NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
651209 |
6vgb   |
30708 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6vgb
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 1430
_Distance_constraint_stats_list.Viol_count 14610
_Distance_constraint_stats_list.Viol_total 193819.672
_Distance_constraint_stats_list.Viol_max 5.278
_Distance_constraint_stats_list.Viol_rms 0.5053
_Distance_constraint_stats_list.Viol_average_all_restraints 0.3388
_Distance_constraint_stats_list.Viol_average_violations_only 0.6633
_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 22 GLY 68.357 2.567 2 20 [*+*****************-]
1 23 LEU 261.998 2.449 16 20 [***************+***-]
1 24 LEU 343.781 2.578 8 20 [**-****+************]
1 25 VAL 261.379 2.288 19 20 [**-***************+*]
1 26 LEU 222.982 2.860 12 20 [*-*********+********]
1 27 ILE 353.398 2.860 12 20 [*******-***+********]
1 28 TRP 377.276 5.213 13 20 [*******-****+*******]
1 29 SER 296.232 4.156 5 20 [****+**************-]
1 30 ASN 39.248 1.057 9 20 [********+**********-]
1 31 ASP 83.835 1.241 5 20 [****+*********-*****]
1 32 LYS 207.224 4.156 5 20 [****+*************-*]
1 33 LYS 75.521 1.164 17 20 [******-*********+***]
1 34 LEU 302.062 2.219 9 20 [********+-**********]
1 35 ILE 265.353 5.213 13 20 [*****-******+*******]
1 36 GLU 72.431 1.544 4 20 [***+**-*************]
1 37 GLU 18.495 0.749 1 6 "[+ . -* * . **2]"
1 38 ALA 195.290 1.538 12 20 [********-**+********]
1 39 ARG 147.198 1.990 20 20 [****************-**+]
1 40 LYS 102.256 1.732 16 20 [****-**********+****]
1 41 MET 189.355 2.062 8 20 [*****-*+************]
1 42 ALA 169.174 1.484 17 20 [*********-******+***]
1 43 GLU 58.536 1.541 6 20 [**-**+**************]
1 44 LYS 35.248 1.355 13 14 "[ * ** ***-*+ *****2]"
1 45 ALA 122.730 1.483 2 20 [*+**************-***]
1 46 ASN 35.123 1.001 3 13 "[* +*. - ** **** * **]"
1 47 LEU 247.497 1.794 3 20 [**+****************-]
1 48 TYR 182.298 2.294 20 20 [***************-***+]
1 49 LEU 318.636 2.294 20 20 [*-*****************+]
1 50 LEU 206.840 2.051 6 20 [*****+******-*******]
1 51 THR 119.047 1.802 13 20 [*******-****+*******]
1 52 LEU 222.116 2.431 7 20 [******+*******-*****]
1 53 GLU 130.488 2.845 18 20 [***********-*****+**]
1 54 THR 68.026 2.845 18 20 [*******-*********+**]
1 55 ASP 21.860 1.339 17 20 [**************-*+***]
1 56 ASP 65.327 2.026 11 20 [**********+********-]
1 57 LYS 48.889 1.961 19 19 "[*** *-************+*]"
1 58 LYS 81.338 1.789 16 20 [*-*************+****]
1 59 ILE 257.385 2.026 11 20 [**********+*********]
1 60 GLU 65.801 1.982 1 20 [+**-****************]
1 61 ASP 59.058 0.965 5 20 [****+*-*************]
1 62 ILE 292.242 2.251 18 20 [**-**************+**]
1 63 LEU 318.926 2.293 5 20 [****+************-**]
1 64 LYS 83.813 1.684 10 20 [*********+**-*******]
1 65 SER 69.278 1.935 2 20 [*+**-***************]
1 66 LEU 290.540 2.679 2 20 [*+**-***************]
1 67 GLY 116.251 2.186 2 20 [*+**********-*******]
1 68 PRO 93.327 2.186 2 20 [*+**************-***]
1 69 PRO 17.700 0.980 17 20 [***********-****+***]
1 70 VAL 372.925 2.679 2 20 [*+***************-**]
1 71 LYS 107.108 1.971 7 20 [******+***********-*]
1 72 ILE 331.445 1.831 2 20 [*+*********-********]
1 73 LEU 433.191 2.527 10 20 [***-*****+**********]
1 74 VAL 272.883 5.278 14 20 [***********-*+******]
1 75 LEU 456.782 2.816 5 20 [****+************-**]
1 76 LEU 505.355 5.278 14 20 [*******-*****+******]
1 77 GLU 196.047 1.966 14 20 [************-+******]
1 78 ASP 114.878 2.174 14 20 [*******-*****+******]
1 79 THR 119.884 1.966 14 20 [***-*********+******]
1 80 LYS 29.363 0.650 15 20 [*-************+*****]
1 81 ASP 52.720 1.662 3 20 [**+****-************]
1 82 ALA 282.565 3.592 12 20 [*******-***+********]
1 83 ASP 74.384 1.418 10 20 [*********+***-******]
1 84 LYS 114.882 1.846 11 20 [-*********+*********]
1 85 VAL 358.554 2.465 12 20 [***********+********]
1 86 LYS 234.735 1.948 12 20 [*********-*+********]
1 87 LYS 53.629 1.553 15 20 [****-*********+*****]
1 88 GLU 45.299 1.786 17 20 [**-*************+***]
1 89 ILE 312.306 2.456 9 20 [********+*-*********]
1 90 GLU 116.713 1.714 10 20 [******-**+**********]
1 91 LYS 77.359 1.135 17 20 [*************-**+***]
1 92 LYS 38.842 1.653 3 18 "[**+*-*********.** **]"
1 93 ALA 103.636 1.436 8 20 [*******+**-*********]
1 94 ARG 83.322 1.625 4 20 [***+*********-******]
1 95 LYS 52.063 0.809 11 20 [*****-****+*********]
1 96 LYS 83.495 1.628 14 20 [*******-*****+******]
1 97 ASN 45.583 0.991 3 20 [**+******-**********]
1 98 LEU 214.697 1.889 12 20 [***********+******-*]
1 99 PRO 112.953 1.889 12 20 [*******-***+********]
1 100 VAL 206.617 1.661 17 20 [*-**************+***]
1 101 ARG 159.767 2.307 12 20 [*-*********+********]
1 102 ILE 312.484 1.983 18 20 [****-************+**]
1 103 ARG 113.104 2.527 10 20 [-********+**********]
1 104 LYS 123.935 1.562 8 20 [****-**+************]
1 105 VAL 345.533 1.967 8 20 [***-***+************]
1 106 THR 64.348 1.125 1 20 [+**-****************]
1 107 SER 130.498 1.576 9 20 [********+*******-***]
1 108 PRO 172.242 2.219 9 20 [********+-**********]
1 109 ASP 99.887 1.576 9 20 [********+-**********]
1 110 GLU 205.901 1.919 18 20 [*****************+*-]
1 111 ALA 226.478 2.120 8 20 [****-**+************]
1 112 LYS 192.467 1.883 10 20 [********-+**********]
1 113 ARG 119.983 1.889 9 20 [*******-+***********]
1 114 TRP 248.252 2.196 13 20 [***********-+*******]
1 115 ILE 392.164 2.062 8 20 [*****-*+************]
1 116 LYS 37.451 1.411 1 18 "[+** *** *****-******]"
1 117 GLU 123.070 2.089 2 20 [*+***************-**]
1 118 PHE 168.401 2.135 20 20 [*****************-*+]
1 119 SER 166.557 2.449 16 20 [***************+-***]
1 120 GLU 50.490 1.283 6 20 [*****+**-***********]
1 121 GLU 50.930 1.755 2 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 41 MET HA 1 41 MET QG 4.111 3.450 4.933 2.835 2.483 3.105 0.967 17 17 "[*-******** **** +* *]" 1
2 1 23 LEU QD 1 71 LYS QB 4.238 3.818 5.086 2.265 1.847 3.097 1.971 7 20 [******+-************] 1
3 1 23 LEU MD1 1 23 LEU MD2 3.345 2.676 4.014 2.083 2.072 2.098 0.604 15 20 [**************+*-***] 1
4 1 23 LEU QD 1 47 LEU QD 3.383 2.714 4.060 2.098 1.767 2.960 0.947 2 15 "[-+**.****** *.* ***]" 1
5 1 39 ARG QB 1 49 LEU QD 4.259 3.912 5.111 2.775 1.922 3.294 1.990 20 20 [********-**********+] 1
6 1 39 ARG HA 1 49 LEU QD 4.029 3.586 4.150 2.073 1.748 2.614 1.838 1 20 [+******************-] 1
7 1 49 LEU QD 1 50 LEU HA 4.611 3.689 5.533 3.972 2.760 5.183 0.929 20 4 "[ *.* - . +]" 1
8 1 49 LEU HA 1 49 LEU QD 4.726 3.781 5.028 3.132 2.570 3.438 1.211 15 12 "[ *.** *- **+** **]" 1
9 1 24 LEU HA 1 25 VAL H 3.556 2.845 4.267 2.200 2.097 2.338 0.748 10 20 [**-******+**********] 1
10 1 24 LEU HA 1 24 LEU QD 3.701 2.961 4.441 2.305 1.928 3.063 1.033 8 16 "[* ***- +******* ***2]" 1
11 1 24 LEU HA 1 25 VAL QG 4.289 3.431 5.147 3.424 3.201 3.583 0.230 20 0 "[ . 1 . 2]" 1
12 1 24 LEU QB 1 72 ILE QG 3.960 3.338 4.752 2.553 1.893 3.962 1.445 15 15 "[*-*** ***** * +* * *]" 1
13 1 24 LEU QB 1 66 LEU QD . 4.274 4.739 3.568 2.229 4.106 2.045 2 10 "[*+ *. -** *** *]" 1
14 1 24 LEU QB 1 72 ILE MG 4.628 3.702 5.554 2.886 2.160 3.352 1.542 18 18 "[****** ***-* ****+**]" 1
15 1 66 LEU QD 1 70 VAL QG 4.052 3.242 4.814 2.203 1.730 2.889 1.512 7 18 "[ *-***+***** *******]" 1
16 1 63 LEU QB 1 98 LEU QD 4.176 3.921 5.011 3.671 3.067 4.227 0.854 14 3 "[* . 1 +.- 2]" 1
17 1 98 LEU QD 1 99 PRO QD 4.315 3.869 5.178 2.571 1.980 3.017 1.889 12 20 [*-*********+********] 1
18 1 75 LEU QD 1 111 ALA MB 4.151 3.321 4.273 2.534 1.935 3.917 1.386 13 16 "[** ** ***** + *****-]" 1
19 1 34 LEU HA 1 34 LEU HG 4.587 3.670 4.753 2.991 2.593 3.693 1.077 12 14 "[-***** * **+ ** * *]" 1
20 1 25 VAL HA 1 26 LEU H . 2.938 3.450 2.177 2.120 2.310 0.818 2 20 [*+*****************-] 1
21 1 24 LEU QD 1 25 VAL HA 3.932 3.146 4.718 4.030 2.923 4.657 0.223 7 0 "[ . 1 . 2]" 1
22 1 25 VAL HB 1 49 LEU QD 4.132 3.560 4.958 3.315 2.089 5.439 1.471 15 9 "[ .-* *1 **+** *2]" 1
23 1 25 VAL QG 1 118 PHE QD 4.403 3.522 5.284 4.705 2.638 5.557 0.884 20 1 "[ . 1 . +]" 1
24 1 25 VAL QG 1 47 LEU QD 3.395 2.716 4.074 2.463 1.864 3.141 0.852 20 5 "[ . *- 1 * .* +]" 1
25 1 25 VAL QG 1 49 LEU QD 4.154 3.323 4.985 2.701 1.973 3.742 1.350 13 11 "[ *.** *1- +**** *2]" 1
26 1 26 LEU HA 1 26 LEU QD 3.652 3.148 4.382 2.418 2.038 3.437 1.110 1 16 "[+********* *- * ***2]" 1
27 1 26 LEU HA 1 26 LEU HG 4.082 3.266 4.898 3.328 3.131 3.695 0.135 7 0 "[ . 1 . 2]" 1
28 1 26 LEU HA 1 27 ILE H . 2.988 3.608 2.230 2.176 2.365 0.812 12 20 [***********+*******-] 1
29 1 28 TRP QB 1 76 LEU QD 4.258 3.615 5.110 2.316 1.815 4.498 1.800 11 18 "[********-*+ *******]" 1
30 1 26 LEU QD 1 50 LEU QB 3.247 2.598 3.896 2.181 1.763 4.160 0.835 19 15 "[********** * * *-+2]" 1
31 1 23 LEU HG 1 47 LEU QD 3.628 2.902 4.354 3.123 2.378 3.713 0.524 7 1 "[ . + 1 . 2]" 1
32 1 47 LEU HA 1 47 LEU QD 4.215 3.372 5.058 2.168 1.896 3.418 1.476 9 19 "[*******-+*** *******]" 1
33 1 27 ILE HA 1 27 ILE MG 4.166 3.333 4.999 3.133 2.440 3.214 0.893 14 2 "[ . 1- +. 2]" 1
34 1 27 ILE HA 1 27 ILE MD 4.480 3.584 5.376 3.845 3.776 4.192 . 0 0 "[ . 1 . 2]" 1
35 1 27 ILE MD 1 49 LEU HG 4.442 3.554 5.330 5.383 3.477 6.251 0.921 5 7 "[ + -*1 * . ***]" 1
36 1 72 ILE QG 1 72 ILE MG 3.693 2.954 4.432 2.327 2.288 2.366 0.666 14 20 [*********-***+******] 1
37 1 27 ILE QG 1 35 ILE MD 4.193 3.354 5.032 4.674 3.674 5.399 0.367 14 0 "[ . 1 . 2]" 1
38 1 27 ILE MG 1 35 ILE MD 3.836 3.069 4.603 4.539 3.010 5.369 0.766 11 3 "[ - . 1+ . * 2]" 1
39 1 27 ILE MG 1 49 LEU QD 3.640 3.252 4.368 2.319 1.901 3.858 1.351 6 18 "[****-+**** ** ******]" 1
40 1 28 TRP HA 1 35 ILE QG 4.200 3.360 5.040 5.274 4.819 5.668 0.628 3 4 "[ *+ . - 1 . * 2]" 1
41 1 27 ILE HB 1 28 TRP HA 4.457 3.566 5.348 5.583 4.395 5.890 0.542 7 3 "[ . +- 1 . * 2]" 1
42 1 29 SER HA 1 77 GLU QB 4.075 3.880 4.890 2.386 1.991 3.059 1.889 10 20 [******-**+**********] 1
43 1 29 SER QB 1 35 ILE MD 4.189 3.351 5.027 3.609 1.887 5.005 1.464 5 5 "[ +- ** *. 2]" 1
44 1 30 ASN HA 1 31 ASP HA 4.311 3.449 5.173 4.335 4.213 4.393 . 0 0 "[ . 1 . 2]" 1
45 1 32 LYS HA 1 33 LYS H 4.531 3.625 4.577 3.536 3.484 3.587 0.141 13 0 "[ . 1 . 2]" 1
46 1 32 LYS HA 1 35 ILE H 4.499 3.599 4.781 4.541 4.125 4.977 0.196 14 0 "[ . 1 . 2]" 1
47 1 32 LYS HA 1 32 LYS QB 3.303 2.642 3.964 2.370 2.158 2.483 0.484 1 0 "[ . 1 . 2]" 1
48 1 32 LYS HA 1 35 ILE HB 3.575 3.375 4.290 4.204 3.537 5.037 0.747 14 1 "[ . 1 +. 2]" 1
49 1 32 LYS HA 1 32 LYS QG 3.909 3.127 4.691 2.777 2.234 3.498 0.893 16 7 "[ . -* 1* * *+ *]" 1
50 1 64 LYS QB 1 64 LYS HG2 3.173 2.538 3.808 2.342 2.158 2.371 0.380 3 0 "[ . 1 . 2]" 1
51 1 84 LYS QB 1 88 GLU QG 3.142 2.514 3.770 3.728 3.038 4.198 0.428 6 0 "[ . 1 . 2]" 1
52 1 80 LYS HA 1 80 LYS HB2 3.612 2.890 4.334 2.616 2.435 3.025 0.455 2 0 "[ . 1 . 2]" 1
53 1 33 LYS H 1 33 LYS HA 3.709 2.967 3.823 2.899 2.868 2.919 0.099 2 0 "[ . 1 . 2]" 1
54 1 33 LYS H 1 33 LYS QB . 3.080 3.235 2.415 2.223 2.763 0.857 2 17 "[ +-** *********** **]" 1
55 1 34 LEU HA 1 108 PRO QG 4.347 4.106 5.216 3.634 2.187 5.119 1.919 4 11 "[ *+* *** *.* -**]" 1
56 1 34 LEU HA 1 108 PRO QB 4.246 3.397 5.095 3.228 1.829 4.211 1.568 10 5 "[ *.* +- * 2]" 1
57 1 34 LEU HA 1 37 GLU QB 4.027 3.222 4.832 3.209 2.732 4.513 0.490 3 0 "[ . 1 . 2]" 1
58 1 34 LEU HA 1 34 LEU QD 3.604 3.280 4.325 2.324 1.889 3.143 1.391 7 16 "[***-* +**** * .*****]" 1
59 1 34 LEU HA 1 37 GLU H . 3.650 4.434 3.816 3.561 4.134 0.089 2 0 "[ . 1 . 2]" 1
60 1 34 LEU QD 1 111 ALA MB 3.341 3.005 4.009 2.280 1.943 3.233 1.062 11 17 "[ **** ** *+*******-*]" 1
61 1 34 LEU QD 1 38 ALA MB 4.295 3.436 5.154 3.135 2.164 4.554 1.272 10 9 "[ **. * + *-** *]" 1
62 1 34 LEU QD 1 105 VAL HB 4.330 3.774 5.196 4.352 3.776 5.075 . 0 0 "[ . 1 . 2]" 1
63 1 34 LEU QD 1 108 PRO HA 4.093 3.274 4.381 2.747 2.027 4.013 1.247 19 12 "[-* * ** ** * .***+2]" 1
64 1 35 ILE HA 1 35 ILE MG . 3.336 3.980 2.427 2.310 2.568 1.026 15 20 [****-*********+*****] 1
65 1 35 ILE HA 1 38 ALA MB 3.825 3.519 4.590 2.786 2.605 3.192 0.914 4 16 "[ *-+*********** * *]" 1
66 1 35 ILE HA 1 35 ILE QG 4.004 3.203 4.805 2.398 2.238 2.538 0.965 11 20 [**********+***-*****] 1
67 1 35 ILE HA 1 38 ALA H . 3.673 4.530 3.716 3.428 3.988 0.245 4 0 "[ . 1 . 2]" 1
68 1 32 LYS HA 1 35 ILE MD 4.319 3.455 5.183 3.938 3.431 4.393 0.024 19 0 "[ . 1 . 2]" 1
69 1 35 ILE HA 1 35 ILE MD 4.694 3.755 5.633 3.693 2.653 3.894 1.102 5 3 "[ + 1- *. 2]" 1
70 1 32 LYS QE 1 35 ILE MD 4.669 3.735 5.603 4.378 3.238 6.010 0.497 19 0 "[ . 1 . 2]" 1
71 1 35 ILE MG 1 51 THR HG1 4.039 3.231 4.847 4.274 2.785 5.665 0.818 5 3 "[ - + 1 * . 2]" 1
72 1 35 ILE MG 1 36 GLU HA 4.123 3.298 4.948 3.348 3.029 3.674 0.269 16 0 "[ . 1 . 2]" 1
73 1 36 GLU H 1 36 GLU HA . 2.944 3.649 2.812 2.782 2.869 0.162 18 0 "[ . 1 . 2]" 1
74 1 36 GLU HA 1 39 ARG H 4.289 3.431 4.397 3.705 3.357 4.008 0.074 19 0 "[ . 1 . 2]" 1
75 1 38 ALA HA 1 41 MET H . 3.745 4.208 3.586 3.367 3.769 0.378 14 0 "[ . 1 . 2]" 1
76 1 38 ALA HA 1 111 ALA MB 4.329 3.463 5.195 3.647 2.986 4.134 0.477 20 0 "[ . 1 . 2]" 1
77 1 38 ALA HA 1 115 ILE QG 4.099 3.279 4.919 4.533 4.179 4.917 . 0 0 "[ . 1 . 2]" 1
78 1 38 ALA HA 1 115 ILE MD . 3.675 4.350 2.485 2.137 2.803 1.538 12 20 [*********-*+********] 1
79 1 27 ILE MD 1 38 ALA HA 4.505 3.604 5.406 4.758 4.203 5.576 0.170 11 0 "[ . 1 . 2]" 1
80 1 38 ALA MB 1 115 ILE MD 3.442 3.351 4.130 2.256 2.033 2.516 1.318 14 20 [************-+******] 1
81 1 38 ALA MB 1 49 LEU QD 3.516 3.355 4.219 2.681 2.044 3.825 1.311 17 15 "[***** ** 1***** +-*2]" 1
82 1 39 ARG HA 1 39 ARG QG 3.919 3.135 4.648 2.675 2.318 3.348 0.817 15 14 "[*** * * 1****+-***2]" 1
83 1 94 ARG H 1 94 ARG QB . 3.515 3.533 2.377 2.218 2.659 1.297 14 20 [************-+******] 1
84 1 117 GLU H 1 117 GLU HA 3.606 2.885 3.732 2.818 2.771 2.879 0.114 20 0 "[ . 1 . 2]" 1
85 1 40 LYS HA 1 41 MET H . 3.376 4.200 3.527 3.473 3.561 . 0 0 "[ . 1 . 2]" 1
86 1 41 MET HA 1 42 ALA H . 3.706 4.507 3.529 3.484 3.561 0.222 20 0 "[ . 1 . 2]" 1
87 1 77 GLU HA 1 105 VAL QG . 4.476 4.842 4.222 3.486 4.738 0.990 6 2 "[ .+ - . 2]" 1
88 1 77 GLU HA 1 77 GLU QG 4.184 3.698 4.728 2.590 2.408 3.111 1.290 17 20 [****************+-**] 1
89 1 41 MET HA 1 44 LYS QB 3.229 2.583 3.875 2.844 2.235 4.265 0.390 19 0 "[ . 1 . 2]" 1
90 1 41 MET HA 1 44 LYS QD 4.340 3.472 5.208 3.599 2.117 5.637 1.355 13 7 "[ . 1**+ ** *-2]" 1
91 1 41 MET QG 1 115 ILE MD 4.694 3.755 5.633 3.298 2.673 4.168 1.082 16 10 "[ * **** 1* .+**-2]" 1
92 1 41 MET QG 1 112 LYS QB 4.075 3.642 4.890 2.484 2.153 3.349 1.489 12 19 "[***********+-*** ***]" 1
93 1 42 ALA HA 1 47 LEU HG 4.304 3.443 5.165 3.298 2.559 3.754 0.884 13 1 "[ . 1 + . 2]" 1
94 1 42 ALA HA 1 47 LEU QB 3.764 3.011 4.517 2.753 2.211 4.446 0.800 12 6 "[ * * * 1 + . * -]" 1
95 1 42 ALA HA 1 115 ILE MG 3.527 3.232 4.232 2.553 2.364 3.273 0.868 1 17 "[+***.****** -*** ***]" 1
96 1 42 ALA HA 1 47 LEU H . 3.428 4.193 3.630 2.674 4.078 0.754 12 1 "[ . 1 + . 2]" 1
97 1 42 ALA HA 1 45 ALA H . 3.646 4.427 3.508 3.272 3.740 0.374 6 0 "[ . 1 . 2]" 1
98 1 42 ALA MB 1 49 LEU QB 4.316 3.453 5.179 2.847 1.969 4.464 1.484 17 13 "[- **.*** * **.*+* *]" 1
99 1 42 ALA MB 1 47 LEU QD 4.322 3.458 5.186 2.968 2.481 3.744 0.977 13 11 "[* -* ** +*.* ***]" 1
100 1 42 ALA MB 1 115 ILE MG 3.669 2.935 4.403 2.692 2.185 3.423 0.750 19 6 "[* . *- . *+*]" 1
101 1 93 ALA MB 1 100 VAL QG 3.544 2.835 4.253 2.087 1.793 2.537 1.042 16 19 "[***-****** ****+****]" 1
102 1 42 ALA H 1 42 ALA MB . 2.819 3.254 2.228 2.168 2.245 0.651 9 20 [********+**********-] 1
103 1 42 ALA MB 1 43 GLU H 4.126 3.301 4.951 2.560 2.444 2.762 0.857 3 20 [**+***************-*] 1
104 1 43 GLU HA 1 43 GLU QG 3.693 3.361 4.432 2.618 2.398 2.926 0.963 10 17 "[**-******+****** * 2]" 1
105 1 43 GLU H 1 43 GLU HA . 2.827 3.532 2.817 2.791 2.869 0.036 15 0 "[ . 1 . 2]" 1
106 1 43 GLU HA 1 44 LYS H 4.226 3.381 5.071 3.512 3.391 3.557 . 0 0 "[ . 1 . 2]" 1
107 1 44 LYS H 1 44 LYS HA . 2.849 3.455 2.813 2.762 2.906 0.087 9 0 "[ . 1 . 2]" 1
108 1 45 ALA HA 1 46 ASN H . 3.368 3.929 3.176 3.080 3.274 0.288 1 0 "[ . 1 . 2]" 1
109 1 42 ALA HA 1 45 ALA MB 4.369 3.495 5.243 3.198 2.598 3.874 0.897 19 7 "[ * ** - 1* .* +2]" 1
110 1 45 ALA MB 1 47 LEU QD 4.016 3.213 4.819 2.184 1.830 2.548 1.383 12 20 [-**********+********] 1
111 1 45 ALA MB 1 115 ILE MG 4.306 3.445 4.841 3.369 2.901 4.056 0.544 11 3 "[ - . * 1+ . 2]" 1
112 1 46 ASN H 1 46 ASN HA . 2.608 3.088 2.263 2.253 2.274 0.355 8 0 "[ . 1 . 2]" 1
113 1 46 ASN HA 1 47 LEU H . 2.963 3.578 2.720 2.387 2.857 0.576 7 1 "[ . + 1 . 2]" 1
114 1 46 ASN HA 1 46 ASN HB3 3.749 2.999 4.499 2.727 2.483 3.028 0.516 17 2 "[ . 1 -. + 2]" 1
115 1 23 LEU QB 1 47 LEU QD 3.920 3.136 4.704 1.987 1.746 2.364 1.390 9 20 [****-***+***********] 1
116 1 47 LEU QD 1 119 SER HA 4.486 3.589 4.667 3.029 2.248 3.496 1.341 2 10 "[*+ *.* ** * * -*2]" 1
117 1 48 TYR HA 1 48 TYR QE 4.088 3.270 4.906 4.669 4.525 4.794 . 0 0 "[ . 1 . 2]" 1
118 1 25 VAL H 1 49 LEU HA . 3.702 4.414 2.974 2.636 3.369 1.066 10 15 "[** **** *+***-.* **2]" 1
119 1 25 VAL HB 1 49 LEU HA 4.336 3.469 5.203 2.882 2.506 4.538 0.963 3 17 "[* +**** *-*********2]" 1
120 1 26 LEU HG 1 49 LEU HA 4.224 3.379 5.069 5.713 5.153 6.073 1.004 14 13 "[ * ** *1***+*** -*]" 1
121 1 49 LEU HA 1 49 LEU HG 4.228 3.382 5.074 3.239 2.508 4.328 0.874 7 9 "[ *.*+ *1 ***- *2]" 1
122 1 26 LEU QD 1 49 LEU HA 4.434 3.547 5.321 4.123 3.543 5.325 0.004 1 0 "[ . 1 . 2]" 1
123 1 42 ALA MB 1 49 LEU QD 3.656 2.925 4.387 2.119 1.687 2.417 1.238 9 20 [********+*******-***] 1
124 1 50 LEU HA 1 51 THR HB 4.233 3.386 5.080 4.807 4.522 5.736 0.656 18 1 "[ . 1 . + 2]" 1
125 1 51 THR HB 1 52 LEU H 4.310 3.448 4.934 4.021 3.541 4.425 . 0 0 "[ . 1 . 2]" 1
126 1 51 THR H 1 51 THR HB 4.611 3.689 4.807 2.872 2.666 3.611 1.023 4 17 "[***+****** ****-* *2]" 1
127 1 27 ILE MG 1 51 THR HB 4.558 3.646 5.470 4.393 2.645 6.389 1.001 16 3 "[ . 1 -.+ *]" 1
128 1 51 THR HA 1 51 THR HG1 4.467 3.574 5.360 2.838 2.572 3.645 1.002 13 15 "[*** -*******+*.* *]" 1
129 1 66 LEU HA 1 66 LEU QD 3.341 3.066 4.009 2.027 1.883 2.615 1.183 6 19 "[* ***+*********-****]" 1
130 1 66 LEU HA 1 66 LEU HG 4.384 3.507 5.261 3.216 2.561 3.701 0.946 10 8 "[ * *. -*+ .* * *]" 1
131 1 66 LEU HA 1 67 GLY H . 3.082 3.510 3.520 2.800 3.588 0.282 2 0 "[ . 1 . 2]" 1
132 1 50 LEU QD 1 59 ILE QG 3.978 3.482 4.774 2.095 1.792 2.786 1.690 8 20 [*******+-***********] 1
133 1 53 GLU HA 1 53 GLU QG 4.243 3.394 5.016 2.746 2.327 3.550 1.067 16 13 "[***** **- *+ ***]" 1
134 1 117 GLU H 1 117 GLU QG . 3.451 3.715 2.840 2.032 3.944 1.419 18 13 "[* -*****1* *** +*2]" 1
135 1 50 LEU QB 1 51 THR H . 4.052 4.206 3.002 2.603 3.528 1.449 10 20 [*********+*******-**] 1
136 1 50 LEU QD 1 51 THR H . 4.365 4.648 3.816 3.190 4.279 1.175 19 9 "[ *** ** ** -+2]" 1
137 1 28 TRP HA 1 52 LEU QB 5.660 4.528 6.792 5.379 3.730 7.356 0.798 10 3 "[ - .* + . 2]" 1
138 1 52 LEU QD 1 85 VAL QG 5.030 4.024 6.036 3.537 1.925 5.247 2.099 1 10 "[+ **** * * - * *2]" 1
139 1 52 LEU HA 1 52 LEU QD 4.964 3.971 5.657 2.708 1.816 3.464 2.155 15 20 [*******-******+*****] 1
140 1 76 LEU H 1 76 LEU QD . 4.433 4.478 3.629 2.739 3.947 1.694 18 19 "[*******-***** ***+**]" 1
141 1 52 LEU H 1 52 LEU QD . 4.230 4.748 2.887 1.799 3.837 2.431 7 18 "[******+**** ****- **]" 1
142 1 53 GLU HA 1 54 THR H 5.098 4.078 5.510 3.548 3.382 3.594 0.696 7 16 "[******+- * * ** ****]" 1
143 1 54 THR H 1 54 THR HB 5.015 4.012 6.018 3.435 2.808 3.724 1.204 10 6 "[-* .* + .* *]" 1
144 1 77 GLU QG 1 78 ASP HA 4.320 3.456 5.184 4.261 3.951 4.559 . 0 0 "[ . 1 . 2]" 1
145 1 56 ASP H 1 56 ASP QB 4.675 3.740 5.329 2.378 2.166 2.568 1.574 11 20 [*******-**+*********] 1
146 1 56 ASP HA 1 59 ILE MD . 4.275 4.930 4.070 2.387 5.198 1.888 9 6 "[ . -+1* * .* * 2]" 1
147 1 57 LYS HA 1 57 LYS HG2 3.864 3.091 4.637 3.209 2.286 3.872 0.805 13 5 "[- . ** + . * 2]" 1
148 1 57 LYS HA 1 57 LYS QD 3.961 3.169 4.753 3.353 1.955 4.470 1.214 20 5 "[ * .* 1- . * +]" 1
149 1 57 LYS HA 1 57 LYS HB2 3.302 2.642 3.962 2.575 2.397 3.017 0.245 16 0 "[ . 1 . 2]" 1
150 1 57 LYS HA 1 60 GLU QB 4.085 3.268 4.902 3.696 2.606 4.583 0.662 5 1 "[ + 1 . 2]" 1
151 1 64 LYS QB 1 65 SER H 3.469 2.775 4.163 2.875 2.583 3.187 0.192 2 0 "[ . 1 . 2]" 1
152 1 59 ILE HA 1 62 ILE H 4.866 3.893 5.176 3.750 3.109 4.277 0.784 11 2 "[ . 1+ -. 2]" 1
153 1 59 ILE HA 1 59 ILE MD . 3.898 4.027 3.815 3.756 3.850 0.142 20 0 "[ . 1 . 2]" 1
154 1 59 ILE HB 1 59 ILE MD . 3.388 3.871 2.378 2.316 2.468 1.072 19 20 [******************+-] 1
155 1 87 LYS HA 1 90 GLU QB 4.431 3.545 5.317 2.775 1.992 3.444 1.553 15 15 "[ ***.** *** **+- ***]" 1
156 1 39 ARG QB 1 40 LYS H 5.010 4.008 6.012 2.667 2.276 3.587 1.732 16 17 "[*** **-**1*****+***2]" 1
157 1 90 GLU QB 1 102 ILE MD 4.782 3.826 5.738 3.286 2.715 4.299 1.111 2 11 "[ +**. **1* -**** 2]" 1
158 1 115 ILE MG 1 116 LYS H . 3.550 3.919 3.405 3.122 3.732 0.428 1 0 "[ . 1 . 2]" 1
159 1 89 ILE HA 1 89 ILE MG 3.860 3.088 4.400 2.443 2.372 2.546 0.716 9 20 [-*******+***********] 1
160 1 89 ILE MG 1 92 LYS QE 4.542 3.634 5.450 5.117 1.981 6.106 1.653 3 4 "[ + . - *1 * . 2]" 1
161 1 41 MET QG 1 115 ILE MG 4.509 3.697 5.411 2.930 1.980 4.163 1.717 16 15 "[ ** *****-* * *+***2]" 1
162 1 59 ILE MG 1 60 GLU QG 5.078 4.062 6.094 4.584 3.604 5.349 0.458 3 0 "[ . 1 . 2]" 1
163 1 89 ILE MG 1 93 ALA MB 3.917 3.134 4.700 3.008 2.440 3.752 0.694 5 1 "[ + 1 . 2]" 1
164 1 59 ILE QG 1 59 ILE MG 3.739 3.139 4.487 2.299 2.250 2.393 0.889 13 20 [************+******-] 1
165 1 60 GLU HA 1 60 GLU QG 3.725 3.326 4.470 2.456 2.301 3.023 1.025 3 19 [**+**********-.*****] 1
166 1 60 GLU HA 1 63 LEU QB 4.640 3.712 5.568 2.867 2.210 3.782 1.502 19 15 "[ ***.*****-* ** *+*]" 1
167 1 62 ILE HA 1 63 LEU H 4.714 3.771 5.657 3.552 3.515 3.580 0.256 7 0 "[ . 1 . 2]" 1
168 1 61 ASP QB 1 62 ILE HA 5.597 4.478 6.554 3.999 3.670 4.277 0.808 8 9 "[ *.- +*1 *** ** 2]" 1
169 1 62 ILE HA 1 62 ILE QG 3.985 3.729 4.624 2.353 2.313 2.440 1.416 17 20 [****************+-**] 1
170 1 62 ILE HA 1 62 ILE MG 3.409 3.349 4.091 2.434 2.388 2.478 0.961 18 20 [****************-+**] 1
171 1 62 ILE HA 1 62 ILE MD 5.260 4.208 6.312 3.790 3.732 3.851 0.476 3 0 "[ . 1 . 2]" 1
172 1 62 ILE H 1 62 ILE QG . 4.283 4.925 2.200 2.032 2.319 2.251 18 20 [**-**************+**] 1
173 1 62 ILE H 1 62 ILE MG . 4.162 4.890 3.769 3.756 3.779 0.406 16 0 "[ . 1 . 2]" 1
174 1 63 LEU HA 1 66 LEU QB 3.949 3.159 4.739 2.807 2.094 3.842 1.065 2 8 "[ + -.* * 1 **.* *]" 1
175 1 63 LEU HA 1 66 LEU HG 4.293 4.266 5.152 4.304 3.382 5.571 0.884 8 7 "[* -.* + 1 *. * *]" 1
176 1 63 LEU HA 1 63 LEU QD 4.309 3.797 4.333 2.465 1.990 3.357 1.807 15 18 "[ *****-*******+* ***]" 1
177 1 63 LEU QB 1 66 LEU QD 4.903 3.922 5.884 4.069 3.580 4.788 0.342 18 0 "[ . 1 . 2]" 1
178 1 63 LEU H 1 63 LEU QD . 4.098 4.374 3.541 3.166 3.804 0.932 11 9 "[****.* -+ * * 2]" 1
179 1 63 LEU QD 1 98 LEU QB . 4.000 4.928 3.947 3.301 4.606 0.699 13 1 "[ . 1 + . 2]" 1
180 1 63 LEU QD 1 70 VAL QG 3.477 2.782 4.172 2.280 1.852 2.804 0.930 15 14 "[ *.* *******+* -**]" 1
181 1 87 LYS HA 1 88 GLU H 3.458 2.766 4.150 3.522 3.424 3.565 . 0 0 "[ . 1 . 2]" 1
182 1 87 LYS HA 1 87 LYS HG3 3.498 2.099 4.897 3.190 2.436 3.843 . 0 0 "[ . 1 . 2]" 1
183 1 86 LYS QG 1 87 LYS HA 4.419 3.535 5.303 3.564 3.092 4.988 0.443 2 0 "[ . 1 . 2]" 1
184 1 65 SER HA 1 66 LEU H 4.676 3.741 5.611 3.465 3.362 3.532 0.379 18 0 "[ . 1 . 2]" 1
185 1 66 LEU QB 1 71 LYS H 5.476 4.381 6.571 6.520 5.940 7.293 0.722 7 1 "[ . + 1 . 2]" 1
186 1 63 LEU QD 1 66 LEU QB 5.392 4.314 6.470 3.317 2.373 4.255 1.941 2 17 "[ +**-* ********* ***]" 1
187 1 66 LEU QD 1 67 GLY H 5.132 4.106 6.158 3.958 3.617 4.188 0.489 12 0 "[ . 1 . 2]" 1
188 1 66 LEU HA 1 67 GLY QA 5.306 4.245 6.367 4.230 4.177 4.296 0.068 7 0 "[ . 1 . 2]" 1
189 1 67 GLY QA 1 68 PRO QD 3.801 3.049 4.432 2.006 1.897 2.450 1.152 8 20 [*-*****+************] 1
190 1 67 GLY QA 1 68 PRO QG 5.248 4.279 6.298 3.799 3.700 4.203 0.579 20 11 "[ *** **1* **.*- +]" 1
191 1 68 PRO QB 1 70 VAL QG 4.674 4.120 5.609 3.853 2.880 4.864 1.240 2 2 "[ + . -1 . 2]" 1
192 1 68 PRO QB 1 70 VAL H . 4.545 4.549 4.984 4.701 5.283 0.734 1 9 "[+** ** 1* *- * 2]" 1
193 1 68 PRO HA 1 68 PRO QD 4.885 3.908 5.862 3.292 3.146 3.393 0.762 10 20 [****-****+**********] 1
194 1 67 GLY H 1 68 PRO QD . 4.480 4.961 3.671 2.294 4.061 2.186 2 19 "[*+********-** ******]" 1
195 1 69 PRO HA 1 69 PRO QD 5.112 4.090 6.134 3.302 3.110 3.392 0.980 17 20 [***********-****+***] 1
196 1 68 PRO QG 1 69 PRO QD 4.972 3.978 5.966 3.911 3.656 4.179 0.322 11 0 "[ . 1 . 2]" 1
197 1 22 GLY QA 1 70 VAL HA 4.585 3.782 5.502 3.421 2.491 4.454 1.291 5 10 "[* **+ *** *. * -]" 1
198 1 70 VAL HA 1 71 LYS H . 2.820 3.373 2.199 2.109 2.360 0.711 10 19 "[*********+** *****-*]" 1
199 1 70 VAL HB 1 71 LYS H . 4.044 4.544 3.983 2.985 4.159 1.059 15 1 "[ . 1 + 2]" 1
200 1 68 PRO HA 1 70 VAL QG 4.745 4.303 5.694 4.905 4.470 5.642 . 0 0 "[ . 1 . 2]" 1
201 1 63 LEU HA 1 70 VAL QG 5.402 4.322 6.482 3.163 2.920 4.183 1.402 17 19 "[* **********-***+***]" 1
202 1 23 LEU QD 1 70 VAL QG 4.402 3.522 5.282 3.518 3.089 3.931 0.433 7 0 "[ . 1 . 2]" 1
203 1 70 VAL QG 1 72 ILE MD 4.218 3.374 5.062 3.612 2.037 4.369 1.337 14 5 "[ .* 1 - +. * *2]" 1
204 1 70 VAL MG1 1 70 VAL MG2 3.442 2.754 4.130 2.079 2.068 2.094 0.686 15 20 [**************+*-***] 1
205 1 71 LYS QB 1 72 ILE H 5.339 4.474 6.407 3.324 3.053 3.738 1.421 3 20 [**+****-************] 1
206 1 24 LEU HA 1 72 ILE HA 5.277 4.222 6.332 4.740 4.418 5.087 . 0 0 "[ . 1 . 2]" 1
207 1 24 LEU QB 1 72 ILE HA 4.639 4.058 5.567 2.675 2.261 3.015 1.797 18 20 [**********-******+**] 1
208 1 72 ILE HA 1 72 ILE MG 3.797 3.305 4.556 2.353 2.257 2.437 1.048 14 20 [******-******+******] 1
209 1 72 ILE H 1 72 ILE MD 5.167 4.134 6.200 3.729 3.160 4.032 0.974 14 5 "[ .* 1 * +. * -2]" 1
210 1 72 ILE MD 1 100 VAL HA 5.822 4.658 6.986 4.236 3.577 4.964 1.081 13 10 "[ *-** **** + * 2]" 1
211 1 72 ILE MD 1 98 LEU QB 4.850 3.880 5.820 3.438 2.049 5.110 1.831 2 8 "[*+ ** *1 -.* *]" 1
212 1 24 LEU QB 1 72 ILE MD 4.465 3.572 5.358 3.103 1.945 3.903 1.627 17 5 "[ .- 1 * *. + *2]" 1
213 1 72 ILE MG 1 73 LEU H . 3.476 3.942 2.898 2.606 3.310 0.870 11 13 "[* * * ****+ * * *-*]" 1
214 1 24 LEU H 1 72 ILE MG 5.457 4.366 6.548 4.409 3.925 4.893 0.441 3 0 "[ . 1 . 2]" 1
215 1 26 LEU H 1 72 ILE MG 5.175 4.140 6.210 3.546 3.053 4.652 1.087 8 12 "[*** * *+-* ** * * 2]" 1
216 1 102 ILE MG 1 103 ARG H . 3.442 3.710 2.712 2.549 2.968 0.893 15 19 "[**************+* **-]" 1
217 1 72 ILE MG 1 100 VAL HA 5.296 4.237 6.355 3.461 3.146 4.380 1.091 2 17 "[ + ************** *-]" 1
218 1 102 ILE HA 1 102 ILE MG 4.014 3.211 4.817 2.387 2.325 2.464 0.886 6 20 [*****+*-************] 1
219 1 25 VAL HA 1 72 ILE MG 5.234 4.187 6.281 3.790 3.086 4.475 1.101 7 9 "[*** - + 1* * * *]" 1
220 1 74 VAL HB 1 102 ILE MG 4.184 3.347 5.021 3.279 2.468 5.357 0.879 10 11 "[* *** * *+ * * -* 2]" 1
221 1 102 ILE MG 1 104 LYS QG 3.671 3.190 4.405 3.188 2.627 3.783 0.563 8 1 "[ . + 1 . 2]" 1
222 1 25 VAL HA 1 73 LEU QB 6.003 4.802 7.204 2.915 2.514 3.469 2.288 19 20 [**********-*******+*] 1
223 1 73 LEU QD 1 102 ILE HA 5.381 4.305 6.457 4.241 3.560 4.642 0.745 10 1 "[ . + . 2]" 1
224 1 73 LEU QD 1 118 PHE HA 5.382 4.306 5.663 4.833 4.231 5.351 0.075 20 0 "[ . 1 . 2]" 1
225 1 73 LEU QD 1 74 VAL H . 3.512 3.763 2.532 2.113 2.727 1.399 11 20 [******-***+*********] 1
226 1 73 LEU QD 1 103 ARG H 5.252 4.202 6.302 4.014 3.451 4.481 0.751 10 4 "[ -. * + . *]" 1
227 1 73 LEU QD 1 101 ARG H . 4.530 5.054 4.354 3.943 4.668 0.587 16 2 "[ . 1 .+ -]" 1
228 1 73 LEU QD 1 118 PHE QD 5.300 4.240 5.947 2.908 2.759 3.244 1.481 2 20 [-+******************] 1
229 1 73 LEU QD 1 118 PHE QB 5.368 4.294 5.484 2.754 2.159 3.594 2.135 20 20 [-******************+] 1
230 1 73 LEU QD 1 103 ARG QD 5.509 4.407 6.611 3.981 1.880 5.600 2.527 10 9 "[ * - *+* * * * *2]" 1
231 1 73 LEU QD 1 101 ARG QB 4.601 4.006 5.500 2.809 2.386 3.303 1.620 20 20 [******************-+] 1
232 1 73 LEU QD 1 101 ARG QG 4.930 3.944 5.916 3.692 2.273 4.683 1.671 3 7 "[ + . * 1* *-* *]" 1
233 1 73 LEU QD 1 115 ILE MG . 3.438 4.207 3.822 3.474 4.519 0.312 10 0 "[ . 1 . 2]" 1
234 1 73 LEU QD 1 115 ILE H . 4.323 4.621 3.745 3.396 4.389 0.927 3 12 "[ -+ .** *1*** .*** *]" 1
235 1 73 LEU QD 1 118 PHE H . 4.467 4.752 4.105 3.611 4.866 0.856 3 5 "[ + .* 1* .- *]" 1
236 1 73 LEU QD 1 114 TRP QB 4.863 4.174 5.465 2.325 1.978 2.532 2.196 13 20 [************+*-*****] 1
237 1 73 LEU QD 1 115 ILE HA 4.401 3.521 4.588 2.730 2.363 3.298 1.158 3 17 "[ *+-*****1****.*****]" 1
238 1 73 LEU QD 1 115 ILE QG 4.900 3.920 5.880 2.794 2.524 3.716 1.396 11 19 [*******-*1+*********] 1
239 1 73 LEU QD 1 75 LEU QD 3.991 3.193 4.789 2.252 1.826 3.955 1.367 14 17 "[********** **+* * -*]" 1
240 1 26 LEU QB 1 74 VAL HA 4.159 3.327 4.991 2.979 2.331 4.827 0.996 19 15 "[***** **** -* * **+2]" 1
241 1 74 VAL QG 1 89 ILE HA 5.214 4.171 6.257 5.635 4.606 6.384 0.127 11 0 "[ . 1 . 2]" 1
242 1 74 VAL QG 1 102 ILE QG 3.404 2.723 4.085 2.079 1.765 2.589 0.958 14 16 "[ * **-******+*** **]" 1
243 1 74 VAL QG 1 75 LEU HA 4.537 3.630 5.444 3.667 3.371 3.883 0.259 11 0 "[ . 1 . 2]" 1
244 1 75 LEU HA 1 76 LEU QB 4.811 3.849 5.773 4.149 3.861 4.445 . 0 0 "[ . 1 . 2]" 1
245 1 75 LEU HA 1 75 LEU HG 4.397 3.518 5.276 3.070 2.578 3.675 0.940 11 9 "[ * * * 1+ * .* -**]" 1
246 1 75 LEU QB 1 105 VAL QG . 4.089 4.860 2.721 2.122 3.816 1.967 8 16 "[*-*****+** **** * *]" 1
247 1 27 ILE MD 1 75 LEU QB 5.346 4.277 6.269 2.989 2.450 3.747 1.827 9 20 [********+*-*********] 1
248 1 27 ILE HB 1 75 LEU QB 4.412 3.530 5.294 2.648 2.004 4.265 1.526 13 18 "[*****-******+ .*****]" 1
249 1 38 ALA MB 1 75 LEU QD 5.224 4.179 6.269 3.376 2.730 4.281 1.449 5 14 "[*- *+ ***1* * *** **]" 1
250 1 27 ILE MD 1 75 LEU QD 3.795 3.036 4.554 2.617 1.934 3.875 1.102 16 10 "[** * **1 * .+ *-*]" 1
251 1 75 LEU QD 1 115 ILE QG 5.103 4.082 6.124 2.711 2.151 3.825 1.931 4 19 "[***+****** *******-*]" 1
252 1 75 LEU QD 1 114 TRP QB 4.765 4.065 5.705 2.716 2.205 4.066 1.860 8 19 "[****-**+** *********]" 1
253 1 74 VAL HA 1 75 LEU QD 5.376 4.301 6.451 3.924 3.056 5.212 1.245 20 9 "[ -* *** 1 ***. +]" 1
254 1 75 LEU QD 1 114 TRP HD1 4.760 3.808 5.712 3.124 2.252 4.627 1.556 9 12 "[ -.* *+* * ******2]" 1
255 1 75 LEU QD 1 113 ARG H 5.310 4.248 6.372 5.529 5.090 6.292 . 0 0 "[ . 1 . 2]" 1
256 1 75 LEU QD 1 76 LEU H 5.105 4.084 6.126 3.594 2.567 4.295 1.517 18 8 "[ - .* 1** *.* +*2]" 1
257 1 75 LEU H 1 75 LEU QD . 4.076 4.195 3.088 2.296 3.956 1.780 7 16 "[******+**- **** * *]" 1
258 1 73 LEU QD 1 75 LEU HG 4.941 3.953 5.550 3.705 2.226 5.246 1.727 10 7 "[* *. **+ - * 2]" 1
259 1 75 LEU H 1 76 LEU HG 5.589 4.471 6.707 6.112 3.816 7.767 1.060 12 9 "[ ** *-1 + ** * *2]" 1
260 1 76 LEU HA 1 76 LEU HG 4.820 3.856 5.784 3.122 2.809 3.676 1.047 16 17 "[**-******** **+* **]" 1
261 1 28 TRP QB 1 76 LEU HA 5.319 4.255 5.530 3.588 2.805 5.428 1.450 10 15 "[***** -* +* **** **]" 1
262 1 76 LEU QD 1 86 LYS HA 5.065 4.052 6.078 2.790 2.293 3.393 1.759 20 20 [****-**************+] 1
263 1 76 LEU QD 1 87 LYS H . 4.458 5.167 4.947 4.682 5.798 0.631 18 1 "[ . 1 . + 2]" 1
264 1 28 TRP H 1 76 LEU QD . 4.013 4.327 2.966 1.952 5.238 2.061 7 17 "[****.*+***** -*****]" 1
265 1 34 LEU QD 1 77 GLU HA 4.644 3.715 5.573 4.470 3.810 4.944 . 0 0 "[ . 1 . 2]" 1
266 1 41 MET HA 1 45 ALA MB 5.176 4.141 6.211 4.984 4.419 5.878 . 0 0 "[ . 1 . 2]" 1
267 1 41 MET HA 1 112 LYS QG 4.807 3.846 5.768 4.848 4.461 5.334 . 0 0 "[ . 1 . 2]" 1
268 1 77 GLU HA 1 104 LYS HA 5.084 4.067 6.101 4.241 3.644 4.572 0.423 1 0 "[ . 1 . 2]" 1
269 1 77 GLU HA 1 105 VAL H 4.576 3.661 4.734 3.345 3.115 3.798 0.546 6 1 "[ .+ 1 . 2]" 1
270 1 77 GLU QB 1 79 THR HG1 5.005 4.004 6.006 3.330 2.816 3.840 1.188 6 13 "[* **+ *-* **.* ***]" 1
271 1 76 LEU HA 1 77 GLU QB 5.627 4.502 6.752 4.104 3.959 4.265 0.543 2 1 "[ + . 1 . 2]" 1
272 1 77 GLU QB 1 78 ASP H . 4.194 4.460 3.687 3.464 3.872 0.730 15 9 "[*** ** -*1 +* 2]" 1
273 1 77 GLU H 1 77 GLU QB . 3.611 3.829 2.269 2.199 2.333 1.412 3 20 [**+*******-*********] 1
274 1 77 GLU H 1 77 GLU QG . 4.474 4.742 3.970 3.918 4.015 0.556 18 12 "[****. * * -** +**]" 1
275 1 77 GLU QG 1 79 THR HG1 4.791 4.023 5.749 2.888 2.057 4.266 1.966 14 15 "[* *-* **** *+** ***]" 1
276 1 34 LEU QD 1 77 GLU QG 4.725 3.780 5.670 3.915 3.166 4.881 0.614 5 1 "[ + 1 . 2]" 1
277 1 29 SER HA 1 77 GLU QG 4.546 3.637 5.455 4.074 3.189 5.039 0.448 15 0 "[ . 1 . 2]" 1
278 1 36 GLU HA 1 36 GLU QG 4.313 3.450 5.176 2.601 2.312 2.952 1.138 15 19 "[** ***-*******+*****]" 1
279 1 36 GLU H 1 36 GLU QG . 3.377 3.950 3.488 2.119 4.051 1.258 2 6 "[ +*-. 1* * *2]" 1
280 1 78 ASP QB 1 106 THR HG1 5.174 4.139 6.209 5.475 3.975 6.537 0.328 8 0 "[ . 1 . 2]" 1
281 1 24 LEU QB 1 48 TYR QB 5.661 4.529 6.793 4.025 2.724 4.810 1.805 7 8 "[ .*+ ** * .* -*]" 1
282 1 79 THR HA 1 79 THR HB 3.429 2.743 4.115 2.871 2.500 3.026 0.243 2 0 "[ . 1 . 2]" 1
283 1 79 THR HB 1 79 THR HG1 3.423 2.738 4.108 2.617 2.264 2.860 0.474 19 0 "[ . 1 . 2]" 1
284 1 80 LYS HA 1 80 LYS QG 3.756 3.005 4.507 2.637 2.355 3.358 0.650 15 13 "[ -**.* **1* +*****]" 1
285 1 80 LYS HA 1 81 ASP HA 3.895 3.116 4.674 4.756 4.616 4.847 0.173 20 0 "[ . 1 . 2]" 1
286 1 80 LYS HA 1 81 ASP H 5.126 4.101 5.440 3.534 3.480 3.561 0.621 3 20 [**+****************-] 1
287 1 82 ALA HA 1 86 LYS H 4.653 3.722 5.140 3.903 3.625 4.290 0.097 19 0 "[ . 1 . 2]" 1
288 1 82 ALA HA 1 84 LYS H 4.897 3.918 5.204 4.069 3.804 4.342 0.114 17 0 "[ . 1 . 2]" 1
289 1 82 ALA HA 1 85 VAL H 4.178 3.342 4.790 3.229 2.998 3.601 0.344 2 0 "[ . 1 . 2]" 1
290 1 28 TRP HE3 1 82 ALA HA 5.032 4.026 6.038 4.041 3.000 6.241 1.026 6 4 "[- * .+ * 1 . 2]" 1
291 1 82 ALA HA 1 85 VAL HB 4.073 3.850 4.888 3.121 2.838 4.198 1.012 4 17 "[***+*-***** * .*****]" 1
292 1 76 LEU QD 1 82 ALA HA 4.434 3.547 5.321 3.380 2.382 4.237 1.165 14 4 "[ . * 1* -+. 2]" 1
293 1 82 ALA HA 1 85 VAL QG 4.272 4.266 5.126 2.264 1.801 2.895 2.465 12 20 [**********-+********] 1
294 1 76 LEU QD 1 82 ALA MB 4.997 3.998 5.996 2.542 1.723 3.305 2.275 12 20 [*-*********+********] 1
295 1 82 ALA MB 1 104 LYS QG 5.253 4.202 6.304 4.755 3.745 5.936 0.457 11 0 "[ . 1 . 2]" 1
296 1 79 THR HA 1 82 ALA MB 5.616 4.493 6.739 4.019 3.734 4.441 0.759 16 10 "[ ** -**1 * *+* *]" 1
297 1 76 LEU QD 1 83 ASP HA 4.834 3.867 5.801 4.308 2.965 5.618 0.902 5 1 "[ + 1 . 2]" 1
298 1 83 ASP HA 1 86 LYS QG 4.699 3.759 5.639 4.511 3.591 5.330 0.168 7 0 "[ . 1 . 2]" 1
299 1 83 ASP HA 1 86 LYS QB 3.389 2.941 4.067 2.737 2.346 3.348 0.595 16 5 "[- * . ** 1 .+ 2]" 1
300 1 82 ALA HA 1 83 ASP HA 5.403 4.322 6.484 4.734 4.604 4.778 . 0 0 "[ . 1 . 2]" 1
301 1 83 ASP HA 1 86 LYS HA 5.303 4.242 6.364 5.464 4.835 6.142 . 0 0 "[ . 1 . 2]" 1
302 1 83 ASP HA 1 85 VAL H 5.307 4.246 6.368 4.478 4.186 4.819 0.060 1 0 "[ . 1 . 2]" 1
303 1 83 ASP HA 1 84 LYS H 4.309 3.447 4.537 3.468 3.425 3.544 0.022 17 0 "[ . 1 . 2]" 1
304 1 83 ASP HA 1 86 LYS H 3.836 3.069 4.397 3.572 3.099 4.115 . 0 0 "[ . 1 . 2]" 1
305 1 83 ASP QB 1 84 LYS H . 3.898 4.141 2.834 2.676 3.535 1.222 19 18 "[ ***************-*+2]" 1
306 1 83 ASP H 1 83 ASP QB . 3.625 3.728 2.301 2.207 2.477 1.418 10 20 [-********+**********] 1
307 1 84 LYS HA 1 85 VAL H . 3.826 4.748 3.532 3.476 3.556 0.350 18 0 "[ . 1 . 2]" 1
308 1 84 LYS H 1 84 LYS HA 3.645 2.916 3.668 2.860 2.820 2.895 0.096 11 0 "[ . 1 . 2]" 1
309 1 84 LYS HA 1 84 LYS QB 2.892 2.314 3.470 2.334 2.164 2.452 0.150 14 0 "[ . 1 . 2]" 1
310 1 84 LYS QB 1 85 VAL H . 3.595 3.869 2.758 2.261 3.546 1.334 11 15 "[ ** * ****+* ***-**]" 1
311 1 84 LYS QB 1 85 VAL QG 5.313 4.564 6.376 3.378 2.718 4.710 1.846 11 18 "[***** ****+** -*****]" 1
312 1 85 VAL HA 1 88 GLU H 4.349 3.479 4.518 3.349 2.946 3.826 0.533 12 1 "[ . 1 + . 2]" 1
313 1 85 VAL HA 1 86 LYS H 4.779 3.823 4.871 3.524 3.487 3.551 0.336 6 0 "[ . 1 . 2]" 1
314 1 85 VAL HA 1 88 GLU QG 4.716 3.773 5.659 3.195 1.987 3.929 1.786 17 10 "[ **-** 1 * **+ *]" 1
315 1 84 LYS QB 1 85 VAL HA 4.718 3.774 5.662 4.009 3.715 4.554 0.059 7 0 "[ . 1 . 2]" 1
316 1 85 VAL HB 1 86 LYS H . 3.775 4.003 3.007 2.714 4.122 1.061 17 16 "[***** ***** * .-+***]" 1
317 1 76 LEU QD 1 85 VAL HB 5.247 4.198 6.296 3.296 2.299 5.489 1.899 8 15 "[***** *+*** * .**- *]" 1
318 1 85 VAL QG 1 89 ILE QG 5.403 4.322 6.484 2.192 1.866 2.639 2.456 9 20 [********+**********-] 1
319 1 85 VAL QG 1 89 ILE MD 4.604 3.798 5.525 2.907 2.440 3.259 1.358 16 20 [**************-+****] 1
320 1 84 LYS H 1 85 VAL QG . 4.672 4.721 3.556 3.351 3.912 1.321 1 20 [+****-**************] 1
321 1 85 VAL QG 1 86 LYS HA 5.149 4.672 6.179 3.750 3.115 4.132 1.557 6 20 [*****+**-***********] 1
322 1 86 LYS HA 1 102 ILE MG . 3.902 4.536 3.991 3.307 4.736 0.595 10 1 "[ . + . 2]" 1
323 1 86 LYS HA 1 86 LYS QG 3.901 3.121 4.681 2.603 2.366 3.201 0.755 11 16 "[-***** *+ ********]" 1
324 1 86 LYS HA 1 86 LYS QD 4.610 3.688 5.532 3.690 2.346 4.227 1.342 7 5 "[ * . + *1-* . 2]" 1
325 1 86 LYS HA 1 89 ILE HB 4.440 3.552 5.328 3.178 2.631 3.827 0.921 5 5 "[* +* - . *2]" 1
326 1 86 LYS HA 1 88 GLU H 4.670 3.736 5.189 4.465 4.057 4.655 . 0 0 "[ . 1 . 2]" 1
327 1 86 LYS HA 1 89 ILE H 4.954 3.963 5.945 3.822 3.354 4.251 0.609 6 2 "[ -+ 1 . 2]" 1
328 1 76 LEU QD 1 86 LYS QB 4.481 3.585 5.377 2.283 2.012 3.359 1.573 17 19 "[************-***+ **]" 1
329 1 86 LYS QB 1 88 GLU H 5.056 4.045 6.067 4.679 4.435 4.954 . 0 0 "[ . 1 . 2]" 1
330 1 86 LYS QB 1 104 LYS QG 4.734 3.787 5.681 4.912 3.986 5.519 . 0 0 "[ . 1 . 2]" 1
331 1 31 ASP HA 1 32 LYS QB 5.168 4.134 6.202 4.450 4.058 4.690 0.076 19 0 "[ . 1 . 2]" 1
332 1 89 ILE HA 1 92 LYS H . 3.950 4.655 3.517 3.198 3.819 0.752 9 7 "[ -* +1* **. * 2]" 1
333 1 89 ILE HA 1 93 ALA H 5.419 4.335 5.485 3.964 3.604 4.553 0.731 5 8 "[ * + * 1- ** * *2]" 1
334 1 89 ILE HA 1 92 LYS QG 3.995 3.196 4.794 3.098 1.918 4.226 1.278 5 7 "[ * + * *- .* *]" 1
335 1 89 ILE HA 1 93 ALA MB 4.913 3.930 5.896 4.433 3.820 5.141 0.110 5 0 "[ . 1 . 2]" 1
336 1 89 ILE H 1 89 ILE HB . 3.290 3.593 2.505 2.422 2.604 0.868 1 20 [+**************-****] 1
337 1 89 ILE MG 1 90 GLU H . 3.715 4.030 3.410 2.970 3.578 0.745 1 2 "[+ . 1 . -2]" 1
338 1 89 ILE H 1 89 ILE MG . 3.582 3.679 3.768 3.752 3.788 0.109 5 0 "[ . 1 . 2]" 1
339 1 89 ILE MG 1 93 ALA H . 4.268 4.829 3.901 3.577 4.365 0.691 14 8 "[ **- *1* +. * *2]" 1
340 1 89 ILE MG 1 90 GLU HA 4.546 3.637 5.455 3.371 2.923 3.587 0.714 1 1 "[+ . 1 . 2]" 1
341 1 85 VAL QG 1 89 ILE MG 5.311 4.249 6.373 4.220 3.824 4.732 0.425 14 0 "[ . 1 . 2]" 1
342 1 90 GLU HA 1 91 LYS H . 3.752 4.439 3.533 3.493 3.556 0.259 8 0 "[ . 1 . 2]" 1
343 1 90 GLU HA 1 90 GLU QG 3.640 3.397 4.368 2.563 2.338 3.089 1.059 7 18 "[****-*+*** * *******]" 1
344 1 91 LYS H 1 91 LYS HA . 2.924 3.574 2.821 2.767 2.862 0.157 8 0 "[ . 1 . 2]" 1
345 1 91 LYS HA 1 94 ARG QD 4.709 3.767 5.651 3.770 2.632 5.769 1.135 17 8 "[ * .* * 1 *-. +**2]" 1
346 1 121 GLU H 1 121 GLU HA . 2.834 3.401 2.818 2.259 2.940 0.575 15 3 "[ .- 1 +* 2]" 1
347 1 121 GLU HA 1 121 GLU QG 4.163 3.330 4.352 2.784 2.331 3.354 0.999 15 10 "[* .* -*** *+* * 2]" 1
348 1 93 ALA HA 1 98 LEU QB 4.704 4.002 5.645 2.972 2.806 3.570 1.196 7 19 "[******+********** *-]" 1
349 1 41 MET H 1 42 ALA MB 5.030 4.024 6.036 4.254 4.107 4.443 . 0 0 "[ . 1 . 2]" 1
350 1 42 ALA MB 1 49 LEU HA 5.467 4.374 6.560 4.546 3.899 5.118 0.475 17 0 "[ . 1 . 2]" 1
351 1 93 ALA MB 1 94 ARG HA 5.051 4.041 6.061 3.852 3.743 3.947 0.298 13 0 "[ . 1 . 2]" 1
352 1 42 ALA MB 1 43 GLU QG 5.284 4.227 6.341 4.970 3.089 5.528 1.138 12 3 "[ .- 1 + * 2]" 1
353 1 90 GLU QG 1 93 ALA MB 5.501 4.401 6.601 4.091 2.965 5.147 1.436 8 4 "[* .- + 1 .* 2]" 1
354 1 94 ARG HA 1 94 ARG QD 4.459 3.567 5.351 3.690 1.942 4.566 1.625 4 4 "[- +. 1** . 2]" 1
355 1 96 LYS HA 1 96 LYS HG2 3.536 2.829 4.243 3.225 2.393 3.884 0.436 16 0 "[ . 1 . 2]" 1
356 1 96 LYS QB 1 98 LEU QD 4.591 3.673 5.509 3.159 2.449 4.127 1.224 20 10 "[** **- *1* *.* +]" 1
357 1 97 ASN H 1 97 ASN HA 3.434 2.747 3.599 2.262 2.248 2.273 0.499 9 0 "[ . 1 . 2]" 1
358 1 97 ASN HA 1 98 LEU QB 4.857 3.886 5.828 4.730 4.401 5.053 . 0 0 "[ . 1 . 2]" 1
359 1 46 ASN H 1 46 ASN HB2 . 3.743 4.204 3.353 3.066 3.548 0.677 13 8 "[* *. - * + * **]" 1
360 1 98 LEU HA 1 98 LEU QD 3.982 3.186 4.778 2.112 1.946 2.969 1.240 5 19 "[****+*-********** **]" 1
361 1 70 VAL HB 1 98 LEU QD 5.050 4.040 6.060 4.407 2.808 5.564 1.232 1 3 "[+ . * 1 . -]" 1
362 1 70 VAL QG 1 98 LEU QD 5.114 4.091 6.137 4.027 2.748 4.938 1.343 13 5 "[* . - 1 +** 2]" 1
363 1 99 PRO HA 1 100 VAL H . 2.616 3.203 2.158 2.104 2.245 0.512 8 1 "[ . + 1 . 2]" 1
364 1 99 PRO HA 1 100 VAL HB 5.338 4.270 6.406 5.346 4.427 5.804 . 0 0 "[ . 1 . 2]" 1
365 1 99 PRO HA 1 100 VAL QG 4.492 3.594 5.390 3.466 3.232 3.724 0.362 13 0 "[ . 1 . 2]" 1
366 1 93 ALA MB 1 99 PRO HA 4.846 3.877 5.815 4.356 3.190 5.344 0.687 8 2 "[ . + 1 - . 2]" 1
367 1 99 PRO QB 1 100 VAL H . 4.183 4.358 3.379 2.906 3.494 1.277 13 20 [***********-+*******] 1
368 1 98 LEU HA 1 99 PRO QD 3.906 3.209 4.687 1.968 1.826 2.055 1.383 16 20 [*********-*****+****] 1
369 1 98 LEU QB 1 99 PRO QD 5.423 4.486 6.127 3.477 2.916 3.805 1.570 20 20 [*********-*********+] 1
370 1 98 LEU HA 1 99 PRO QG 5.301 4.241 6.361 3.871 3.700 3.959 0.541 16 1 "[ . 1 .+ 2]" 1
371 1 71 LYS HA 1 99 PRO QG 5.163 4.130 6.196 4.648 3.029 6.834 1.101 5 3 "[* + 1 - . 2]" 1
372 1 100 VAL HA 1 101 ARG H . 2.904 3.432 2.183 2.134 2.255 0.770 8 20 [*******+*******-****] 1
373 1 100 VAL HA 1 100 VAL QG 3.848 3.078 4.618 2.256 2.116 2.365 0.962 18 20 [***************-*+**] 1
374 1 100 VAL HB 1 101 ARG H 4.986 3.989 5.983 3.464 2.942 4.356 1.047 16 13 "[ -* *** ** ***.+* *2]" 1
375 1 100 VAL H 1 100 VAL HB . 3.727 4.216 3.491 2.667 3.855 1.060 8 6 "[* -. + 1 * * *]" 1
376 1 93 ALA MB 1 100 VAL HB 4.292 3.434 5.150 3.678 2.520 4.426 0.914 4 6 "[* +. * 1 - * *]" 1
377 1 100 VAL QG 1 101 ARG H . 3.850 3.850 3.157 2.318 3.585 1.532 4 7 "[* +. * 1* - * *]" 1
378 1 74 VAL QG 1 90 GLU HA 4.966 3.973 5.959 5.574 4.802 6.059 0.100 6 0 "[ . 1 . 2]" 1
379 1 74 VAL QG 1 76 LEU QB 3.517 2.814 4.220 3.354 2.321 4.496 0.493 15 0 "[ . 1 . 2]" 1
380 1 101 ARG HA 1 102 ILE H . 2.839 3.444 2.165 2.120 2.216 0.719 16 20 [*************-*+****] 1
381 1 100 VAL QG 1 101 ARG HA 4.636 3.709 5.563 3.810 3.396 4.190 0.313 4 0 "[ . 1 . 2]" 1
382 1 73 LEU HA 1 101 ARG QB 5.277 4.423 6.332 2.667 2.116 3.487 2.307 12 20 [***********+*****-**] 1
383 1 101 ARG QD 1 118 PHE QD 5.072 4.058 6.086 4.849 3.003 6.368 1.055 7 2 "[ . + 1 . -]" 1
384 1 101 ARG HA 1 101 ARG QD 4.814 3.851 5.777 3.607 1.930 4.230 1.921 12 5 "[ -* . **+ . 2]" 1
385 1 102 ILE HB 1 102 ILE MD 4.045 3.266 4.854 2.462 2.438 2.585 0.828 17 20 [****************+-**] 1
386 1 86 LYS QG 1 102 ILE HB 5.280 4.224 6.336 4.454 3.629 5.704 0.595 6 1 "[ .+ 1 . 2]" 1
387 1 76 LEU QD 1 102 ILE HB 4.184 3.347 5.021 4.526 3.944 5.001 . 0 0 "[ . 1 . 2]" 1
388 1 86 LYS QG 1 102 ILE MD 4.423 3.538 5.308 2.613 2.009 4.253 1.529 20 17 "[****** * ** ******-+]" 1
389 1 74 VAL HB 1 102 ILE MD 4.645 3.716 5.574 4.137 2.833 5.604 0.883 18 1 "[ . 1 . + 2]" 1
390 1 102 ILE HA 1 102 ILE MD 5.397 4.318 6.476 3.825 3.713 3.877 0.605 18 7 "[ * *. * 1* - + *]" 1
391 1 76 LEU QD 1 102 ILE MD 3.370 2.696 4.044 3.082 2.274 3.578 0.422 1 0 "[ . 1 . 2]" 1
392 1 90 GLU HA 1 102 ILE QG 6.135 4.908 7.362 5.024 4.653 5.317 0.255 18 0 "[ . 1 . 2]" 1
393 1 74 VAL HB 1 102 ILE QG 4.555 3.783 5.466 2.657 1.800 4.265 1.983 18 14 "[***** * **- * * *+*2]" 1
394 1 86 LYS QE 1 102 ILE MG 5.037 4.075 6.044 3.719 2.235 4.873 1.840 7 8 "[ .*+ 1*** * -*]" 1
395 1 102 ILE H 1 102 ILE MG . 3.986 4.351 3.806 3.767 3.846 0.219 8 0 "[ . 1 . 2]" 1
396 1 103 ARG HA 1 104 LYS H . 2.846 3.403 2.199 2.131 2.368 0.715 6 18 "[*****+**-1 *********]" 1
397 1 103 ARG HA 1 103 ARG QD 4.805 3.844 5.479 3.182 1.966 4.687 1.878 4 10 "[***+. -* 1 * *.* *]" 1
398 1 78 ASP QB 1 104 LYS HA 5.264 4.211 6.317 4.990 4.154 6.274 0.057 6 0 "[ . 1 . 2]" 1
399 1 76 LEU QB 1 104 LYS HA 4.035 3.228 4.842 2.834 2.318 3.396 0.910 13 6 "[ - * * 1 *+*. 2]" 1
400 1 104 LYS HA 1 105 VAL QG 5.219 4.474 5.670 3.397 3.308 3.540 1.166 20 20 [**********-********+] 1
401 1 76 LEU QD 1 104 LYS HA 5.118 4.094 6.142 4.187 3.242 4.817 0.852 12 2 "[ - 1 + . 2]" 1
402 1 76 LEU QB 1 104 LYS QB 4.233 3.386 5.080 4.039 3.400 4.588 . 0 0 "[ . 1 . 2]" 1
403 1 31 ASP H 1 31 ASP QB . 3.684 3.845 2.475 2.443 2.533 1.241 5 20 [****+*************-*] 1
404 1 105 VAL HB 1 111 ALA MB 4.843 3.874 5.812 4.355 4.022 4.887 . 0 0 "[ . 1 . 2]" 1
405 1 105 VAL HB 1 110 GLU QB 5.103 4.082 6.124 2.860 2.255 3.205 1.827 3 20 [*-+*****************] 1
406 1 105 VAL HB 1 106 THR HA 5.181 4.145 6.217 4.079 3.880 4.296 0.265 20 0 "[ . 1 . 2]" 1
407 1 105 VAL HB 1 111 ALA H 5.427 4.342 6.512 4.524 4.143 5.042 0.199 12 0 "[ . 1 . 2]" 1
408 1 105 VAL H 1 105 VAL HB . 3.990 4.392 3.892 3.835 3.948 0.155 4 0 "[ . 1 . 2]" 1
409 1 105 VAL HB 1 106 THR H . 4.020 4.339 2.988 2.917 3.171 1.103 19 20 [******-***********+*] 1
410 1 105 VAL QG 1 111 ALA MB 4.092 3.331 4.844 3.024 2.621 3.369 0.710 18 4 "[ * . 1 .-*+ 2]" 1
411 1 76 LEU H 1 105 VAL QG . 4.029 4.206 3.265 2.788 3.840 1.241 4 14 "[ **+*****- **** *]" 1
412 1 78 ASP H 1 105 VAL QG . 4.236 4.614 5.398 4.440 5.889 1.275 2 18 "[*+*** ***1*-********]" 1
413 1 105 VAL QG 1 110 GLU QG 5.058 4.046 6.070 3.719 2.127 4.384 1.919 18 6 "[ . **1 * .- + *]" 1
414 1 105 VAL QG 1 110 GLU QB 4.559 4.019 5.471 2.766 2.252 3.188 1.767 20 20 [*****************-*+] 1
415 1 105 VAL QG 1 111 ALA HA 4.239 3.955 4.244 2.965 2.470 3.291 1.485 18 20 [********-********+**] 1
416 1 105 VAL QG 1 114 TRP HD1 4.140 3.312 4.968 2.462 2.176 2.976 1.136 3 19 "[*-+******* *********]" 1
417 1 105 VAL QG 1 111 ALA H . 4.200 4.336 3.870 3.452 4.161 0.748 18 5 "[ . 1* .**+-2]" 1
418 1 105 VAL QG 1 107 SER H . 4.299 4.433 3.567 3.152 3.965 1.147 18 17 "[***-*** **** ****+*2]" 1
419 1 106 THR HB 1 107 SER H . 4.023 4.661 4.417 4.367 4.472 . 0 0 "[ . 1 . 2]" 1
420 1 106 THR HA 1 106 THR HB 3.152 2.522 3.782 2.711 2.354 3.034 0.168 8 0 "[ . 1 . 2]" 1
421 1 106 THR HB 1 106 THR HG1 3.033 2.426 3.640 2.458 2.081 2.817 0.345 15 0 "[ . 1 . 2]" 1
422 1 107 SER HA 1 108 PRO QD 3.134 2.842 3.761 1.943 1.868 2.043 0.974 19 20 [************-*****+*] 1
423 1 107 SER HA 1 108 PRO QG 4.617 4.295 5.540 3.848 3.778 3.941 0.517 19 2 "[ . 1 . - +2]" 1
424 1 34 LEU QD 1 107 SER HA 4.612 3.690 5.534 3.370 2.534 4.078 1.156 9 5 "[* * +1 * .- 2]" 1
425 1 106 THR HA 1 107 SER QB 4.470 3.576 4.826 4.440 4.214 4.703 . 0 0 "[ . 1 . 2]" 1
426 1 107 SER QB 1 109 ASP QB 5.545 4.436 6.654 3.845 2.860 4.730 1.576 9 11 "[ * ***-*+1 * ** * 2]" 1
427 1 27 ILE MD 1 29 SER QB 5.155 4.124 6.186 3.368 2.719 4.612 1.405 5 16 "[ ***+*** * ** -*****]" 1
428 1 108 PRO HA 1 111 ALA H . 3.582 4.406 3.722 3.492 4.073 0.090 10 0 "[ . 1 . 2]" 1
429 1 108 PRO HA 1 108 PRO QD 4.114 3.291 4.937 3.312 3.123 3.429 0.168 13 0 "[ . 1 . 2]" 1
430 1 34 LEU HA 1 108 PRO HA 4.399 3.519 5.279 3.000 2.540 3.631 0.979 14 10 "[ **** 1***+* -]" 1
431 1 108 PRO HA 1 112 LYS QD 4.126 3.301 4.951 4.473 3.408 5.477 0.526 6 1 "[ .+ 1 . 2]" 1
432 1 108 PRO HA 1 111 ALA MB 3.445 3.387 4.134 2.742 2.391 3.161 0.996 14 14 "[* *- ***** +*** **]" 1
433 1 107 SER QB 1 108 PRO QD 3.928 3.142 4.714 3.163 2.415 3.662 0.727 13 3 "[ . 1 -+ . *]" 1
434 1 34 LEU QD 1 108 PRO QD 4.557 3.646 5.468 3.083 2.183 3.990 1.463 9 12 "[** ** * +* * .*-**2]" 1
435 1 34 LEU HG 1 108 PRO QG 5.279 4.223 6.335 5.042 2.786 6.922 1.437 8 6 "[ * *. *+ - . *]" 1
436 1 34 LEU QD 1 108 PRO QG 5.577 4.462 6.692 3.809 2.243 4.770 2.219 9 9 "[* ** -*+1 .* **2]" 1
437 1 109 ASP QB 1 112 LYS QB 5.177 4.142 6.212 4.633 4.006 5.172 0.136 18 0 "[ . 1 . 2]" 1
438 1 109 ASP QB 1 110 GLU H . 3.442 3.964 2.586 2.292 3.455 1.150 16 17 "[** ************+- *2]" 1
439 1 109 ASP QB 1 112 LYS H 4.651 3.721 5.320 5.099 4.865 5.353 0.033 9 0 "[ . 1 . 2]" 1
440 1 109 ASP QB 1 110 GLU HA 4.887 3.910 5.864 4.037 3.756 4.350 0.154 13 0 "[ . 1 . 2]" 1
441 1 110 GLU HA 1 110 GLU QG 3.727 2.982 4.472 2.622 2.132 3.042 0.850 20 8 "[* ** 1*- *. * +]" 1
442 1 110 GLU HA 1 113 ARG QB . 3.930 4.604 2.550 2.116 2.879 1.814 7 20 [*****-+*************] 1
443 1 110 GLU HA 1 111 ALA MB 4.955 3.964 5.946 5.021 4.979 5.042 . 0 0 "[ . 1 . 2]" 1
444 1 110 GLU HA 1 113 ARG H . 3.436 4.188 3.409 3.011 3.708 0.425 7 0 "[ . 1 . 2]" 1
445 1 110 GLU HA 1 111 ALA H . 3.689 4.592 3.531 3.498 3.560 0.191 6 0 "[ . 1 . 2]" 1
446 1 110 GLU HA 1 114 TRP H . 4.120 4.831 4.175 3.898 4.658 0.222 20 0 "[ . 1 . 2]" 1
447 1 107 SER H 1 110 GLU QB . 4.413 4.510 3.903 3.246 4.365 1.167 3 9 "[ +-. *** ** . * *]" 1
448 1 111 ALA HA 1 114 TRP HD1 4.527 3.622 5.432 3.010 2.684 3.468 0.938 5 13 "[ * +* ** -*******2]" 1
449 1 111 ALA HA 1 113 ARG H 5.047 4.038 6.056 4.256 4.081 4.431 . 0 0 "[ . 1 . 2]" 1
450 1 111 ALA HA 1 114 TRP H 4.887 3.910 5.864 3.750 3.492 3.997 0.418 2 0 "[ . 1 . 2]" 1
451 1 111 ALA HA 1 112 LYS H . 3.775 4.460 3.546 3.506 3.579 0.269 20 0 "[ . 1 . 2]" 1
452 1 111 ALA HA 1 114 TRP QB 4.769 3.815 5.723 3.398 3.045 3.819 0.770 5 7 "[** + ** * . -2]" 1
453 1 108 PRO QB 1 111 ALA MB 4.491 3.593 5.389 4.209 3.946 4.614 . 0 0 "[ . 1 . 2]" 1
454 1 34 LEU QB 1 111 ALA MB 4.745 3.796 5.694 4.482 3.912 5.101 . 0 0 "[ . 1 . 2]" 1
455 1 75 LEU HG 1 111 ALA MB 4.764 3.811 5.717 4.306 3.175 5.251 0.636 12 2 "[ .- 1 + . 2]" 1
456 1 49 LEU QD 1 111 ALA MB 4.835 3.868 5.802 5.207 4.479 6.322 0.520 10 1 "[ . + . 2]" 1
457 1 112 LYS HA 1 113 ARG H 4.898 3.918 5.878 3.504 3.471 3.530 0.447 15 0 "[ . 1 . 2]" 1
458 1 112 LYS HA 1 115 ILE H 4.439 3.551 4.562 3.732 3.298 4.265 0.253 2 0 "[ . 1 . 2]" 1
459 1 41 MET QG 1 112 LYS HA 4.596 3.677 5.087 2.335 1.946 2.887 1.731 20 20 [****************-**+] 1
460 1 41 MET QB 1 112 LYS HA 4.168 3.334 5.002 3.120 2.688 3.564 0.646 5 2 "[ + - 1 . 2]" 1
461 1 112 LYS HA 1 112 LYS QG 4.080 3.264 4.746 2.457 2.356 2.543 0.908 10 20 [*********+****-*****] 1
462 1 112 LYS HA 1 112 LYS QD 4.469 3.575 5.363 4.178 3.991 4.256 . 0 0 "[ . 1 . 2]" 1
463 1 112 LYS HA 1 115 ILE MD . 4.158 4.610 2.742 2.275 3.702 1.883 10 19 [***-*****+*********2] 1
464 1 113 ARG HA 1 116 LYS H 4.316 3.453 5.179 3.593 3.325 3.888 0.128 19 0 "[ . 1 . 2]" 1
465 1 113 ARG HA 1 114 TRP H . 3.614 4.050 3.566 3.506 3.583 0.108 17 0 "[ . 1 . 2]" 1
466 1 113 ARG HA 1 117 GLU H 4.646 3.717 5.575 4.146 3.819 4.571 . 0 0 "[ . 1 . 2]" 1
467 1 113 ARG HA 1 116 LYS QB 3.761 3.009 4.513 3.005 2.388 4.421 0.621 19 2 "[ .- 1 . +2]" 1
468 1 113 ARG HA 1 113 ARG QG 3.369 3.310 4.043 2.484 2.392 2.654 0.918 11 20 [******-***+*********] 1
469 1 113 ARG H 1 113 ARG QD . 4.398 5.183 4.465 4.273 4.776 0.125 18 0 "[ . 1 . 2]" 1
470 1 113 ARG HA 1 113 ARG QD 5.542 4.492 6.650 4.041 3.876 4.290 0.616 5 5 "[* + - * . * 2]" 1
471 1 110 GLU HA 1 113 ARG QD 5.489 4.536 6.587 3.489 2.929 4.182 1.607 15 19 [**************+*-**2] 1
472 1 103 ARG QG 1 114 TRP QB 5.092 4.158 6.110 4.420 3.153 5.526 1.005 3 3 "[ + . - 1 . *]" 1
473 1 115 ILE HA 1 118 PHE H 4.471 3.577 5.365 3.754 3.312 4.014 0.265 15 0 "[ . 1 . 2]" 1
474 1 115 ILE HA 1 118 PHE QD 4.970 3.976 5.964 4.328 3.638 5.458 0.338 15 0 "[ . 1 . 2]" 1
475 1 115 ILE HA 1 118 PHE QB 4.229 3.383 5.075 3.195 2.511 3.577 0.872 15 1 "[ . 1 + 2]" 1
476 1 73 LEU HG 1 115 ILE HA 4.566 3.653 5.479 5.320 3.294 6.443 0.964 10 1 "[ . + . 2]" 1
477 1 47 LEU QD 1 115 ILE HA 4.376 3.501 5.251 3.816 3.290 4.981 0.211 2 0 "[ . 1 . 2]" 1
478 1 115 ILE HA 1 115 ILE MG 3.318 2.654 3.982 2.445 2.363 2.512 0.291 17 0 "[ . 1 . 2]" 1
479 1 41 MET QG 1 115 ILE HB 4.983 4.162 5.980 2.945 2.100 3.983 2.062 8 18 "[*******+*** *-*****2]" 1
480 1 115 ILE H 1 115 ILE MD 5.041 4.033 6.049 3.626 3.550 3.694 0.483 17 0 "[ . 1 . 2]" 1
481 1 42 ALA HA 1 115 ILE MD 5.374 4.299 6.449 3.753 3.220 4.382 1.079 11 12 "[****.** -1+ *** *2]" 1
482 1 115 ILE HA 1 115 ILE MD 5.081 4.065 6.097 3.811 3.768 3.850 0.297 2 0 "[ . 1 . 2]" 1
483 1 111 ALA MB 1 115 ILE MD 4.709 3.767 5.651 3.170 2.815 3.559 0.952 3 15 "[*-+** *** ** * ****]" 1
484 1 25 VAL QG 1 115 ILE MD 4.598 3.678 5.518 2.767 2.338 3.343 1.340 4 18 "[*-*+****** **** ****]" 1
485 1 41 MET HA 1 115 ILE MG 5.642 4.514 6.770 4.616 4.198 5.107 0.316 14 0 "[ . 1 . 2]" 1
486 1 116 LYS HA 1 117 GLU H 4.367 3.494 4.446 3.506 3.431 3.578 0.063 4 0 "[ . 1 . 2]" 1
487 1 45 ALA MB 1 116 LYS HA 3.606 2.885 4.327 4.070 2.599 5.014 0.687 15 1 "[ . 1 + 2]" 1
488 1 117 GLU HA 1 117 GLU QG 4.027 3.351 4.832 2.823 2.291 3.355 1.060 4 7 "[* +. *1 ***.- 2]" 1
489 1 40 LYS HA 1 43 GLU QG 4.366 3.493 5.239 4.191 2.898 4.788 0.595 6 1 "[ .+ 1 . 2]" 1
490 1 117 GLU HA 1 120 GLU H . 3.617 4.130 3.894 3.387 4.719 0.589 6 1 "[ .+ 1 . 2]" 1
491 1 117 GLU QB 1 118 PHE H . 4.096 4.246 2.816 2.382 3.720 1.714 8 19 [****.**+*********-**] 1
492 1 118 PHE HA 1 121 GLU QG 4.449 3.559 5.312 3.709 2.219 5.774 1.340 4 6 "[ *+* * 1 *- . 2]" 1
493 1 47 LEU QD 1 118 PHE HA 4.924 3.939 5.909 5.645 4.698 6.118 0.209 13 0 "[ . 1 . 2]" 1
494 1 118 PHE HA 1 118 PHE QD 3.740 2.992 4.488 2.974 2.361 3.082 0.631 20 1 "[ . 1 . +]" 1
495 1 118 PHE HA 1 121 GLU H . 3.811 4.711 3.788 3.171 4.737 0.640 19 2 "[ . - 1 . +2]" 1
496 1 118 PHE H 1 118 PHE QB . 3.412 3.880 2.232 2.087 2.276 1.325 20 20 [****************-**+] 1
497 1 119 SER HA 1 120 GLU H . 3.557 4.009 3.427 3.307 3.562 0.250 9 0 "[ . 1 . 2]" 1
498 1 118 PHE QD 1 119 SER HA 5.561 4.449 6.673 5.568 3.750 5.931 0.699 10 1 "[ . + . 2]" 1
499 1 119 SER HA 1 119 SER QB 3.318 2.654 3.982 2.243 2.166 2.377 0.488 14 0 "[ . 1 . 2]" 1
500 1 23 LEU QD 1 119 SER HA 4.585 3.668 4.746 2.802 1.919 4.077 1.749 13 14 "[ **.****** +*.**- *]" 1
501 1 119 SER H 1 119 SER QB . 3.552 3.902 2.631 2.289 2.855 1.263 19 20 [*****************-+*] 1
502 1 119 SER QB 1 120 GLU H 5.532 4.426 6.636 3.409 3.143 3.757 1.283 6 20 [****-+**************] 1
503 1 47 LEU QD 1 119 SER QB 4.385 3.508 4.882 2.208 1.714 3.790 1.794 3 18 "[**+*** ****-**.*****]" 1
504 1 120 GLU H 1 120 GLU HA 3.657 2.926 3.671 2.898 2.790 2.946 0.136 20 0 "[ . 1 . 2]" 1
505 1 120 GLU HA 1 120 GLU QG 3.889 3.251 4.013 2.890 2.337 3.380 0.914 6 6 "[ -* .+ *1* . *]" 1
506 1 59 ILE MD 1 72 ILE MG 3.887 3.110 4.664 3.967 2.676 4.922 0.434 16 0 "[ . 1 . 2]" 1
507 1 24 LEU QB 1 59 ILE MG 3.900 3.120 4.680 4.384 3.711 5.109 0.429 2 0 "[ . 1 . 2]" 1
508 1 59 ILE HA 1 59 ILE MG 4.186 3.349 5.023 2.506 2.438 2.688 0.911 2 20 [*+********-*********] 1
509 1 59 ILE H 1 59 ILE MG . 3.934 4.543 3.752 3.660 3.781 0.274 11 0 "[ . 1 . 2]" 1
510 1 59 ILE MG 1 60 GLU HA 4.250 3.400 5.100 3.141 2.974 3.320 0.426 17 0 "[ . 1 . 2]" 1
511 1 50 LEU QB 1 59 ILE QG 4.985 3.988 5.982 3.271 2.797 3.770 1.191 10 14 "[******* +-* * ***2]" 1
512 1 59 ILE HA 1 61 ASP H 5.651 4.521 6.781 4.480 4.157 4.884 0.364 5 0 "[ . 1 . 2]" 1
513 1 59 ILE HA 1 62 ILE QG 5.609 4.487 6.043 4.062 2.933 4.766 1.554 11 5 "[ . 1+ *.- * *]" 1
514 1 59 ILE H 1 59 ILE MD 5.285 4.228 6.342 3.577 3.403 3.866 0.825 7 18 "[******+***-** *****2]" 1
515 1 56 ASP QB 1 59 ILE MD . 4.412 5.431 5.201 3.399 6.031 1.013 18 6 "[ * . ** .* + -]" 1
516 1 50 LEU HA 1 59 ILE QG 4.640 3.712 5.568 5.750 5.386 6.075 0.507 13 1 "[ . 1 + . 2]" 1
517 1 58 LYS QG 1 62 ILE MD 5.071 4.057 6.085 4.089 2.268 5.423 1.789 16 5 "[ * * * -+ 2]" 1
518 1 58 LYS HA 1 62 ILE QG 4.928 3.942 5.914 3.960 3.205 4.571 0.737 17 2 "[ .- 1 . + 2]" 1
519 1 62 ILE QG 1 63 LEU H 5.386 4.309 6.463 4.038 3.825 4.173 0.484 18 0 "[ . 1 . 2]" 1
520 1 62 ILE MG 1 63 LEU H 4.813 3.850 5.776 3.322 3.026 3.566 0.824 11 10 "[ *** * 1+ **-* * 2]" 1
521 1 62 ILE MG 1 63 LEU HA 4.338 3.470 5.206 3.307 3.027 3.455 0.443 5 0 "[ . 1 . 2]" 1
522 1 59 ILE HA 1 62 ILE MG 4.918 3.934 5.902 4.540 3.747 5.041 0.187 11 0 "[ . 1 . 2]" 1
523 1 24 LEU HG 1 62 ILE MG 4.439 3.551 5.327 4.689 3.140 5.590 0.411 2 0 "[ . 1 . 2]" 1
524 1 62 ILE MG 1 63 LEU QD 3.857 3.086 4.628 4.357 3.382 4.906 0.278 1 0 "[ . 1 . 2]" 1
525 1 24 LEU QB 1 63 LEU QD 4.261 4.168 5.113 3.387 2.195 4.378 1.973 6 10 "[ ****+* ** * - 2]" 1
526 1 60 GLU HA 1 63 LEU QD 4.889 3.911 5.867 3.104 1.929 4.368 1.982 1 15 "[+-**.** **** .*****]" 1
527 1 59 ILE MG 1 63 LEU HG 4.586 3.669 5.503 4.087 2.755 5.582 0.914 11 5 "[ -**. 1+ * 2]" 1
528 1 52 LEU QD 1 89 ILE MD 3.293 2.634 3.952 3.165 1.804 4.640 0.830 1 10 "[+ **.* * 1 -* .* * *]" 1
529 1 26 LEU QB 1 52 LEU QD 4.172 3.338 5.006 3.291 1.886 5.560 1.452 10 10 "[* **** + * *-*2]" 1
530 1 24 LEU QD 1 50 LEU QB 4.319 3.455 5.183 3.584 3.033 4.404 0.422 17 0 "[ . 1 . 2]" 1
531 1 50 LEU MD1 1 50 LEU MD2 3.166 2.533 3.799 2.084 2.068 2.094 0.465 2 0 "[ . 1 . 2]" 1
532 1 48 TYR QB 1 48 TYR QE 4.703 3.762 5.644 3.934 3.929 3.939 . 0 0 "[ . 1 . 2]" 1
533 1 24 LEU QD 1 48 TYR QB 4.769 3.815 5.723 2.273 1.923 3.349 1.892 15 19 "[* ************+****-]" 1
534 1 48 TYR QB 1 62 ILE MD 4.699 3.759 5.639 2.828 2.046 4.423 1.713 2 14 "[*+*** **1 *-*** **]" 1
535 1 63 LEU QD 1 98 LEU QD 3.638 2.910 4.366 2.015 1.671 2.398 1.239 14 20 [*************+****-*] 1
536 1 96 LYS QB 1 98 LEU HG 5.317 4.254 6.380 4.258 2.626 6.344 1.628 14 8 "[** -* *1 +.* *]" 1
537 1 88 GLU H 1 89 ILE QG 5.026 4.021 6.031 4.261 3.916 4.550 0.105 16 0 "[ . 1 . 2]" 1
538 1 89 ILE MG 1 92 LYS QB 3.865 3.092 4.638 4.044 3.217 5.038 0.400 12 0 "[ . 1 . 2]" 1
539 1 113 ARG QG 1 117 GLU QG 5.351 4.281 6.421 3.321 2.392 5.014 1.889 9 12 "[* *.***+1* *** -*2]" 1
540 1 58 LYS HA 1 58 LYS QG 3.904 3.123 4.685 2.666 2.326 3.373 0.797 6 11 "[ -* .+* ** ** * * *]" 1
541 1 58 LYS HA 1 62 ILE MD 5.757 4.606 6.908 4.433 3.451 5.206 1.155 17 3 "[ .- * . + 2]" 1
542 1 58 LYS HA 1 61 ASP QB 4.215 3.372 5.058 3.047 2.584 3.905 0.788 6 8 "[ - *.+ **1* .* *]" 1
543 1 58 LYS HA 1 59 ILE H 4.573 3.658 5.488 3.542 3.467 3.579 0.191 4 0 "[ . 1 . 2]" 1
544 1 91 LYS H 1 91 LYS QB . 3.039 3.178 2.360 2.145 2.551 0.894 8 19 [****.**+********-***] 1
545 1 91 LYS QB 1 92 LYS H 3.908 3.126 4.690 2.511 2.391 2.772 0.735 19 16 "[**-******* ***. * +*]" 1
546 1 58 LYS H 1 58 LYS QB . 3.452 4.302 2.358 2.209 2.617 1.243 2 20 [*+*-****************] 1
547 1 60 GLU QB 1 60 GLU QG 2.797 2.238 3.356 2.066 1.992 2.089 0.246 14 0 "[ . 1 . 2]" 1
548 1 60 GLU QG 1 96 LYS QE 4.299 3.439 5.159 3.721 2.115 4.991 1.324 20 4 "[ *-* 1 . +]" 1
549 1 88 GLU HB3 1 89 ILE HA 4.925 3.940 5.910 4.391 4.058 5.608 . 0 0 "[ . 1 . 2]" 1
550 1 76 LEU QB 1 85 VAL QG 5.615 4.492 6.738 4.915 3.566 5.900 0.926 6 1 "[ .+ 1 . 2]" 1
551 1 33 LYS H 1 33 LYS HD3 4.010 3.208 4.812 4.351 2.665 5.091 0.543 7 1 "[ . + 1 . 2]" 1
552 1 109 ASP HA 1 113 ARG H 4.200 3.360 5.040 4.286 3.797 4.656 . 0 0 "[ . 1 . 2]" 1
553 1 26 LEU H 1 26 LEU QB 3.473 3.001 4.168 2.699 2.446 3.276 0.555 8 3 "[ - . + * . 2]" 1
554 1 28 TRP H 1 75 LEU H 4.273 3.418 4.993 4.162 3.451 4.729 . 0 0 "[ . 1 . 2]" 1
555 1 62 ILE H 1 62 ILE MD 4.286 3.429 5.143 3.662 3.541 3.815 . 0 0 "[ . 1 . 2]" 1
556 1 28 TRP HA 1 29 SER H . 3.029 3.487 2.154 2.043 2.206 0.986 9 20 [******-*+***********] 1
557 1 74 VAL H 1 74 VAL HB . 3.795 3.959 2.940 2.541 3.962 1.254 19 16 "[***** ***** * * **+-]" 1
558 1 101 ARG QD 1 102 ILE H 4.590 3.672 5.508 5.072 3.601 5.798 0.290 9 0 "[ . 1 . 2]" 1
559 1 80 LYS HA 1 83 ASP H 4.707 3.766 5.648 4.077 3.678 5.052 0.088 19 0 "[ . 1 . 2]" 1
560 1 101 ARG H 1 101 ARG QG 4.033 3.661 4.840 3.613 2.677 4.169 0.984 10 6 "[ *. *-+ * . * 2]" 1
561 1 112 LYS QE 1 113 ARG H 4.607 3.686 5.528 5.224 4.547 5.900 0.372 20 0 "[ . 1 . 2]" 1
562 1 110 GLU H 1 110 GLU QG 3.550 2.840 3.772 2.675 2.111 4.031 0.729 6 9 "[* .+-* * **. * *2]" 1
563 1 66 LEU H 1 67 GLY H 4.418 3.534 5.149 2.630 2.525 2.962 1.009 7 20 [*-****+*************] 1
564 1 101 ARG H 1 101 ARG QD 4.782 3.826 5.738 4.396 3.662 4.881 0.164 12 0 "[ . 1 . 2]" 1
565 1 53 GLU H 1 53 GLU QG 4.103 3.282 4.924 3.187 1.787 4.435 1.495 18 7 "[ * . * *1 *-. + *]" 1
566 1 72 ILE H 1 100 VAL HA 3.657 2.926 4.388 3.593 2.686 4.315 0.240 1 0 "[ . 1 . 2]" 1
567 1 81 ASP H 1 81 ASP HA 3.475 2.780 4.170 2.836 2.778 2.908 0.002 20 0 "[ . 1 . 2]" 1
568 1 115 ILE HA 1 117 GLU H 4.291 3.433 5.149 4.471 4.062 4.902 . 0 0 "[ . 1 . 2]" 1
569 1 60 GLU HA 1 61 ASP H 4.036 3.229 4.843 3.530 3.496 3.574 . 0 0 "[ . 1 . 2]" 1
570 1 41 MET H 1 115 ILE MG 3.765 3.012 4.518 4.908 4.314 5.269 0.751 3 9 "[* + .- *** * .* *2]" 1
571 1 50 LEU HG 1 51 THR H 4.323 3.458 5.188 4.584 3.806 5.372 0.184 9 0 "[ . 1 . 2]" 1
572 1 26 LEU H 1 26 LEU HG 3.439 2.751 4.127 2.607 2.278 3.089 0.473 11 0 "[ . 1 . 2]" 1
573 1 24 LEU H 1 71 LYS H 3.992 3.194 4.790 4.042 3.660 4.510 . 0 0 "[ . 1 . 2]" 1
574 1 37 GLU H 1 38 ALA MB 3.801 3.041 4.561 4.308 4.061 4.430 . 0 0 "[ . 1 . 2]" 1
575 1 110 GLU QB 1 114 TRP HE1 3.969 3.175 4.763 2.962 2.126 4.650 1.049 19 4 "[ . *1 *- +2]" 1
576 1 44 LYS HA 1 45 ALA H 3.365 2.692 4.038 3.516 3.424 3.577 . 0 0 "[ . 1 . 2]" 1
577 1 40 LYS H 1 42 ALA H 4.164 3.331 4.997 4.169 3.941 4.380 . 0 0 "[ . 1 . 2]" 1
578 1 85 VAL HA 1 89 ILE H 4.207 3.366 5.048 3.803 3.400 4.369 . 0 0 "[ . 1 . 2]" 1
579 1 38 ALA H 1 40 LYS H 3.865 3.421 4.638 4.213 3.976 4.459 . 0 0 "[ . 1 . 2]" 1
580 1 59 ILE HA 1 63 LEU H 4.676 3.741 5.611 3.891 3.033 4.398 0.708 14 2 "[ - 1 +. 2]" 1
581 1 49 LEU H 1 49 LEU HA 3.620 2.896 4.344 2.930 2.866 2.952 0.030 10 0 "[ . 1 . 2]" 1
582 1 24 LEU H 1 24 LEU QD 3.568 2.914 4.282 3.871 3.669 3.982 . 0 0 "[ . 1 . 2]" 1
583 1 26 LEU H 1 26 LEU QD 2.930 2.842 3.516 3.165 2.253 3.502 0.589 20 1 "[ . 1 . +]" 1
584 1 46 ASN HB3 1 47 LEU H 4.057 3.246 4.868 4.356 4.197 4.440 . 0 0 "[ . 1 . 2]" 1
585 1 102 ILE H 1 102 ILE HB . 3.522 3.730 2.560 2.446 2.639 1.076 8 20 [*******+***-********] 1
586 1 105 VAL H 1 111 ALA MB 4.576 3.661 5.491 6.264 5.656 6.477 0.986 4 18 "[*-*+************ **]" 1
587 1 110 GLU QG 1 114 TRP HE1 4.227 3.382 5.068 4.050 2.642 4.763 0.740 18 1 "[ . 1 . + 2]" 1
588 1 74 VAL HB 1 103 ARG H 3.765 3.012 4.518 4.032 3.113 5.360 0.842 8 6 "[ .* + 1 * *.- *]" 1
589 1 105 VAL HA 1 114 TRP HE1 4.537 3.630 5.444 5.521 4.958 6.431 0.987 11 2 "[ - . 1+ . 2]" 1
590 1 97 ASN H 1 98 LEU QD 4.671 3.737 5.605 5.194 4.663 5.604 . 0 0 "[ . 1 . 2]" 1
591 1 117 GLU H 1 118 PHE H 3.457 2.766 3.914 2.648 2.483 2.817 0.283 5 0 "[ . 1 . 2]" 1
592 1 88 GLU HB3 1 89 ILE H 3.453 2.762 4.144 3.528 3.150 3.993 . 0 0 "[ . 1 . 2]" 1
593 1 91 LYS HA 1 93 ALA H 3.821 3.057 4.585 4.442 4.205 4.813 0.228 7 0 "[ . 1 . 2]" 1
594 1 78 ASP QB 1 79 THR H 4.634 3.707 5.561 3.953 3.780 4.028 . 0 0 "[ . 1 . 2]" 1
595 1 40 LYS H 1 41 MET H 3.124 2.499 3.692 2.662 2.472 2.791 0.027 10 0 "[ . 1 . 2]" 1
596 1 111 ALA HA 1 114 TRP HE1 4.825 3.860 5.790 5.215 4.661 5.816 0.026 11 0 "[ . 1 . 2]" 1
597 1 71 LYS H 1 72 ILE H 4.291 3.433 5.004 4.498 4.415 4.545 . 0 0 "[ . 1 . 2]" 1
598 1 96 LYS QB 1 97 ASN H 3.980 3.325 4.776 3.451 3.250 3.953 0.075 7 0 "[ . 1 . 2]" 1
599 1 31 ASP H 1 32 LYS QE 4.053 3.242 4.864 4.783 3.901 5.537 0.673 7 5 "[ * + 1 * . * -2]" 1
600 1 35 ILE H 1 38 ALA H 5.094 4.075 6.113 4.794 4.660 4.951 . 0 0 "[ . 1 . 2]" 1
601 1 110 GLU HA 1 114 TRP HE1 5.018 4.014 6.022 4.489 3.908 5.025 0.106 3 0 "[ . 1 . 2]" 1
602 1 55 ASP H 1 55 ASP QB 4.603 3.682 5.341 2.589 2.343 2.889 1.339 17 20 [**************-*+***] 1
603 1 41 MET QG 1 42 ALA H 4.475 3.580 5.039 3.907 3.405 4.424 0.175 16 0 "[ . 1 . 2]" 1
604 1 48 TYR H 1 48 TYR QD 3.920 3.136 4.704 2.687 2.321 3.243 0.815 6 10 "[ -.+* ** *** * *]" 1
605 1 96 LYS H 1 96 LYS HG2 3.500 2.800 4.200 3.716 2.362 4.817 0.617 13 6 "[ * *1 *+ - *2]" 1
606 1 116 LYS H 1 116 LYS QD 3.997 3.198 4.734 4.236 3.537 4.691 . 0 0 "[ . 1 . 2]" 1
607 1 22 GLY QA 1 71 LYS H 4.408 3.584 5.290 4.115 3.424 5.039 0.160 4 0 "[ . 1 . 2]" 1
608 1 27 ILE H 1 27 ILE HA 3.628 2.902 4.354 2.924 2.893 2.948 0.009 8 0 "[ . 1 . 2]" 1
609 1 29 SER H 1 30 ASN QB 5.029 4.023 6.035 5.237 4.931 5.729 . 0 0 "[ . 1 . 2]" 1
610 1 31 ASP H 1 34 LEU QB 4.232 3.542 5.078 3.581 2.998 4.238 0.544 11 1 "[ . 1+ . 2]" 1
611 1 76 LEU H 1 76 LEU HG 3.528 2.822 4.234 3.922 2.795 4.684 0.450 16 0 "[ . 1 . 2]" 1
612 1 34 LEU HA 1 35 ILE H 4.348 3.478 5.218 3.551 3.520 3.575 . 0 0 "[ . 1 . 2]" 1
613 1 25 VAL HA 1 73 LEU H . 3.679 4.404 2.863 2.483 3.452 1.196 13 18 "[*** ******* +*****-*]" 1
614 1 26 LEU H 1 27 ILE H 4.714 3.771 5.426 4.405 4.222 4.569 . 0 0 "[ . 1 . 2]" 1
615 1 116 LYS QG 1 117 GLU H 3.806 3.045 4.567 3.800 2.490 4.809 0.555 12 2 "[ . 1 + -. 2]" 1
616 1 75 LEU QB 1 76 LEU H 4.076 3.286 4.891 3.446 2.961 3.890 0.325 14 0 "[ . 1 . 2]" 1
617 1 51 THR HG1 1 52 LEU H 4.189 3.351 5.027 4.344 2.901 4.993 0.450 6 0 "[ . 1 . 2]" 1
618 1 28 TRP H 1 29 SER H 4.836 3.869 5.402 3.826 3.573 4.058 0.296 15 0 "[ . 1 . 2]" 1
619 1 43 GLU HA 1 46 ASN H 3.436 2.749 4.123 3.501 3.019 3.853 . 0 0 "[ . 1 . 2]" 1
620 1 84 LYS HA 1 86 LYS H 4.588 3.670 5.506 4.320 4.040 4.474 . 0 0 "[ . 1 . 2]" 1
621 1 78 ASP H 1 82 ALA MB 4.219 3.375 5.063 4.695 4.273 5.214 0.151 18 0 "[ . 1 . 2]" 1
622 1 35 ILE MG 1 36 GLU H 3.200 2.560 3.840 3.397 3.167 3.675 . 0 0 "[ . 1 . 2]" 1
623 1 73 LEU H 1 74 VAL H 4.152 3.530 4.982 4.378 4.152 4.535 . 0 0 "[ . 1 . 2]" 1
624 1 102 ILE H 1 102 ILE MD 3.638 2.910 4.366 3.805 3.651 4.149 . 0 0 "[ . 1 . 2]" 1
625 1 76 LEU QB 1 78 ASP H 4.509 3.607 5.411 5.258 4.621 5.983 0.572 5 2 "[ + 1 - 2]" 1
626 1 38 ALA MB 1 115 ILE H 4.910 3.928 5.892 5.982 5.483 6.352 0.460 3 0 "[ . 1 . 2]" 1
627 1 29 SER H 1 77 GLU QB 4.737 3.790 5.684 4.549 4.269 5.004 . 0 0 "[ . 1 . 2]" 1
628 1 27 ILE H 1 27 ILE MD 3.560 2.848 4.272 4.695 4.019 4.878 0.606 8 9 "[- ****+*1 * . * 2]" 1
629 1 111 ALA MB 1 113 ARG H 3.900 3.120 4.680 4.347 4.227 4.512 . 0 0 "[ . 1 . 2]" 1
630 1 89 ILE HA 1 90 GLU H 3.873 3.098 4.648 3.525 3.480 3.575 . 0 0 "[ . 1 . 2]" 1
631 1 73 LEU QB 1 118 PHE H 4.984 3.987 5.981 5.838 5.291 6.443 0.462 14 0 "[ . 1 . 2]" 1
632 1 23 LEU QD 1 72 ILE H 4.444 3.555 5.333 4.607 4.010 5.228 . 0 0 "[ . 1 . 2]" 1
633 1 35 ILE HA 1 36 GLU H 3.858 3.086 4.630 3.539 3.510 3.563 . 0 0 "[ . 1 . 2]" 1
634 1 43 GLU H 1 43 GLU QG 3.375 2.700 3.869 3.727 2.213 4.055 0.487 12 0 "[ . 1 . 2]" 1
635 1 93 ALA HA 1 94 ARG H 3.695 2.956 4.434 3.517 3.424 3.575 . 0 0 "[ . 1 . 2]" 1
636 1 29 SER H 1 29 SER QB 4.104 3.283 4.925 2.897 2.631 3.192 0.652 3 4 "[ *+ . 1 * -]" 1
637 1 31 ASP HA 1 32 LYS H 3.464 3.033 4.157 2.346 2.189 2.508 0.844 17 20 [****************+-**] 1
638 1 28 TRP H 1 28 TRP QB 3.780 3.024 4.379 2.619 2.386 3.211 0.638 7 6 "[ . +**1 .- * *]" 1
639 1 112 LYS H 1 113 ARG H 3.242 2.594 3.736 2.646 2.533 2.742 0.061 11 0 "[ . 1 . 2]" 1
640 1 95 LYS H 1 95 LYS HD2 3.620 2.896 4.344 4.482 2.438 4.954 0.610 11 5 "[ ** .- 1+ *. 2]" 1
641 1 96 LYS H 1 98 LEU H 4.599 3.679 5.519 3.746 3.234 4.276 0.445 13 0 "[ . 1 . 2]" 1
642 1 103 ARG H 1 103 ARG QB 3.641 3.056 4.369 2.641 2.456 3.209 0.600 8 9 "[- *** + 1* . * **]" 1
643 1 79 THR H 1 79 THR HG1 3.386 2.709 4.063 2.520 2.067 3.404 0.642 1 5 "[+ -.* 1 *. * 2]" 1
644 1 32 LYS HA 1 34 LEU H 4.091 3.273 4.909 4.792 4.337 5.095 0.186 7 0 "[ . 1 . 2]" 1
645 1 29 SER HA 1 77 GLU H 4.349 3.479 5.219 3.612 3.110 4.886 0.369 14 0 "[ . 1 . 2]" 1
646 1 111 ALA MB 1 112 LYS H . 3.346 3.534 2.387 2.253 2.535 1.093 10 20 [*********+*********-] 1
647 1 101 ARG QB 1 102 ILE H 3.961 3.169 4.753 3.790 3.370 4.002 . 0 0 "[ . 1 . 2]" 1
648 1 34 LEU H 1 34 LEU QD 3.360 2.688 4.032 3.546 2.308 3.771 0.380 7 0 "[ . 1 . 2]" 1
649 1 78 ASP H 1 78 ASP HA 3.537 2.830 4.244 2.863 2.813 2.936 0.017 10 0 "[ . 1 . 2]" 1
650 1 33 LYS H 1 35 ILE H 4.128 3.840 4.954 4.270 4.061 4.717 . 0 0 "[ . 1 . 2]" 1
651 1 51 THR H 1 52 LEU H 4.884 3.907 5.407 4.280 3.813 4.607 0.094 13 0 "[ . 1 . 2]" 1
652 1 38 ALA H 1 111 ALA MB 3.852 3.082 4.622 4.257 3.777 5.042 0.420 10 0 "[ . 1 . 2]" 1
653 1 76 LEU H 1 76 LEU QB . 3.658 4.038 2.483 2.176 2.596 1.482 13 20 [*****-******+*******] 1
654 1 24 LEU HG 1 73 LEU H 4.586 3.669 5.503 5.274 4.591 6.184 0.681 2 3 "[ + . *- 1 . 2]" 1
655 1 109 ASP HA 1 110 GLU H 3.774 3.019 4.529 3.547 3.435 3.582 . 0 0 "[ . 1 . 2]" 1
656 1 91 LYS H 1 91 LYS QD 3.512 2.810 4.214 3.793 2.943 4.688 0.474 11 0 "[ . 1 . 2]" 1
657 1 88 GLU HA 1 91 LYS H 3.416 2.733 4.099 3.555 3.269 3.919 . 0 0 "[ . 1 . 2]" 1
658 1 51 THR HA 1 52 LEU H 3.381 2.705 4.057 2.268 2.139 2.386 0.566 16 10 "[ * . *-*1* **.+ * *]" 1
659 1 116 LYS H 1 117 GLU QG 4.581 3.665 5.497 4.746 3.830 5.929 0.432 16 0 "[ . 1 . 2]" 1
660 1 93 ALA H 1 94 ARG H 3.261 2.658 3.913 2.660 2.463 2.764 0.195 3 0 "[ . 1 . 2]" 1
661 1 115 ILE HB 1 116 LYS H 3.187 2.550 3.824 2.686 2.510 2.883 0.040 1 0 "[ . 1 . 2]" 1
662 1 24 LEU H 1 72 ILE MD 3.909 3.127 4.691 4.831 3.256 5.528 0.837 4 11 "[** +* *-*1 * .* * *]" 1
663 1 107 SER QB 1 110 GLU H 4.028 3.222 4.834 2.789 2.339 3.484 0.883 15 10 "[* **.*** - *+ * 2]" 1
664 1 57 LYS HA 1 58 LYS H 4.415 3.532 5.298 3.554 3.487 3.590 0.045 13 0 "[ . 1 . 2]" 1
665 1 117 GLU H 1 118 PHE QB 4.401 3.521 5.281 4.517 4.298 4.771 . 0 0 "[ . 1 . 2]" 1
666 1 90 GLU H 1 91 LYS H 3.144 2.702 3.773 2.655 2.395 2.872 0.307 8 0 "[ . 1 . 2]" 1
667 1 34 LEU QD 1 107 SER H 3.999 3.199 4.799 2.190 1.626 2.557 1.573 17 20 [********-*******+***] 1
668 1 91 LYS H 1 91 LYS QE 4.355 3.484 5.226 4.525 3.848 5.790 0.564 7 1 "[ . + 1 . 2]" 1
669 1 43 GLU QG 1 44 LYS H 3.875 3.331 4.650 3.822 3.428 4.223 . 0 0 "[ . 1 . 2]" 1
670 1 105 VAL H 1 106 THR H 4.722 3.782 5.666 4.326 4.213 4.388 . 0 0 "[ . 1 . 2]" 1
671 1 23 LEU H 1 47 LEU QD 3.957 3.166 4.748 3.528 2.353 4.426 0.813 11 2 "[ . 1+ . -2]" 1
672 1 30 ASN H 1 30 ASN QB 3.583 2.866 4.300 2.706 2.306 3.231 0.560 8 4 "[ *. +*1 - 2]" 1
673 1 74 VAL H 1 101 ARG QB 4.213 3.370 4.727 3.529 3.110 4.169 0.260 14 0 "[ . 1 . 2]" 1
674 1 118 PHE QB 1 119 SER H 3.587 2.870 4.111 2.999 2.681 3.196 0.189 20 0 "[ . 1 . 2]" 1
675 1 81 ASP HA 1 82 ALA H 3.120 2.496 3.744 3.456 3.411 3.548 . 0 0 "[ . 1 . 2]" 1
676 1 103 ARG QB 1 104 LYS H 3.684 2.947 4.421 3.325 2.461 3.919 0.486 11 0 "[ . 1 . 2]" 1
677 1 115 ILE H 1 117 GLU H 3.815 3.052 4.578 4.085 3.865 4.414 . 0 0 "[ . 1 . 2]" 1
678 1 27 ILE H 1 28 TRP H 4.814 3.851 5.431 4.187 3.751 4.408 0.100 8 0 "[ . 1 . 2]" 1
679 1 87 LYS H 1 89 ILE H 4.327 3.462 5.192 4.305 4.103 4.529 . 0 0 "[ . 1 . 2]" 1
680 1 96 LYS H 1 96 LYS QD 3.880 3.104 4.656 4.178 3.458 4.702 0.046 4 0 "[ . 1 . 2]" 1
681 1 27 ILE MD 1 38 ALA H 3.824 3.059 4.589 4.510 4.202 5.067 0.478 11 0 "[ . 1 . 2]" 1
682 1 76 LEU QB 1 77 GLU H 3.735 2.988 4.482 3.495 2.922 3.911 0.066 2 0 "[ . 1 . 2]" 1
683 1 38 ALA MB 1 42 ALA H 4.403 3.522 5.284 4.545 4.368 4.841 . 0 0 "[ . 1 . 2]" 1
684 1 109 ASP HA 1 112 LYS H 3.664 2.931 4.397 3.665 3.043 4.122 . 0 0 "[ . 1 . 2]" 1
685 1 92 LYS H 1 95 LYS H 4.687 3.750 5.624 4.788 4.572 5.114 . 0 0 "[ . 1 . 2]" 1
686 1 31 ASP H 1 31 ASP HA 3.688 2.950 4.426 2.938 2.926 2.944 0.024 5 0 "[ . 1 . 2]" 1
687 1 40 LYS H 1 40 LYS HG2 2.685 2.454 3.680 2.829 1.901 4.027 0.553 18 1 "[ . 1 . + 2]" 1
688 1 44 LYS H 1 45 ALA H 2.825 2.278 3.390 2.661 2.437 2.855 . 0 0 "[ . 1 . 2]" 1
689 1 23 LEU QD 1 121 GLU H 4.581 3.677 5.497 4.511 2.984 5.585 0.693 15 1 "[ . 1 + 2]" 1
690 1 95 LYS HB2 1 96 LYS H 3.720 2.976 4.464 3.337 2.480 4.170 0.496 8 0 "[ . 1 . 2]" 1
691 1 39 ARG H 1 39 ARG QD 4.293 3.434 5.152 4.297 3.679 4.824 . 0 0 "[ . 1 . 2]" 1
692 1 73 LEU H 1 73 LEU QD 3.996 3.197 4.795 3.826 3.531 3.921 . 0 0 "[ . 1 . 2]" 1
693 1 61 ASP H 1 62 ILE H . 3.292 3.634 2.746 2.487 2.852 0.805 11 13 "[ * * -* *+***.*** *]" 1
694 1 45 ALA MB 1 120 GLU H 4.457 3.566 5.348 5.535 4.791 6.237 0.889 10 6 "[ * *-+ . * *2]" 1
695 1 111 ALA H 1 113 ARG H 3.897 3.118 4.668 3.983 3.664 4.151 . 0 0 "[ . 1 . 2]" 1
696 1 93 ALA MB 1 100 VAL H 4.096 3.277 4.915 3.873 2.658 4.846 0.619 8 1 "[ . + 1 . 2]" 1
697 1 29 SER H 1 31 ASP H 4.485 3.588 5.382 4.924 4.466 5.309 . 0 0 "[ . 1 . 2]" 1
698 1 111 ALA H 1 112 LYS QD 4.613 3.690 5.536 5.498 5.019 5.951 0.415 16 0 "[ . 1 . 2]" 1
699 1 34 LEU H 1 35 ILE H 3.419 2.735 3.641 2.823 2.549 2.976 0.186 5 0 "[ . 1 . 2]" 1
700 1 29 SER H 1 35 ILE MD 3.687 2.950 4.424 3.649 3.105 4.235 . 0 0 "[ . 1 . 2]" 1
701 1 72 ILE H 1 73 LEU H 4.502 4.139 5.402 4.304 4.116 4.452 0.023 14 0 "[ . 1 . 2]" 1
702 1 112 LYS H 1 112 LYS QG 3.468 2.774 3.788 2.186 1.979 2.398 0.795 18 14 "[*** ****-1 * ** +**]" 1
703 1 71 LYS HA 1 72 ILE H 2.876 2.301 3.451 2.173 2.116 2.255 0.185 18 0 "[ . 1 . 2]" 1
704 1 38 ALA MB 1 41 MET H 4.025 3.220 4.830 4.674 4.505 4.817 . 0 0 "[ . 1 . 2]" 1
705 1 82 ALA H 1 85 VAL HB 4.578 3.662 5.494 5.711 5.317 6.330 0.836 12 1 "[ . 1 + . 2]" 1
706 1 62 ILE H 1 63 LEU QB 4.429 3.543 5.315 4.454 4.097 4.699 . 0 0 "[ . 1 . 2]" 1
707 1 94 ARG H 1 95 LYS H 3.368 2.813 4.042 2.563 2.421 2.736 0.392 12 0 "[ . 1 . 2]" 1
708 1 59 ILE H 1 59 ILE QG . 3.984 4.279 2.299 2.128 2.677 1.856 12 20 [**********-+********] 1
709 1 38 ALA H 1 41 MET H 4.765 3.812 5.718 4.837 4.682 5.132 . 0 0 "[ . 1 . 2]" 1
710 1 86 LYS H 1 87 LYS HA 4.861 3.889 5.833 5.319 5.185 5.405 . 0 0 "[ . 1 . 2]" 1
711 1 46 ASN H 1 47 LEU QD 4.310 3.448 5.172 4.072 2.903 4.601 0.545 12 1 "[ . 1 + . 2]" 1
712 1 47 LEU QD 1 119 SER H 3.672 2.938 4.406 3.830 3.040 4.302 . 0 0 "[ . 1 . 2]" 1
713 1 80 LYS HA 1 82 ALA H 4.207 3.366 5.048 4.142 3.731 4.512 . 0 0 "[ . 1 . 2]" 1
714 1 109 ASP H 1 110 GLU H 4.432 3.556 5.318 2.717 2.630 2.931 0.926 18 20 [********-********+**] 1
715 1 77 GLU HA 1 78 ASP H 2.872 2.869 3.446 2.233 2.155 2.361 0.714 13 20 [*-**********+*******] 1
716 1 114 TRP QB 1 115 ILE H 3.590 2.872 4.308 2.689 2.566 2.844 0.306 5 0 "[ . 1 . 2]" 1
717 1 112 LYS H 1 113 ARG QB 3.992 3.194 4.790 4.399 4.258 4.539 . 0 0 "[ . 1 . 2]" 1
718 1 119 SER QB 1 121 GLU H 4.095 3.276 4.914 4.771 4.514 5.294 0.380 20 0 "[ . 1 . 2]" 1
719 1 84 LYS H 1 84 LYS QE 4.344 3.475 5.213 4.350 2.587 5.254 0.888 18 1 "[ . 1 . + 2]" 1
720 1 112 LYS H 1 112 LYS QD 3.651 2.921 4.235 3.660 3.383 4.155 . 0 0 "[ . 1 . 2]" 1
721 1 34 LEU H 1 34 LEU QB . 3.506 3.511 2.230 2.082 2.523 1.424 8 20 [*******+-***********] 1
722 1 74 VAL H 1 101 ARG H 4.189 3.390 5.027 3.627 2.877 4.033 0.513 16 1 "[ . 1 .+ 2]" 1
723 1 118 PHE H 1 119 SER HA 4.441 3.553 5.329 5.032 4.842 5.311 . 0 0 "[ . 1 . 2]" 1
724 1 62 ILE H 1 62 ILE HB 3.712 3.315 4.454 2.493 2.443 2.567 0.872 17 20 [****************+-**] 1
725 1 25 VAL QG 1 73 LEU H 3.702 2.962 4.442 3.448 2.683 4.016 0.279 13 0 "[ . 1 . 2]" 1
726 1 44 LYS H 1 44 LYS QD 3.791 3.033 4.549 4.115 3.467 4.678 0.129 4 0 "[ . 1 . 2]" 1
727 1 25 VAL H 1 26 LEU H 4.349 3.681 5.219 4.310 4.073 4.489 . 0 0 "[ . 1 . 2]" 1
728 1 32 LYS HA 1 36 GLU H 3.817 3.054 4.580 4.753 4.224 5.185 0.605 14 4 "[ * . 1 +. - *]" 1
729 1 62 ILE H 1 63 LEU H 3.873 3.098 4.092 2.669 2.542 2.831 0.556 9 4 "[ - . +1 * *2]" 1
730 1 31 ASP H 1 35 ILE MD 3.750 3.000 4.500 2.570 2.018 3.223 0.982 5 9 "[ +** ** **- * 2]" 1
731 1 27 ILE QG 1 28 TRP H 3.569 2.855 4.204 2.896 2.370 4.169 0.485 3 0 "[ . 1 . 2]" 1
732 1 90 GLU HA 1 93 ALA H 4.069 3.255 4.883 3.562 3.013 4.070 0.242 1 0 "[ . 1 . 2]" 1
733 1 113 ARG HA 1 115 ILE H 3.989 3.191 4.787 4.460 4.204 4.820 0.033 20 0 "[ . 1 . 2]" 1
734 1 84 LYS H 1 84 LYS QD 3.889 3.111 4.667 3.686 2.090 4.534 1.021 7 3 "[ . + 1 . -* 2]" 1
735 1 110 GLU H 1 111 ALA H 3.115 2.992 3.738 2.661 2.415 2.795 0.577 18 1 "[ . 1 . + 2]" 1
736 1 39 ARG H 1 41 MET H 4.524 3.619 5.429 4.171 3.926 4.462 . 0 0 "[ . 1 . 2]" 1
737 1 89 ILE MD 1 90 GLU H 4.126 3.301 4.951 4.662 4.619 4.730 . 0 0 "[ . 1 . 2]" 1
738 1 112 LYS H 1 112 LYS QE 4.514 3.611 5.195 4.499 3.379 4.806 0.232 2 0 "[ . 1 . 2]" 1
739 1 101 ARG H 1 102 ILE MD 4.541 3.633 5.449 5.727 5.432 6.263 0.814 8 3 "[ . + 1 .* -]" 1
740 1 37 GLU HG2 1 38 ALA H 4.019 3.150 4.724 4.487 2.930 5.043 0.319 9 0 "[ . 1 . 2]" 1
741 1 120 GLU HA 1 121 GLU H 3.243 2.594 3.892 3.229 2.567 3.546 0.027 2 0 "[ . 1 . 2]" 1
742 1 34 LEU H 1 34 LEU HG 3.523 2.818 4.228 4.073 2.239 4.546 0.579 9 2 "[ . +1 . - 2]" 1
743 1 95 LYS HA 1 96 LYS H 4.190 3.352 5.028 3.436 3.255 3.567 0.097 15 0 "[ . 1 . 2]" 1
744 1 38 ALA HA 1 112 LYS H 4.816 3.853 5.779 4.915 4.424 5.707 . 0 0 "[ . 1 . 2]" 1
745 1 28 TRP H 1 76 LEU HA . 3.935 4.648 3.022 2.494 4.104 1.441 19 18 "[****-****** *****+*]" 1
746 1 87 LYS H 1 87 LYS HD2 3.358 2.686 4.030 4.244 2.696 4.913 0.883 8 8 "[ *- *+ 1* *. ** 2]" 1
747 1 36 GLU H 1 38 ALA H 3.992 3.194 4.790 4.133 3.938 4.398 . 0 0 "[ . 1 . 2]" 1
748 1 24 LEU QB 1 73 LEU H 4.183 3.346 5.020 3.983 3.408 4.358 . 0 0 "[ . 1 . 2]" 1
749 1 78 ASP HA 1 79 THR H . 3.159 3.733 2.249 2.191 2.299 0.968 4 20 [*-*+****************] 1
750 1 115 ILE H 1 118 PHE H 4.455 3.564 5.346 4.912 4.729 5.059 . 0 0 "[ . 1 . 2]" 1
751 1 45 ALA H 1 46 ASN H 2.855 2.427 3.426 2.419 2.215 2.529 0.212 9 0 "[ . 1 . 2]" 1
752 1 91 LYS H 1 93 ALA H 4.367 3.516 5.240 4.078 3.812 4.277 . 0 0 "[ . 1 . 2]" 1
753 1 114 TRP HD1 1 115 ILE H 4.749 3.799 5.699 4.869 4.547 5.126 . 0 0 "[ . 1 . 2]" 1
754 1 42 ALA HA 1 46 ASN H 4.487 3.590 5.384 4.760 3.796 5.153 . 0 0 "[ . 1 . 2]" 1
755 1 28 TRP H 1 77 GLU H 4.371 3.497 5.245 4.069 3.678 4.528 . 0 0 "[ . 1 . 2]" 1
756 1 40 LYS H 1 49 LEU QD 3.876 3.101 4.651 4.633 4.260 4.999 0.348 4 0 "[ . 1 . 2]" 1
757 1 49 LEU H 1 49 LEU QB 3.200 2.755 3.840 2.687 2.303 3.221 0.452 17 0 "[ . 1 . 2]" 1
758 1 93 ALA H 1 93 ALA MB 2.860 2.288 3.432 2.234 2.207 2.265 0.081 16 0 "[ . 1 . 2]" 1
759 1 121 GLU H 1 121 GLU QG . 3.741 3.830 2.868 1.986 4.044 1.755 2 14 "[-+***** 1 ****** *]" 1
760 1 44 LYS H 1 46 ASN H 4.023 3.218 4.828 3.872 3.410 4.130 . 0 0 "[ . 1 . 2]" 1
761 1 103 ARG QD 1 114 TRP HE1 4.679 3.743 5.615 3.940 2.793 5.513 0.950 15 3 "[ .* - 1 + 2]" 1
762 1 47 LEU H 1 47 LEU HG 3.154 2.523 3.785 2.861 2.324 4.407 0.622 7 2 "[ - . + 1 . 2]" 1
763 1 89 ILE HB 1 90 GLU H . 3.534 3.998 2.685 2.536 2.840 0.998 7 20 [******+******-******] 1
764 1 72 ILE HA 1 74 VAL H 4.833 3.866 5.800 5.807 5.423 6.023 0.223 20 0 "[ . 1 . 2]" 1
765 1 37 GLU HG3 1 38 ALA H 3.937 3.215 4.823 4.694 2.905 5.420 0.597 18 2 "[ . - 1 . + 2]" 1
766 1 112 LYS H 1 112 LYS QB 2.915 2.337 3.498 2.439 2.357 2.535 . 0 0 "[ . 1 . 2]" 1
767 1 103 ARG H 1 103 ARG QG 3.566 2.958 4.279 3.432 2.110 4.206 0.848 9 3 "[ . +- * . 2]" 1
768 1 103 ARG QD 1 104 LYS H 4.260 3.408 5.112 4.034 2.544 5.403 0.864 12 3 "[ . - 1 + . *]" 1
769 1 66 LEU QB 1 67 GLY H 3.533 3.098 4.240 2.686 2.453 3.820 0.645 15 5 "[ * - 1 ** + 2]" 1
770 1 93 ALA H 1 93 ALA HA 3.449 2.759 4.139 2.811 2.769 2.865 . 0 0 "[ . 1 . 2]" 1
771 1 103 ARG H 1 103 ARG QD 4.516 3.896 5.419 4.550 3.891 5.210 0.005 14 0 "[ . 1 . 2]" 1
772 1 97 ASN QB 1 98 LEU H 4.395 3.516 5.167 3.920 3.846 4.049 . 0 0 "[ . 1 . 2]" 1
773 1 43 GLU H 1 44 LYS H 3.065 2.452 3.642 2.636 2.472 2.750 . 0 0 "[ . 1 . 2]" 1
774 1 87 LYS H 1 87 LYS HD3 3.965 3.172 4.758 4.154 2.883 4.988 0.289 15 0 "[ . 1 . 2]" 1
775 1 109 ASP QB 1 111 ALA H 4.473 3.578 5.368 4.733 4.461 5.361 . 0 0 "[ . 1 . 2]" 1
776 1 93 ALA H 1 96 LYS QB 4.111 3.289 4.933 5.022 4.122 5.645 0.712 17 2 "[ . 1 .-+ 2]" 1
777 1 76 LEU H 1 103 ARG H 4.232 3.386 5.078 3.594 3.215 3.832 0.171 16 0 "[ . 1 . 2]" 1
778 1 77 GLU QG 1 79 THR H 4.238 3.390 5.086 3.849 3.360 4.164 0.030 15 0 "[ . 1 . 2]" 1
779 1 96 LYS H 1 97 ASN HA 4.564 3.651 5.477 4.422 4.169 4.732 . 0 0 "[ . 1 . 2]" 1
780 1 90 GLU QG 1 91 LYS H 3.495 3.345 4.194 3.665 3.052 4.197 0.293 3 0 "[ . 1 . 2]" 1
781 1 87 LYS H 1 87 LYS HG3 3.023 2.842 4.232 3.356 2.029 4.455 0.813 3 5 "[ + . * 1 **-. 2]" 1
782 1 101 ARG QG 1 102 ILE H 4.215 3.372 5.058 3.784 3.237 4.882 0.135 19 0 "[ . 1 . 2]" 1
783 1 116 LYS H 1 116 LYS QG 3.724 3.006 4.469 3.453 2.147 4.075 0.859 12 3 "[ . 1*+ -. 2]" 1
784 1 33 LYS QB 1 34 LEU H . 3.394 3.563 2.811 2.230 3.704 1.164 17 14 "[ *** **** ** **+ *-]" 1
785 1 80 LYS QG 1 82 ALA H 4.487 3.590 5.384 5.048 4.013 5.573 0.189 7 0 "[ . 1 . 2]" 1
786 1 50 LEU H 1 51 THR H 4.720 3.798 5.664 4.360 4.039 4.475 . 0 0 "[ . 1 . 2]" 1
787 1 112 LYS H 1 115 ILE MD 4.097 3.278 4.916 4.382 4.035 4.856 . 0 0 "[ . 1 . 2]" 1
788 1 73 LEU HG 1 74 VAL H 3.601 2.881 4.321 3.395 2.633 5.080 0.759 8 2 "[- . + 1 . 2]" 1
789 1 71 LYS H 1 72 ILE MD 4.424 3.539 5.309 5.675 4.014 6.241 0.932 15 15 "[***** ***-* * +* * *]" 1
790 1 83 ASP H 1 83 ASP HA 3.399 2.719 4.079 2.865 2.841 2.914 . 0 0 "[ . 1 . 2]" 1
791 1 104 LYS QG 1 105 VAL H 4.026 3.221 4.831 4.298 4.008 4.778 . 0 0 "[ . 1 . 2]" 1
792 1 73 LEU H 1 101 ARG QB 4.496 3.597 5.395 5.061 4.532 5.988 0.593 18 1 "[ . 1 . + 2]" 1
793 1 39 ARG HA 1 40 LYS H 3.508 2.806 4.210 3.540 3.484 3.580 . 0 0 "[ . 1 . 2]" 1
794 1 32 LYS H 1 32 LYS QG 4.295 3.436 4.886 3.012 2.347 4.058 1.089 17 9 "[ -**.* ** *. +* 2]" 1
795 1 34 LEU H 1 36 GLU H 4.234 3.387 4.679 4.168 3.901 4.353 . 0 0 "[ . 1 . 2]" 1
796 1 40 LYS HB3 1 42 ALA H 4.142 2.485 5.799 5.701 5.362 6.086 0.287 18 0 "[ . 1 . 2]" 1
797 1 113 ARG H 1 113 ARG QG 3.836 3.069 4.603 3.962 3.937 3.982 . 0 0 "[ . 1 . 2]" 1
798 1 23 LEU QD 1 24 LEU H 3.823 3.058 4.588 2.788 2.133 3.630 0.925 12 8 "[** - *** + .* 2]" 1
799 1 47 LEU QD 1 120 GLU H 4.639 3.711 5.567 5.095 4.566 5.566 . 0 0 "[ . 1 . 2]" 1
800 1 82 ALA HA 1 83 ASP H 4.098 3.278 4.918 3.446 3.362 3.522 . 0 0 "[ . 1 . 2]" 1
801 1 27 ILE HA 1 75 LEU H 3.643 2.914 4.372 2.624 2.437 2.978 0.477 12 0 "[ . 1 . 2]" 1
802 1 40 LYS HG3 1 41 MET H 3.617 2.889 4.333 3.997 2.154 5.023 0.735 2 7 "[ + -.* 1* * ** 2]" 1
803 1 57 LYS QD 1 58 LYS H 4.528 3.622 5.434 4.352 3.616 5.113 0.006 9 0 "[ . 1 . 2]" 1
804 1 82 ALA H 1 83 ASP QB 4.841 3.873 5.809 4.527 4.326 5.047 . 0 0 "[ . 1 . 2]" 1
805 1 74 VAL HA 1 75 LEU H 2.944 2.852 3.533 2.142 2.086 2.231 0.766 20 20 [***********-*******+] 1
806 1 83 ASP QB 1 85 VAL H 5.065 4.060 6.078 4.874 4.661 5.275 . 0 0 "[ . 1 . 2]" 1
807 1 43 GLU QB 1 44 LYS H 3.213 2.570 3.775 2.633 2.415 3.138 0.155 19 0 "[ . 1 . 2]" 1
808 1 107 SER H 1 110 GLU QG 4.174 3.339 5.009 5.148 4.389 5.630 0.621 2 5 "[ + * 1 *.* -]" 1
809 1 113 ARG QD 1 114 TRP H 4.685 3.748 5.239 4.289 3.593 4.965 0.155 7 0 "[ . 1 . 2]" 1
810 1 87 LYS H 1 87 LYS HA 3.139 2.511 3.767 2.819 2.747 2.863 . 0 0 "[ . 1 . 2]" 1
811 1 82 ALA H 1 84 LYS H 4.300 3.440 5.160 4.301 4.049 4.556 . 0 0 "[ . 1 . 2]" 1
812 1 24 LEU H 1 25 VAL H 4.472 3.578 4.933 4.338 4.160 4.490 . 0 0 "[ . 1 . 2]" 1
813 1 93 ALA H 1 95 LYS H 4.735 4.078 5.682 4.097 3.867 4.603 0.211 5 0 "[ . 1 . 2]" 1
814 1 37 GLU H 1 37 GLU HG3 3.195 2.445 3.667 3.639 2.392 4.416 0.749 1 3 "[+ . - 1 . *2]" 1
815 1 39 ARG H 1 39 ARG QG 3.422 3.054 4.106 3.344 2.080 4.057 0.974 7 7 "[* *. +* - . * *]" 1
816 1 47 LEU H 1 47 LEU QD 3.315 2.652 3.978 2.970 2.198 3.286 0.454 13 0 "[ . 1 . 2]" 1
817 1 74 VAL QG 1 75 LEU H . 3.553 3.696 2.817 2.265 3.355 1.288 11 16 "[***** ***-+ * * ****]" 1
818 1 110 GLU QG 1 111 ALA H 3.977 3.182 4.772 4.170 3.649 4.640 . 0 0 "[ . 1 . 2]" 1
819 1 27 ILE H 1 27 ILE HB 3.438 2.750 4.126 3.333 2.678 3.892 0.072 14 0 "[ . 1 . 2]" 1
820 1 44 LYS H 1 44 LYS QB 2.536 2.029 3.043 2.304 2.168 2.559 . 0 0 "[ . 1 . 2]" 1
821 1 42 ALA H 1 115 ILE MG 3.373 2.698 4.048 3.331 2.909 3.627 . 0 0 "[ . 1 . 2]" 1
822 1 115 ILE HA 1 116 LYS H 3.899 3.119 4.679 3.530 3.470 3.575 . 0 0 "[ . 1 . 2]" 1
823 1 73 LEU QD 1 75 LEU H 4.547 3.638 5.456 4.342 3.605 4.872 0.033 8 0 "[ . 1 . 2]" 1
824 1 85 VAL QG 1 88 GLU H 4.707 3.766 5.648 4.316 3.927 4.627 . 0 0 "[ . 1 . 2]" 1
825 1 114 TRP H 1 115 ILE H 3.281 2.625 3.810 2.659 2.381 2.784 0.244 17 0 "[ . 1 . 2]" 1
826 1 85 VAL H 1 85 VAL HB . 3.476 3.751 2.768 2.516 2.855 0.960 6 20 [*****+************-*] 1
827 1 73 LEU HA 1 103 ARG H 4.784 3.827 5.741 5.815 5.327 6.360 0.619 16 2 "[ . 1- .+ 2]" 1
828 1 94 ARG HA 1 98 LEU H 3.893 3.114 4.672 3.786 2.750 4.660 0.364 2 0 "[ . 1 . 2]" 1
829 1 75 LEU HA 1 76 LEU H 3.019 2.886 3.623 2.149 2.113 2.208 0.773 12 20 [***********+*****-**] 1
830 1 41 MET H 1 112 LYS QG 4.369 3.495 5.243 4.210 3.763 4.528 . 0 0 "[ . 1 . 2]" 1
831 1 86 LYS H 1 86 LYS QG 3.935 3.148 4.673 3.954 3.885 3.979 . 0 0 "[ . 1 . 2]" 1
832 1 33 LYS H 1 33 LYS HG3 3.473 2.778 4.168 3.484 2.279 4.554 0.499 9 0 "[ . 1 . 2]" 1
833 1 31 ASP QB 1 34 LEU H 3.844 3.288 4.613 2.699 2.456 2.959 0.832 16 16 "[* *** **** ***-+***2]" 1
834 1 104 LYS H 1 104 LYS QD 3.693 2.954 4.432 4.050 3.559 4.691 0.259 11 0 "[ . 1 . 2]" 1
835 1 73 LEU HA 1 101 ARG H 3.765 3.012 4.518 3.125 2.799 3.520 0.213 7 0 "[ . 1 . 2]" 1
836 1 37 GLU QB 1 38 ALA H 3.170 2.536 3.804 2.690 2.301 3.665 0.235 19 0 "[ . 1 . 2]" 1
837 1 110 GLU H 1 112 LYS H 4.254 3.403 5.105 4.279 3.870 4.450 . 0 0 "[ . 1 . 2]" 1
838 1 116 LYS H 1 117 GLU H 3.167 2.534 3.800 2.524 2.299 2.734 0.235 12 0 "[ . 1 . 2]" 1
839 1 27 ILE MG 1 29 SER H 3.818 3.054 4.582 4.140 2.609 5.415 0.833 11 1 "[ . 1+ . 2]" 1
840 1 29 SER HA 1 31 ASP H 4.066 3.253 4.879 4.668 4.393 4.927 0.048 16 0 "[ . 1 . 2]" 1
841 1 42 ALA H 1 43 GLU HA 4.488 3.590 5.386 5.227 5.071 5.356 . 0 0 "[ . 1 . 2]" 1
842 1 108 PRO QD 1 109 ASP H 4.215 3.372 5.058 2.860 2.480 3.245 0.892 19 11 "[* *.****-* *. +*]" 1
843 1 113 ARG QG 1 115 ILE H 4.350 3.480 5.220 5.035 4.693 5.364 0.144 17 0 "[ . 1 . 2]" 1
844 1 103 ARG QG 1 104 LYS H 4.117 3.653 4.940 3.658 2.369 4.701 1.284 5 5 "[ +* 1 - * *2]" 1
845 1 37 GLU H 1 37 GLU HA 3.081 2.465 3.697 2.831 2.797 2.900 . 0 0 "[ . 1 . 2]" 1
846 1 37 GLU H 1 37 GLU HG2 3.056 2.556 3.834 2.881 2.140 4.541 0.707 1 3 "[+ . * 1 . -2]" 1
847 1 83 ASP H 1 85 VAL HB 4.790 3.832 5.748 5.623 5.392 6.286 0.538 12 1 "[ . 1 + . 2]" 1
848 1 61 ASP QB 1 62 ILE H 3.963 3.297 4.756 2.465 2.332 2.723 0.965 5 20 [****+*****-*********] 1
849 1 78 ASP H 1 105 VAL H 3.995 3.362 4.794 4.515 3.647 5.109 0.315 2 0 "[ . 1 . 2]" 1
850 1 93 ALA H 1 100 VAL QG 3.954 3.163 4.745 4.190 3.291 4.756 0.011 19 0 "[ . 1 . 2]" 1
851 1 76 LEU QB 1 105 VAL H 3.860 3.088 4.632 4.173 3.708 4.838 0.206 1 0 "[ . 1 . 2]" 1
852 1 83 ASP H 1 84 LYS H 3.300 2.710 3.960 2.399 2.245 2.551 0.465 6 0 "[ . 1 . 2]" 1
853 1 77 GLU H 1 82 ALA MB 4.498 3.598 5.398 4.052 3.427 4.880 0.171 6 0 "[ . 1 . 2]" 1
854 1 111 ALA MB 1 114 TRP H 4.042 3.234 4.850 4.862 4.659 5.051 0.201 3 0 "[ . 1 . 2]" 1
855 1 112 LYS HA 1 114 TRP H 4.611 3.689 5.533 4.730 4.252 4.977 . 0 0 "[ . 1 . 2]" 1
856 1 61 ASP HA 1 62 ILE H 4.172 3.338 5.006 3.553 3.521 3.570 . 0 0 "[ . 1 . 2]" 1
857 1 114 TRP HA 1 117 GLU H 3.792 3.034 4.550 3.400 3.115 3.656 . 0 0 "[ . 1 . 2]" 1
858 1 115 ILE MG 1 119 SER H 4.043 3.234 4.852 4.413 3.972 4.820 . 0 0 "[ . 1 . 2]" 1
859 1 66 LEU HG 1 67 GLY H 4.326 3.461 5.191 4.900 3.641 5.249 0.058 2 0 "[ . 1 . 2]" 1
860 1 78 ASP H 1 104 LYS HA 4.546 3.637 5.455 4.855 4.287 5.588 0.133 2 0 "[ . 1 . 2]" 1
861 1 41 MET QG 1 115 ILE H 4.480 3.584 5.376 4.753 4.059 5.458 0.082 20 0 "[ . 1 . 2]" 1
862 1 93 ALA HA 1 96 LYS H 4.529 3.623 5.435 3.544 3.158 4.208 0.465 11 0 "[ . 1 . 2]" 1
863 1 103 ARG QG 1 114 TRP HE1 4.740 3.792 5.688 4.249 2.529 5.953 1.263 2 3 "[ + . - 1 .* 2]" 1
864 1 113 ARG QG 1 114 TRP H 3.977 3.182 4.772 3.296 2.851 3.861 0.331 7 0 "[ . 1 . 2]" 1
865 1 106 THR H 1 106 THR HG1 3.552 2.842 4.262 4.109 3.090 4.982 0.720 13 6 "[ * . -*1 + * *]" 1
866 1 41 MET H 1 41 MET QG 3.720 2.976 4.349 3.748 2.319 4.073 0.657 14 2 "[ . 1 +. -]" 1
867 1 81 ASP HA 1 84 LYS H 3.258 2.606 3.910 3.557 3.163 3.964 0.054 4 0 "[ . 1 . 2]" 1
868 1 41 MET H 1 41 MET QB 3.025 2.420 3.530 2.254 2.169 2.406 0.251 12 0 "[ . 1 . 2]" 1
869 1 119 SER H 1 120 GLU H 3.138 2.569 3.766 2.457 2.243 2.806 0.326 3 0 "[ . 1 . 2]" 1
870 1 105 VAL QG 1 113 ARG H 4.929 3.943 5.726 5.768 5.257 6.057 0.331 9 0 "[ . 1 . 2]" 1
871 1 67 GLY H 1 70 VAL HB 4.553 3.642 5.464 6.192 5.319 6.509 1.045 15 18 "[********-*** +*****]" 1
872 1 30 ASN H 1 30 ASN HA 3.117 2.494 3.740 2.933 2.886 2.960 . 0 0 "[ . 1 . 2]" 1
873 1 48 TYR QB 1 63 LEU H 4.952 3.962 5.942 6.245 5.929 6.461 0.519 11 2 "[ . 1+ . -2]" 1
874 1 88 GLU H 1 89 ILE H 3.178 2.542 3.808 2.632 2.515 2.725 0.027 16 0 "[ . 1 . 2]" 1
875 1 35 ILE H 1 35 ILE HB . 3.406 3.724 2.521 2.336 2.698 1.070 5 20 [****+*********-*****] 1
876 1 95 LYS H 1 96 LYS HA 4.858 3.886 5.830 5.173 4.977 5.364 . 0 0 "[ . 1 . 2]" 1
877 1 42 ALA H 1 43 GLU H 3.171 2.537 3.749 2.608 2.456 2.748 0.081 19 0 "[ . 1 . 2]" 1
878 1 37 GLU H 1 38 ALA H 2.970 2.438 3.564 2.620 2.340 2.754 0.098 10 0 "[ . 1 . 2]" 1
879 1 113 ARG H 1 115 ILE MD 4.657 3.726 5.588 5.339 5.137 5.786 0.198 20 0 "[ . 1 . 2]" 1
880 1 23 LEU QD 1 120 GLU H 4.954 3.963 5.945 4.726 4.295 5.564 . 0 0 "[ . 1 . 2]" 1
881 1 46 ASN H 1 47 LEU H 3.075 2.460 3.599 2.712 2.602 2.857 . 0 0 "[ . 1 . 2]" 1
882 1 37 GLU H 1 37 GLU QB 2.921 2.337 3.464 2.361 2.189 2.621 0.148 19 0 "[ . 1 . 2]" 1
883 1 112 LYS QB 1 113 ARG H 3.040 2.432 3.648 2.696 2.453 2.908 . 0 0 "[ . 1 . 2]" 1
884 1 74 VAL H 1 103 ARG H 4.158 3.326 4.990 3.987 3.501 4.550 . 0 0 "[ . 1 . 2]" 1
885 1 23 LEU H 1 24 LEU H 4.733 3.786 5.086 4.259 4.112 4.395 . 0 0 "[ . 1 . 2]" 1
886 1 33 LYS H 1 34 LEU QB 3.962 3.170 4.754 4.128 3.972 4.451 . 0 0 "[ . 1 . 2]" 1
887 1 37 GLU H 1 39 ARG H 4.408 3.526 5.087 4.159 3.795 4.480 . 0 0 "[ . 1 . 2]" 1
888 1 74 VAL H 1 102 ILE H 4.967 4.146 5.960 4.776 4.460 5.106 . 0 0 "[ . 1 . 2]" 1
889 1 35 ILE H 1 35 ILE QG 3.161 2.529 3.784 2.273 1.864 3.421 0.665 15 4 "[ . * + -*]" 1
890 1 120 GLU H 1 120 GLU QG 3.242 2.594 3.838 2.685 1.884 4.019 0.710 12 5 "[ * 1 +**. -2]" 1
891 1 23 LEU HA 1 24 LEU H . 2.993 3.515 2.156 2.115 2.239 0.878 13 20 [************+*-*****] 1
892 1 85 VAL H 1 86 LYS H 3.321 2.657 3.971 2.577 2.418 2.700 0.239 1 0 "[ . 1 . 2]" 1
893 1 35 ILE HA 1 37 GLU H 4.562 3.650 5.474 4.654 4.316 4.901 . 0 0 "[ . 1 . 2]" 1
894 1 92 LYS H 1 92 LYS QG 3.068 2.454 3.265 2.294 1.985 2.503 0.469 13 0 "[ . 1 . 2]" 1
895 1 105 VAL QG 1 110 GLU H 4.695 3.756 5.387 5.056 4.786 5.495 0.108 5 0 "[ . 1 . 2]" 1
896 1 63 LEU QB 1 64 LYS H 3.533 3.282 4.240 2.783 2.354 3.569 0.928 15 14 "[ *** ****** +- ***]" 1
897 1 31 ASP H 1 77 GLU QB 4.821 3.857 5.785 5.417 5.026 6.144 0.359 13 0 "[ . 1 . 2]" 1
898 1 34 LEU H 1 36 GLU HA 5.099 4.079 6.119 6.911 6.636 7.071 0.952 17 20 [*************-**+***] 1
899 1 24 LEU QD 1 73 LEU H 4.134 3.307 4.961 4.564 3.670 5.082 0.121 13 0 "[ . 1 . 2]" 1
900 1 82 ALA MB 1 86 LYS H 3.987 3.190 4.784 4.336 4.009 4.813 0.029 6 0 "[ . 1 . 2]" 1
901 1 88 GLU H 1 88 GLU HA 2.983 2.386 3.580 2.840 2.811 2.878 . 0 0 "[ . 1 . 2]" 1
902 1 97 ASN HA 1 98 LEU H 3.226 2.581 3.871 2.696 2.390 2.848 0.191 12 0 "[ . 1 . 2]" 1
903 1 104 LYS HA 1 105 VAL H 2.906 2.897 3.487 2.146 2.098 2.213 0.799 14 20 [-************+******] 1
904 1 45 ALA H 1 47 LEU H 3.605 2.884 4.326 3.720 3.441 4.271 . 0 0 "[ . 1 . 2]" 1
905 1 45 ALA MB 1 46 ASN H 3.337 2.670 4.004 3.378 3.238 3.470 . 0 0 "[ . 1 . 2]" 1
906 1 35 ILE H 1 35 ILE MD 3.147 2.518 3.776 3.330 1.899 3.649 0.619 14 2 "[ . 1- +. 2]" 1
907 1 82 ALA H 1 85 VAL QG 4.637 3.710 5.564 4.031 3.816 4.313 . 0 0 "[ . 1 . 2]" 1
908 1 106 THR H 1 107 SER H 3.383 2.706 3.852 3.646 3.486 3.796 . 0 0 "[ . 1 . 2]" 1
909 1 69 PRO QB 1 70 VAL H 3.979 3.183 4.775 3.616 3.426 3.735 . 0 0 "[ . 1 . 2]" 1
910 1 76 LEU H 1 105 VAL H 4.122 3.298 4.829 3.236 2.693 3.794 0.605 8 1 "[ . + 1 . 2]" 1
911 1 94 ARG H 1 100 VAL QG 4.052 3.242 4.862 4.759 3.912 5.215 0.353 15 0 "[ . 1 . 2]" 1
912 1 88 GLU H 1 88 GLU QG 3.407 2.726 3.947 2.363 2.126 2.901 0.600 17 3 "[ - .* 1 . + 2]" 1
913 1 44 LYS H 1 44 LYS QE 4.510 3.608 5.412 4.812 3.701 5.959 0.547 17 2 "[ .- 1 . + 2]" 1
914 1 59 ILE MG 1 63 LEU H 3.279 2.623 3.935 3.862 3.180 4.520 0.585 6 2 "[ .+ 1 . - 2]" 1
915 1 78 ASP H 1 79 THR HG1 4.254 3.403 5.105 4.639 3.972 5.975 0.870 17 3 "[ - . 1 * . + 2]" 1
916 1 90 GLU HA 1 94 ARG H 4.165 3.332 4.998 4.246 3.781 4.771 . 0 0 "[ . 1 . 2]" 1
917 1 84 LYS QD 1 85 VAL H 4.511 3.609 5.413 4.527 3.972 5.148 . 0 0 "[ . 1 . 2]" 1
918 1 42 ALA H 1 44 LYS H 4.429 3.543 5.315 4.063 3.864 4.325 . 0 0 "[ . 1 . 2]" 1
919 1 33 LYS H 1 35 ILE MD 4.117 3.294 4.940 5.662 4.660 5.832 0.892 15 17 "[-***.***** ** +*****]" 1
920 1 74 VAL H 1 100 VAL HA 4.613 3.690 5.536 5.307 4.570 5.799 0.263 4 0 "[ . 1 . 2]" 1
921 1 117 GLU H 1 119 SER H 4.276 3.421 5.131 3.988 3.695 4.199 . 0 0 "[ . 1 . 2]" 1
922 1 119 SER H 1 120 GLU QG 4.635 3.708 5.562 4.333 3.316 5.979 0.417 6 0 "[ . 1 . 2]" 1
923 1 75 LEU QD 1 114 TRP H 3.903 3.122 4.684 4.421 3.944 5.378 0.694 11 1 "[ . 1+ . 2]" 1
924 1 116 LYS H 1 119 SER H 4.489 3.591 5.387 4.772 4.618 5.029 . 0 0 "[ . 1 . 2]" 1
925 1 41 MET H 1 42 ALA H 3.053 2.442 3.655 2.583 2.465 2.775 . 0 0 "[ . 1 . 2]" 1
926 1 86 LYS H 1 87 LYS QB 3.699 2.959 4.439 4.677 4.160 4.986 0.547 16 3 "[ . 1* .+ -]" 1
927 1 113 ARG H 1 114 TRP H 3.128 2.502 3.733 2.775 2.570 2.964 . 0 0 "[ . 1 . 2]" 1
928 1 92 LYS H 1 92 LYS QE 4.238 3.390 5.086 4.501 3.938 4.923 . 0 0 "[ . 1 . 2]" 1
929 1 38 ALA H 1 38 ALA MB . 3.036 3.170 2.243 2.226 2.262 0.810 12 20 [***********+*****-**] 1
930 1 70 VAL H 1 71 LYS H 4.270 3.416 4.802 4.526 4.361 4.594 . 0 0 "[ . 1 . 2]" 1
931 1 29 SER QB 1 34 LEU H 4.603 3.682 5.524 5.812 5.343 6.095 0.571 19 4 "[ * . *1 - +2]" 1
932 1 32 LYS H 1 32 LYS QD 4.720 3.776 5.664 3.397 1.968 4.555 1.808 5 8 "[* + * 1* * *- *]" 1
933 1 40 LYS H 1 40 LYS HG3 3.067 2.148 3.222 3.016 1.962 3.835 0.613 11 4 "[ *. 1+ *- 2]" 1
934 1 112 LYS HA 1 116 LYS H 4.087 3.270 4.904 4.212 3.911 4.502 . 0 0 "[ . 1 . 2]" 1
935 1 102 ILE H 1 103 ARG H 4.298 3.438 4.553 4.442 4.338 4.504 . 0 0 "[ . 1 . 2]" 1
936 1 34 LEU QD 1 106 THR H 5.257 4.206 6.308 4.478 4.016 5.055 0.190 17 0 "[ . 1 . 2]" 1
937 1 86 LYS QB 1 87 LYS H 3.163 2.530 3.796 2.478 2.286 2.732 0.244 2 0 "[ . 1 . 2]" 1
938 1 47 LEU QD 1 118 PHE H 4.611 3.689 5.533 4.996 4.365 5.640 0.107 9 0 "[ . 1 . 2]" 1
939 1 103 ARG H 1 104 LYS H 4.481 3.585 5.239 4.289 4.077 4.441 . 0 0 "[ . 1 . 2]" 1
940 1 100 VAL H 1 101 ARG H 4.143 3.390 4.972 4.349 4.111 4.452 . 0 0 "[ . 1 . 2]" 1
941 1 90 GLU H 1 90 GLU QG 3.315 2.857 3.978 3.289 2.135 4.016 0.722 18 8 "[* * - * * . +**]" 1
942 1 113 ARG H 1 116 LYS H 4.085 3.874 4.902 4.746 4.566 4.976 0.074 11 0 "[ . 1 . 2]" 1
943 1 62 ILE H 1 64 LYS H 4.257 3.406 5.108 4.125 3.835 4.362 . 0 0 "[ . 1 . 2]" 1
944 1 95 LYS H 1 97 ASN H 4.676 3.741 5.611 3.905 3.635 4.221 0.106 5 0 "[ . 1 . 2]" 1
945 1 94 ARG H 1 96 LYS QB 4.297 3.438 5.156 5.189 4.408 5.836 0.680 16 2 "[ . 1 .+- 2]" 1
946 1 34 LEU H 1 35 ILE QG 4.236 3.389 5.083 4.551 4.171 5.569 0.486 11 0 "[ . 1 . 2]" 1
947 1 34 LEU QD 1 105 VAL H 4.282 3.426 5.138 5.042 4.423 5.728 0.590 9 1 "[ . +1 . 2]" 1
948 1 73 LEU H 1 118 PHE QD 4.291 3.433 5.149 5.248 4.378 6.034 0.885 19 5 "[ *. - * *. +2]" 1
949 1 111 ALA H 1 112 LYS QG 4.595 3.676 5.514 4.384 3.855 4.850 . 0 0 "[ . 1 . 2]" 1
950 1 42 ALA H 1 47 LEU HG 4.314 3.451 5.177 5.982 5.032 6.142 0.965 9 18 "[****** *+*** -******]" 1
951 1 46 ASN HB2 1 47 LEU H 3.941 3.153 4.729 4.422 4.183 4.656 . 0 0 "[ . 1 . 2]" 1
952 1 104 LYS H 1 105 VAL H 4.474 3.579 5.180 4.323 3.999 4.449 . 0 0 "[ . 1 . 2]" 1
953 1 28 TRP QB 1 29 SER H 4.275 3.533 5.130 3.914 3.580 3.979 . 0 0 "[ . 1 . 2]" 1
954 1 47 LEU H 1 47 LEU QB 3.073 2.458 3.364 2.529 2.264 2.966 0.194 9 0 "[ . 1 . 2]" 1
955 1 86 LYS H 1 86 LYS QD 3.639 2.911 4.367 4.435 4.249 4.784 0.417 19 0 "[ . 1 . 2]" 1
956 1 105 VAL HB 1 107 SER H . 3.956 3.961 3.792 3.684 3.943 0.272 2 0 "[ . 1 . 2]" 1
957 1 103 ARG H 1 104 LYS QG 3.905 3.124 4.686 4.896 4.497 5.210 0.524 5 1 "[ + 1 . 2]" 1
958 1 67 GLY H 1 70 VAL QG . 3.619 3.898 3.905 3.471 4.470 0.572 13 3 "[ * . 1 +-. 2]" 1
959 1 82 ALA MB 1 83 ASP H 3.381 2.705 4.057 2.960 2.687 3.196 0.018 11 0 "[ . 1 . 2]" 1
960 1 28 TRP HZ3 1 77 GLU H 4.652 3.722 5.582 5.275 4.314 6.578 0.996 9 2 "[ .- +1 . 2]" 1
961 1 33 LYS HA 1 34 LEU H 3.598 2.878 4.318 3.514 3.395 3.565 . 0 0 "[ . 1 . 2]" 1
962 1 79 THR HG1 1 82 ALA H 4.044 3.235 4.853 4.147 2.667 4.985 0.568 3 1 "[ + . 1 . 2]" 1
963 1 33 LYS HG3 1 34 LEU H 3.922 3.138 4.706 4.351 2.424 5.374 0.714 6 4 "[** .+ 1 -. 2]" 1
964 1 28 TRP HZ3 1 82 ALA H 4.181 3.345 5.017 3.765 2.649 5.878 0.861 12 2 "[ - . 1 + . 2]" 1
965 1 35 ILE H 1 36 GLU QB 4.609 3.687 5.531 4.454 4.233 4.748 . 0 0 "[ . 1 . 2]" 1
966 1 33 LYS H 1 34 LEU H 2.907 2.392 3.488 2.370 2.226 2.528 0.166 5 0 "[ . 1 . 2]" 1
967 1 29 SER H 1 30 ASN H 4.265 3.615 5.118 4.301 3.991 4.414 . 0 0 "[ . 1 . 2]" 1
968 1 44 LYS H 1 44 LYS HG2 3.676 2.941 4.411 3.889 2.104 4.613 0.837 19 3 "[ - * 1 . +2]" 1
969 1 25 VAL H 1 50 LEU H 4.136 3.473 4.963 4.381 3.945 5.037 0.074 20 0 "[ . 1 . 2]" 1
970 1 61 ASP HA 1 64 LYS H 3.843 3.074 4.612 3.836 3.368 4.573 . 0 0 "[ . 1 . 2]" 1
971 1 28 TRP QB 1 77 GLU H 4.605 3.684 4.982 4.097 3.447 5.451 0.469 9 0 "[ . 1 . 2]" 1
972 1 22 GLY QA 1 70 VAL H 4.690 3.752 5.628 5.540 4.728 6.314 0.686 6 5 "[ .+- 1* * . *2]" 1
973 1 75 LEU H 1 75 LEU HG 3.380 2.704 4.056 3.803 2.359 4.776 0.720 11 8 "[ * .* 1+* *.* -*2]" 1
974 1 42 ALA H 1 49 LEU QD 3.946 3.157 4.735 3.745 3.443 4.306 . 0 0 "[ . 1 . 2]" 1
975 1 34 LEU H 1 108 PRO QG 4.285 3.428 5.142 4.426 3.037 5.668 0.526 1 1 "[+ . 1 . 2]" 1
976 1 27 ILE H 1 51 THR HG1 4.384 3.507 5.261 4.785 3.263 6.193 0.932 12 5 "[ . 1 + * -**2]" 1
977 1 33 LYS HA 1 35 ILE H 4.519 3.615 5.423 4.511 4.050 4.883 . 0 0 "[ . 1 . 2]" 1
978 1 45 ALA HA 1 47 LEU H 4.021 3.217 4.825 4.986 4.713 5.639 0.814 7 2 "[ . + 1 - . 2]" 1
979 1 33 LYS H 1 33 LYS HG2 3.658 2.926 4.390 3.398 2.059 4.642 0.867 6 4 "[- * .+ 1 . * 2]" 1
980 1 87 LYS H 1 87 LYS QB 2.689 2.151 3.227 2.364 2.087 2.623 0.064 8 0 "[ . 1 . 2]" 1
981 1 40 LYS HG2 1 41 MET H 3.611 2.894 4.340 4.195 2.610 5.113 0.773 15 9 "[* * -*1 * *+ * *]" 1
982 1 57 LYS H 1 57 LYS HG3 4.344 3.475 5.213 4.082 2.505 4.583 0.970 17 3 "[- . * . + 2]" 1
983 1 87 LYS H 1 87 LYS HG2 3.553 2.418 3.628 3.220 2.016 4.520 0.892 1 4 "[+ * - 1 . * 2]" 1
984 1 79 THR H 1 79 THR HA 3.170 2.536 3.804 2.942 2.934 2.946 . 0 0 "[ . 1 . 2]" 1
985 1 87 LYS H 1 87 LYS QE 4.457 3.566 5.348 4.736 3.535 5.908 0.560 8 2 "[ . + 1 . - 2]" 1
986 1 102 ILE HB 1 103 ARG H 3.891 3.113 4.669 4.173 4.067 4.302 . 0 0 "[ . 1 . 2]" 1
987 1 112 LYS H 1 115 ILE H 4.771 3.817 5.725 4.986 4.703 5.199 . 0 0 "[ . 1 . 2]" 1
988 1 49 LEU QD 1 51 THR H 4.501 3.601 5.401 4.580 3.326 5.905 0.504 19 1 "[ . 1 . +2]" 1
989 1 71 LYS H 1 72 ILE QG 4.853 3.882 5.824 4.799 4.520 5.223 . 0 0 "[ . 1 . 2]" 1
990 1 29 SER H 1 51 THR HG1 4.842 3.874 5.810 5.080 2.822 6.638 1.052 20 7 "[ . -* * ***+]" 1
991 1 106 THR H 1 106 THR HA 3.136 2.509 3.763 2.921 2.892 2.942 . 0 0 "[ . 1 . 2]" 1
992 1 52 LEU QD 1 53 GLU H 4.152 3.322 4.982 3.261 1.685 4.370 1.637 18 5 "[ . *1** -. + 2]" 1
993 1 102 ILE MG 1 104 LYS H 4.391 3.513 5.269 4.051 3.275 4.660 0.238 8 0 "[ . 1 . 2]" 1
994 1 63 LEU HA 1 64 LYS H 4.156 3.325 4.987 3.527 3.415 3.566 . 0 0 "[ . 1 . 2]" 1
995 1 36 GLU H 1 39 ARG H 4.531 3.625 5.437 4.758 4.606 4.981 . 0 0 "[ . 1 . 2]" 1
996 1 106 THR H 1 110 GLU QG 4.851 3.881 5.821 4.933 3.702 5.935 0.179 18 0 "[ . 1 . 2]" 1
997 1 106 THR H 1 106 THR HB 3.990 3.814 4.788 3.113 2.689 3.491 1.125 1 13 "[+* -* * *** *.****2]" 1
998 1 105 VAL QG 1 114 TRP H 4.318 3.454 5.182 4.864 4.399 5.240 0.058 9 0 "[ . 1 . 2]" 1
999 1 57 LYS H 1 57 LYS HB2 3.469 2.775 4.163 2.562 2.390 3.643 0.385 1 0 "[ . 1 . 2]" 1
1000 1 102 ILE HA 1 103 ARG H 2.858 2.286 3.430 2.137 2.098 2.189 0.188 2 0 "[ . 1 . 2]" 1
1001 1 25 VAL H 1 49 LEU QB 4.156 3.674 4.987 4.229 3.279 5.259 0.395 10 0 "[ . 1 . 2]" 1
1002 1 39 ARG QD 1 40 LYS H 4.340 3.472 5.208 4.581 4.008 5.302 0.094 11 0 "[ . 1 . 2]" 1
1003 1 41 MET HA 1 44 LYS H 3.442 2.754 4.130 3.488 3.207 3.794 . 0 0 "[ . 1 . 2]" 1
1004 1 39 ARG H 1 42 ALA MB 4.134 3.307 4.961 4.716 4.514 4.923 . 0 0 "[ . 1 . 2]" 1
1005 1 77 GLU QG 1 78 ASP H 3.799 3.039 4.559 2.653 2.058 3.097 0.981 16 7 "[** *- *1 *+ 2]" 1
1006 1 83 ASP H 1 86 LYS QB 4.451 3.561 5.341 4.783 4.499 5.214 . 0 0 "[ . 1 . 2]" 1
1007 1 94 ARG H 1 95 LYS HA 4.196 3.357 5.035 5.193 5.081 5.339 0.304 14 0 "[ . 1 . 2]" 1
1008 1 31 ASP HA 1 34 LEU H 4.771 3.817 5.725 4.750 4.462 4.938 . 0 0 "[ . 1 . 2]" 1
1009 1 25 VAL H 1 72 ILE MG 3.978 3.182 4.774 4.825 4.117 5.481 0.707 17 2 "[ . 1 -. + 2]" 1
1010 1 48 TYR H 1 49 LEU H 4.250 3.486 5.100 4.276 4.008 4.516 . 0 0 "[ . 1 . 2]" 1
1011 1 46 ASN H 1 47 LEU HG 4.158 3.326 4.990 4.418 3.791 5.991 1.001 3 4 "[ + . - *1 * . 2]" 1
1012 1 117 GLU QB 1 119 SER H 4.240 3.392 5.088 4.662 4.375 5.028 . 0 0 "[ . 1 . 2]" 1
1013 1 38 ALA H 1 112 LYS QG 4.298 3.438 5.158 4.427 3.894 5.162 0.004 1 0 "[ . 1 . 2]" 1
1014 1 44 LYS QB 1 46 ASN H 4.093 3.274 4.912 4.406 4.243 4.664 . 0 0 "[ . 1 . 2]" 1
1015 1 23 LEU H 1 23 LEU QB 3.334 2.854 4.001 2.595 2.464 2.693 0.390 8 0 "[ . 1 . 2]" 1
1016 1 65 SER H 1 66 LEU H 3.780 3.157 4.536 2.432 2.332 2.642 0.825 6 20 [****-+**************] 1
1017 1 91 LYS QB 1 93 ALA H 4.094 3.275 4.913 4.649 4.429 4.908 . 0 0 "[ . 1 . 2]" 1
1018 1 37 GLU HA 1 38 ALA H 3.595 2.876 4.314 3.522 3.438 3.554 . 0 0 "[ . 1 . 2]" 1
1019 1 119 SER H 1 121 GLU H 4.083 3.266 4.900 4.078 3.550 4.718 . 0 0 "[ . 1 . 2]" 1
1020 1 86 LYS H 1 87 LYS H 3.354 2.683 4.018 2.733 2.577 2.854 0.106 17 0 "[ . 1 . 2]" 1
1021 1 48 TYR HA 1 49 LEU H . 2.880 3.317 2.182 2.096 2.272 0.784 13 20 [************+******-] 1
1022 1 40 LYS H 1 40 LYS HB2 2.606 2.114 3.170 2.779 2.243 3.635 0.465 10 0 "[ . 1 . 2]" 1
1023 1 91 LYS H 1 92 LYS H 3.109 2.487 3.731 2.666 2.493 2.796 . 0 0 "[ . 1 . 2]" 1
1024 1 40 LYS HA 1 42 ALA H 4.273 3.418 5.128 4.498 4.258 4.745 . 0 0 "[ . 1 . 2]" 1
1025 1 34 LEU H 1 37 GLU QB 4.307 3.446 5.168 5.097 4.560 5.797 0.629 10 1 "[ . + . 2]" 1
1026 1 95 LYS HB2 1 97 ASN H 3.956 3.165 4.747 5.067 4.591 5.548 0.801 2 6 "[*+- . 1 ** * 2]" 1
1027 1 105 VAL QG 1 106 THR H 3.922 3.222 4.706 3.417 3.345 3.507 . 0 0 "[ . 1 . 2]" 1
1028 1 83 ASP H 1 84 LYS QD 4.648 3.718 5.578 5.257 3.463 6.345 0.767 20 2 "[ . 1 - +]" 1
1029 1 23 LEU H 1 23 LEU HA 3.550 2.840 4.260 2.936 2.918 2.947 . 0 0 "[ . 1 . 2]" 1
1030 1 94 ARG H 1 94 ARG QG 3.677 2.942 3.956 3.026 1.946 4.054 0.996 13 10 "[* * ** * * *+ . -* 2]" 1
1031 1 108 PRO QB 1 112 LYS H 3.827 3.062 4.592 4.841 4.537 5.124 0.532 6 1 "[ .+ 1 . 2]" 1
1032 1 57 LYS H 1 57 LYS QD 4.767 3.814 5.720 4.175 1.853 4.666 1.961 19 1 "[ . 1 . +2]" 1
1033 1 27 ILE MG 1 52 LEU H 4.296 3.437 5.155 4.994 4.256 6.097 0.942 11 5 "[ * . - 1+ *. *]" 1
1034 1 78 ASP H 1 79 THR H 3.648 2.918 4.378 4.001 3.837 4.081 . 0 0 "[ . 1 . 2]" 1
1035 1 40 LYS H 1 40 LYS HB3 2.642 2.085 3.127 3.300 2.583 3.594 0.467 20 0 "[ . 1 . 2]" 1
1036 1 92 LYS HA 1 95 LYS H 3.677 2.942 4.412 3.376 3.027 3.698 . 0 0 "[ . 1 . 2]" 1
1037 1 32 LYS H 1 34 LEU H 4.588 3.670 5.506 3.967 3.619 4.446 0.051 18 0 "[ . 1 . 2]" 1
1038 1 107 SER H 1 111 ALA H 4.408 3.526 5.148 4.221 3.619 4.901 . 0 0 "[ . 1 . 2]" 1
1039 1 86 LYS H 1 86 LYS QE 5.214 4.171 6.046 5.669 4.448 6.092 0.046 6 0 "[ . 1 . 2]" 1
1040 1 109 ASP H 1 109 ASP QB 3.658 2.926 4.390 2.347 2.229 2.623 0.697 9 16 "[** *** *+*** *-****2]" 1
1041 1 27 ILE MD 1 35 ILE H 4.352 3.482 5.222 4.478 3.797 5.144 . 0 0 "[ . 1 . 2]" 1
1042 1 83 ASP H 1 85 VAL H 4.422 3.538 5.306 3.960 3.691 4.259 . 0 0 "[ . 1 . 2]" 1
1043 1 84 LYS H 1 85 VAL H 3.065 2.549 3.678 2.484 2.287 2.699 0.262 13 0 "[ . 1 . 2]" 1
1044 1 41 MET H 1 43 GLU H 3.924 3.139 4.709 4.003 3.812 4.234 . 0 0 "[ . 1 . 2]" 1
1045 1 23 LEU H 1 23 LEU QD 3.858 3.127 4.630 3.690 2.547 4.039 0.580 17 1 "[ . 1 . + 2]" 1
1046 1 71 LYS H 1 71 LYS QD 3.943 3.154 4.732 4.064 3.028 5.040 0.308 11 0 "[ . 1 . 2]" 1
1047 1 114 TRP H 1 116 LYS H 3.786 3.029 4.543 4.161 3.796 4.452 . 0 0 "[ . 1 . 2]" 1
1048 1 85 VAL H 1 86 LYS QB 4.448 3.558 5.338 4.298 4.101 4.450 . 0 0 "[ . 1 . 2]" 1
1049 1 32 LYS H 1 33 LYS H 4.066 3.313 4.879 2.574 2.428 2.953 0.885 10 19 "[*********+ ******-**]" 1
1050 1 23 LEU H 1 66 LEU QD 4.502 3.602 5.402 3.660 2.614 5.047 0.988 17 4 "[* . 1 -. + *]" 1
1051 1 73 LEU HA 1 74 VAL H 2.933 2.346 3.520 2.179 2.142 2.211 0.204 16 0 "[ . 1 . 2]" 1
1052 1 108 PRO HA 1 112 LYS H 4.257 3.406 5.108 4.066 3.612 4.473 . 0 0 "[ . 1 . 2]" 1
1053 1 83 ASP H 1 84 LYS HA 4.908 3.926 5.890 5.067 4.934 5.184 . 0 0 "[ . 1 . 2]" 1
1054 1 87 LYS QB 1 88 GLU H 2.982 2.386 3.578 2.788 2.221 3.691 0.165 1 0 "[ . 1 . 2]" 1
1055 1 86 LYS QG 1 87 LYS H 3.860 3.088 4.632 3.474 3.058 4.296 0.030 10 0 "[ . 1 . 2]" 1
1056 1 39 ARG H 1 49 LEU QB 5.207 4.166 6.248 5.837 5.481 6.344 0.096 16 0 "[ . 1 . 2]" 1
1057 1 76 LEU HG 1 77 GLU H 4.476 3.581 5.371 4.115 2.671 5.460 0.910 17 6 "[ . -1* ***+ 2]" 1
1058 1 29 SER HA 1 30 ASN H . 3.294 3.818 2.384 2.237 2.556 1.057 9 20 [********+**-********] 1
1059 1 120 GLU QB 1 121 GLU H 3.646 2.917 4.375 3.420 2.437 4.006 0.480 20 0 "[ . 1 . 2]" 1
1060 1 24 LEU H 1 24 LEU HA 3.563 2.850 4.276 2.948 2.937 2.955 . 0 0 "[ . 1 . 2]" 1
1061 1 29 SER QB 1 30 ASN H 4.102 3.282 4.922 2.899 2.415 3.753 0.867 16 12 "[ *** *****.+* *-]" 1
1062 1 74 VAL H 1 75 LEU H 3.880 3.362 4.656 4.346 4.201 4.458 . 0 0 "[ . 1 . 2]" 1
1063 1 101 ARG H 1 102 ILE H 4.612 3.690 5.468 4.145 3.947 4.378 . 0 0 "[ . 1 . 2]" 1
1064 1 45 ALA MB 1 119 SER H 4.042 3.234 4.850 4.892 4.290 5.602 0.752 10 3 "[ . + .*- 2]" 1
1065 1 46 ASN H 1 47 LEU QB 4.275 3.420 5.130 4.779 4.425 5.029 . 0 0 "[ . 1 . 2]" 1
1066 1 30 ASN H 1 77 GLU QB 4.105 3.284 4.926 3.642 2.989 4.556 0.295 14 0 "[ . 1 . 2]" 1
1067 1 24 LEU H 1 24 LEU QB 3.406 2.725 3.794 2.463 2.386 2.596 0.339 12 0 "[ . 1 . 2]" 1
1068 1 31 ASP H 1 34 LEU H 5.003 4.002 6.004 4.964 4.563 5.329 . 0 0 "[ . 1 . 2]" 1
1069 1 83 ASP H 1 84 LYS QB 4.145 3.316 4.974 4.423 4.064 5.078 0.104 14 0 "[ . 1 . 2]" 1
1070 1 75 LEU H 1 76 LEU H 4.595 3.676 5.021 4.275 4.058 4.432 . 0 0 "[ . 1 . 2]" 1
1071 1 38 ALA MB 1 40 LYS H 3.936 3.149 4.723 4.583 4.341 4.802 0.079 15 0 "[ . 1 . 2]" 1
1072 1 76 LEU QD 1 105 VAL H 4.556 3.645 5.467 5.217 4.539 5.701 0.234 1 0 "[ . 1 . 2]" 1
1073 1 30 ASN HA 1 31 ASP H 3.386 2.709 4.063 2.396 2.322 2.531 0.387 7 0 "[ . 1 . 2]" 1
1074 1 22 GLY QA 1 23 LEU H 3.510 2.808 4.212 2.223 2.118 2.601 0.690 18 18 "[*** *** *********+*-]" 1
1075 1 106 THR HG1 1 107 SER H 3.725 2.980 4.470 4.524 3.950 4.962 0.492 1 0 "[ . 1 . 2]" 1
1076 1 39 ARG H 1 115 ILE MD 3.814 3.051 4.577 4.767 4.399 5.150 0.573 3 1 "[ + . 1 . 2]" 1
1077 1 59 ILE MG 1 61 ASP H 4.276 3.421 5.131 4.883 4.642 5.006 . 0 0 "[ . 1 . 2]" 1
1078 1 29 SER QB 1 31 ASP H 4.375 3.500 5.250 3.194 2.883 3.770 0.617 6 5 "[ .+* - . * *2]" 1
1079 1 43 GLU H 1 44 LYS QB 3.709 2.967 4.451 4.481 4.176 4.979 0.528 19 1 "[ . 1 . +2]" 1
1080 1 57 LYS H 1 57 LYS HG2 4.276 3.421 5.131 4.251 2.434 4.644 0.987 16 1 "[ . 1 .+ 2]" 1
1081 1 46 ASN H 1 46 ASN HB3 3.456 2.765 4.147 3.928 3.617 4.149 0.002 3 0 "[ . 1 . 2]" 1
1082 1 76 LEU QD 1 82 ALA H 4.709 3.767 5.651 5.114 4.313 6.021 0.370 2 0 "[ . 1 . 2]" 1
1083 1 44 LYS H 1 45 ALA MB 3.824 3.059 4.589 4.440 4.271 4.662 0.073 13 0 "[ . 1 . 2]" 1
1084 1 114 TRP HA 1 118 PHE H 4.703 3.762 5.644 4.173 3.799 4.552 . 0 0 "[ . 1 . 2]" 1
1085 1 47 LEU H 1 47 LEU HA 3.500 2.800 4.200 2.935 2.916 2.949 . 0 0 "[ . 1 . 2]" 1
1086 1 89 ILE HB 1 91 LYS H 3.739 2.991 4.487 5.116 4.916 5.255 0.768 15 16 "[ ***** *** **+-****]" 1
1087 1 121 GLU H 1 121 GLU HB2 2.659 2.127 3.191 3.051 2.344 3.775 0.584 12 4 "[ * 1 + . - *]" 1
1088 1 28 TRP HE3 1 82 ALA H 4.401 3.521 5.281 5.301 4.262 6.441 1.160 9 5 "[ . +1 ** * - 2]" 1
1089 1 29 SER H 1 30 ASN HA 4.194 3.355 5.033 4.494 4.240 4.617 . 0 0 "[ . 1 . 2]" 1
1090 1 28 TRP HE1 1 85 VAL QG 3.693 2.954 4.432 3.650 1.984 4.856 0.970 9 1 "[ . +1 . 2]" 1
1091 1 85 VAL H 1 86 LYS HA 4.552 3.642 5.462 5.190 5.073 5.288 . 0 0 "[ . 1 . 2]" 1
1092 1 82 ALA MB 1 84 LYS H 3.945 3.156 4.734 4.552 4.361 4.774 0.040 14 0 "[ . 1 . 2]" 1
1093 1 116 LYS H 1 118 PHE QB 4.526 3.621 5.431 5.182 4.858 5.496 0.065 19 0 "[ . 1 . 2]" 1
1094 1 79 THR H 1 79 THR HB 4.287 4.021 5.144 3.055 2.720 3.737 1.301 19 14 "[* ** **** *-** *+*]" 1
1095 1 33 LYS QB 1 35 ILE H 4.217 3.374 5.060 4.970 4.733 5.332 0.272 1 0 "[ . 1 . 2]" 1
1096 1 85 VAL QG 1 89 ILE H 4.296 3.437 5.155 3.676 3.361 4.097 0.076 12 0 "[ . 1 . 2]" 1
1097 1 118 PHE H 1 118 PHE QD 3.898 3.118 4.678 2.680 2.293 4.193 0.825 19 15 "[****.* * 1*******-+2]" 1
1098 1 118 PHE HA 1 120 GLU H 4.218 3.374 5.062 3.969 3.364 4.813 0.010 15 0 "[ . 1 . 2]" 1
1099 1 25 VAL H 1 25 VAL HB 3.406 2.725 4.087 2.758 2.577 3.871 0.148 10 0 "[ . 1 . 2]" 1
1100 1 34 LEU HG 1 35 ILE H 4.253 3.402 5.104 4.491 3.537 5.128 0.024 18 0 "[ . 1 . 2]" 1
1101 1 27 ILE H 1 52 LEU H 4.537 3.630 5.444 4.549 3.775 5.435 . 0 0 "[ . 1 . 2]" 1
1102 1 91 LYS H 1 93 ALA MB 3.928 3.142 4.714 4.769 4.442 4.989 0.275 9 0 "[ . 1 . 2]" 1
1103 1 23 LEU HA 1 71 LYS H 3.595 2.876 4.314 3.105 2.642 3.997 0.234 17 0 "[ . 1 . 2]" 1
1104 1 25 VAL H 1 25 VAL QG . 3.546 4.021 2.501 2.089 2.874 1.457 2 20 [*+****-*************] 1
1105 1 104 LYS H 1 114 TRP HE1 4.949 3.959 5.939 6.912 6.473 6.989 1.050 10 20 [*********+*****-****] 1
1106 1 40 LYS H 1 40 LYS HE2 4.108 3.286 4.930 4.981 3.225 5.860 0.930 11 5 "[ * *- 1+ . * 2]" 1
1107 1 70 VAL H 1 70 VAL HB . 3.537 3.755 2.586 2.338 3.652 1.199 16 18 "[************- .+****]" 1
1108 1 65 SER H 1 66 LEU QD 4.618 3.694 5.542 4.001 3.093 5.534 0.601 12 1 "[ . 1 + . 2]" 1
1109 1 115 ILE HB 1 117 GLU H 4.181 3.345 5.017 5.020 4.729 5.442 0.425 18 0 "[ . 1 . 2]" 1
1110 1 86 LYS H 1 86 LYS QB . 3.614 3.700 2.225 2.163 2.275 1.451 3 20 [**+****************-] 1
1111 1 106 THR H 1 110 GLU QB 4.465 3.572 5.358 4.528 3.740 4.946 . 0 0 "[ . 1 . 2]" 1
1112 1 98 LEU H 1 98 LEU HA 3.420 2.736 4.104 2.944 2.929 2.951 . 0 0 "[ . 1 . 2]" 1
1113 1 35 ILE H 1 37 GLU H 4.511 3.609 5.413 4.314 4.053 4.600 . 0 0 "[ . 1 . 2]" 1
1114 1 45 ALA H 1 47 LEU QD 4.058 3.246 4.870 3.829 2.907 4.347 0.339 3 0 "[ . 1 . 2]" 1
1115 1 48 TYR H 1 48 TYR QE 3.903 3.122 4.684 4.631 4.288 5.257 0.573 1 1 "[+ . 1 . 2]" 1
1116 1 91 LYS H 1 91 LYS QG 3.328 3.054 3.994 2.788 2.085 4.011 0.969 6 13 "[***-*+ * **** * *2]" 1
1117 1 39 ARG H 1 49 LEU QD 3.482 2.786 4.178 3.400 2.870 3.854 . 0 0 "[ . 1 . 2]" 1
1118 1 26 LEU H 1 26 LEU HA 3.695 2.956 4.434 2.933 2.882 2.954 0.074 20 0 "[ . 1 . 2]" 1
1119 1 89 ILE H 1 92 LYS H 4.697 3.758 5.636 4.792 4.620 5.021 . 0 0 "[ . 1 . 2]" 1
1120 1 24 LEU QD 1 25 VAL H 3.173 2.538 3.808 2.486 1.870 2.993 0.668 12 1 "[ . 1 + . 2]" 1
1121 1 90 GLU H 1 92 LYS H 4.486 3.589 5.383 4.159 3.921 4.377 . 0 0 "[ . 1 . 2]" 1
1122 1 98 LEU H 1 99 PRO HA 4.881 3.905 5.857 4.969 4.695 5.281 . 0 0 "[ . 1 . 2]" 1
1123 1 116 LYS H 1 117 GLU QB 4.413 3.530 5.296 4.462 4.007 4.940 . 0 0 "[ . 1 . 2]" 1
1124 1 56 ASP HA 1 59 ILE H 4.126 3.301 4.951 4.287 3.334 5.027 0.076 17 0 "[ . 1 . 2]" 1
1125 1 28 TRP H 1 76 LEU H 4.279 3.423 5.135 5.059 4.759 5.736 0.601 13 1 "[ . 1 + . 2]" 1
1126 1 91 LYS H 1 94 ARG H 4.214 3.371 5.057 4.839 4.650 5.125 0.068 5 0 "[ . 1 . 2]" 1
1127 1 58 LYS H 1 58 LYS QG 4.165 3.376 4.998 2.996 2.296 4.093 1.080 4 12 "[- +.*** 1** *. ****]" 1
1128 1 86 LYS HA 1 87 LYS H 3.890 3.112 4.668 3.540 3.493 3.581 . 0 0 "[ . 1 . 2]" 1
1129 1 40 LYS HB3 1 41 MET H 3.279 . 4.591 3.695 3.280 4.103 . 0 0 "[ . 1 . 2]" 1
1130 1 25 VAL QG 1 26 LEU H 3.492 2.794 4.190 2.772 2.277 3.314 0.517 16 1 "[ . 1 .+ 2]" 1
1131 1 105 VAL HA 1 107 SER H 3.768 3.014 4.522 5.116 5.002 5.217 0.695 19 18 "[****.* *******-***+*]" 1
1132 1 65 SER QB 1 66 LEU H 4.025 3.220 4.830 2.979 2.606 3.814 0.614 16 2 "[ . 1 .+ -2]" 1
1133 1 41 MET QB 1 42 ALA H 3.265 2.612 3.918 2.563 2.420 2.766 0.192 17 0 "[ . 1 . 2]" 1
1134 1 24 LEU HG 1 26 LEU H 4.210 3.368 5.052 5.030 3.879 5.991 0.939 18 7 "[ - . ** 1 * .* + *]" 1
1135 1 39 ARG HA 1 42 ALA H 3.482 2.786 4.178 3.587 3.205 4.067 . 0 0 "[ . 1 . 2]" 1
1136 1 112 LYS QG 1 113 ARG H 4.165 3.332 4.998 4.117 3.972 4.290 . 0 0 "[ . 1 . 2]" 1
1137 1 111 ALA H 1 111 ALA MB . 3.041 3.248 2.238 2.224 2.263 0.817 9 20 [*-******+***********] 1
1138 1 35 ILE HA 1 39 ARG H 4.335 3.468 5.202 4.017 3.780 4.385 . 0 0 "[ . 1 . 2]" 1
1139 1 48 TYR H 1 48 TYR QB 4.349 3.479 5.050 2.534 2.373 2.747 1.106 16 20 [***************+**-*] 1
1140 1 25 VAL H 1 48 TYR QB 4.530 3.624 5.436 3.803 3.192 4.186 0.432 7 0 "[ . 1 . 2]" 1
1141 1 52 LEU QB 1 53 GLU H 5.065 4.052 6.078 2.971 1.777 3.807 2.275 9 18 "[********+** **-** **]" 1
1142 1 26 LEU H 1 73 LEU QD 4.115 3.292 4.938 4.441 3.695 5.124 0.186 11 0 "[ . 1 . 2]" 1
1143 1 88 GLU HA 1 89 ILE H 3.729 2.983 4.475 3.550 3.517 3.572 . 0 0 "[ . 1 . 2]" 1
1144 1 57 LYS H 1 59 ILE H 4.954 3.963 5.945 4.217 3.865 4.482 0.098 14 0 "[ . 1 . 2]" 1
1145 1 115 ILE H 1 115 ILE HB . 3.216 3.523 2.488 2.423 2.596 0.793 2 20 [*+**************-***] 1
1146 1 98 LEU H 1 98 LEU QD . 4.073 4.075 3.740 3.460 3.995 0.613 9 7 "[-* ** +1 *.* 2]" 1
1147 1 88 GLU H 1 88 GLU HB3 2.870 2.296 3.444 3.544 2.738 3.622 0.178 18 0 "[ . 1 . 2]" 1
1148 1 27 ILE H 1 50 LEU H 4.433 3.546 5.228 3.562 2.847 3.977 0.699 2 2 "[ + . 1 - . 2]" 1
1149 1 108 PRO QG 1 109 ASP H 4.598 3.678 5.518 3.123 2.209 3.902 1.469 6 9 "[** .+- ** * * * 2]" 1
1150 1 30 ASN H 1 31 ASP H 3.328 2.662 3.826 3.351 3.023 3.735 . 0 0 "[ . 1 . 2]" 1
1151 1 105 VAL QG 1 112 LYS H 4.741 3.793 5.689 5.466 5.004 5.705 0.016 9 0 "[ . 1 . 2]" 1
1152 1 27 ILE H 1 51 THR HA 3.744 2.995 4.493 3.172 2.685 3.881 0.310 5 0 "[ . 1 . 2]" 1
1153 1 118 PHE QB 1 120 GLU H 4.753 3.802 5.704 4.670 4.450 5.110 . 0 0 "[ . 1 . 2]" 1
1154 1 83 ASP HA 1 87 LYS H 3.917 3.134 4.700 4.395 3.954 4.872 0.172 6 0 "[ . 1 . 2]" 1
1155 1 56 ASP HA 1 57 LYS H 4.020 3.216 4.824 3.533 3.448 3.595 . 0 0 "[ . 1 . 2]" 1
1156 1 81 ASP HA 1 83 ASP H 3.043 2.434 3.652 3.753 3.497 4.141 0.489 5 0 "[ . 1 . 2]" 1
1157 1 76 LEU H 1 104 LYS QG 4.586 3.669 5.503 4.258 3.665 5.102 0.004 2 0 "[ . 1 . 2]" 1
1158 1 63 LEU HA 1 66 LEU H . 4.427 4.668 3.330 2.725 3.889 1.702 2 20 [*+**-***************] 1
1159 1 117 GLU QG 1 118 PHE H 4.548 3.638 5.458 3.631 2.365 4.277 1.273 7 4 "[ * + 1 . * -]" 1
1160 1 57 LYS H 1 58 LYS H 4.278 3.422 5.134 2.739 2.522 3.021 0.900 9 18 "[* * *-**+***********]" 1
1161 1 42 ALA HA 1 44 LYS H 4.418 3.534 5.302 4.278 3.833 4.551 . 0 0 "[ . 1 . 2]" 1
1162 1 114 TRP H 1 114 TRP HD1 3.793 3.034 4.552 3.231 2.617 3.896 0.417 18 0 "[ . 1 . 2]" 1
1163 1 26 LEU H 1 74 VAL HA 3.502 2.802 4.202 2.630 2.474 2.882 0.328 6 0 "[ . 1 . 2]" 1
1164 1 38 ALA MB 1 39 ARG H . 3.478 3.664 2.509 2.349 2.636 1.129 20 20 [-******************+] 1
1165 1 45 ALA H 1 45 ALA MB . 3.154 3.194 2.319 2.269 2.373 0.885 16 20 [**-************+****] 1
1166 1 26 LEU QB 1 27 ILE H 3.976 3.181 4.771 3.020 2.496 3.467 0.685 20 1 "[ . 1 . +]" 1
1167 1 73 LEU QD 1 114 TRP H 4.336 3.469 5.203 4.756 4.362 5.207 0.004 10 0 "[ . 1 . 2]" 1
1168 1 93 ALA MB 1 94 ARG H . 3.434 3.724 2.584 2.308 2.913 1.126 13 20 [******-*****+*******] 1
1169 1 77 GLU H 1 78 ASP H 4.174 3.613 5.009 4.544 4.406 4.651 . 0 0 "[ . 1 . 2]" 1
1170 1 87 LYS H 1 102 ILE MD 4.485 3.588 5.382 5.598 5.255 6.306 0.924 19 4 "[ * - *1 . +2]" 1
1171 1 84 LYS H 1 85 VAL HA 4.514 3.611 5.417 5.124 4.963 5.299 . 0 0 "[ . 1 . 2]" 1
1172 1 50 LEU H 1 50 LEU HG 3.588 2.870 4.306 3.638 2.721 4.512 0.206 9 0 "[ . 1 . 2]" 1
1173 1 25 VAL HB 1 50 LEU H 4.091 3.273 4.909 4.402 4.028 5.812 0.903 2 2 "[ + . 1 . -]" 1
1174 1 115 ILE H 1 115 ILE MG 2.859 2.287 3.431 3.764 3.744 3.782 0.351 13 0 "[ . 1 . 2]" 1
1175 1 25 VAL QG 1 49 LEU H 4.496 3.717 5.395 4.757 3.366 5.226 0.351 2 0 "[ . 1 . 2]" 1
1176 1 53 GLU QB 1 54 THR H 4.985 4.561 5.982 2.267 1.716 3.738 2.845 18 20 [******-**********+**] 1
1177 1 89 ILE MG 1 91 LYS H 4.071 3.257 4.885 5.004 4.787 5.178 0.293 4 0 "[ . 1 . 2]" 1
1178 1 100 VAL H 1 100 VAL QG . 3.401 3.661 2.247 1.941 2.866 1.460 14 20 [*************+-*****] 1
1179 1 74 VAL HB 1 102 ILE H 4.464 3.571 5.357 4.932 3.997 6.496 1.139 12 6 "[ .* * 1 + *.* -]" 1
1180 1 33 LYS HA 1 36 GLU H 3.372 2.698 4.046 3.441 2.935 3.807 . 0 0 "[ . 1 . 2]" 1
1181 1 114 TRP H 1 114 TRP HA 3.426 2.741 4.111 2.813 2.775 2.882 . 0 0 "[ . 1 . 2]" 1
1182 1 61 ASP H 1 63 LEU H 3.985 3.188 4.782 4.218 3.986 4.420 . 0 0 "[ . 1 . 2]" 1
1183 1 64 LYS H 1 64 LYS HA 3.318 2.654 3.982 2.834 2.795 2.865 . 0 0 "[ . 1 . 2]" 1
1184 1 94 ARG HA 1 97 ASN H 3.827 3.062 4.592 3.538 3.027 3.878 0.035 5 0 "[ . 1 . 2]" 1
1185 1 27 ILE HA 1 28 TRP H 3.090 3.078 3.708 2.162 2.117 2.224 0.961 18 20 [**********-******+**] 1
1186 1 81 ASP QB 1 82 ALA H 4.240 3.405 5.088 3.019 2.482 3.666 0.923 9 6 "[ * -+* .* *2]" 1
1187 1 105 VAL HA 1 106 THR H 3.099 2.479 3.719 2.218 2.141 2.298 0.338 7 0 "[ . 1 . 2]" 1
1188 1 113 ARG H 1 115 ILE H 4.212 3.370 5.054 4.091 3.836 4.427 . 0 0 "[ . 1 . 2]" 1
1189 1 49 LEU H 1 50 LEU H 4.712 3.770 5.195 4.408 4.250 4.541 . 0 0 "[ . 1 . 2]" 1
1190 1 39 ARG H 1 40 LYS H 3.025 2.583 3.630 2.727 2.543 2.904 0.040 5 0 "[ . 1 . 2]" 1
1191 1 47 LEU H 1 115 ILE MG 4.006 3.205 4.807 5.183 4.538 5.424 0.617 16 6 "[* . * -.+ **2]" 1
1192 1 69 PRO QD 1 70 VAL H 4.333 3.466 5.200 4.784 4.684 4.934 . 0 0 "[ . 1 . 2]" 1
1193 1 26 LEU H 1 73 LEU H 4.084 3.267 4.901 3.979 3.547 4.483 . 0 0 "[ . 1 . 2]" 1
1194 1 61 ASP H 1 61 ASP HA 3.477 2.782 4.172 2.812 2.767 2.867 0.015 9 0 "[ . 1 . 2]" 1
1195 1 61 ASP H 1 63 LEU QD 4.791 3.833 5.749 5.563 4.549 6.129 0.380 5 0 "[ . 1 . 2]" 1
1196 1 49 LEU QB 1 50 LEU H 3.942 3.154 4.730 3.140 2.591 3.885 0.563 19 1 "[ . 1 . +2]" 1
1197 1 60 GLU QG 1 61 ASP H 3.987 3.190 4.784 3.846 3.275 4.394 . 0 0 "[ . 1 . 2]" 1
1198 1 25 VAL HB 1 49 LEU H 4.553 3.642 5.464 4.881 4.221 6.441 0.977 20 2 "[ - . 1 . +]" 1
1199 1 84 LYS H 1 84 LYS QB 2.671 2.156 3.205 2.409 2.232 2.865 . 0 0 "[ . 1 . 2]" 1
1200 1 80 LYS QG 1 83 ASP H 4.761 3.809 5.713 5.307 4.685 6.225 0.512 14 1 "[ . 1 +. 2]" 1
1201 1 43 GLU H 1 45 ALA H 3.575 2.860 4.290 4.184 3.855 4.517 0.227 7 0 "[ . 1 . 2]" 1
1202 1 24 LEU QD 1 49 LEU H 4.089 3.271 4.907 4.605 3.360 5.427 0.520 2 1 "[ + . 1 . 2]" 1
1203 1 61 ASP H 1 61 ASP QB 3.288 2.829 3.946 2.257 2.078 2.429 0.751 8 18 "[*******+*-** **** **]" 1
1204 1 114 TRP HA 1 115 ILE H 4.239 3.391 5.087 3.513 3.468 3.548 . 0 0 "[ . 1 . 2]" 1
1205 1 94 ARG QD 1 95 LYS H 5.144 4.115 6.173 4.768 4.323 5.332 . 0 0 "[ . 1 . 2]" 1
1206 1 35 ILE H 1 36 GLU H 3.259 2.714 3.911 2.651 2.510 2.806 0.204 18 0 "[ . 1 . 2]" 1
1207 1 88 GLU H 1 89 ILE MG 4.166 3.333 4.999 5.863 5.737 5.939 0.940 9 20 [********+******-****] 1
1208 1 64 LYS H 1 65 SER H 4.017 3.307 4.820 2.562 2.460 2.687 0.847 6 20 [*****+*-************] 1
1209 1 79 THR H 1 82 ALA HA 4.795 3.836 5.754 4.601 4.062 5.177 . 0 0 "[ . 1 . 2]" 1
1210 1 28 TRP H 1 75 LEU QB 4.566 3.653 5.479 4.002 3.298 4.960 0.355 12 0 "[ . 1 . 2]" 1
1211 1 43 GLU H 1 49 LEU QD 4.388 3.510 5.266 4.176 3.656 4.911 . 0 0 "[ . 1 . 2]" 1
1212 1 92 LYS H 1 93 ALA H 3.301 2.641 3.961 2.616 2.423 2.803 0.218 20 0 "[ . 1 . 2]" 1
1213 1 38 ALA H 1 39 ARG H 3.097 2.545 3.716 2.637 2.491 2.748 0.054 16 0 "[ . 1 . 2]" 1
1214 1 64 LYS H 1 64 LYS QB 3.203 2.562 3.844 2.272 2.192 2.435 0.370 15 0 "[ . 1 . 2]" 1
1215 1 71 LYS H 1 71 LYS HA 3.612 2.890 4.334 2.903 2.872 2.940 0.018 18 0 "[ . 1 . 2]" 1
1216 1 27 ILE H 1 75 LEU H 4.893 3.914 5.872 4.619 4.515 4.801 . 0 0 "[ . 1 . 2]" 1
1217 1 84 LYS H 1 84 LYS HG2 3.640 2.912 4.368 3.166 1.942 4.473 0.970 6 5 "[- *.+ 1 **. 2]" 1
1218 1 48 TYR QB 1 49 LEU H 3.865 3.092 4.580 3.354 2.837 3.753 0.255 8 0 "[ . 1 . 2]" 1
1219 1 95 LYS H 1 96 LYS H 3.681 3.190 4.417 2.557 2.381 2.781 0.809 11 19 "[ ******-**+*********]" 1
1220 1 116 LYS H 1 116 LYS QE 4.224 3.379 5.069 4.769 4.033 5.642 0.573 7 3 "[ * + 1 . - 2]" 1
1221 1 26 LEU H 1 75 LEU H 4.113 3.290 4.936 3.870 3.560 4.411 . 0 0 "[ . 1 . 2]" 1
1222 1 30 ASN QB 1 31 ASP H 4.032 3.226 4.838 3.938 3.865 4.027 . 0 0 "[ . 1 . 2]" 1
1223 1 114 TRP H 1 114 TRP HE1 4.900 3.920 5.880 4.861 4.525 5.185 . 0 0 "[ . 1 . 2]" 1
1224 1 81 ASP QB 1 85 VAL H 4.843 3.874 5.812 4.747 4.170 5.527 . 0 0 "[ . 1 . 2]" 1
1225 1 110 GLU H 1 113 ARG QB 4.707 3.766 5.576 4.699 4.395 5.042 . 0 0 "[ . 1 . 2]" 1
1226 1 72 ILE HA 1 73 LEU H 2.995 2.922 3.594 2.122 2.074 2.203 0.848 8 20 [*******+***-********] 1
1227 1 49 LEU H 1 49 LEU HG 4.056 3.245 4.867 3.672 2.335 4.611 0.910 12 4 "[ - * 1*+ . 2]" 1
1228 1 116 LYS QD 1 117 GLU H 4.041 3.233 4.849 4.440 2.489 5.302 0.744 16 1 "[ . 1 .+ 2]" 1
1229 1 76 LEU QD 1 85 VAL H 4.447 3.558 5.336 4.586 3.982 5.474 0.138 19 0 "[ . 1 . 2]" 1
1230 1 94 ARG H 1 94 ARG QD 4.332 3.466 5.198 4.057 3.047 4.721 0.419 1 0 "[ . 1 . 2]" 1
1231 1 23 LEU H 1 71 LYS H 4.806 3.845 5.767 5.004 4.557 5.799 0.032 7 0 "[ . 1 . 2]" 1
1232 1 33 LYS H 1 33 LYS HD2 3.997 3.198 4.796 4.468 2.650 5.152 0.548 14 1 "[ . 1 +. 2]" 1
1233 1 111 ALA H 1 112 LYS H 3.156 2.525 3.743 2.735 2.436 2.914 0.089 2 0 "[ . 1 . 2]" 1
1234 1 95 LYS H 1 95 LYS HB2 2.746 2.197 3.295 2.483 2.215 3.639 0.344 7 0 "[ . 1 . 2]" 1
1235 1 49 LEU H 1 49 LEU QD 3.711 2.969 4.453 2.750 1.696 3.829 1.273 2 11 "[*+* . ***-* . ***]" 1
1236 1 31 ASP QB 1 32 LYS H 4.644 3.715 5.573 3.446 3.186 3.692 0.529 18 1 "[ . 1 . + 2]" 1
1237 1 72 ILE H 1 101 ARG H 4.445 3.556 5.334 4.342 3.820 5.070 . 0 0 "[ . 1 . 2]" 1
1238 1 71 LYS H 1 71 LYS QG 3.562 3.002 4.274 2.834 2.114 4.040 0.888 12 11 "[ ** . *- +**** * *]" 1
1239 1 111 ALA MB 1 115 ILE H 4.268 3.414 5.122 4.829 4.566 5.092 . 0 0 "[ . 1 . 2]" 1
1240 1 40 LYS HB3 1 43 GLU H 4.307 2.584 6.030 5.499 5.207 5.803 . 0 0 "[ . 1 . 2]" 1
1241 1 110 GLU H 1 111 ALA MB 3.842 3.074 4.610 4.319 4.122 4.440 . 0 0 "[ . 1 . 2]" 1
1242 1 49 LEU QD 1 50 LEU H 3.429 2.743 4.115 3.544 2.861 4.229 0.114 3 0 "[ . 1 . 2]" 1
1243 1 87 LYS HA 1 90 GLU H 3.762 3.010 4.514 3.689 3.240 4.216 . 0 0 "[ . 1 . 2]" 1
1244 1 24 LEU QB 1 25 VAL H 4.060 3.248 4.872 3.715 3.508 3.952 . 0 0 "[ . 1 . 2]" 1
1245 1 91 LYS HA 1 94 ARG H 3.672 2.938 4.406 3.635 3.300 3.986 . 0 0 "[ . 1 . 2]" 1
1246 1 49 LEU HA 1 50 LEU H . 3.004 3.456 2.166 2.053 2.249 0.951 3 20 [-*+*****************] 1
1247 1 85 VAL HA 1 87 LYS H 4.649 3.719 5.579 4.396 3.991 4.740 . 0 0 "[ . 1 . 2]" 1
1248 1 76 LEU QD 1 83 ASP H 4.936 3.949 5.923 5.039 4.098 6.127 0.204 18 0 "[ . 1 . 2]" 1
1249 1 108 PRO HA 1 110 GLU H 4.489 3.591 5.387 4.683 4.242 4.870 . 0 0 "[ . 1 . 2]" 1
1250 1 96 LYS H 1 97 ASN H 3.643 3.050 4.372 2.292 2.059 2.568 0.991 3 19 "[**+******-*** ******]" 1
1251 1 42 ALA H 1 112 LYS HA 4.884 3.907 5.861 5.809 5.524 6.403 0.542 17 1 "[ . 1 . + 2]" 1
1252 1 34 LEU H 1 35 ILE HA 4.906 3.925 5.887 5.399 5.195 5.495 . 0 0 "[ . 1 . 2]" 1
1253 1 95 LYS H 1 95 LYS HA 3.093 2.474 3.712 2.850 2.792 2.892 . 0 0 "[ . 1 . 2]" 1
1254 1 70 VAL QG 1 72 ILE H 4.527 3.622 5.432 4.320 4.087 4.546 . 0 0 "[ . 1 . 2]" 1
1255 1 32 LYS QE 1 35 ILE H 4.628 3.702 5.554 5.709 4.973 6.374 0.820 5 5 "[ + * 1 *.-* 2]" 1
1256 1 44 LYS H 1 44 LYS HG3 3.394 2.715 4.073 3.675 2.110 4.484 0.605 15 2 "[ . 1- + 2]" 1
1257 1 109 ASP HA 1 111 ALA H 4.291 3.433 5.149 4.481 4.082 4.880 . 0 0 "[ . 1 . 2]" 1
1258 1 51 THR H 1 51 THR HA 3.734 2.987 4.481 2.924 2.902 2.951 0.085 19 0 "[ . 1 . 2]" 1
1259 1 52 LEU HG 1 53 GLU H 4.622 3.698 5.546 4.543 2.714 5.207 0.984 20 2 "[ . - 1 . +]" 1
1260 1 63 LEU QD 1 64 LYS H 4.533 3.626 5.440 3.638 2.701 4.423 0.925 7 4 "[- . + * . * 2]" 1
1261 1 88 GLU H 1 89 ILE MD 4.829 3.863 5.795 5.254 4.966 5.596 . 0 0 "[ . 1 . 2]" 1
1262 1 50 LEU HA 1 51 THR H 2.976 2.381 3.571 2.190 2.131 2.295 0.250 9 0 "[ . 1 . 2]" 1
1263 1 82 ALA H 1 83 ASP H 3.662 2.940 4.394 2.713 2.535 3.022 0.405 6 0 "[ . 1 . 2]" 1
1264 1 108 PRO QB 1 109 ASP H 4.223 3.378 5.068 2.676 2.039 3.206 1.339 18 13 "[ -*** **1 ***.* +**]" 1
1265 1 85 VAL QG 1 87 LYS H 4.946 3.957 5.935 4.641 4.167 4.908 . 0 0 "[ . 1 . 2]" 1
1266 1 51 THR H 1 51 THR HG1 3.639 2.911 4.367 3.679 2.174 4.721 0.737 18 3 "[ * . - . + 2]" 1
1267 1 85 VAL H 1 87 LYS H 4.550 3.640 5.460 4.245 3.870 4.570 . 0 0 "[ . 1 . 2]" 1
1268 1 106 THR HA 1 107 SER H 3.040 2.432 3.648 2.171 2.126 2.231 0.306 15 0 "[ . 1 . 2]" 1
1269 1 72 ILE H 1 72 ILE HB . 3.406 3.850 2.607 2.522 2.762 0.884 11 20 [**********+**-******] 1
1270 1 84 LYS HA 1 87 LYS H 3.684 2.947 4.421 3.571 3.207 4.102 . 0 0 "[ . 1 . 2]" 1
1271 1 23 LEU QD 1 71 LYS H 3.836 3.069 4.603 3.403 2.438 4.093 0.631 15 1 "[ . 1 + 2]" 1
1272 1 103 ARG H 1 104 LYS HA 4.832 3.866 5.798 4.759 4.631 4.872 . 0 0 "[ . 1 . 2]" 1
1273 1 95 LYS H 1 95 LYS HG3 3.540 2.832 4.248 3.448 2.200 4.506 0.632 10 2 "[ .- + . 2]" 1
1274 1 56 ASP QB 1 57 LYS H 4.228 3.382 5.074 2.913 2.113 3.648 1.269 8 10 "[ ** **-+ 1 * . * **]" 1
1275 1 34 LEU QD 1 78 ASP H 4.417 3.534 5.300 5.795 5.008 6.059 0.759 1 13 "[+* *. *** ** ** -**]" 1
1276 1 72 ILE MG 1 74 VAL H 3.484 2.787 4.181 4.006 3.503 4.354 0.173 12 0 "[ . 1 . 2]" 1
1277 1 118 PHE HA 1 119 SER H 3.820 3.056 4.584 3.455 3.389 3.526 . 0 0 "[ . 1 . 2]" 1
1278 1 26 LEU HG 1 73 LEU H 4.341 3.473 5.209 4.812 4.189 6.011 0.802 20 1 "[ . 1 . +]" 1
1279 1 39 ARG H 1 111 ALA MB 4.474 3.579 5.369 5.874 5.220 6.349 0.980 17 10 "[** . -** ** * +* 2]" 1
1280 1 103 ARG QB 1 114 TRP HE1 4.337 3.470 5.204 4.688 4.007 5.452 0.248 19 0 "[ . 1 . 2]" 1
1281 1 26 LEU H 1 74 VAL HB 4.029 3.223 4.835 5.040 3.520 5.637 0.802 19 8 "[ **. **- . **+2]" 1
1282 1 41 MET QG 1 116 LYS H 4.497 3.598 5.396 4.026 3.291 4.598 0.307 8 0 "[ . 1 . 2]" 1
1283 1 118 PHE QD 1 119 SER H 3.928 3.142 4.714 4.487 4.310 4.707 . 0 0 "[ . 1 . 2]" 1
1284 1 44 LYS QB 1 45 ALA H 2.983 2.386 3.580 2.694 2.384 3.672 0.092 19 0 "[ . 1 . 2]" 1
1285 1 26 LEU H 1 72 ILE HA 4.719 3.775 5.663 5.186 4.762 5.792 0.129 20 0 "[ . 1 . 2]" 1
1286 1 42 ALA H 1 45 ALA MB 4.117 3.294 4.940 5.233 4.685 5.850 0.910 9 7 "[ * . - +1 *** * 2]" 1
1287 1 115 ILE H 1 116 LYS QB 3.865 3.092 4.638 4.463 4.219 5.038 0.400 12 0 "[ . 1 . 2]" 1
1288 1 116 LYS H 1 117 GLU HA 4.461 3.569 5.353 5.137 4.947 5.317 . 0 0 "[ . 1 . 2]" 1
1289 1 89 ILE MD 1 91 LYS H 4.801 3.841 5.761 5.773 5.573 6.062 0.301 2 0 "[ . 1 . 2]" 1
1290 1 35 ILE HB 1 36 GLU H . 3.497 3.648 2.615 2.357 2.879 1.140 16 20 [***************+-***] 1
1291 1 95 LYS H 1 95 LYS QE 4.626 3.701 5.551 4.536 3.507 5.878 0.327 16 0 "[ . 1 . 2]" 1
1292 1 23 LEU HA 1 23 LEU QD 3.948 3.285 4.738 2.046 1.874 2.253 1.411 1 20 [+*******-***********] 1
1293 1 23 LEU QD 1 71 LYS QD 4.346 3.477 5.215 3.638 2.211 4.959 1.266 14 5 "[*- .* 1 +* 2]" 1
1294 1 24 LEU HA 1 48 TYR H 4.405 3.524 5.286 3.335 2.298 3.782 1.226 7 3 "[ . + 1* .- 2]" 1
1295 1 25 VAL HA 1 49 LEU QD 4.555 3.644 5.466 5.217 4.116 6.251 0.785 20 2 "[ - . 1 . +]" 1
1296 1 25 VAL QG 1 47 LEU QB 4.548 3.638 4.946 2.656 1.920 3.398 1.718 20 18 "[*********1** *****-+]" 1
1297 1 25 VAL QG 1 115 ILE QG 3.348 2.678 4.018 2.449 1.911 3.083 0.767 8 1 "[ . + 1 . 2]" 1
1298 1 25 VAL QG 1 73 LEU QD 4.062 3.250 4.874 2.233 1.844 2.775 1.406 12 19 [**-******1*+********] 1
1299 1 24 LEU QD 1 26 LEU HA 4.115 3.292 4.938 4.410 3.501 5.443 0.505 14 1 "[ . 1 +. 2]" 1
1300 1 26 LEU HA 1 50 LEU H 4.424 3.539 5.309 2.413 2.018 2.661 1.521 20 20 [****************-**+] 1
1301 1 76 LEU QD 1 85 VAL QG . 4.259 5.039 2.841 1.836 3.582 2.423 14 20 [*************+****-*] 1
1302 1 27 ILE HB 1 27 ILE MD 4.196 3.357 5.035 2.432 2.401 2.476 0.956 14 20 [************-+******] 1
1303 1 27 ILE MD 1 38 ALA MB 3.951 3.161 4.741 2.422 1.961 2.939 1.200 14 19 "[********** **+****-*]" 1
1304 1 27 ILE MD 1 35 ILE HA . 3.718 4.548 2.824 2.127 3.407 1.591 15 15 "[* ****- *** *+** **]" 1
1305 1 27 ILE MG 1 51 THR HG1 4.436 3.549 5.323 3.390 1.747 5.088 1.802 13 7 "[-* . ***1 + .* 2]" 1
1306 1 29 SER HA 1 32 LYS QE 4.532 3.626 5.438 8.613 7.509 9.594 4.156 5 20 [***-+***************] 1
1307 1 29 SER QB 1 32 LYS QE 3.613 2.890 4.336 6.976 6.037 7.540 3.204 5 20 [****+-**************] 1
1308 1 112 LYS QB 1 113 ARG QB 3.111 2.489 3.733 3.971 3.766 4.181 0.448 16 0 "[ . 1 . 2]" 1
1309 1 112 LYS QB 1 112 LYS QE 4.076 3.261 4.891 2.233 1.850 3.515 1.411 10 17 "[** ** ***+*-*******2]" 1
1310 1 64 LYS QB 1 67 GLY QA 3.896 3.117 4.675 5.711 5.048 6.359 1.684 10 18 "[******** +* -*******]" 1
1311 1 40 LYS HA 1 40 LYS HB2 3.443 2.754 4.132 2.848 2.404 3.022 0.350 10 0 "[ . 1 . 2]" 1
1312 1 64 LYS QB 1 65 SER QB 3.555 2.844 4.266 4.437 3.860 4.826 0.560 12 1 "[ . 1 + . 2]" 1
1313 1 34 LEU QD 1 105 VAL QG 4.445 3.556 5.334 3.076 2.487 3.991 1.069 16 11 "[ *- *** 1** **+* 2]" 1
1314 1 29 SER QB 1 34 LEU QD 4.270 3.416 5.124 2.343 1.939 4.030 1.477 4 19 "[**-+** *************]" 1
1315 1 35 ILE MD 1 51 THR HG1 4.322 3.458 5.186 4.752 3.587 5.963 0.777 3 2 "[ + - 1 . 2]" 1
1316 1 35 ILE HB 1 35 ILE MD 4.022 3.218 4.826 2.415 2.310 2.458 0.908 11 20 [**********+*****-***] 1
1317 1 39 ARG HA 1 42 ALA MB 3.570 3.142 4.284 2.739 2.288 3.293 0.854 4 9 "[ +* * * ***. - *]" 1
1318 1 41 MET QB 1 44 LYS H 3.723 2.978 4.468 4.956 4.546 5.306 0.838 19 11 "[ * ** **** *- *+2]" 1
1319 1 45 ALA MB 1 47 LEU HG 4.206 3.365 5.047 2.528 1.921 4.159 1.444 16 15 "[** *-* * ** **+****]" 1
1320 1 51 THR HB 1 52 LEU QD 4.478 3.582 5.374 5.153 4.466 6.613 1.239 12 1 "[ . 1 + . 2]" 1
1321 1 50 LEU HA 1 50 LEU QD 3.966 3.173 4.759 2.493 1.897 3.093 1.276 9 10 "[ *** +* **-**2]" 1
1322 1 28 TRP QB 1 52 LEU QD 5.057 4.046 6.068 3.481 1.896 5.344 2.150 19 10 "[* **** * - * * +2]" 1
1323 1 52 LEU H 1 52 LEU HG 5.310 4.248 6.372 3.440 2.485 5.241 1.763 1 12 "[+ **** -*1 **.** *2]" 1
1324 1 56 ASP HA 1 59 ILE HB 4.914 3.931 5.897 3.505 1.905 4.321 2.026 11 7 "[ -. *1+ **.* * 2]" 1
1325 1 90 GLU HA 1 100 VAL QG 3.934 3.147 4.721 3.246 2.721 4.221 0.426 20 0 "[ . 1 . 2]" 1
1326 1 62 ILE HB 1 63 LEU H 4.226 3.381 5.071 2.585 2.211 2.817 1.170 18 20 [******-**********+**] 1
1327 1 62 ILE HB 1 62 ILE MD 4.379 3.503 5.255 2.456 2.418 2.502 1.085 11 20 [**-*******+*********] 1
1328 1 63 LEU HA 1 66 LEU QD . 4.268 4.412 2.575 1.975 3.716 2.293 5 20 [****+*-*************] 1
1329 1 87 LYS HA 1 87 LYS HG2 3.498 2.798 4.198 3.168 2.478 3.898 0.320 2 0 "[ . 1 . 2]" 1
1330 1 109 ASP H 1 112 LYS QB 4.137 3.310 4.964 5.203 4.797 5.627 0.663 6 2 "[ .+- 1 . 2]" 1
1331 1 66 LEU QB 1 70 VAL QG . 4.449 4.758 2.164 1.770 2.580 2.679 2 20 [*+**********-*******] 1
1332 1 65 SER QB 1 66 LEU QD 5.426 4.341 6.511 3.304 2.406 4.791 1.935 2 14 "[*+* -* ******** *2]" 1
1333 1 64 LYS HA 1 68 PRO QD 4.937 3.950 5.924 6.759 5.850 7.163 1.239 10 17 "[* ******-+* *******]" 1
1334 1 24 LEU QB 1 70 VAL QG 5.536 4.429 6.643 2.206 1.851 3.093 2.578 8 20 [*******+******-*****] 1
1335 1 22 GLY QA 1 70 VAL QG 5.556 4.445 6.667 2.367 1.878 2.865 2.567 2 20 [*+********-*********] 1
1336 1 23 LEU HA 1 70 VAL QG 5.632 4.506 6.758 2.621 2.110 3.608 2.396 20 20 [**************-****+] 1
1337 1 24 LEU H 1 70 VAL QG 5.653 4.522 6.784 2.568 2.230 4.113 2.292 14 19 [*************+.**-**] 1
1338 1 24 LEU H 1 72 ILE HA 4.536 3.629 5.443 2.885 2.432 3.399 1.197 3 15 "[**+***-**** * ** * 2]" 1
1339 1 72 ILE HB 1 100 VAL HA 4.582 3.666 5.150 2.391 2.005 3.455 1.661 17 19 "[**********-*****+ **]" 1
1340 1 72 ILE HB 1 72 ILE MD 4.229 3.383 5.075 2.644 2.414 3.243 0.969 5 15 "[****+ *-*** * ** * *]" 1
1341 1 73 LEU QD 1 101 ARG QD 4.577 3.662 5.492 3.698 2.148 5.270 1.514 20 5 "[ .-* 1 * * +]" 1
1342 1 74 VAL HB 1 102 ILE HA 4.231 3.474 5.077 2.689 1.804 4.386 1.670 9 14 "[***** * +** * * *-*2]" 1
1343 1 74 VAL QG 1 76 LEU H 5.653 4.522 6.784 3.857 3.421 4.442 1.101 15 16 "[***** ****** +-* **]" 1
1344 1 27 ILE HA 1 75 LEU QB 5.225 4.180 6.270 2.784 2.105 3.433 2.075 20 20 [*****************-*+] 1
1345 1 75 LEU QD 1 111 ALA HA 4.918 4.107 5.902 2.591 1.987 3.665 2.120 8 19 "[*****-*+***** ******]" 1
1346 1 75 LEU QD 1 76 LEU HG 3.750 3.000 4.500 6.166 4.866 7.316 2.816 5 18 "[** *+ ************-*]" 1
1347 1 82 ALA MB 1 104 LYS QE 5.376 4.301 6.451 4.393 2.739 6.724 1.562 8 8 "[ . *+ - * ** * *]" 1
1348 1 78 ASP HA 1 82 ALA MB 5.549 4.439 6.659 2.964 2.265 3.644 2.174 14 20 [*****-*******+******] 1
1349 1 28 TRP HZ3 1 82 ALA MB 5.231 4.185 6.277 2.749 1.878 4.903 2.307 15 15 "[****** * * - +*****]" 1
1350 1 85 VAL HA 1 88 GLU HB3 4.283 3.426 5.140 4.252 3.737 5.050 . 0 0 "[ . 1 . 2]" 1
1351 1 28 TRP HD1 1 85 VAL QG 5.821 4.657 6.985 3.623 2.414 5.392 2.243 7 16 "[***-* +**1* **.*****]" 1
1352 1 86 LYS HA 1 102 ILE MD 3.961 3.916 4.753 3.208 2.791 4.276 1.125 12 17 "[* *-*******+****** 2]" 1
1353 1 86 LYS QD 1 102 ILE MG 4.859 3.887 5.831 3.061 1.939 3.805 1.948 12 15 "[ ***** ** + **-****]" 1
1354 1 89 ILE HA 1 89 ILE MD 4.212 4.111 5.054 2.004 1.933 2.084 2.178 19 20 [******************+-] 1
1355 1 95 LYS H 1 97 ASN QB 5.238 4.190 6.286 6.503 5.959 6.949 0.663 2 7 "[ +**. *1 -*. * 2]" 1
1356 1 98 LEU QD 1 99 PRO QB 4.919 3.935 5.903 4.645 3.604 5.350 0.331 7 0 "[ . 1 . 2]" 1
1357 1 74 VAL QG 1 100 VAL HA 4.421 3.537 5.305 3.792 2.999 4.676 0.538 2 1 "[ + . 1 . 2]" 1
1358 1 90 GLU H 1 102 ILE MD 5.356 4.285 6.427 3.833 3.199 4.547 1.086 12 11 "[* *-*** * + .*** 2]" 1
1359 1 90 GLU QG 1 102 ILE MD 4.558 3.646 5.470 3.304 1.932 4.682 1.714 10 9 "[*- * * + * . ***]" 1
1360 1 76 LEU QD 1 102 ILE QG 3.418 2.734 4.102 3.942 3.406 4.539 0.437 11 0 "[ . 1 . 2]" 1
1361 1 76 LEU H 1 104 LYS HA 4.505 3.604 5.406 2.839 2.392 3.330 1.212 2 16 "[*+* - ***** *** ****]" 1
1362 1 75 LEU HA 1 105 VAL QG 5.493 4.394 6.592 3.178 2.664 4.138 1.730 13 19 "[************+**** -*]" 1
1363 1 107 SER QB 1 108 PRO QB 5.028 4.022 6.034 5.083 4.359 5.617 . 0 0 "[ . 1 . 2]" 1
1364 1 115 ILE HB 1 115 ILE MD 4.375 3.500 5.250 2.441 2.421 2.468 1.079 1 20 [+-******************] 1
1365 1 114 TRP HA 1 117 GLU QB 5.309 4.247 6.371 2.766 2.158 4.375 2.089 2 17 "[-+**.* ********** **]" 1
1366 1 45 ALA MB 1 119 SER QB 4.247 3.418 5.096 2.435 1.935 3.286 1.483 2 17 "[*+**.****1***** -***]" 1
1367 1 23 LEU QD 1 119 SER QB 5.703 4.562 6.844 3.330 2.113 5.190 2.449 16 16 "[ ********* **.+**-*]" 1
1368 1 59 ILE HB 1 60 GLU QB 4.110 3.288 4.932 4.170 3.781 5.024 0.092 13 0 "[ . 1 . 2]" 1
1369 1 59 ILE H 1 59 ILE HB . 3.774 4.568 2.434 2.246 2.530 1.528 11 20 [**********+-********] 1
1370 1 59 ILE HA 1 62 ILE HB 4.352 3.482 5.222 3.218 2.342 3.771 1.140 11 6 "[ . 1+ **.* - *]" 1
1371 1 59 ILE HA 1 62 ILE MD 5.071 4.057 6.085 3.566 2.120 4.142 1.937 11 9 "[ -. **1+ **.* * *]" 1
1372 1 52 LEU HA 1 53 GLU H 4.342 3.474 5.210 2.306 2.054 2.884 1.420 15 20 [********-*****+*****] 1
1373 1 52 LEU QD 1 89 ILE QG 3.823 3.058 4.057 3.829 1.889 6.092 2.035 16 15 "[* *** -**1* * *+****]" 1
1374 1 24 LEU H 1 48 TYR QB 4.759 3.807 5.711 5.759 4.564 6.565 0.854 1 4 "[+ * * - 1 . 2]" 1
1375 1 89 ILE MG 1 102 ILE MG 3.179 2.543 3.815 4.701 3.891 5.454 1.639 2 16 "[ +*-* ***1* ********]" 1
1376 1 39 ARG QG 1 43 GLU QG 4.789 3.831 5.747 5.039 2.290 7.129 1.541 6 7 "[* .+-* 1 * * * 2]" 1
1377 1 40 LYS HB3 1 40 LYS HG3 3.151 2.521 3.781 2.844 2.432 3.013 0.089 11 0 "[ . 1 . 2]" 1
1378 1 116 LYS QB 1 116 LYS QE 4.147 3.318 4.976 2.766 1.907 3.750 1.411 1 10 "[+** . -** * * * *]" 1
1379 1 89 ILE MD 1 89 ILE MG 3.468 2.774 4.162 1.978 1.935 2.010 0.839 1 20 [+************-******] 1
1380 1 81 ASP H 1 82 ALA H 4.494 3.987 5.393 2.555 2.325 2.829 1.662 3 20 [**+*****-***********] 1
1381 1 23 LEU H 1 23 LEU HG 3.360 2.688 4.032 4.273 2.824 5.035 1.003 2 9 "[*+ * * 1 ** . *-*]" 1
1382 1 95 LYS H 1 95 LYS HG2 3.458 2.766 4.150 3.398 2.029 4.607 0.737 7 2 "[ . + 1 . - 2]" 1
1383 1 23 LEU H 1 48 TYR QB 4.726 3.781 5.671 5.925 4.828 7.310 1.639 3 8 "[**+ * * 1- * *]" 1
1384 1 24 LEU HG 1 25 VAL H 3.470 2.776 4.164 3.197 2.273 5.021 0.857 18 3 "[ - . * 1 . + 2]" 1
1385 1 26 LEU H 1 27 ILE MD 3.433 2.746 4.120 6.536 5.271 6.980 2.860 12 20 [***********+*-******] 1
1386 1 27 ILE H 1 50 LEU HG 4.163 3.330 4.996 6.516 5.804 7.047 2.051 6 20 [*****+********-*****] 1
1387 1 118 PHE H 1 118 PHE QE 4.328 3.462 5.194 4.943 4.565 6.227 1.033 7 3 "[ . + * . -]" 1
1388 1 34 LEU H 1 108 PRO QB 4.422 3.538 5.306 4.845 3.647 5.891 0.585 3 1 "[ + . 1 . 2]" 1
1389 1 34 LEU QD 1 38 ALA H 3.670 2.936 4.404 4.061 3.235 5.083 0.679 1 2 "[+ . -1 . 2]" 1
1390 1 38 ALA H 1 108 PRO QB 3.938 3.150 4.726 5.148 4.534 6.121 1.395 12 7 "[ * * * -1 + . * *]" 1
1391 1 35 ILE HB 1 38 ALA H 3.948 3.158 4.738 5.695 5.454 5.976 1.238 17 20 [****************+-**] 1
1392 1 40 LYS H 1 41 MET QG 4.554 3.643 5.465 6.003 4.355 6.489 1.024 15 16 "[*** *****-* * +****2]" 1
1393 1 36 GLU QG 1 40 LYS H 4.345 3.476 5.214 5.085 4.147 6.758 1.544 4 6 "[ **+. 1* - *2]" 1
1394 1 40 LYS HB2 1 41 MET H 3.279 2.623 3.935 3.005 2.388 4.008 0.235 8 0 "[ . 1 . 2]" 1
1395 1 40 LYS HB2 1 42 ALA H 4.142 3.314 4.970 5.260 4.853 5.817 0.847 10 6 "[ ** . - + . **2]" 1
1396 1 42 ALA H 1 47 LEU QD 4.382 3.506 5.258 4.581 4.046 5.006 . 0 0 "[ . 1 . 2]" 1
1397 1 40 LYS HB2 1 43 GLU H 4.307 3.446 5.168 5.506 5.254 5.744 0.576 15 2 "[ -. 1 + 2]" 1
1398 1 43 GLU QB 1 45 ALA H 3.959 3.167 4.751 4.749 4.417 5.246 0.495 12 0 "[ . 1 . 2]" 1
1399 1 47 LEU HA 1 48 TYR H 3.840 3.072 4.608 2.362 2.154 2.563 0.918 15 20 [**************+***-*] 1
1400 1 48 TYR QE 1 49 LEU H 3.679 2.943 4.415 6.355 5.868 6.709 2.294 20 20 [-******************+] 1
1401 1 26 LEU QD 1 50 LEU H 3.811 3.049 4.573 3.058 2.377 4.608 0.672 1 3 "[+ * . 1 . -2]" 1
1402 1 28 TRP HA 1 52 LEU H 4.479 3.583 5.375 3.837 3.232 4.822 0.351 1 0 "[ . 1 . 2]" 1
1403 1 64 LYS H 1 66 LEU QD 4.209 3.367 5.051 4.860 4.053 6.050 0.999 7 2 "[ . + 1 . - 2]" 1
1404 1 24 LEU QB 1 72 ILE H 4.219 3.375 5.063 4.815 4.397 5.199 0.136 2 0 "[ . 1 . 2]" 1
1405 1 74 VAL H 1 76 LEU HG 4.099 3.279 4.919 8.088 5.752 10.197 5.278 14 20 [*************+*****-] 1
1406 1 74 VAL H 1 75 LEU QD 4.173 3.338 5.008 4.211 3.238 6.031 1.023 11 1 "[ . 1+ . 2]" 1
1407 1 77 GLU H 1 105 VAL QG 4.175 3.340 5.010 5.019 4.630 5.679 0.669 17 2 "[ . 1- . + 2]" 1
1408 1 76 LEU QD 1 77 GLU H 3.680 2.944 4.416 3.085 2.242 3.601 0.702 14 1 "[ . 1 +. 2]" 1
1409 1 105 VAL QG 1 114 TRP HE1 3.321 2.657 3.985 2.303 1.961 2.881 0.696 14 5 "[ . *1 *+. - *2]" 1
1410 1 75 LEU QD 1 114 TRP HE1 3.802 3.042 4.562 4.673 3.821 6.113 1.551 11 5 "[ * * 1+ * . -]" 1
1411 1 113 ARG QB 1 114 TRP HE1 4.726 3.781 5.671 4.769 4.042 5.295 . 0 0 "[ . 1 . 2]" 1
1412 1 28 TRP HE1 1 29 SER HA 4.496 3.597 5.395 6.977 6.300 8.775 3.380 12 20 [-**********+********] 1
1413 1 28 TRP HE1 1 82 ALA HA 4.312 3.450 5.174 6.348 1.633 8.766 3.592 12 18 "[****.******+ *****-*]" 1
1414 1 28 TRP HE1 1 35 ILE MD 4.119 3.295 4.943 7.809 6.557 10.156 5.213 13 20 [*******-****+*******] 1
1415 1 28 TRP HE1 1 76 LEU QD 4.509 3.607 5.411 5.494 1.574 6.521 2.033 13 9 "[-** ** *1 + . * *]" 1
1416 1 78 ASP H 1 106 THR HG1 4.009 3.207 4.811 4.274 2.563 5.381 0.644 10 3 "[ . - *+ . 2]" 1
1417 1 28 TRP HZ3 1 79 THR H 4.773 3.818 5.728 4.415 3.072 6.706 0.978 9 3 "[ . +* . -]" 1
1418 1 79 THR HB 1 82 ALA H 4.513 3.610 5.416 2.693 1.716 3.727 1.894 5 15 "[* *+- **** **** ***]" 1
1419 1 91 LYS QG 1 94 ARG H 4.659 3.727 5.591 5.549 4.841 6.301 0.710 5 1 "[ + 1 . 2]" 1
1420 1 96 LYS HG2 1 97 ASN H 3.861 3.089 4.633 4.953 3.898 5.607 0.974 13 8 "[ * **1 *+ * -*2]" 1
1421 1 98 LEU HA 1 100 VAL H 4.381 3.505 5.257 5.914 5.754 6.319 1.062 13 19 [****.*******+-******] 1
1422 1 73 LEU QD 1 102 ILE H 4.627 3.702 5.552 5.193 4.688 5.652 0.100 14 0 "[ . 1 . 2]" 1
1423 1 34 LEU QD 1 110 GLU H 4.870 3.896 5.844 5.135 4.649 5.787 . 0 0 "[ . 1 . 2]" 1
1424 1 34 LEU QD 1 111 ALA H 3.831 3.065 4.597 3.893 3.482 4.424 . 0 0 "[ . 1 . 2]" 1
1425 1 110 GLU QB 1 114 TRP H 3.675 2.940 4.410 4.729 4.371 5.807 1.397 18 4 "[ .- 1 .**+ 2]" 1
1426 1 112 LYS QG 1 114 TRP H 4.652 3.722 5.582 5.989 5.690 6.220 0.638 4 3 "[* +. 1 - . 2]" 1
1427 1 114 TRP H 1 115 ILE MD 3.774 3.019 4.529 5.313 4.947 5.434 0.905 14 19 "[*************+** -**]" 1
1428 1 25 VAL QG 1 115 ILE H 4.215 3.372 5.058 4.922 4.413 5.532 0.474 11 0 "[ . 1 . 2]" 1
1429 1 119 SER H 1 120 GLU QB 4.306 3.445 5.167 4.532 3.981 4.936 . 0 0 "[ . 1 . 2]" 1
1430 1 73 LEU QD 1 119 SER H 4.221 3.377 5.065 5.255 4.804 6.077 1.012 1 3 "[+ -. 1 * 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 96
_Distance_constraint_stats_list.Viol_count 108
_Distance_constraint_stats_list.Viol_total 80.977
_Distance_constraint_stats_list.Viol_max 0.226
_Distance_constraint_stats_list.Viol_rms 0.0120
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0021
_Distance_constraint_stats_list.Viol_average_violations_only 0.0375
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 24 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 VAL 0.038 0.028 20 0 "[ . 1 . 2]"
1 26 LEU 0.084 0.028 13 0 "[ . 1 . 2]"
1 27 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 TRP 0.493 0.226 13 0 "[ . 1 . 2]"
1 32 LYS 1.186 0.117 20 0 "[ . 1 . 2]"
1 33 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 LEU 0.004 0.004 18 0 "[ . 1 . 2]"
1 35 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 GLU 1.249 0.117 20 0 "[ . 1 . 2]"
1 37 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 ALA 0.004 0.004 18 0 "[ . 1 . 2]"
1 39 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 LYS 0.103 0.050 4 0 "[ . 1 . 2]"
1 41 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 LYS 0.039 0.039 12 0 "[ . 1 . 2]"
1 48 TYR 0.007 0.007 7 0 "[ . 1 . 2]"
1 50 LEU 0.032 0.028 20 0 "[ . 1 . 2]"
1 55 ASP 0.039 0.028 17 0 "[ . 1 . 2]"
1 56 ASP 0.451 0.073 15 0 "[ . 1 . 2]"
1 57 LYS 0.712 0.152 14 0 "[ . 1 . 2]"
1 58 LYS 0.049 0.041 15 0 "[ . 1 . 2]"
1 59 ILE 0.041 0.028 17 0 "[ . 1 . 2]"
1 60 GLU 0.495 0.073 15 0 "[ . 1 . 2]"
1 61 ASP 0.911 0.152 14 0 "[ . 1 . 2]"
1 62 ILE 0.049 0.041 15 0 "[ . 1 . 2]"
1 63 LEU 0.002 0.002 16 0 "[ . 1 . 2]"
1 64 LYS 0.045 0.045 5 0 "[ . 1 . 2]"
1 65 SER 0.199 0.092 2 0 "[ . 1 . 2]"
1 71 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 ILE 0.048 0.015 3 0 "[ . 1 . 2]"
1 73 LEU 0.014 0.007 4 0 "[ . 1 . 2]"
1 74 VAL 0.032 0.021 2 0 "[ . 1 . 2]"
1 75 LEU 0.153 0.039 9 0 "[ . 1 . 2]"
1 76 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 GLU 0.411 0.226 13 0 "[ . 1 . 2]"
1 81 ASP 0.025 0.025 18 0 "[ . 1 . 2]"
1 82 ALA 0.022 0.022 6 0 "[ . 1 . 2]"
1 83 ASP 0.244 0.075 20 0 "[ . 1 . 2]"
1 84 LYS 0.033 0.023 18 0 "[ . 1 . 2]"
1 85 VAL 0.025 0.025 18 0 "[ . 1 . 2]"
1 86 LYS 0.022 0.022 6 0 "[ . 1 . 2]"
1 87 LYS 0.390 0.083 5 0 "[ . 1 . 2]"
1 88 GLU 0.033 0.023 18 0 "[ . 1 . 2]"
1 89 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 GLU 0.071 0.049 5 0 "[ . 1 . 2]"
1 91 LYS 0.146 0.083 5 0 "[ . 1 . 2]"
1 92 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 ARG 0.071 0.049 5 0 "[ . 1 . 2]"
1 95 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 ARG 0.048 0.015 3 0 "[ . 1 . 2]"
1 103 ARG 0.032 0.021 2 0 "[ . 1 . 2]"
1 108 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 109 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 110 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 111 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 112 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 113 ARG 0.011 0.011 20 0 "[ . 1 . 2]"
1 114 TRP 0.000 0.000 6 0 "[ . 1 . 2]"
1 115 ILE 0.011 0.009 7 0 "[ . 1 . 2]"
1 116 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 117 GLU 0.011 0.011 20 0 "[ . 1 . 2]"
1 118 PHE 0.000 0.000 6 0 "[ . 1 . 2]"
1 119 SER 0.011 0.009 7 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 32 LYS O 1 36 GLU H 2.200 . 2.700 2.759 2.705 2.817 0.117 20 0 "[ . 1 . 2]" 2
2 1 33 LYS O 1 37 GLU H 2.200 . 2.700 1.837 1.730 2.009 . 0 0 "[ . 1 . 2]" 2
3 1 34 LEU O 1 38 ALA H 2.200 . 2.700 2.099 1.827 2.704 0.004 18 0 "[ . 1 . 2]" 2
4 1 35 ILE O 1 39 ARG H 2.200 . 2.700 2.043 1.798 2.537 . 0 0 "[ . 1 . 2]" 2
5 1 36 GLU O 1 40 LYS H 2.200 . 2.700 2.199 1.827 2.750 0.050 4 0 "[ . 1 . 2]" 2
6 1 37 GLU O 1 41 MET H 2.200 . 2.700 2.234 1.953 2.663 . 0 0 "[ . 1 . 2]" 2
7 1 38 ALA O 1 42 ALA H 2.200 . 2.700 2.002 1.820 2.287 . 0 0 "[ . 1 . 2]" 2
8 1 39 ARG O 1 43 GLU H 2.200 . 2.700 1.950 1.742 2.247 . 0 0 "[ . 1 . 2]" 2
9 1 40 LYS O 1 44 LYS H 2.200 . 2.700 2.177 1.784 2.739 0.039 12 0 "[ . 1 . 2]" 2
10 1 55 ASP O 1 59 ILE H 2.200 . 2.700 2.127 1.789 2.728 0.028 17 0 "[ . 1 . 2]" 2
11 1 56 ASP O 1 60 GLU H 2.200 . 2.700 2.513 1.841 2.773 0.073 15 0 "[ . 1 . 2]" 2
12 1 57 LYS O 1 61 ASP H 2.200 . 2.700 2.584 1.862 2.852 0.152 14 0 "[ . 1 . 2]" 2
13 1 58 LYS O 1 62 ILE H 2.200 . 2.700 2.229 1.898 2.741 0.041 15 0 "[ . 1 . 2]" 2
14 1 59 ILE O 1 63 LEU H 2.200 . 2.700 1.958 1.728 2.436 0.002 16 0 "[ . 1 . 2]" 2
15 1 60 GLU O 1 64 LYS H 2.200 . 2.700 2.075 1.783 2.745 0.045 5 0 "[ . 1 . 2]" 2
16 1 61 ASP O 1 65 SER H 2.200 . 2.700 2.485 2.126 2.792 0.092 2 0 "[ . 1 . 2]" 2
17 1 81 ASP O 1 85 VAL H 2.200 . 2.700 2.338 2.043 2.725 0.025 18 0 "[ . 1 . 2]" 2
18 1 82 ALA O 1 86 LYS H 2.200 . 2.700 2.092 1.855 2.722 0.022 6 0 "[ . 1 . 2]" 2
19 1 83 ASP O 1 87 LYS H 2.200 . 2.700 2.506 2.084 2.775 0.075 20 0 "[ . 1 . 2]" 2
20 1 84 LYS O 1 88 GLU H 2.200 . 2.700 2.196 1.861 2.723 0.023 18 0 "[ . 1 . 2]" 2
21 1 85 VAL O 1 89 ILE H 2.200 . 2.700 1.937 1.773 2.284 . 0 0 "[ . 1 . 2]" 2
22 1 86 LYS O 1 90 GLU H 2.200 . 2.700 2.146 1.781 2.632 . 0 0 "[ . 1 . 2]" 2
23 1 87 LYS O 1 91 LYS H 2.200 . 2.700 2.171 1.872 2.783 0.083 5 0 "[ . 1 . 2]" 2
24 1 88 GLU O 1 92 LYS H 2.200 . 2.700 2.053 1.780 2.414 . 0 0 "[ . 1 . 2]" 2
25 1 89 ILE O 1 93 ALA H 2.200 . 2.700 1.957 1.756 2.410 . 0 0 "[ . 1 . 2]" 2
26 1 90 GLU O 1 94 ARG H 2.200 . 2.700 2.245 1.937 2.749 0.049 5 0 "[ . 1 . 2]" 2
27 1 91 LYS O 1 95 LYS H 2.200 . 2.700 2.223 1.841 2.606 . 0 0 "[ . 1 . 2]" 2
28 1 108 PRO O 1 112 LYS H 2.200 . 2.700 2.065 1.869 2.445 . 0 0 "[ . 1 . 2]" 2
29 1 109 ASP O 1 113 ARG H 2.200 . 2.700 2.178 1.994 2.447 . 0 0 "[ . 1 . 2]" 2
30 1 110 GLU O 1 114 TRP H 2.200 . 2.700 2.129 1.880 2.640 . 0 0 "[ . 1 . 2]" 2
31 1 111 ALA O 1 115 ILE H 2.200 . 2.700 2.260 2.008 2.560 . 0 0 "[ . 1 . 2]" 2
32 1 112 LYS O 1 116 LYS H 2.200 . 2.700 2.183 1.905 2.618 . 0 0 "[ . 1 . 2]" 2
33 1 113 ARG O 1 117 GLU H 2.200 . 2.700 1.964 1.719 2.319 0.011 20 0 "[ . 1 . 2]" 2
34 1 114 TRP O 1 118 PHE H 2.200 . 2.700 2.291 1.951 2.700 . 6 0 "[ . 1 . 2]" 2
35 1 115 ILE O 1 119 SER H 2.200 . 2.700 2.416 2.019 2.709 0.009 7 0 "[ . 1 . 2]" 2
36 1 25 VAL H 1 48 TYR O 2.200 . 2.700 1.965 1.723 2.698 0.007 7 0 "[ . 1 . 2]" 2
37 1 25 VAL O 1 50 LEU H 2.200 . 2.700 2.030 1.726 2.728 0.028 20 0 "[ . 1 . 2]" 2
38 1 27 ILE H 1 50 LEU O 2.200 . 2.700 2.016 1.833 2.499 . 0 0 "[ . 1 . 2]" 2
39 1 28 TRP O 1 77 GLU H 2.200 . 2.700 2.330 1.845 2.926 0.226 13 0 "[ . 1 . 2]" 2
40 1 28 TRP H 1 75 LEU O 2.200 . 2.700 2.181 1.732 2.739 0.039 9 0 "[ . 1 . 2]" 2
41 1 26 LEU O 1 75 LEU H 2.200 . 2.700 1.804 1.702 2.208 0.028 13 0 "[ . 1 . 2]" 2
42 1 26 LEU H 1 73 LEU O 2.200 . 2.700 1.924 1.723 2.369 0.007 4 0 "[ . 1 . 2]" 2
43 1 24 LEU O 1 73 LEU H 2.200 . 2.700 1.913 1.746 2.330 . 0 0 "[ . 1 . 2]" 2
44 1 24 LEU H 1 71 LYS O 2.200 . 2.700 1.965 1.770 2.395 . 0 0 "[ . 1 . 2]" 2
45 1 72 ILE O 1 101 ARG H 2.200 . 2.700 2.010 1.715 2.713 0.015 3 0 "[ . 1 . 2]" 2
46 1 74 VAL H 1 101 ARG O 2.200 . 2.700 1.930 1.732 2.252 . 0 0 "[ . 1 . 2]" 2
47 1 74 VAL O 1 103 ARG H 2.200 . 2.700 1.989 1.709 2.590 0.021 2 0 "[ . 1 . 2]" 2
48 1 76 LEU H 1 103 ARG O 2.200 . 2.700 1.954 1.798 2.235 . 0 0 "[ . 1 . 2]" 2
49 1 89 ILE O 1 93 ALA N 3.200 2.516 3.927 2.862 2.699 3.292 . 0 0 "[ . 1 . 2]" 2
50 1 25 VAL N 1 48 TYR O 3.200 2.516 3.927 2.919 2.701 3.613 . 0 0 "[ . 1 . 2]" 2
51 1 114 TRP O 1 118 PHE N 3.200 2.516 3.927 3.163 2.887 3.490 . 0 0 "[ . 1 . 2]" 2
52 1 32 LYS O 1 36 GLU N 3.200 2.516 3.927 3.655 3.544 3.761 . 0 0 "[ . 1 . 2]" 2
53 1 109 ASP O 1 113 ARG N 3.200 2.516 3.927 3.020 2.819 3.296 . 0 0 "[ . 1 . 2]" 2
54 1 34 LEU O 1 38 ALA N 3.200 2.516 3.927 3.011 2.763 3.519 . 0 0 "[ . 1 . 2]" 2
55 1 36 GLU O 1 40 LYS N 3.200 2.516 3.927 3.128 2.788 3.602 . 0 0 "[ . 1 . 2]" 2
56 1 33 LYS O 1 37 GLU N 3.200 2.516 3.927 2.796 2.701 2.984 . 0 0 "[ . 1 . 2]" 2
57 1 39 ARG O 1 43 GLU N 3.200 2.516 3.927 2.861 2.646 3.132 . 0 0 "[ . 1 . 2]" 2
58 1 57 LYS O 1 61 ASP N 3.200 2.516 3.927 3.466 2.792 3.774 . 0 0 "[ . 1 . 2]" 2
59 1 72 ILE O 1 101 ARG N 3.200 2.516 3.927 2.960 2.671 3.600 . 0 0 "[ . 1 . 2]" 2
60 1 115 ILE O 1 119 SER N 3.200 2.516 3.927 3.172 2.864 3.475 . 0 0 "[ . 1 . 2]" 2
61 1 38 ALA O 1 42 ALA N 3.200 2.516 3.927 2.935 2.767 3.181 . 0 0 "[ . 1 . 2]" 2
62 1 111 ALA O 1 115 ILE N 3.200 2.516 3.927 3.196 2.965 3.483 . 0 0 "[ . 1 . 2]" 2
63 1 82 ALA O 1 86 LYS N 3.200 2.516 3.927 2.979 2.796 3.533 . 0 0 "[ . 1 . 2]" 2
64 1 113 ARG O 1 117 GLU N 3.200 2.516 3.927 2.867 2.670 3.241 . 0 0 "[ . 1 . 2]" 2
65 1 24 LEU O 1 73 LEU N 3.200 2.516 3.927 2.836 2.677 3.185 . 0 0 "[ . 1 . 2]" 2
66 1 83 ASP O 1 87 LYS N 3.200 2.516 3.927 3.413 2.934 3.736 . 0 0 "[ . 1 . 2]" 2
67 1 58 LYS O 1 62 ILE N 3.200 2.516 3.927 3.189 2.837 3.709 . 0 0 "[ . 1 . 2]" 2
68 1 26 LEU O 1 75 LEU N 3.200 2.516 3.927 2.750 2.648 3.157 . 0 0 "[ . 1 . 2]" 2
69 1 110 GLU O 1 114 TRP N 3.200 2.516 3.927 3.088 2.851 3.568 . 0 0 "[ . 1 . 2]" 2
70 1 28 TRP O 1 77 GLU N 3.200 2.516 3.927 3.273 2.819 3.767 . 0 0 "[ . 1 . 2]" 2
71 1 76 LEU N 1 103 ARG O 3.200 2.516 3.927 2.914 2.754 3.172 . 0 0 "[ . 1 . 2]" 2
72 1 91 LYS O 1 95 LYS N 3.200 2.516 3.927 3.114 2.781 3.543 . 0 0 "[ . 1 . 2]" 2
73 1 55 ASP O 1 59 ILE N 3.200 2.516 3.927 2.995 2.733 3.529 . 0 0 "[ . 1 . 2]" 2
74 1 35 ILE O 1 39 ARG N 3.200 2.516 3.927 2.964 2.725 3.412 . 0 0 "[ . 1 . 2]" 2
75 1 87 LYS O 1 91 LYS N 3.200 2.516 3.927 3.080 2.829 3.688 . 0 0 "[ . 1 . 2]" 2
76 1 88 GLU O 1 92 LYS N 3.200 2.516 3.927 2.991 2.754 3.332 . 0 0 "[ . 1 . 2]" 2
77 1 85 VAL O 1 89 ILE N 3.200 2.516 3.927 2.896 2.747 3.246 . 0 0 "[ . 1 . 2]" 2
78 1 74 VAL N 1 101 ARG O 3.200 2.516 3.927 2.870 2.685 3.164 . 0 0 "[ . 1 . 2]" 2
79 1 60 GLU O 1 64 LYS N 3.200 2.516 3.927 2.968 2.737 3.563 . 0 0 "[ . 1 . 2]" 2
80 1 56 ASP O 1 60 GLU N 3.200 2.516 3.927 3.355 2.773 3.615 . 0 0 "[ . 1 . 2]" 2
81 1 27 ILE N 1 50 LEU O 3.200 2.516 3.927 2.953 2.770 3.386 . 0 0 "[ . 1 . 2]" 2
82 1 81 ASP O 1 85 VAL N 3.200 2.516 3.927 3.263 3.017 3.589 . 0 0 "[ . 1 . 2]" 2
83 1 37 GLU O 1 41 MET N 3.200 2.516 3.927 3.135 2.884 3.543 . 0 0 "[ . 1 . 2]" 2
84 1 24 LEU N 1 71 LYS O 3.200 2.516 3.927 2.937 2.747 3.375 . 0 0 "[ . 1 . 2]" 2
85 1 59 ILE O 1 63 LEU N 3.200 2.516 3.927 2.895 2.678 3.375 . 0 0 "[ . 1 . 2]" 2
86 1 26 LEU N 1 73 LEU O 3.200 2.516 3.927 2.841 2.668 3.254 . 0 0 "[ . 1 . 2]" 2
87 1 108 PRO O 1 112 LYS N 3.200 2.516 3.927 3.019 2.836 3.354 . 0 0 "[ . 1 . 2]" 2
88 1 25 VAL O 1 50 LEU N 3.200 2.516 3.927 2.916 2.693 3.461 . 0 0 "[ . 1 . 2]" 2
89 1 40 LYS O 1 44 LYS N 3.200 2.516 3.927 3.034 2.725 3.381 . 0 0 "[ . 1 . 2]" 2
90 1 90 GLU O 1 94 ARG N 3.200 2.516 3.927 3.123 2.865 3.667 . 0 0 "[ . 1 . 2]" 2
91 1 112 LYS O 1 116 LYS N 3.200 2.516 3.927 3.050 2.775 3.520 . 0 0 "[ . 1 . 2]" 2
92 1 74 VAL O 1 103 ARG N 3.200 2.516 3.927 2.932 2.679 3.393 . 0 0 "[ . 1 . 2]" 2
93 1 61 ASP O 1 65 SER N 3.200 2.516 3.927 3.221 2.862 3.639 . 0 0 "[ . 1 . 2]" 2
94 1 86 LYS O 1 90 GLU N 3.200 2.516 3.927 3.047 2.684 3.583 . 0 0 "[ . 1 . 2]" 2
95 1 28 TRP N 1 75 LEU O 3.200 2.516 3.927 3.073 2.700 3.595 . 0 0 "[ . 1 . 2]" 2
96 1 84 LYS O 1 88 GLU N 3.200 2.516 3.927 3.095 2.824 3.617 . 0 0 "[ . 1 . 2]" 2
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