Project name: PfBGL_WT

Status: done

Started: 2025-07-18 19:34:32
Settings
Chain sequence(s) A: AKFPKNFMFGYSWSGFQFEMGLPGSEVESDWWVWVHDKENIASGLVSGDLPENGPAYWHLYKQDHDIAEKLGMDCIRGGIEWARIFPKPTFDVKVDVEKDEEGNIISVDVPESTIKELEKIANMEALEHYRKIYSDWKERGKTFILNLYHWPLPLWIHDPIAVRKLGPDRAPAGWLDEKTVVEFVKFAAFVAYHLDDLVDMWSTMNEPNVVYNQGYINLRSGFPPGYLSFEAAEKAKFNLIQAHIGAYDAIKEYSEKSVGVIYAFAWHDPLAEEYKDEVEEIRKKDYEFVTILHSKGKLDWIGVNYYSRLVYGAKDGHLVPLPGYGFMSERGGFAKSGRPASDFGWEMYPEGLENLLKYLNNAYELPMIITENGMADAADRYRPHYLVSHLKAVYNAMKEGADVRGYLHWSLTDNYEWAQGFRMRFGLVYVDFETKKRYLRPSALVFREIATQKEIPEELAHLADLKFVTR
C: AKFPKNFMFGYSWSGFQFEMGLPGSEVESDWWVWVHDKENIASGLVSGDLPENGPAYWHLYKQDHDIAEKLGMDCIRGGIEWARIFPKPTFDVKVDVEKDEEGNIISVDVPESTIKELEKIANMEALEHYRKIYSDWKERGKTFILNLYHWPLPLWIHDPIAVRKLGPDRAPAGWLDEKTVVEFVKFAAFVAYHLDDLVDMWSTMNEPNVVYNQGYINLRSGFPPGYLSFEAAEKAKFNLIQAHIGAYDAIKEYSEKSVGVIYAFAWHDPLAEEYKDEVEEIRKKDYEFVTILHSKGKLDWIGVNYYSRLVYGAKDGHLVPLPGYGFMSERGGFAKSGRPASDFGWEMYPEGLENLLKYLNNAYELPMIITENGMADAADRYRPHYLVSHLKAVYNAMKEGADVRGYLHWSLTDNYEWAQGFRMRFGLVYVDFETKKRYLRPSALVFREIATQKEIPEELAHLADLKFVTR
B: AKFPKNFMFGYSWSGFQFEMGLPGSEVESDWWVWVHDKENIASGLVSGDLPENGPAYWHLYKQDHDIAEKLGMDCIRGGIEWARIFPKPTFDVKVDVEKDEEGNIISVDVPESTIKELEKIANMEALEHYRKIYSDWKERGKTFILNLYHWPLPLWIHDPIAVRKLGPDRAPAGWLDEKTVVEFVKFAAFVAYHLDDLVDMWSTMNEPNVVYNQGYINLRSGFPPGYLSFEAAEKAKFNLIQAHIGAYDAIKEYSEKSVGVIYAFAWHDPLAEEYKDEVEEIRKKDYEFVTILHSKGKLDWIGVNYYSRLVYGAKDGHLVPLPGYGFMSERGGFAKSGRPASDFGWEMYPEGLENLLKYLNNAYELPMIITENGMADAADRYRPHYLVSHLKAVYNAMKEGADVRGYLHWSLTDNYEWAQGFRMRFGLVYVDFETKKRYLRPSALVFREIATQKEIPEELAHLADLKFVTR
D: AKFPKNFMFGYSWSGFQFEMGLPGSEVESDWWVWVHDKENIASGLVSGDLPENGPAYWHLYKQDHDIAEKLGMDCIRGGIEWARIFPKPTFDVKVDVEKDEEGNIISVDVPESTIKELEKIANMEALEHYRKIYSDWKERGKTFILNLYHWPLPLWIHDPIAVRKLGPDRAPAGWLDEKTVVEFVKFAAFVAYHLDDLVDMWSTMNEPNVVYNQGYINLRSGFPPGYLSFEAAEKAKFNLIQAHIGAYDAIKEYSEKSVGVIYAFAWHDPLAEEYKDEVEEIRKKDYEFVTILHSKGKLDWIGVNYYSRLVYGAKDGHLVPLPGYGFMSERGGFAKSGRPASDFGWEMYPEGLENLLKYLNNAYELPMIITENGMADAADRYRPHYLVSHLKAVYNAMKEGADVRGYLHWSLTDNYEWAQGFRMRFGLVYVDFETKKRYLRPSALVFREIATQKEIPEELAHLADLKFVTR
input PDB
Selected Chain(s) A,B,C,D
Distance of aggregation 10 Å
FoldX usage Yes
Dynamic mode No
Automated mutations No
Downloads Download all the data
Simulation log
[INFO]       Logger:   Verbosity set to: 2 - [INFO]                                                (00:00:01)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:01)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with all chain(s) selected           (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:03)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:32:28)
[INFO]       Main:     Simulation completed successfully.                                          (00:33:01)
Show buried residues

Minimal score value
-4.938
Maximal score value
0.7366
Average score
-0.7764
Total score value
-1462.7636

The table below lists A3D score for protein residues. Residues with A3D score > 0.0000 are marked by yellow rows.

residue index residue name chain Aggrescan3D score mutation
residue index residue name chain Aggrescan3D score
mutation
1 A A -1.6367
2 K A -2.5298
3 F A 0.0000
4 P A -1.9717
5 K A -2.8500
6 N A -2.3999
7 F A 0.0000
8 M A -0.9937
9 F A 0.0000
10 G A 0.0000
11 Y A 0.0000
12 S A 0.0000
13 W A 0.0000
14 S A 0.0000
15 G A 0.0000
16 F A 0.0000
17 Q A 0.0000
18 F A 0.0000
19 E A 0.0000
20 M A 0.0000
21 G A -1.0445
22 L A -0.4792
23 P A -0.8730
24 G A -1.0762
25 S A 0.0000
26 E A -2.3495
27 V A -1.5377
28 E A -1.8412
29 S A 0.0000
30 D A 0.0000
31 W A 0.0000
32 W A -0.4752
33 V A -0.2550
34 W A 0.0000
35 V A 0.0000
36 H A -0.6249
37 D A -0.8839
38 K A -1.5656
39 E A 0.0000
40 N A 0.0000
41 I A -0.2141
42 A A -0.1489
43 S A 0.0000
44 G A -0.6512
45 L A -0.5645
46 V A 0.0000
47 S A -0.5476
48 G A -0.6106
49 D A -1.0357
50 L A -0.4307
51 P A 0.0000
52 E A -1.2439
53 N A -1.4747
54 G A 0.0000
55 P A 0.0000
56 A A 0.0000
57 Y A 0.0000
58 W A 0.0000
59 H A -0.8646
60 L A -0.8803
61 Y A 0.0000
62 K A -2.9358
63 Q A -2.7011
64 D A 0.0000
65 H A 0.0000
66 D A -3.1902
67 I A -1.8480
68 A A 0.0000
69 E A -2.4725
70 K A -2.1622
71 L A 0.0000
72 G A -1.3787
73 M A 0.0000
74 D A -1.1888
75 C A 0.0000
76 I A 0.0000
77 R A 0.0000
78 G A 0.0000
79 G A 0.0000
80 I A 0.0000
81 E A -0.1658
82 W A 0.0000
83 A A 0.0000
84 R A 0.0000
85 I A 0.0000
86 F A 0.0000
87 P A -1.1696
88 K A -1.5549
89 P A -0.7934
90 T A 0.0000
91 F A -0.4067
92 D A -1.7774
93 V A 0.0000
94 K A -2.5820
95 V A 0.0000
96 D A -3.1890
97 V A -1.9953
98 E A -2.4785
99 K A -2.6298
100 D A -2.7182
101 E A -3.1506
102 E A -3.2466
103 G A -2.3622
104 N A -1.4966
105 I A 0.0000
106 I A 0.5011
107 S A -0.6747
108 V A 0.0000
109 D A -3.1612
110 V A 0.0000
111 P A -2.3445
112 E A -2.7193
113 S A -2.0746
114 T A 0.0000
115 I A 0.0000
116 K A -3.2027
117 E A -3.1430
118 L A 0.0000
119 E A -2.0197
120 K A -2.4136
121 I A -1.4920
122 A A -1.4664
123 N A -1.5444
124 M A -1.6062
125 E A -2.5373
126 A A 0.0000
127 L A 0.0000
128 E A -3.1275
129 H A -2.3452
130 Y A 0.0000
131 R A -2.4491
132 K A -2.7224
133 I A 0.0000
134 Y A 0.0000
135 S A -1.8766
136 D A -2.1589
137 W A 0.0000
138 K A -2.2041
139 E A -2.4508
140 R A -2.1156
141 G A -1.6109
142 K A -1.5435
143 T A -0.8586
144 F A 0.0000
145 I A 0.0000
146 L A 0.0000
147 N A 0.0000
148 L A 0.0000
149 Y A 0.0000
150 H A -0.1068
151 W A 0.0000
152 P A 0.0000
153 L A 0.0000
154 P A 0.0000
155 L A -0.2871
156 W A -0.2552
157 I A 0.0000
158 H A 0.0000
159 D A -0.1785
160 P A 0.0000
161 I A 0.2298
162 A A -0.2549
163 V A 0.0000
164 R A 0.0000
165 K A -0.0927
166 L A -0.3959
167 G A 0.0000
168 P A -1.3378
169 D A -2.2790
170 R A -1.5876
171 A A -0.9590
172 P A -0.9680
173 A A 0.0000
174 G A 0.0000
175 W A 0.0000
176 L A 0.0000
177 D A -2.5891
178 E A -3.0217
179 K A -2.5291
180 T A 0.0000
181 V A 0.0000
182 V A -0.9305
183 E A 0.0000
184 F A 0.0000
185 V A 0.0000
186 K A 0.0000
187 F A 0.0000
188 A A 0.0000
189 A A 0.0000
190 F A 0.0000
191 V A 0.0000
192 A A 0.0000
193 Y A -0.2934
194 H A -0.5889
195 L A 0.0000
196 D A -1.5404
197 D A -2.1404
198 L A 0.0000
199 V A 0.0000
200 D A -1.3365
201 M A -0.6444
202 W A 0.0000
203 S A 0.0000
204 T A 0.0000
205 M A 0.0000
206 N A 0.0000
207 E A 0.0000
208 P A 0.0000
209 N A -0.6851
210 V A -0.2718
211 V A -0.1742
212 Y A 0.0000
213 N A -1.2769
214 Q A -1.0163
215 G A 0.0000
216 Y A 0.0000
217 I A -0.6879
218 N A -1.3679
219 L A -1.3701
220 R A -2.4084
221 S A -1.1828
222 G A 0.0000
223 F A 0.0000
224 P A 0.0000
225 P A 0.0000
226 G A -0.2378
227 Y A -0.0484
228 L A 0.0000
229 S A 0.0000
230 F A -1.1417
231 E A -2.4211
232 A A 0.0000
233 A A 0.0000
234 E A -2.9246
235 K A -2.6617
236 A A 0.0000
237 K A -1.4182
238 F A -0.6652
239 N A 0.0000
240 L A 0.0000
241 I A 0.0000
242 Q A 0.0000
243 A A 0.0000
244 H A 0.0000
245 I A 0.0000
246 G A 0.0000
247 A A 0.0000
248 Y A -0.4878
249 D A -0.7739
250 A A 0.0000
251 I A 0.0000
252 K A -1.5114
253 E A -1.5159
254 Y A -0.6931
255 S A -1.6035
256 E A -2.3655
257 K A -1.6420
258 S A -0.9641
259 V A 0.0000
260 G A 0.0000
261 V A 0.0000
262 I A 0.0000
263 Y A 0.0000
264 A A -0.0724
265 F A 0.0000
266 A A -0.0772
267 W A 0.0000
268 H A 0.0000
269 D A -0.4886
270 P A -1.3671
271 L A 0.4207
272 A A -1.1493
273 E A -3.2164
274 E A -3.5016
275 Y A -3.1086
276 K A -4.5443
277 D A -4.7818
278 E A -4.1518
279 V A 0.0000
280 E A -4.3603
281 E A -4.3179
282 I A -3.0650
283 R A 0.0000
284 K A -3.9592
285 K A -3.9304
286 D A -3.1172
287 Y A 0.0000
288 E A -2.6935
289 F A 0.0000
290 V A 0.0000
291 T A -1.2626
292 I A -0.4923
293 L A 0.0000
294 H A -1.2388
295 S A -0.8456
296 K A -1.0009
297 G A -1.2076
298 K A -1.0251
299 L A 0.0000
300 D A -0.6642
301 W A 0.0000
302 I A 0.0000
303 G A 0.0000
304 V A 0.0000
305 N A 0.0000
306 Y A 0.0000
307 Y A 0.2450
308 S A 0.0000
309 R A 0.0942
310 L A 0.4627
311 V A 0.0000
312 Y A 0.0000
313 G A 0.0000
314 A A -1.3314
315 K A -2.8317
316 D A -3.0485
317 G A -2.3177
318 H A -2.0847
319 L A -0.9790
320 V A -0.3406
321 P A 0.2504
322 L A 0.0000
323 P A -0.4799
324 G A -0.8795
325 Y A -0.2606
326 G A 0.0000
327 F A 0.3444
328 M A -0.0467
329 S A -1.3022
330 E A -2.7560
331 R A -2.6598
332 G A -1.5633
333 G A -1.3992
334 F A -1.3132
335 A A 0.0000
336 K A -2.1872
337 S A -1.2229
338 G A 0.0000
339 R A -1.0692
340 P A 0.0000
341 A A 0.0000
342 S A 0.0000
343 D A -1.4614
344 F A -0.9327
345 G A 0.0000
346 W A -0.1319
347 E A 0.0000
348 M A 0.0000
349 Y A -0.1468
350 P A 0.0000
351 E A -1.1878
352 G A 0.0000
353 L A 0.0000
354 E A -1.7373
355 N A -1.5480
356 L A 0.0000
357 L A 0.0000
358 K A -2.3972
359 Y A -1.1298
360 L A 0.0000
361 N A -2.1791
362 N A -2.0776
363 A A -1.3566
364 Y A 0.0000
365 E A -2.4403
366 L A -1.1780
367 P A -0.9428
368 M A 0.0000
369 I A 0.0000
370 I A 0.0000
371 T A 0.0000
372 E A 0.0000
373 N A 0.0000
374 G A 0.0000
375 M A 0.0000
376 A A 0.0000
377 D A 0.0000
378 A A -0.3473
379 A A 0.0000
380 D A 0.0000
381 R A -0.2253
382 Y A 0.0000
383 R A 0.0000
384 P A 0.0000
385 H A 0.0000
386 Y A 0.0000
387 L A 0.0000
388 V A 0.0000
389 S A 0.0000
390 H A 0.0000
391 L A 0.0000
392 K A -1.2545
393 A A 0.0000
394 V A 0.0000
395 Y A -1.3172
396 N A -1.8992
397 A A 0.0000
398 M A -2.1600
399 K A -2.7861
400 E A -3.2503
401 G A -2.6041
402 A A 0.0000
403 D A -1.8964
404 V A 0.0000
405 R A -1.5485
406 G A 0.0000
407 Y A 0.0000
408 L A 0.0000
409 H A 0.0000
410 W A 0.0000
411 S A 0.0000
412 L A 0.0000
413 T A 0.0000
414 D A 0.0000
415 N A 0.0000
416 Y A 0.0000
417 E A 0.0000
418 W A 0.0000
419 A A 0.0000
420 Q A -0.8678
421 G A 0.0000
422 F A -0.9795
423 R A -1.9432
424 M A 0.0000
425 R A 0.0000
426 F A 0.0000
427 G A 0.0000
428 L A 0.0000
429 V A 0.0000
430 Y A 0.0000
431 V A 0.0000
432 D A -1.4356
433 F A -1.4426
434 E A -2.3159
435 T A -1.6141
436 K A -1.6054
437 K A -2.3973
438 R A -1.5605
439 Y A -1.1615
440 L A -0.4359
441 R A 0.0000
442 P A 0.0000
443 S A 0.0000
444 A A 0.0000
445 L A 0.0000
446 V A 0.0000
447 F A 0.0000
448 R A -1.4766
449 E A -1.5585
450 I A 0.0000
451 A A 0.0000
452 T A -1.5329
453 Q A -2.2936
454 K A -2.3246
455 E A -2.5169
456 I A 0.0000
457 P A -2.1869
458 E A -2.7767
459 E A -2.4806
460 L A 0.0000
461 A A -1.5226
462 H A -1.3066
463 L A 0.0000
464 A A -1.1231
465 D A -1.9833
466 L A 0.0000
467 K A -2.2130
468 F A -0.9232
469 V A 0.0000
470 T A -1.5054
471 R A -2.2605
1 A B -1.5065
2 K B -2.2710
3 F B 0.0000
4 P B -1.9403
5 K B -2.7597
6 N B -2.3760
7 F B 0.0000
8 M B -0.9546
9 F B 0.0000
10 G B 0.0000
11 Y B 0.0000
12 S B 0.0000
13 W B 0.0000
14 S B 0.0000
15 G B 0.0000
16 F B 0.0000
17 Q B 0.0000
18 F B 0.0000
19 E B 0.0000
20 M B 0.0000
21 G B -1.0581
22 L B -0.4615
23 P B -0.8665
24 G B -1.0089
25 S B 0.0000
26 E B -2.2283
27 V B -1.5411
28 E B -1.8615
29 S B 0.0000
30 D B 0.0000
31 W B 0.0000
32 W B -0.4375
33 V B -0.2538
34 W B 0.0000
35 V B 0.0000
36 H B -0.6587
37 D B -1.0788
38 K B -1.8260
39 E B -1.0040
40 N B 0.0000
41 I B -0.5789
42 A B -0.4286
43 S B 0.0000
44 G B -1.0003
45 L B 0.0000
46 V B 0.0000
47 S B -0.5679
48 G B -0.5090
49 D B -0.6076
50 L B -0.1341
51 P B 0.0000
52 E B -1.1358
53 N B -1.5771
54 G B 0.0000
55 P B 0.0000
56 A B 0.0000
57 Y B 0.0000
58 W B 0.0000
59 H B -0.7663
60 L B -0.7115
61 Y B 0.0000
62 K B -2.6265
63 Q B -2.3059
64 D B 0.0000
65 H B 0.0000
66 D B -2.4227
67 I B -1.5343
68 A B 0.0000
69 E B -2.3478
70 K B -2.5271
71 L B 0.0000
72 G B -1.6885
73 M B 0.0000
74 D B -1.1707
75 C B 0.0000
76 I B 0.0000
77 R B 0.0000
78 G B 0.0000
79 G B 0.0000
80 I B 0.0000
81 E B -0.2048
82 W B 0.0000
83 A B 0.0000
84 R B 0.0000
85 I B 0.0000
86 F B 0.0000
87 P B -1.2436
88 K B -1.4806
89 P B -0.8784
90 T B 0.0000
91 F B -0.9088
92 D B -1.9700
93 V B 0.0000
94 K B -2.4390
95 V B -2.1053
96 D B -3.0068
97 V B -1.7906
98 E B -2.2608
99 K B -2.2874
100 D B -2.6032
101 E B -3.1068
102 E B -3.1623
103 G B -2.1319
104 N B 0.0000
105 I B 0.0000
106 I B 0.6574
107 S B -0.6561
108 V B 0.0000
109 D B -2.9796
110 V B 0.0000
111 P B -2.2234
112 E B -2.6407
113 S B -2.0142
114 T B -2.4309
115 I B 0.0000
116 K B -2.9282
117 E B -3.2249
118 L B 0.0000
119 E B -1.9594
120 K B -2.4544
121 I B -1.4050
122 A B -1.4953
123 N B -1.6887
124 M B -1.6730
125 E B -2.6205
126 A B 0.0000
127 L B 0.0000
128 E B -3.1735
129 H B -2.3578
130 Y B 0.0000
131 R B -2.3803
132 K B -2.6804
133 I B 0.0000
134 Y B 0.0000
135 S B -1.7764
136 D B 0.0000
137 W B 0.0000
138 K B -2.1336
139 E B -2.4046
140 R B -1.9473
141 G B -1.6110
142 K B -1.4857
143 T B -0.8465
144 F B 0.0000
145 I B 0.0000
146 L B 0.0000
147 N B 0.0000
148 L B 0.0000
149 Y B 0.0000
150 H B -0.1090
151 W B 0.0000
152 P B 0.0000
153 L B 0.0000
154 P B 0.0000
155 L B -0.2656
156 W B -0.2868
157 I B 0.0000
158 H B 0.0000
159 D B -0.2363
160 P B 0.0000
161 I B -0.1264
162 A B -0.4091
163 V B 0.0000
164 R B 0.0000
165 K B -0.9616
166 L B -0.7460
167 G B 0.0000
168 P B -1.2259
169 D B -2.0133
170 R B -1.4905
171 A B -1.0104
172 P B -0.6302
173 A B 0.0000
174 G B 0.0000
175 W B 0.0000
176 L B 0.0000
177 D B -1.9983
178 E B -2.5667
179 K B -2.0469
180 T B 0.0000
181 V B 0.0000
182 V B -0.7349
183 E B 0.0000
184 F B 0.0000
185 V B 0.0000
186 K B 0.0000
187 F B 0.0000
188 A B 0.0000
189 A B 0.0000
190 F B 0.0000
191 V B 0.0000
192 A B 0.0000
193 Y B -0.3291
194 H B -0.5627
195 L B 0.0000
196 D B -1.5423
197 D B -2.1467
198 L B 0.0000
199 V B 0.0000
200 D B -1.3379
201 M B -0.6564
202 W B 0.0000
203 S B 0.0000
204 T B 0.0000
205 M B 0.0000
206 N B 0.0000
207 E B 0.0000
208 P B 0.0000
209 N B 0.0000
210 V B -0.0103
211 V B -0.0132
212 Y B 0.0000
213 N B -0.8129
214 Q B -0.6853
215 G B 0.0000
216 Y B 0.0000
217 I B -0.4285
218 N B -0.8531
219 L B -1.1734
220 R B -2.3035
221 S B -1.1041
222 G B 0.0000
223 F B 0.0000
224 P B 0.0000
225 P B 0.0000
226 G B -0.3666
227 Y B 0.0000
228 L B 0.0000
229 S B 0.0000
230 F B -1.3723
231 E B -2.6723
232 A B 0.0000
233 A B 0.0000
234 E B -3.0300
235 K B -2.7799
236 A B 0.0000
237 K B -1.3419
238 F B -0.3939
239 N B 0.0000
240 L B 0.0000
241 I B 0.0000
242 Q B 0.0000
243 A B 0.0000
244 H B 0.0000
245 I B 0.0000
246 G B 0.0000
247 A B 0.0000
248 Y B -0.4246
249 D B -0.6329
250 A B 0.0000
251 I B 0.0000
252 K B -1.5307
253 E B -1.6648
254 Y B -0.9462
255 S B -1.5806
256 E B -2.3741
257 K B -1.6120
258 S B -0.9848
259 V B 0.0000
260 G B 0.0000
261 V B 0.0000
262 I B 0.0000
263 Y B 0.0000
264 A B 0.0228
265 F B 0.0000
266 A B 0.0096
267 W B 0.0000
268 H B 0.0000
269 D B -0.7013
270 P B -1.4222
271 L B 0.4012
272 A B -1.0604
273 E B -3.0967
274 E B -3.4178
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244 H D 0.0000
245 I D 0.0000
246 G D 0.0000
247 A D 0.0000
248 Y D -0.5199
249 D D -0.7417
250 A D 0.0000
251 I D 0.0000
252 K D -1.6627
253 E D -1.6356
254 Y D -0.9814
255 S D -1.6065
256 E D -2.4260
257 K D -1.6594
258 S D -0.9760
259 V D 0.0000
260 G D 0.0000
261 V D 0.0000
262 I D 0.0000
263 Y D 0.0000
264 A D -0.0725
265 F D 0.0000
266 A D -0.0649
267 W D 0.0000
268 H D 0.0000
269 D D -0.7079
270 P D -1.2242
271 L D 0.4519
272 A D -1.0909
273 E D -3.1720
274 E D -3.4635
275 Y D -3.2398
276 K D -4.5200
277 D D -4.7068
278 E D -3.9384
279 V D 0.0000
280 E D -4.4864
281 E D -4.0431
282 I D -2.7981
283 R D 0.0000
284 K D -3.7692
285 K D -3.7366
286 D D -2.9296
287 Y D 0.0000
288 E D -2.1781
289 F D 0.0000
290 V D 0.0000
291 T D -0.9764
292 I D -0.2484
293 L D 0.0000
294 H D -1.0938
295 S D -0.7910
296 K D -0.9311
297 G D -1.1347
298 K D -0.9571
299 L D 0.0000
300 D D -0.6305
301 W D 0.0000
302 I D 0.0000
303 G D 0.0000
304 V D 0.0000
305 N D 0.0000
306 Y D 0.0000
307 Y D 0.2464
308 S D 0.0000
309 R D 0.1257
310 L D 0.5082
311 V D 0.0000
312 Y D 0.0000
313 G D 0.0000
314 A D -1.1369
315 K D -2.6554
316 D D -2.9781
317 G D -2.4229
318 H D -1.8710
319 L D -0.8038
320 V D -0.2363
321 P D 0.2181
322 L D 0.0000
323 P D -0.4427
324 G D -1.0751
325 Y D -0.2621
326 G D 0.0000
327 F D 0.4596
328 M D 0.0143
329 S D -1.2743
330 E D -2.7458
331 R D -2.6405
332 G D -1.5731
333 G D -1.4286
334 F D -1.3209
335 A D 0.0000
336 K D -2.2195
337 S D -1.2923
338 G D 0.0000
339 R D -1.0704
340 P D 0.0000
341 A D 0.0000
342 S D 0.0000
343 D D -1.4659
344 F D -0.8968
345 G D 0.0000
346 W D -0.0774
347 E D 0.0000
348 M D 0.0000
349 Y D -0.1188
350 P D 0.0000
351 E D -1.1038
352 G D 0.0000
353 L D 0.0000
354 E D -1.7289
355 N D -1.6372
356 L D 0.0000
357 L D 0.0000
358 K D -2.7831
359 Y D -1.2558
360 L D 0.0000
361 N D -2.1806
362 N D -2.1561
363 A D -1.4076
364 Y D 0.0000
365 E D -2.4573
366 L D -1.1948
367 P D -0.9879
368 M D 0.0000
369 I D 0.0000
370 I D 0.0000
371 T D 0.0000
372 E D 0.0000
373 N D 0.0000
374 G D 0.0000
375 M D 0.0000
376 A D 0.0000
377 D D 0.0000
378 A D -0.5110
379 A D 0.0000
380 D D 0.0000
381 R D -0.2448
382 Y D 0.0000
383 R D 0.0000
384 P D 0.0000
385 H D 0.0000
386 Y D 0.0000
387 L D 0.0000
388 V D 0.0000
389 S D 0.0000
390 H D 0.0000
391 L D 0.0000
392 K D -1.1931
393 A D 0.0000
394 V D 0.0000
395 Y D -1.1821
396 N D -1.7965
397 A D 0.0000
398 M D -2.1211
399 K D -2.7559
400 E D -3.2938
401 G D -2.7031
402 A D 0.0000
403 D D -1.9545
404 V D 0.0000
405 R D -1.8213
406 G D 0.0000
407 Y D 0.0000
408 L D 0.0000
409 H D 0.0000
410 W D 0.0000
411 S D 0.0000
412 L D 0.0000
413 T D 0.0000
414 D D 0.0000
415 N D 0.0000
416 Y D 0.0000
417 E D 0.0000
418 W D 0.0000
419 A D 0.0000
420 Q D -0.9695
421 G D 0.0000
422 F D -1.0294
423 R D -2.0036
424 M D 0.0000
425 R D -0.6461
426 F D 0.0000
427 G D 0.0000
428 L D 0.0000
429 V D 0.0000
430 Y D 0.0000
431 V D 0.0000
432 D D -1.3563
433 F D -1.4424
434 E D -2.2314
435 T D -1.5549
436 K D -1.3350
437 K D -1.8377
438 R D -1.2426
439 Y D -0.9250
440 L D -0.3625
441 R D 0.0000
442 P D 0.0000
443 S D 0.0000
444 A D 0.0000
445 L D 0.0000
446 V D 0.0000
447 F D 0.0000
448 R D -2.2840
449 E D -1.7944
450 I D 0.0000
451 A D 0.0000
452 T D -1.8142
453 Q D -2.3877
454 K D -2.4505
455 E D -2.4291
456 I D 0.0000
457 P D -2.0124
458 E D -2.3178
459 E D -2.0834
460 L D 0.0000
461 A D -1.3943
462 H D -1.3562
463 L D 0.0000
464 A D -1.2677
465 D D -2.2884
466 L D 0.0000
467 K D -2.2950
468 F D -0.9162
469 V D 0.0000
470 T D -1.5128
471 R D -2.2534
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Laboratory of Theory of Biopolymers 2018