [**+**-**************] 1
813 1 60 ASP HA 1 68 ALA MB 2.812 . 3.801 9.529 9.409 9.687 5.886 18 20 [-****************+**] 1
814 1 61 LYS H 1 62 PHE QD 3.259 . 4.586 6.540 6.457 6.648 2.062 11 20 [**********+***-*****] 1
815 1 61 LYS H 1 63 LYS HA 2.900 . 3.951 6.664 6.588 6.735 2.784 11 20 [****-*****+*********] 1
816 1 61 LYS H 1 65 ILE H 2.721 . 3.646 6.051 5.968 6.164 2.518 20 20 [****-**************+] 1
817 1 61 LYS H 1 65 ILE HB 2.800 . 3.780 7.737 7.616 7.885 4.105 11 20 [**********+****-****] 1
818 1 61 LYS H 1 65 ILE QG 2.882 . 3.921 5.648 5.527 5.775 1.854 13 20 [****-*******+*******] 1
819 1 61 LYS H 1 65 ILE MG 2.630 . 3.495 7.950 7.840 8.038 4.543 20 20 [***************-***+] 1
820 1 61 LYS HA 1 67 ASN H 2.375 . 3.080 5.851 5.691 6.074 2.994 13 20 [************+**-****] 1
821 1 61 LYS QB 1 63 LYS QG 3.093 . 4.289 3.731 3.379 4.509 0.220 5 0 "[ . 1 . 2]" 1
822 1 61 LYS QB 1 63 LYS HA 2.487 . 3.260 6.641 6.592 6.858 3.598 3 20 [**+******-**********] 1
823 1 61 LYS QB 1 63 LYS QG 2.993 . 7.000 7.018 6.922 7.154 0.154 3 0 "[ . 1 . 2]" 1
824 1 61 LYS QB 1 65 ILE H 3.290 . 4.643 4.800 4.571 5.110 0.467 3 0 "[ . 1 . 2]" 1
825 1 61 LYS QB 1 65 ILE HA 3.324 . 7.000 6.597 6.285 6.954 . 0 0 "[ . 1 . 2]" 1
826 1 61 LYS QB 1 65 ILE HB 3.235 . 4.543 5.661 5.361 6.266 1.723 5 20 [****+**********-****] 1
827 1 61 LYS QB 1 66 ASN H 2.194 . 2.796 6.505 6.296 6.913 4.117 3 20 [**+************-****] 1
828 1 61 LYS QB 1 66 ASN HA 2.403 . 3.125 8.838 8.624 9.304 6.179 3 20 [**+************-****] 1
829 1 62 PHE H 1 64 GLU HA 2.891 . 3.936 7.191 7.137 7.269 3.333 14 20 [**-**********+******] 1
830 1 62 PHE H 1 67 ASN QB 2.103 . 2.656 8.031 7.808 8.290 5.634 19 20 [********-*********+*] 1
831 1 62 PHE H 1 68 ALA MB 2.828 . 7.000 8.764 8.681 8.895 1.895 9 20 [****-***+***********] 1
832 1 62 PHE HA 1 64 GLU HA 3.205 . 7.000 6.567 6.529 6.637 . 0 0 "[ . 1 . 2]" 1
833 1 62 PHE HA 1 67 ASN QB 2.264 . 2.905 7.077 6.834 7.393 4.488 13 20 [************+**-****] 1
834 1 63 LYS H 1 67 ASN HA 2.639 . 3.509 6.380 6.261 6.550 3.041 13 20 [********-***+*******] 1
835 1 63 LYS H 1 67 ASN HA 2.923 . 3.991 8.260 8.077 8.416 4.425 13 20 [********-***+*******] 1
836 1 63 LYS H 1 67 ASN QB 2.365 . 3.064 6.069 5.842 6.287 3.223 13 20 [**-*********+*******] 1
837 1 63 LYS H 1 68 ALA HA 2.516 . 3.307 10.588 10.502 10.753 7.446 4 20 [**-+****************] 1
838 1 63 LYS H 1 68 ALA MB 2.206 . 2.814 8.009 7.936 8.144 5.330 9 20 [****-***+***********] 1
839 1 63 LYS HA 1 72 LEU QD 3.375 . 4.799 9.363 9.222 9.480 4.681 4 20 [-**+****************] 1
840 1 64 GLU H 1 65 ILE HA 3.007 . 4.137 5.205 5.162 5.244 1.107 6 20 [*****+*********-****] 1
841 1 64 GLU H 1 68 ALA MB 2.426 . 3.161 6.085 6.020 6.179 3.018 9 20 [********+*****-*****] 1
842 1 64 GLU H 1 69 HIS HA 2.658 . 3.541 10.260 10.174 10.447 6.906 11 20 [**********+***-*****] 1
843 1 64 GLU H 1 69 HIS QB 2.330 . 3.009 7.965 7.717 8.838 5.829 20 20 [********-**********+] 1
844 1 64 GLU HA 1 68 ALA MB 3.027 . 4.172 4.385 4.265 4.500 0.328 11 0 "[ . 1 . 2]" 1
845 1 64 GLU HA 1 69 HIS QB 2.795 . 3.771 6.907 6.613 7.819 4.048 20 20 [***-***************+] 1
846 1 64 GLU HA 1 72 LEU QD 3.483 . 5.000 6.566 6.388 6.713 1.713 11 20 [-*********+*********] 1
847 1 65 ILE H 1 67 ASN HA 2.768 . 7.000 6.640 6.516 6.831 . 0 0 "[ . 1 . 2]" 1
848 1 65 ILE H 1 69 HIS HA 3.030 . 4.177 8.241 8.121 8.400 4.223 11 20 [**********+***-*****] 1
849 1 65 ILE H 1 69 HIS HA 2.341 . 3.026 8.032 7.927 8.158 5.132 11 20 [**********+***-*****] 1
850 1 65 ILE H 1 69 HIS QB 2.462 . 3.220 6.275 6.069 6.882 3.662 20 20 [***-***************+] 1
851 1 65 ILE H 1 70 ALA HA 2.647 . 3.523 11.117 10.969 11.495 7.972 20 20 [******-************+] 1
852 1 65 ILE H 1 70 ALA MB 1.995 . 2.493 8.695 8.437 9.130 6.637 20 20 [******-************+] 1
853 1 65 ILE H 1 71 ILE H 2.605 . 3.453 9.222 9.100 9.330 5.877 10 20 [*********+******-***] 1
854 1 65 ILE H 1 71 ILE MD 3.539 . 5.104 8.459 8.335 8.654 3.550 13 20 [************+******-] 1
855 1 65 ILE H 1 73 THR MG 3.245 . 4.561 10.772 10.543 11.076 6.515 20 20 [********-**********+] 1
856 1 66 ASN H 1 68 ALA HA 3.370 . 4.789 7.101 7.047 7.195 2.406 20 20 [***********-*******+] 1
857 1 66 ASN H 1 70 ALA HA 3.181 . 4.446 9.429 9.208 10.123 5.677 20 20 [********-**********+] 1
858 1 66 ASN H 1 71 ILE HA 2.731 . 3.663 10.725 10.615 10.856 7.193 20 20 [****************-**+] 1
859 1 66 ASN H 1 71 ILE MD 2.440 . 3.185 7.777 7.676 7.882 4.697 2 20 [*+**-***************] 1
860 1 66 ASN H 1 71 ILE QG 2.157 . 2.739 7.182 7.099 7.265 4.526 13 20 [****-*******+*******] 1
861 1 66 ASN H 1 71 ILE MG 2.666 . 7.000 9.309 9.239 9.406 2.406 13 20 [************+******-] 1
862 1 66 ASN H 1 71 ILE MG 2.802 . 3.783 7.103 7.048 7.240 3.457 20 20 [*-*****************+] 1
863 1 66 ASN H 1 72 LEU QD 3.225 . 4.525 7.369 7.289 7.564 3.039 20 20 [*-*****************+] 1
864 1 66 ASN HA 1 71 ILE HB 2.609 . 3.460 6.597 6.503 6.709 3.249 13 20 [************+******-] 1
865 1 66 ASN HA 1 71 ILE QG 2.989 . 4.106 6.830 6.690 6.953 2.847 13 20 [************+******-] 1
866 1 66 ASN HA 1 89 LEU QD 3.129 . 4.353 8.995 8.464 9.335 4.982 14 20 [*************+*****-] 1
867 1 67 ASN H 1 68 ALA H 3.363 . 4.777 2.688 2.478 2.811 . 0 0 "[ . 1 . 2]" 1
868 1 67 ASN H 1 71 ILE H 2.799 . 3.778 6.181 6.018 6.389 2.611 20 20 [*******-***********+] 1
869 1 67 ASN H 1 71 ILE HA 2.972 . 4.076 8.495 8.319 8.611 4.535 15 20 [*******-******+*****] 1
870 1 67 ASN H 1 71 ILE HB 2.291 . 2.947 7.175 7.066 7.300 4.353 15 20 [*******-******+*****] 1
871 1 67 ASN H 1 71 ILE MD 2.732 . 7.000 5.653 5.494 5.785 . 0 0 "[ . 1 . 2]" 1
872 1 67 ASN H 1 72 LEU HA 2.922 . 3.990 10.735 10.608 10.851 6.861 3 20 [**+*-***************] 1
873 1 67 ASN H 1 72 LEU QD 2.585 . 3.420 6.366 6.248 6.445 3.025 4 20 [-**+****************] 1
874 1 67 ASN H 1 73 THR H 2.939 . 4.018 9.956 9.774 10.168 6.150 20 20 [********-**********+] 1
875 1 67 ASN HA 1 72 LEU QD 3.326 . 4.709 6.134 6.077 6.236 1.527 20 20 [-******************+] 1
876 1 68 ALA H 1 73 THR HA 2.497 . 3.276 8.896 8.746 9.030 5.754 10 20 [********-+**********] 1
877 1 68 ALA H 1 70 ALA HA 3.387 . 4.821 7.231 7.124 7.623 2.802 20 20 [********-**********+] 1
878 1 68 ALA H 1 70 ALA HA 3.088 . 4.280 6.288 6.170 6.447 2.167 20 20 [*******-***********+] 1
879 1 68 ALA H 1 71 ILE H 3.495 . 5.022 4.688 4.510 4.878 . 0 0 "[ . 1 . 2]" 1
880 1 68 ALA H 1 72 LEU QB 2.880 . 3.917 6.908 6.715 7.219 3.302 20 20 [********-**********+] 1
881 1 68 ALA H 1 72 LEU QD 3.109 . 4.317 4.385 4.294 4.477 0.160 20 0 "[ . 1 . 2]" 1
882 1 68 ALA H 1 73 THR HA 2.545 . 3.355 9.295 9.139 9.441 6.086 20 20 [*-*****************+] 1
883 1 68 ALA H 1 73 THR HB 2.992 . 4.111 10.065 9.853 10.206 6.095 11 20 [*-********+*********] 1
884 1 68 ALA H 1 73 THR MG 2.470 . 3.233 7.498 7.260 7.783 4.550 20 20 [********-**********+] 1
885 1 68 ALA HA 1 70 ALA HA 3.108 . 7.000 6.186 6.085 6.400 . 0 0 "[ . 1 . 2]" 1
886 1 68 ALA HA 1 74 ASP HA 3.086 . 7.000 9.633 9.446 9.834 2.834 6 20 [*****+**-***********] 1
887 1 69 HIS H 1 71 ILE HA 3.269 . 4.605 6.878 6.660 6.997 2.392 1 20 [+******************-] 1
888 1 69 HIS H 1 71 ILE MG 3.391 . 4.828 6.423 6.230 6.543 1.715 13 20 [************+******-] 1
889 1 69 HIS H 1 72 LEU H 3.550 . 5.125 5.223 5.111 5.324 0.199 8 0 "[ . 1 . 2]" 1
890 1 69 HIS H 1 72 LEU HA 3.541 . 5.108 7.976 7.879 8.099 2.991 8 20 [******-+************] 1
891 1 69 HIS H 1 73 THR HA 2.735 . 3.670 9.422 9.270 9.580 5.910 10 20 [********-+**********] 1
892 1 69 HIS H 1 73 THR MG 2.888 . 3.930 5.797 5.614 6.033 2.103 10 20 [********-+**********] 1
893 1 69 HIS H 1 74 ASP HA 2.703 . 3.617 10.577 10.394 10.778 7.161 6 20 [*****+********-*****] 1
894 1 69 HIS H 1 74 ASP QB 2.513 . 3.277 7.899 7.703 8.100 4.823 6 20 [*****+********-*****] 1
895 1 69 HIS H 1 77 LYS H 3.609 . 5.237 11.296 11.028 11.556 6.319 12 20 [***********+*******-] 1
896 1 69 HIS H 1 77 LYS QB 3.139 . 4.371 7.867 7.598 8.105 3.734 13 20 [************+******-] 1
897 1 69 HIS H 1 78 ARG H 3.351 . 4.754 10.882 10.613 11.039 6.285 12 20 [***********+*******-] 1
898 1 69 HIS QB 1 74 ASP HA 3.240 . 4.165 9.565 9.267 9.903 5.738 2 20 [*+************-*****] 1
899 1 69 HIS QB 1 74 ASP QB 2.895 . 3.943 7.332 7.036 7.595 3.652 2 20 [*+************-*****] 1
900 1 70 ALA H 1 74 ASP H 3.221 . 4.518 6.389 6.048 6.871 2.353 11 20 [-*********+*********] 1
901 1 70 ALA H 1 74 ASP HA 2.224 . 2.843 8.195 7.899 8.495 5.652 6 20 [*****+********-*****] 1
902 1 70 ALA H 1 74 ASP QB 3.355 . 4.360 5.644 5.374 5.841 1.481 16 20 [**************-+****] 1
903 1 70 ALA H 1 75 ALA HA 2.603 . 3.450 11.314 11.085 11.641 8.191 11 20 [-*********+*********] 1
904 1 70 ALA H 1 75 ALA MB 1.999 . 2.498 10.571 10.339 10.737 8.239 2 20 [*+************-*****] 1
905 1 70 ALA H 1 77 LYS H 3.789 . 5.584 8.936 8.658 9.237 3.653 6 20 [**-**+**************] 1
906 1 70 ALA HA 1 74 ASP HA 2.979 . 7.000 5.868 5.487 6.205 . 0 0 "[ . 1 . 2]" 1
907 1 70 ALA HA 1 79 ASN H 3.143 . 4.378 10.370 10.137 10.581 6.203 12 20 [***********+**-*****] 1
908 1 70 ALA MB 1 74 ASP H 3.009 . 7.000 5.017 4.625 5.671 . 0 0 "[ . 1 . 2]" 1
909 1 70 ALA MB 1 74 ASP HA 2.268 . 7.000 5.623 5.171 6.102 . 0 0 "[ . 1 . 2]" 1
910 1 70 ALA MB 1 74 ASP QB 2.979 . 7.000 3.411 2.974 3.869 . 0 0 "[ . 1 . 2]" 1
911 1 70 ALA MB 1 75 ALA HA 1.802 . 2.208 8.621 8.232 9.074 6.866 7 20 [******+*******-*****] 1
912 1 70 ALA MB 1 76 THR HB 2.659 . 7.000 7.401 6.959 7.913 0.913 6 8 "[ - .+* 1 ***.* * 2]" 1
913 1 70 ALA MB 1 76 THR MG 2.773 . 7.000 7.390 7.020 7.807 0.807 6 7 "[ .+* 1 ***.- * 2]" 1
914 1 70 ALA MB 1 78 ARG H 2.893 . 7.000 6.824 6.518 7.143 0.143 7 0 "[ . 1 . 2]" 1
915 1 70 ALA MB 1 79 ASN H 2.840 . 7.000 8.638 8.353 8.985 1.985 7 20 [******+*******-*****] 1
916 1 70 ALA MB 1 79 ASN QB 2.904 . 3.958 9.027 8.746 9.331 5.373 7 20 [******+*******-*****] 1
917 1 70 ALA MB 1 79 ASN QD 3.074 . 7.000 10.719 10.441 11.033 4.033 6 20 [*****+********-*****] 1
918 1 71 ILE H 1 74 ASP HA 2.825 . 7.000 7.112 6.896 7.386 0.386 6 0 "[ . 1 . 2]" 1
919 1 71 ILE H 1 75 ALA H 2.616 . 3.472 8.762 8.510 8.977 5.505 6 20 [*****+********-*****] 1
920 1 71 ILE H 1 75 ALA HA 2.926 . 3.997 9.631 9.430 9.890 5.893 11 20 [****-*****+*********] 1
921 1 71 ILE H 1 75 ALA HA 2.350 . 3.040 8.910 8.724 9.131 6.091 11 20 [*********-+*********] 1
922 1 71 ILE H 1 75 ALA MB 2.188 . 2.787 9.326 9.123 9.440 6.653 16 20 [**************-+****] 1
923 1 71 ILE H 1 76 THR HA 2.599 . 3.443 10.508 10.204 10.737 7.294 12 20 [***********+**-*****] 1
924 1 71 ILE H 1 76 THR HB 2.238 . 2.864 9.343 8.865 9.852 6.988 12 20 [**-********+********] 1
925 1 71 ILE H 1 76 THR MG 2.348 . 7.000 8.947 8.492 9.309 2.309 6 20 [**-**+**************] 1
926 1 71 ILE H 1 77 LYS H 2.375 . 3.080 7.134 6.745 7.487 4.407 6 20 [**-**+**************] 1
927 1 71 ILE H 1 77 LYS QB 3.531 . 5.089 4.218 3.937 4.510 . 0 0 "[ . 1 . 2]" 1
928 1 71 ILE H 1 80 ILE MD 3.621 . 5.260 7.165 6.848 7.349 2.089 13 20 [***-********+*******] 1
929 1 71 ILE HA 1 72 LEU QB 3.367 . 4.784 5.518 5.503 5.545 0.761 2 20 [*+*-****************] 1
930 1 71 ILE HA 1 75 ALA MB 2.933 . 4.008 7.486 7.366 7.608 3.600 14 20 [*************+-*****] 1
931 1 71 ILE HA 1 76 THR HB 2.627 . 3.490 6.870 6.586 7.297 3.807 12 20 [*********-*+********] 1
932 1 71 ILE HA 1 79 ASN QD 3.468 . 4.972 9.487 9.276 9.763 4.791 12 20 [***********+**-*****] 1
933 1 71 ILE HB 1 74 ASP HA 3.175 . 7.000 7.942 7.845 8.083 1.083 6 20 [****-+**************] 1
934 1 71 ILE HB 1 75 ALA H 3.488 . 5.009 9.195 9.048 9.271 4.262 3 20 [**+-****************] 1
935 1 71 ILE MG 1 72 LEU H 3.260 . 4.589 3.381 3.267 3.470 . 0 0 "[ . 1 . 2]" 1
936 1 71 ILE MG 1 77 LYS HA 3.008 . 4.139 3.671 3.532 3.788 . 0 0 "[ . 1 . 2]" 1
937 1 71 ILE MG 1 73 THR H 3.033 . 4.183 4.861 4.665 5.054 0.871 14 19 "[******* **-**+******]" 1
938 1 71 ILE MG 1 73 THR HA 3.283 . 4.630 6.544 6.436 6.689 2.059 14 20 [*******-*****+******] 1
939 1 71 ILE MG 1 74 ASP HA 2.692 . 7.000 6.437 6.321 6.571 . 0 0 "[ . 1 . 2]" 1
940 1 71 ILE MG 1 75 ALA H 3.146 . 7.000 7.019 6.846 7.214 0.214 3 0 "[ . 1 . 2]" 1
941 1 71 ILE MG 1 76 THR HA 2.091 . 2.638 6.789 6.697 6.885 4.247 3 20 [**+-****************] 1
942 1 71 ILE MG 1 76 THR HB 2.012 . 2.518 6.678 6.591 6.844 4.326 12 20 [*********-*+********] 1
943 1 71 ILE MG 1 77 LYS HA 2.697 . 3.606 3.676 3.536 3.795 0.189 2 0 "[ . 1 . 2]" 1
944 1 71 ILE MG 1 77 LYS QB 3.048 . 7.000 1.912 1.790 2.112 0.010 3 0 "[ . 1 . 2]" 1
945 1 71 ILE MG 1 78 ARG H 3.216 . 4.508 3.609 3.476 3.830 . 0 0 "[ . 1 . 2]" 1
946 1 71 ILE MG 1 79 ASN H 3.157 . 4.403 4.931 4.753 5.054 0.651 3 14 "[* + * * *1-********2]" 1
947 1 71 ILE MG 1 79 ASN QB 2.880 . 3.668 6.035 5.924 6.145 2.477 3 20 [**+******-**********] 1
948 1 71 ILE MG 1 79 ASN QD 3.351 . 4.755 7.353 7.232 7.490 2.735 19 20 [***-**************+*] 1
949 1 71 ILE MG 1 80 ILE H 3.019 . 4.158 5.676 5.472 5.766 1.608 13 20 [***-********+*******] 1
950 1 71 ILE MG 1 80 ILE HA 3.242 . 7.000 7.286 7.074 7.404 0.404 13 0 "[ . 1 . 2]" 1
951 1 71 ILE MG 1 97 GLU QB 2.325 . 3.000 7.305 6.517 8.259 5.259 3 20 [**+*********-*******] 1
952 1 72 LEU H 1 73 THR HA 3.437 . 7.000 5.223 5.160 5.273 . 0 0 "[ . 1 . 2]" 1
953 1 72 LEU H 1 74 ASP QB 3.136 . 4.365 4.793 4.682 5.030 0.665 6 1 "[ .+ 1 . 2]" 1
954 1 72 LEU H 1 76 THR HA 2.996 . 4.118 10.329 10.175 10.601 6.483 11 20 [********-*+*********] 1
955 1 72 LEU H 1 76 THR HB 2.732 . 3.665 9.941 9.701 10.363 6.698 12 20 [*********-*+********] 1
956 1 72 LEU H 1 76 THR MG 2.506 . 3.291 9.451 9.216 9.624 6.333 12 20 [**-********+********] 1
957 1 72 LEU H 1 77 LYS HA 2.910 . 3.969 7.844 7.561 7.967 3.998 12 20 [**-********+********] 1
958 1 72 LEU H 1 77 LYS QB 2.447 . 3.876 4.956 4.742 5.109 1.233 13 20 [**-*********+*******] 1
959 1 72 LEU H 1 77 LYS QE 2.780 . 3.746 5.903 5.258 6.341 2.595 5 20 [****+*******-*******] 1
960 1 72 LEU H 1 79 ASN H 3.648 . 5.311 8.231 8.070 8.415 3.104 12 20 [********-**+********] 1
961 1 72 LEU H 1 80 ILE MG 3.047 . 7.000 10.208 10.001 10.360 3.360 5 20 [**-*+***************] 1
962 1 72 LEU QD 1 73 THR H 3.200 . 7.000 3.759 3.665 3.815 . 0 0 "[ . 1 . 2]" 1
963 1 72 LEU QD 1 73 THR HA 3.050 . 4.212 5.166 5.121 5.200 0.988 15 20 [*-************+*****] 1
964 1 72 LEU QD 1 73 THR HG1 3.554 . 7.000 6.737 6.627 6.841 . 0 0 "[ . 1 . 2]" 1
965 1 73 THR H 1 80 ILE H 3.530 . 5.087 9.412 9.291 9.575 4.488 13 20 [*******-****+*******] 1
966 1 73 THR H 1 75 ALA HA 3.066 . 4.241 7.150 6.884 7.499 3.258 11 20 [*******-**+*********] 1
967 1 73 THR H 1 75 ALA HA 2.963 . 4.060 6.786 6.553 7.006 2.946 17 20 [*******-********+***] 1
968 1 73 THR H 1 76 THR H 3.170 . 4.426 7.926 7.649 8.317 3.891 11 20 [**********+********-] 1
969 1 73 THR H 1 77 LYS H 2.791 . 3.765 7.224 6.939 7.482 3.717 14 20 [*************+*****-] 1
970 1 73 THR H 1 77 LYS QB 3.099 . 4.299 5.438 5.228 5.703 1.404 4 20 [***+***************-] 1
971 1 73 THR H 1 77 LYS QE 3.479 . 4.992 5.803 5.279 6.323 1.331 9 16 "[***** * +* * ***-***]" 1
972 1 73 THR H 1 77 LYS QE 3.087 . 4.278 5.743 5.244 6.218 1.940 9 20 [*******-+***********] 1
973 1 73 THR H 1 78 ARG HA 2.736 . 3.672 6.743 6.461 7.116 3.444 2 20 [*+***-**************] 1
974 1 73 THR H 1 79 ASN QB 2.938 . 4.017 7.531 7.294 7.732 3.715 14 20 [*******-*****+******] 1
975 1 73 THR H 1 80 ILE H 3.383 . 4.814 10.624 10.322 10.839 6.025 16 20 [*******-*******+****] 1
976 1 73 THR H 1 80 ILE MD 3.248 . 4.566 8.440 8.196 8.688 4.122 14 20 [**-**********+******] 1
977 1 73 THR HA 1 79 ASN QB 3.243 . 7.000 9.085 8.899 9.407 2.407 4 20 [***+*-**************] 1
978 1 73 THR HA 1 79 ASN QD 3.296 . 7.000 11.810 11.636 12.111 5.111 4 20 [***+*-**************] 1
979 1 73 THR HA 1 81 TYR QB 3.230 . 4.534 9.119 8.777 9.471 4.937 2 20 [*+-*****************] 1
980 1 74 ASP H 1 76 THR HA 3.058 . 4.227 7.671 7.529 7.832 3.605 4 20 [***+*-**************] 1
981 1 74 ASP H 1 78 ARG H 2.707 . 3.623 4.428 4.197 4.650 1.027 14 20 [**-**********+******] 1
982 1 74 ASP H 1 78 ARG HA 3.038 . 4.192 5.692 5.246 6.110 1.918 10 20 [*********+******-***] 1
983 1 74 ASP H 1 78 ARG QG 2.663 . 3.550 5.292 4.187 5.799 2.249 14 20 [*************+*****-] 1
984 1 74 ASP H 1 79 ASN HA 2.600 . 3.445 8.671 8.293 8.944 5.499 1 20 [+*********-*********] 1
985 1 74 ASP H 1 79 ASN QB 2.353 . 2.848 7.428 7.217 7.637 4.789 1 20 [+*********-*********] 1
986 1 74 ASP H 1 80 ILE MD 3.011 . 4.144 7.149 6.962 7.310 3.166 14 20 [**-**********+******] 1
987 1 74 ASP H 1 80 ILE MD 3.053 . 4.218 6.893 6.724 7.018 2.800 14 20 [**-**********+******] 1
988 1 74 ASP H 1 80 ILE MG 2.803 . 7.000 9.041 8.809 9.213 2.213 1 20 [+****-**************] 1
989 1 74 ASP H 1 81 TYR H 3.635 . 5.287 8.742 8.431 8.997 3.710 14 20 [**********-**+******] 1
990 1 74 ASP HA 1 79 ASN QB 2.395 . 3.112 7.202 7.125 7.316 4.204 17 20 [*********-******+***] 1
991 1 74 ASP HA 1 80 ILE H 3.043 . 4.201 9.203 9.108 9.320 5.119 17 20 [*******-********+***] 1
992 1 74 ASP HA 1 82 ASP H 2.962 . 4.059 11.162 10.912 11.405 7.346 17 20 [**********-*****+***] 1
993 1 74 ASP HA 1 82 ASP QB 2.784 . 3.753 10.608 10.301 10.908 7.155 13 20 [***********-+*******] 1
994 1 74 ASP QB 1 76 THR HA 2.643 . 3.375 5.736 5.574 5.847 2.472 5 20 [****+-**************] 1
995 1 74 ASP QB 1 78 ARG H 3.268 . 4.603 3.264 2.919 3.483 . 0 0 "[ . 1 . 2]" 1
996 1 74 ASP QB 1 79 ASN HA 2.305 . 2.969 7.696 7.364 7.843 4.874 1 20 [+*********-*********] 1
997 1 74 ASP QB 1 79 ASN QB 1.952 . 2.428 6.076 5.842 6.216 3.788 1 20 [+*********-*********] 1
998 1 74 ASP QB 1 79 ASN QD 2.876 . 3.910 8.185 7.965 8.311 4.401 12 20 [***********+****-***] 1
999 1 74 ASP QB 1 80 ILE H 2.725 . 3.361 6.988 6.786 7.152 3.791 10 20 [*********+-*********] 1
1000 1 74 ASP QB 1 80 ILE HA 2.999 . 7.000 9.526 9.303 9.683 2.683 10 20 [*********+-*********] 1
1001 1 74 ASP QB 1 80 ILE MG 2.623 . 3.483 6.994 6.824 7.161 3.678 5 20 [****+-**************] 1
1002 1 74 ASP QB 1 82 ASP H 3.360 . 7.000 8.787 8.394 9.008 2.008 6 20 [*****+****-*********] 1
1003 1 75 ALA H 1 82 ASP H 3.614 . 5.246 3.882 3.681 3.972 . 0 0 "[ . 1 . 2]" 1
1004 1 75 ALA H 1 77 LYS HA 3.034 . 4.184 7.116 6.862 7.251 3.067 10 20 [*********+******-***] 1
1005 1 75 ALA H 1 80 ILE HA 2.664 . 3.551 10.907 10.690 11.043 7.492 2 20 [*+**************-***] 1
1006 1 75 ALA H 1 80 ILE HB 2.418 . 7.000 11.642 11.389 11.835 4.835 2 20 [*+**************-***] 1
1007 1 75 ALA H 1 80 ILE QG 2.650 . 3.528 9.730 9.451 9.862 6.334 2 20 [*+**************-***] 1
1008 1 75 ALA H 1 80 ILE MG 2.347 . 3.036 8.078 7.855 8.317 5.281 5 20 [****+************-**] 1
1009 1 75 ALA HA 1 80 ILE QG 2.931 . 4.005 8.352 7.872 8.618 4.613 12 20 [********-**+********] 1
1010 1 75 ALA HA 1 81 TYR QD 2.913 . 7.000 8.354 7.867 8.683 1.683 13 20 [****-*******+*******] 1
1011 1 75 ALA HA 1 83 LYS QB 3.160 . 4.408 9.880 9.396 10.577 6.169 16 20 [*******-*******+****] 1
1012 1 76 THR H 1 77 LYS HA 3.488 . 5.009 5.133 5.041 5.266 0.257 11 0 "[ . 1 . 2]" 1
1013 1 76 THR H 1 78 ARG HA 3.381 . 4.810 6.678 6.537 6.889 2.079 11 20 [***-******+*********] 1
1014 1 76 THR H 1 78 ARG HA 3.000 . 4.125 6.479 6.361 6.652 2.527 11 20 [**********+*****-***] 1
1015 1 76 THR H 1 79 ASN QD 2.908 . 7.000 6.503 6.435 6.612 . 0 0 "[ . 1 . 2]" 1
1016 1 76 THR H 1 80 ILE H 2.884 . 3.924 6.013 5.930 6.104 2.180 5 20 [****+*-*************] 1
1017 1 76 THR H 1 80 ILE HB 2.810 . 7.000 9.264 9.096 9.436 2.436 5 20 [****+********-******] 1
1018 1 76 THR H 1 80 ILE MD 2.481 . 3.250 5.406 5.340 5.516 2.266 11 20 [******-***+*********] 1
1019 1 76 THR H 1 81 TYR HA 2.910 . 3.969 10.176 10.068 10.303 6.334 11 20 [**********+*-*******] 1
1020 1 76 THR H 1 81 TYR QB 2.581 . 3.414 7.557 7.429 7.691 4.277 3 20 [-*+*****************] 1
1021 1 76 THR HA 1 80 ILE MD 2.854 . 3.872 4.168 4.086 4.226 0.354 4 0 "[ . 1 . 2]" 1
1022 1 76 THR HA 1 81 TYR QB 2.944 . 4.027 6.717 6.595 6.851 2.824 17 20 [******-*********+***] 1
1023 1 77 LYS H 1 78 ARG HA 3.288 . 4.640 5.253 5.186 5.299 0.659 19 20 [****************-*+*] 1
1024 1 77 LYS H 1 79 ASN QD 2.938 . 7.000 6.429 6.288 6.624 . 0 0 "[ . 1 . 2]" 1
1025 1 77 LYS H 1 80 ILE MD 2.979 . 4.088 3.875 3.829 3.913 . 0 0 "[ . 1 . 2]" 1
1026 1 77 LYS H 1 81 TYR H 2.844 . 3.855 6.026 5.972 6.105 2.250 16 20 [-**************+****] 1
1027 1 77 LYS H 1 81 TYR HA 3.147 . 4.385 8.339 8.218 8.459 4.074 16 20 [********-******+****] 1
1028 1 77 LYS H 1 81 TYR QB 2.643 . 3.516 5.993 5.896 6.155 2.639 3 20 [-*+*****************] 1
1029 1 77 LYS H 1 82 ASP HA 2.610 . 3.461 10.827 10.677 10.974 7.513 17 20 [*********-******+***] 1
1030 1 77 LYS H 1 82 ASP QB 2.468 . 3.229 8.518 8.272 8.735 5.506 14 20 [***********-*+******] 1
1031 1 77 LYS H 1 83 LYS H 2.737 . 3.673 9.275 9.144 9.527 5.854 19 20 [***********-******+*] 1
1032 1 77 LYS H 1 83 LYS QB 3.370 . 4.790 9.013 8.625 9.542 4.752 16 20 [***-***********+****] 1
1033 1 77 LYS H 1 84 TYR H 3.418 . 4.878 10.334 10.142 10.528 5.650 19 20 [***-**************+*] 1
1034 1 77 LYS HA 1 83 LYS H 2.870 . 3.900 7.765 7.628 7.888 3.988 19 20 [**************-***+*] 1
1035 1 78 ARG H 1 81 TYR QD 3.316 . 4.691 5.816 5.542 6.143 1.452 17 20 [*********-******+***] 1
1036 1 78 ARG H 1 83 LYS HA 2.613 . 3.466 10.394 10.174 10.721 7.255 17 20 [***********-****+***] 1
1037 1 78 ARG H 1 83 LYS QB 2.591 . 3.430 8.108 7.684 8.658 5.228 16 20 [***-***********+****] 1
1038 1 78 ARG H 1 83 LYS QE 2.825 . 3.823 7.460 7.033 7.931 4.108 19 20 [*********-********+*] 1
1039 1 78 ARG H 1 83 LYS QG 2.608 . 7.000 8.589 7.185 9.245 2.245 1 14 "[+***. ** -***** * *]" 1
1040 1 78 ARG H 1 84 TYR H 2.731 . 3.664 9.276 9.056 9.548 5.884 19 20 [***-**************+*] 1
1041 1 78 ARG H 1 85 GLY H 3.299 . 4.659 9.381 9.074 9.573 4.914 19 20 [***-**************+*] 1
1042 1 78 ARG HA 1 81 TYR QD 3.162 . 7.000 3.317 2.939 3.721 . 0 0 "[ . 1 . 2]" 1
1043 1 78 ARG HA 1 83 LYS QB 2.524 . 3.320 7.501 7.074 8.020 4.700 19 20 [***********-******+*] 1
1044 1 78 ARG HA 1 83 LYS QG 2.366 . 3.066 8.201 6.765 8.952 5.886 4 20 [***+****-***********] 1
1045 1 78 ARG QB 1 83 LYS H 2.954 . 4.044 7.154 6.634 7.651 3.607 17 20 [*********-******+***] 1
1046 1 78 ARG QB 1 83 LYS HA 2.712 . 3.631 9.391 8.850 9.974 6.343 17 20 [*********-******+***] 1
1047 1 78 ARG QB 1 83 LYS QB 2.429 . 3.166 7.849 7.386 8.446 5.280 19 20 [***********-******+*] 1
1048 1 78 ARG QB 1 83 LYS QD 2.807 . 3.792 7.361 6.758 8.453 4.661 19 20 [**************-***+*] 1
1049 1 78 ARG QB 1 83 LYS QE 3.008 . 4.139 6.542 5.986 7.074 2.935 4 20 [***+*****-**********] 1
1050 1 78 ARG QB 1 83 LYS QG 2.853 . 3.871 8.102 6.835 8.848 4.977 17 20 [********-*******+***] 1
1051 1 78 ARG QD 1 83 LYS H 3.085 . 4.274 7.993 6.426 8.713 4.439 19 20 [**-***************+*] 1
1052 1 78 ARG QD 1 83 LYS HA 2.868 . 3.840 9.926 8.617 10.585 6.745 19 20 [**-***************+*] 1
1053 1 78 ARG QD 1 83 LYS QG 2.404 . 3.115 8.864 7.819 9.853 6.738 4 20 [***+*************-**] 1
1054 1 78 ARG QG 1 83 LYS H 2.773 . 7.000 6.220 5.762 6.742 . 0 0 "[ . 1 . 2]" 1
1055 1 78 ARG QG 1 83 LYS QB 2.507 . 3.292 7.180 6.623 7.756 4.464 19 20 [***********-******+*] 1
1056 1 78 ARG QG 1 83 LYS QD 2.370 . 2.894 6.530 5.865 7.463 4.569 19 20 [*********-********+*] 1
1057 1 78 ARG QG 1 83 LYS QG 2.100 . 2.651 7.305 6.164 8.135 5.484 4 20 [***+****-***********] 1
1058 1 78 ARG QG 1 84 TYR H 3.284 . 4.773 8.292 7.862 8.815 4.042 17 20 [***********-****+***] 1
1059 1 79 ASN H 1 80 ILE HA 3.379 . 4.806 5.514 5.407 5.577 0.771 9 20 [********+*******-***] 1
1060 1 79 ASN H 1 80 ILE MD 3.153 . 4.395 3.442 3.282 3.527 . 0 0 "[ . 1 . 2]" 1
1061 1 79 ASN H 1 80 ILE MG 3.279 . 7.000 4.441 4.298 4.562 . 0 0 "[ . 1 . 2]" 1
1062 1 79 ASN H 1 81 TYR QR 2.958 . 7.000 5.352 5.109 5.572 . 0 0 "[ . 1 . 2]" 1
1063 1 79 ASN H 1 83 LYS HA 2.970 . 4.073 8.590 8.355 8.908 4.835 17 20 [***********-****+***] 1
1064 1 79 ASN H 1 83 LYS QB 2.993 . 4.094 6.487 6.063 7.165 3.071 19 20 [***********-******+*] 1
1065 1 79 ASN H 1 83 LYS QE 3.082 . 7.000 5.655 5.291 6.142 . 0 0 "[ . 1 . 2]" 1
1066 1 79 ASN H 1 84 TYR HA 3.186 . 4.455 10.808 10.643 11.048 6.593 19 20 [*********-********+*] 1
1067 1 79 ASN H 1 85 GLY QA 3.323 . 4.703 7.682 7.387 8.059 3.356 8 20 [*******+********-***] 1
1068 1 80 ILE H 1 80 ILE MD 3.430 . 4.901 1.940 1.877 1.997 0.082 5 0 "[ . 1 . 2]" 1
1069 1 80 ILE H 1 80 ILE MG 3.219 . 4.514 1.986 1.919 2.041 0.005 13 0 "[ . 1 . 2]" 1
1070 1 80 ILE H 1 81 TYR QB 3.315 . 7.000 4.014 3.956 4.068 . 0 0 "[ . 1 . 2]" 1
1071 1 80 ILE H 1 81 TYR QR 3.409 . 7.000 5.731 5.546 5.854 . 0 0 "[ . 1 . 2]" 1
1072 1 80 ILE H 1 83 LYS QB 3.305 . 4.670 4.432 4.130 4.922 0.252 19 0 "[ . 1 . 2]" 1
1073 1 80 ILE H 1 84 TYR H 2.579 . 3.411 5.548 5.272 5.782 2.371 19 20 [*******-**********+*] 1
1074 1 80 ILE H 1 84 TYR HA 3.437 . 4.914 8.461 8.137 8.649 3.735 19 20 [*******-**********+*] 1
1075 1 80 ILE H 1 85 GLY QA 2.443 . 3.189 5.824 5.523 6.292 3.103 8 20 [*******+*******-****] 1
1076 1 80 ILE H 1 86 SER H 3.132 . 4.358 8.863 8.093 9.237 4.879 8 20 [**-****+************] 1
1077 1 80 ILE MD 1 81 TYR H 3.394 . 7.000 1.746 1.691 1.836 0.109 13 0 "[ . 1 . 2]" 1
1078 1 81 TYR H 1 85 GLY QA 2.653 . 3.533 4.093 3.796 4.488 0.955 8 14 "[** *.-*+*1***** **2]" 1
1079 1 82 ASP H 1 85 GLY QA 3.663 . 5.340 4.817 4.633 5.058 . 0 0 "[ . 1 . 2]" 1
1080 1 82 ASP H 1 87 LEU QB 3.314 . 4.612 10.322 9.236 10.782 6.170 3 20 [**+*************-***] 1
1081 1 82 ASP H 1 87 LEU QD 2.928 . 4.353 9.986 9.099 10.508 6.155 3 20 [**+*************-***] 1
1082 1 82 ASP HA 1 87 LEU H 3.405 . 4.854 10.462 9.711 10.960 6.106 3 20 [**+****-************] 1
1083 1 82 ASP QB 1 87 LEU HA 3.283 . 4.630 12.484 12.108 12.786 8.156 3 20 [**+****-************] 1
1084 1 83 LYS H 1 85 GLY QA 3.665 . 5.344 4.787 4.521 4.986 . 0 0 "[ . 1 . 2]" 1
1085 1 83 LYS H 1 87 LEU H 3.205 . 4.489 8.968 8.598 9.314 4.825 20 20 [***-***************+] 1
1086 1 83 LYS H 1 87 LEU HA 3.381 . 4.810 11.101 10.703 11.442 6.632 3 20 [**+-****************] 1
1087 1 83 LYS H 1 87 LEU QB 3.169 . 4.424 9.302 8.044 9.813 5.389 3 20 [**+*************-***] 1
1088 1 83 LYS H 1 87 LEU QD 2.978 . 3.729 9.191 8.044 9.779 6.050 3 20 [**+*************-***] 1
1089 1 83 LYS H 1 88 GLY QA 2.864 . 3.871 6.912 6.151 7.731 3.860 3 20 [**+-****************] 1
1090 1 83 LYS H 1 104 PHE HZ 3.439 . 4.917 9.104 7.695 9.994 5.077 3 20 [**+*************-***] 1
1091 1 84 TYR H 1 87 LEU QB 2.738 . 7.000 7.032 5.806 7.587 0.587 3 1 "[ + . 1 . 2]" 1
1092 1 84 TYR H 1 87 LEU QD 3.172 . 7.000 7.424 6.289 8.050 1.050 3 12 "[* + ** ******* -2]" 1
1093 1 84 TYR H 1 87 LEU QD 2.420 . 7.000 5.731 5.362 6.033 . 0 0 "[ . 1 . 2]" 1
1094 1 84 TYR H 1 88 GLY QA 3.294 . 4.651 5.335 4.382 6.269 1.618 3 11 "[* + ** *-***.* *2]" 1
1095 1 84 TYR H 1 89 LEU QD 2.658 . 7.000 5.980 5.668 6.290 . 0 0 "[ . 1 . 2]" 1
1096 1 84 TYR H 1 104 PHE HZ 3.372 . 4.793 7.053 5.673 8.016 3.223 3 20 [**+*************-***] 1
1097 1 84 TYR HA 1 89 LEU H 3.128 . 4.351 7.365 6.409 8.020 3.669 3 20 [**+****-************] 1
1098 1 84 TYR HA 1 90 TYR H 3.463 . 4.962 9.504 8.547 10.267 5.305 3 20 [**+****-************] 1
1099 1 85 GLY H 1 87 LEU HA 3.489 . 5.011 6.744 6.364 6.934 1.923 3 20 [**+*************-***] 1
1100 1 85 GLY H 1 87 LEU HA 2.725 . 3.653 6.570 6.273 6.778 3.125 3 20 [**+*************-***] 1
1101 1 85 GLY H 1 87 LEU QB 3.198 . 7.000 5.375 4.407 5.730 . 0 0 "[ . 1 . 2]" 1
1102 1 85 GLY H 1 87 LEU QD 2.740 . 7.000 4.745 4.410 5.075 . 0 0 "[ . 1 . 2]" 1
1103 1 85 GLY H 1 89 LEU H 2.960 . 4.055 4.068 3.481 4.585 0.530 3 1 "[ + . 1 . 2]" 1
1104 1 85 GLY H 1 90 TYR HA 3.009 . 4.141 9.087 8.475 9.559 5.418 3 20 [**+****-************] 1
1105 1 85 GLY H 1 90 TYR QB 2.587 . 3.423 7.484 6.955 7.968 4.545 3 20 [**+****-************] 1
1106 1 85 GLY H 1 90 TYR QD 2.564 . 3.386 8.081 7.551 8.684 5.298 3 20 [**+-****************] 1
1107 1 85 GLY H 1 91 VAL H 2.969 . 4.071 7.866 7.298 8.533 4.462 3 20 [**+****-************] 1
1108 1 85 GLY H 1 93 GLU QG 2.990 . 7.000 9.404 8.569 10.121 3.121 20 20 [********-**********+] 1
1109 1 86 SER H 1 89 LEU H 3.604 . 5.228 4.621 4.263 5.065 . 0 0 "[ . 1 . 2]" 1
1110 1 86 SER H 1 90 TYR HA 3.215 . 4.507 8.736 8.367 9.137 4.630 13 20 [************+**-****] 1
1111 1 86 SER H 1 90 TYR QD 2.968 . 4.069 7.162 6.573 7.495 3.426 13 20 [***-********+*******] 1
1112 1 86 SER H 1 91 VAL HA 2.860 . 3.883 10.590 10.273 10.977 7.094 13 20 [*******-****+*******] 1
1113 1 86 SER H 1 91 VAL HB 2.762 . 3.716 9.401 9.107 9.772 6.056 13 20 [*******-****+*******] 1
1114 1 86 SER H 1 91 VAL QG 2.517 . 3.309 6.686 6.463 6.966 3.657 13 20 [***-********+*******] 1
1115 1 86 SER H 1 92 ALA MB 3.378 . 4.805 8.604 8.300 8.899 4.094 13 20 [*******-****+*******] 1
1116 1 86 SER HA 1 90 TYR QD 2.941 . 4.022 6.008 5.579 6.461 2.439 3 20 [**+-****************] 1
1117 1 86 SER HA 1 91 VAL HB 3.289 . 4.641 8.921 8.684 9.132 4.491 3 20 [**+***************-*] 1
1118 1 87 LEU H 1 89 LEU HA 3.203 . 4.486 7.075 6.826 7.375 2.889 7 20 [**-***+*************] 1
1119 1 87 LEU H 1 90 TYR QD 3.322 . 4.701 4.607 4.311 4.766 0.065 16 0 "[ . 1 . 2]" 1
1120 1 87 LEU H 1 91 VAL HA 3.174 . 4.433 8.547 8.429 8.633 4.200 7 20 [******+-************] 1
1121 1 87 LEU H 1 91 VAL HB 2.623 . 7.000 6.819 6.678 6.929 . 0 0 "[ . 1 . 2]" 1
1122 1 87 LEU H 1 91 VAL QG 2.549 . 3.361 5.020 4.917 5.183 1.822 17 20 [**************-*+***] 1
1123 1 87 LEU H 1 92 ALA HA 2.686 . 3.588 10.332 10.039 10.582 6.994 7 20 [**-***+*************] 1
1124 1 87 LEU H 1 92 ALA MB 2.167 . 2.754 7.910 7.698 8.132 5.378 17 20 [*************-**+***] 1
1125 1 87 LEU H 1 93 GLU QG 3.428 . 4.897 9.479 8.666 10.245 5.348 20 20 [******************-+] 1
1126 1 87 LEU H 1 100 VAL QG 2.452 . 3.204 7.235 7.043 7.486 4.282 9 20 [*****-**+***********] 1
1127 1 87 LEU HA 1 95 PHE QD 3.465 . 4.966 5.483 5.242 5.650 0.684 7 11 "[* * . + *1****.* - *]" 1
1128 1 87 LEU HA 1 96 GLY H 3.141 . 4.374 10.545 10.073 11.309 6.935 15 20 [********-*****+*****] 1
1129 1 87 LEU HA 1 97 GLU QB 3.347 . 4.747 10.991 10.317 11.575 6.828 15 20 [**************+**-**] 1
1130 1 87 LEU HA 1 100 VAL HB 3.222 . 4.519 7.725 7.455 7.990 3.471 9 20 [*******-+***********] 1
1131 1 87 LEU HA 1 100 VAL QG 2.897 . 3.946 6.569 6.373 6.701 2.755 7 20 [******+-************] 1
1132 1 88 GLY H 1 90 TYR HA 3.336 . 4.727 7.325 7.122 7.444 2.717 12 20 [***********+****-***] 1
1133 1 88 GLY H 1 92 ALA H 2.704 . 3.618 6.047 5.893 6.229 2.611 11 20 [*****-****+*********] 1
1134 1 88 GLY H 1 92 ALA HA 3.017 . 4.155 8.249 7.912 8.474 4.319 4 20 [**-+****************] 1
1135 1 88 GLY H 1 92 ALA MB 2.416 . 3.146 6.103 5.959 6.296 3.150 4 20 [***+**************-*] 1
1136 1 88 GLY H 1 93 GLU HA 2.593 . 3.433 10.961 10.666 11.267 7.834 11 20 [*****-****+*********] 1
1137 1 88 GLY H 1 93 GLU QB 2.418 . 3.149 9.343 8.955 9.907 6.758 3 20 [**+**-**************] 1
1138 1 88 GLY H 1 93 GLU QG 2.298 . 2.958 8.398 7.876 9.137 6.179 20 20 [******************-+] 1
1139 1 89 LEU H 1 95 PHE H 2.506 . 3.291 5.708 5.491 6.077 2.786 15 20 [-*************+*****] 1
1140 1 89 LEU H 1 91 VAL HA 3.251 . 4.572 6.858 6.759 6.956 2.384 2 20 [*+*************-****] 1
1141 1 89 LEU H 1 93 GLU HA 2.953 . 4.043 8.832 8.416 9.419 5.376 10 20 [*****-***+**********] 1
1142 1 89 LEU H 1 93 GLU QB 2.654 . 3.534 7.372 6.953 7.985 4.451 3 20 [**+**-**************] 1
1143 1 89 LEU H 1 93 GLU QG 3.597 . 5.214 6.112 5.703 6.814 1.600 20 19 "[************* ***-*+]" 1
1144 1 89 LEU H 1 94 GLN HA 2.655 . 3.536 11.278 10.903 11.925 8.389 15 20 [**************+***-*] 1
1145 1 89 LEU H 1 94 GLN QB 2.525 . 3.322 9.349 8.761 10.614 7.292 5 20 [****+*************-*] 1
1146 1 89 LEU H 1 94 GLN QG 2.710 . 3.628 8.610 8.149 9.093 5.465 18 20 [****************-+**] 1
1147 1 89 LEU H 1 95 PHE H 2.692 . 3.598 9.269 9.012 9.682 6.084 5 20 [****+*************-*] 1
1148 1 89 LEU H 1 95 PHE QD 3.231 . 4.536 8.861 8.558 9.198 4.662 2 20 [*+******-***********] 1
1149 1 89 LEU HA 1 93 GLU QB 3.196 . 4.473 5.855 5.009 6.467 1.994 11 20 [**********+*******-*] 1
1150 1 89 LEU HA 1 94 GLN QB 2.537 . 3.341 8.653 8.000 9.793 6.452 5 20 [****+*************-*] 1
1151 1 89 LEU HA 1 94 GLN QG 2.830 . 3.741 7.864 7.464 8.303 4.562 5 20 [****+*************-*] 1
1152 1 90 TYR H 1 92 ALA HA 2.956 . 4.048 6.682 6.471 6.842 2.794 16 20 [***************+***-] 1
1153 1 90 TYR H 1 94 GLN HA 3.110 . 4.319 9.379 8.979 10.087 5.768 15 20 [-*************+*****] 1
1154 1 90 TYR H 1 94 GLN QG 3.557 . 5.138 6.573 6.090 7.086 1.948 18 20 [-****************+**] 1
1155 1 90 TYR H 1 95 PHE HA 3.070 . 4.248 10.600 10.402 10.786 6.538 11 20 [********-*+*********] 1
1156 1 90 TYR H 1 95 PHE QB 2.958 . 4.052 7.977 7.777 8.126 4.074 1 20 [+*************-*****] 1
1157 1 90 TYR H 1 95 PHE QD 3.018 . 4.156 7.391 7.011 7.773 3.617 18 20 [**-**************+**] 1
1158 1 90 TYR QB 1 95 PHE HA 3.049 . 4.129 9.533 9.059 9.851 5.722 2 20 [*+******-***********] 1
1159 1 90 TYR QB 1 95 PHE QB 2.778 . 3.743 7.536 7.262 7.771 4.028 10 20 [********-+**********] 1
1160 1 90 TYR QB 1 95 PHE QD 2.853 . 3.852 6.486 5.983 6.979 3.127 2 20 [*+******-***********] 1
1161 1 91 VAL H 1 92 ALA MB 2.767 . 3.724 4.242 4.179 4.295 0.571 6 13 "[** *+* *1 ****-* *]" 1
1162 1 91 VAL H 1 93 GLU QB 3.424 . 4.889 5.229 4.826 5.987 1.098 3 4 "[ + . * . - *2]" 1
1163 1 91 VAL H 1 95 PHE H 2.488 . 3.262 5.761 5.538 6.144 2.882 15 20 [-*************+*****] 1
1164 1 91 VAL H 1 95 PHE HA 2.967 . 4.067 8.346 8.115 8.574 4.507 5 20 [****+***-***********] 1
1165 1 91 VAL H 1 95 PHE QB 3.269 . 4.335 5.727 5.578 5.920 1.585 10 20 [********-+**********] 1
1166 1 91 VAL H 1 95 PHE QD 3.233 . 4.540 5.079 4.787 5.425 0.885 2 14 "[*+ ** ** ** *-* ** *]" 1
1167 1 91 VAL H 1 96 GLY QA 2.626 . 3.087 7.917 7.602 8.703 5.616 15 20 [********-*****+*****] 1
1168 1 91 VAL H 1 97 GLU H 3.170 . 4.426 8.551 7.048 8.987 4.561 17 20 [*-**************+***] 1
1169 1 92 ALA H 1 97 GLU QB 2.701 . 3.613 3.217 2.770 3.569 . 0 0 "[ . 1 . 2]" 1
1170 1 92 ALA H 1 96 GLY QA 3.098 . 4.298 5.964 5.677 6.739 2.441 15 20 [********-*****+*****] 1
1171 1 92 ALA H 1 97 GLU HA 2.808 . 3.794 4.762 4.548 5.003 1.209 10 20 [*********+****-*****] 1
1172 1 92 ALA H 1 97 GLU QB 2.801 . 3.782 5.918 5.420 6.152 2.370 15 20 [**************+**-**] 1
1173 1 92 ALA H 1 97 GLU QG 2.454 . 3.206 5.290 5.009 5.666 2.460 10 20 [********-+**********] 1
1174 1 92 ALA H 1 98 GLU H 3.583 . 5.188 8.028 7.878 8.122 2.934 3 20 [**+***********-*****] 1
1175 1 92 ALA HA 1 98 GLU H 3.457 . 4.951 5.385 5.156 5.565 0.614 13 5 "[ *- * 1 + . *]" 1
1176 1 92 ALA MB 1 97 GLU HA 2.271 . 2.916 2.230 1.907 2.831 . 0 0 "[ . 1 . 2]" 1
1177 1 93 GLU H 1 98 GLU QB 2.831 . 3.833 10.072 9.233 10.268 6.435 20 20 [********-**********+] 1
1178 1 93 GLU HA 1 97 GLU HA 3.442 . 4.923 6.386 5.682 6.813 1.890 13 20 [**-*********+*******] 1
1179 1 93 GLU HA 1 98 GLU H 2.675 . 3.570 8.140 7.159 8.637 5.067 6 20 [**-**+**************] 1
1180 1 93 GLU HA 1 98 GLU QB 2.121 . 2.683 9.807 8.772 10.345 7.662 6 20 [*****+**-***********] 1
1181 1 93 GLU HA 1 98 GLU QG 2.611 . 7.000 8.744 7.503 10.416 3.416 9 20 [**-*****+***********] 1
1182 1 93 GLU HA 1 99 ASN HA 3.368 . 4.786 11.040 10.253 11.460 6.674 2 20 [*+-*****************] 1
1183 1 93 GLU HA 1 100 VAL H 3.252 . 7.000 8.469 7.818 8.735 1.735 2 20 [*+-*****************] 1
1184 1 93 GLU HA 1 101 ASN H 3.685 . 5.382 11.255 10.710 11.470 6.088 6 20 [**-**+**************] 1
1185 1 93 GLU HA 1 101 ASN QB 3.317 . 4.692 11.950 11.462 12.185 7.493 20 20 [**-****************+] 1
1186 1 93 GLU QB 1 98 GLU H 2.921 . 3.988 9.290 8.586 9.645 5.657 13 20 [**-*********+*******] 1
1187 1 93 GLU QB 1 98 GLU HA 2.143 . 2.717 11.274 10.763 11.600 8.883 13 20 [**-*********+*******] 1
1188 1 93 GLU QG 1 100 VAL H 3.313 . 4.685 8.759 8.066 9.264 4.579 15 20 [**-***********+*****] 1
1189 1 94 GLN H 1 96 GLY QA 3.407 . 4.858 5.361 5.205 5.611 0.753 15 9 "[*- *** 1* * + *]" 1
1190 1 94 GLN H 1 98 GLU H 3.025 . 4.169 9.278 8.757 9.662 5.493 5 20 [*-**+***************] 1
1191 1 94 GLN H 1 98 GLU HA 2.717 . 3.640 11.329 10.782 11.662 8.022 5 20 [*-**+***************] 1
1192 1 94 GLN H 1 98 GLU QB 2.810 . 3.797 10.784 9.923 11.154 7.357 5 20 [****+***-***********] 1
1193 1 94 GLN H 1 98 GLU QG 3.159 . 4.407 9.492 8.723 11.061 6.654 9 20 [********+-**********] 1
1194 1 94 GLN H 1 99 ASN HA 2.675 . 3.569 10.536 10.240 10.758 7.189 14 20 [*********-***+******] 1
1195 1 94 GLN H 1 99 ASN QB 2.793 . 3.707 7.205 6.967 7.391 3.684 14 20 [*********-***+******] 1
1196 1 94 GLN H 1 100 VAL H 2.743 . 3.684 7.940 7.618 8.201 4.517 5 20 [****+****-**********] 1
1197 1 94 GLN H 1 100 VAL QG 3.444 . 4.927 5.176 4.770 5.472 0.545 5 1 "[ + 1 . 2]" 1
1198 1 94 GLN HA 1 98 GLU QB 3.238 . 4.548 11.472 10.414 11.903 7.355 20 20 [********-**********+] 1
1199 1 94 GLN HA 1 98 GLU QG 3.294 . 4.651 9.873 9.270 11.555 6.904 9 20 [*-******+***********] 1
1200 1 94 GLN HA 1 99 ASN QB 2.602 . 3.219 7.665 7.415 7.865 4.646 8 20 [*******+**-*********] 1
1201 1 94 GLN HA 1 99 ASN QD 3.163 . 4.413 7.799 7.117 9.324 4.911 1 20 [+***-***************] 1
1202 1 94 GLN HA 1 100 VAL HA 3.390 . 7.000 9.524 8.945 9.809 2.809 12 20 [-**********+********] 1
1203 1 94 GLN HA 1 100 VAL QG 3.112 . 7.000 6.813 6.400 6.982 . 0 0 "[ . 1 . 2]" 1
1204 1 94 GLN HA 1 102 THR HB 3.127 . 4.349 12.972 12.180 13.322 8.973 12 20 [-**********+********] 1
1205 1 94 GLN QB 1 95 PHE HA 3.463 . 4.962 3.999 3.791 4.383 . 0 0 "[ . 1 . 2]" 1
1206 1 94 GLN QB 1 95 PHE QB 3.418 . 4.878 4.218 3.806 5.015 0.137 15 0 "[ . 1 . 2]" 1
1207 1 94 GLN QB 1 99 ASN QD 2.858 . 3.763 7.423 6.753 8.698 4.935 4 20 [*-*+****************] 1
1208 1 95 PHE H 1 99 ASN HA 2.827 . 3.826 8.363 8.125 8.542 4.716 12 20 [-**********+********] 1
1209 1 95 PHE H 1 99 ASN QB 2.517 . 3.309 5.204 5.041 5.402 2.093 8 20 [-******+************] 1
1210 1 95 PHE H 1 100 VAL HA 2.878 . 3.913 6.042 5.433 6.335 2.422 9 20 [-*******+***********] 1
1211 1 95 PHE H 1 100 VAL QG 2.087 . 2.631 4.105 3.586 4.346 1.715 4 20 [*-*+****************] 1
1212 1 95 PHE H 1 101 ASN H 2.696 . 3.604 8.830 8.389 9.089 5.485 12 20 [*-*********+********] 1
1213 1 95 PHE HA 1 95 PHE QD 3.400 . 4.845 2.987 2.676 3.107 . 0 0 "[ . 1 . 2]" 1
1214 1 95 PHE HA 1 100 VAL QG 2.181 . 2.775 4.820 4.394 5.064 2.289 17 20 [*-**************+***] 1
1215 1 96 GLY H 1 99 ASN HA 3.333 . 4.722 7.021 6.802 7.290 2.568 2 20 [*+********-*********] 1
1216 1 96 GLY H 1 100 VAL HA 2.906 . 3.961 5.675 5.198 6.245 2.284 2 20 [-+******************] 1
1217 1 96 GLY H 1 100 VAL HB 2.638 . 7.000 6.297 6.045 6.634 . 0 0 "[ . 1 . 2]" 1
1218 1 96 GLY H 1 100 VAL QG 2.329 . 3.007 3.432 3.279 3.679 0.672 4 5 "[ *+.- 1 * * 2]" 1
1219 1 96 GLY H 1 100 VAL QG 2.788 . 3.760 3.421 3.266 3.663 . 0 0 "[ . 1 . 2]" 1
1220 1 96 GLY H 1 101 ASN HA 2.647 . 3.523 9.985 9.705 10.248 6.725 15 20 [-*************+*****] 1
1221 1 96 GLY H 1 101 ASN QB 2.262 . 2.902 8.866 8.620 9.045 6.143 4 20 [***+******-*********] 1
1222 1 96 GLY H 1 102 THR H 2.599 . 3.443 8.558 8.146 9.055 5.612 2 20 [*+********-*********] 1
1223 1 96 GLY H 1 102 THR HA 3.385 . 4.818 8.984 8.515 9.559 4.741 2 20 [*+********-*********] 1
1224 1 96 GLY H 1 102 THR HB 3.374 . 7.000 9.476 8.951 10.120 3.120 2 20 [*+********-*********] 1
1225 1 96 GLY H 1 102 THR MG 2.944 . 4.027 6.650 6.111 7.399 3.372 2 20 [-+******************] 1
1226 1 97 GLU H 1 101 ASN HA 2.934 . 4.010 9.661 8.648 9.942 5.932 20 20 [*-*****************+] 1
1227 1 97 GLU H 1 101 ASN QB 2.670 . 3.561 8.005 7.489 8.284 4.723 20 20 [*-*****************+] 1
1228 1 97 GLU H 1 102 THR HA 2.272 . 2.917 9.663 8.895 9.853 6.936 16 20 [**************-+****] 1
1229 1 97 GLU H 1 102 THR HB 2.474 . 3.239 10.276 9.430 10.497 7.258 16 20 [**************-+****] 1
1230 1 97 GLU H 1 102 THR MG 2.263 . 2.903 7.847 6.903 8.052 5.149 16 20 [**************-+****] 1
1231 1 97 GLU HA 1 104 PHE QB 3.104 . 7.000 5.004 4.846 5.322 . 0 0 "[ . 1 . 2]" 1
1232 1 98 GLU H 1 102 THR HA 2.530 . 3.330 8.660 8.564 8.769 5.439 8 20 [*******+**-*********] 1
1233 1 98 GLU H 1 102 THR HB 2.829 . 3.830 9.199 9.094 9.357 5.527 8 20 [*******+**-*********] 1
1234 1 98 GLU H 1 103 TYR QB 3.476 . 4.986 9.704 9.306 10.080 5.094 17 20 [****************+**-] 1
1235 1 98 GLU H 1 104 PHE QD 3.484 . 5.002 8.700 8.577 8.869 3.867 5 20 [-***+***************] 1
1236 1 98 GLU QB 1 103 TYR QB 2.871 . 3.901 9.655 9.297 10.050 6.149 17 20 [********-*******+***] 1
1237 1 99 ASN HA 1 105 VAL QG 2.656 . 7.000 8.731 8.432 8.972 1.972 9 20 [*-******+***********] 1
1238 1 99 ASN QB 1 104 PHE HA 2.792 . 3.766 9.509 9.287 9.797 6.031 2 20 [*+******-***********] 1
1239 1 99 ASN QB 1 105 VAL H 2.838 . 3.845 10.396 10.267 10.537 6.692 2 20 [*+******-***********] 1
1240 1 100 VAL H 1 102 THR HA 2.369 . 7.000 7.192 7.120 7.226 0.226 3 0 "[ . 1 . 2]" 1
1241 1 100 VAL H 1 104 PHE HA 2.325 . 3.001 8.797 8.676 9.017 6.016 2 20 [*+****************-*] 1
1242 1 100 VAL H 1 104 PHE QB 2.929 . 4.002 6.228 6.139 6.368 2.366 2 20 [*+****************-*] 1
1243 1 100 VAL H 1 105 VAL HB 2.308 . 2.974 11.971 11.774 12.188 9.214 20 20 [*-*****************+] 1
1244 1 100 VAL HA 1 104 PHE HA 2.818 . 7.000 6.836 6.655 7.254 0.254 2 0 "[ . 1 . 2]" 1
1245 1 100 VAL HA 1 104 PHE QB 3.186 . 4.455 5.065 4.906 5.409 0.954 2 17 "[*+****-* **** **** *]" 1
1246 1 100 VAL HA 1 105 VAL H 2.113 . 2.671 8.249 8.091 8.562 5.891 2 20 [*+******-***********] 1
1247 1 100 VAL HA 1 105 VAL HB 2.057 . 2.586 10.829 10.685 11.128 8.542 20 20 [*************-*****+] 1
1248 1 100 VAL HB 1 105 VAL QG 1.943 . 2.415 7.033 6.698 7.445 5.030 2 20 [*+**************-***] 1
1249 1 100 VAL QG 1 101 ASN QB 2.813 . 7.000 3.161 3.113 3.204 . 0 0 "[ . 1 . 2]" 1
1250 1 100 VAL QG 1 104 PHE QB 3.001 . 4.127 3.191 3.107 3.269 . 0 0 "[ . 1 . 2]" 1
1251 1 100 VAL QG 1 104 PHE QD 3.115 . 4.328 2.542 2.354 2.735 . 0 0 "[ . 1 . 2]" 1
1252 1 100 VAL QG 1 105 VAL H 2.043 . 2.565 5.716 5.588 5.817 3.252 20 20 [****************-**+] 1
1253 1 100 VAL QG 1 105 VAL HA 1.980 . 7.000 7.600 7.455 7.703 0.703 8 18 "[******-+******* ***]" 1
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