Project name: 0605_50a_7

Status: done

Started: 2026-06-05 05:48:35
Settings
Chain sequence(s) A: IVAHTFKVRVYQKVLTFRRSYAYIHTTYLLGSNTEYVAPPMWEIHHINSHSQCYSSYSRVIAGTVFVAYHRDSYENKTMQLMPDDYSNTHSTRYVTVKDQWHSRGSTWLYRETCNLNCMVTITTARSKYPYHFFATSTGDVVDISPFYNGTNRNASYFGENADKFFIFPNYTIVSDFGRPNSALETHRLVAFLERADSVISWDIQDEKNVTGGGGSLEEIMREFNSYKQRVKYVEDKVVDPLPPYLIKRMKQIEDKIEEIESKQKKIENEIARIKKIKGGGSGGGSEKAAKAEEAARKMEEELEKEKIVAGITADSVEEALEKAAAVFAGGVKIIAISARVPEYELVIELLQPLKKKGAIIGAASITSVEEAEKAIKAGAEFITSPYLDEEIIEYYKAKGIPYIPGVATPTEVKKAMDLGLKILRLYPYSVLGPEFIKAMKTPFPDVKFIPAGGVNLDNIGEVFEAGALAVVVGSALVSGTPEEVKEKAKKFVEKMRGGSHHHHHHHH
C: IVAHTFKVRVYQKVLTFRRSYAYIHTTYLLGSNTEYVAPPMWEIHHINSHSQCYSSYSRVIAGTVFVAYHRDSYENKTMQLMPDDYSNTHSTRYVTVKDQWHSRGSTWLYRETCNLNCMVTITTARSKYPYHFFATSTGDVVDISPFYNGTNRNASYFGENADKFFIFPNYTIVSDFGRPNSALETHRLVAFLERADSVISWDIQDEKNVTGGGGSLEEIMREFNSYKQRVKYVEDKVVDPLPPYLIKRMKQIEDKIEEIESKQKKIENEIARIKKIKGGGSGGGSEKAAKAEEAARKMEEELEKEKIVAGITADSVEEALEKAAAVFAGGVKIIAISARVPEYELVIELLQPLKKKGAIIGAASITSVEEAEKAIKAGAEFITSPYLDEEIIEYYKAKGIPYIPGVATPTEVKKAMDLGLKILRLYPYSVLGPEFIKAMKTPFPDVKFIPAGGVNLDNIGEVFEAGALAVVVGSALVSGTPEEVKEKAKKFVEKMRGGSHHHHHHHH
B: IVAHTFKVRVYQKVLTFRRSYAYIHTTYLLGSNTEYVAPPMWEIHHINSHSQCYSSYSRVIAGTVFVAYHRDSYENKTMQLMPDDYSNTHSTRYVTVKDQWHSRGSTWLYRETCNLNCMVTITTARSKYPYHFFATSTGDVVDISPFYNGTNRNASYFGENADKFFIFPNYTIVSDFGRPNSALETHRLVAFLERADSVISWDIQDEKNVTGGGGSLEEIMREFNSYKQRVKYVEDKVVDPLPPYLIKRMKQIEDKIEEIESKQKKIENEIARIKKIKGGGSGGGSEKAAKAEEAARKMEEELEKEKIVAGITADSVEEALEKAAAVFAGGVKIIAISARVPEYELVIELLQPLKKKGAIIGAASITSVEEAEKAIKAGAEFITSPYLDEEIIEYYKAKGIPYIPGVATPTEVKKAMDLGLKILRLYPYSVLGPEFIKAMKTPFPDVKFIPAGGVNLDNIGEVFEAGALAVVVGSALVSGTPEEVKEKAKKFVEKMRGGSHHHHHHHH
input PDB
Selected Chain(s) A,B,C
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                                        (00:00:02)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:52:23)
[INFO]       Main:     Simulation completed successfully.                                          (00:52:59)
Show buried residues

Minimal score value
-4.8734
Maximal score value
2.4404
Average score
-0.9899
Total score value
-1508.6301

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 I A 1.2814
2 V A 1.7131
3 A A 0.5796
4 H A 0.0420
5 T A -0.4085
6 F A 0.0000
7 K A -1.7533
8 V A 0.0000
9 R A 0.0000
10 V A 0.0000
11 Y A 0.0000
12 Q A -0.1689
13 K A 0.0000
14 V A 0.0000
15 L A 0.0000
16 T A 0.0000
17 F A 0.0000
18 R A -0.5065
19 R A 0.0000
20 S A 0.0000
21 Y A 0.9113
22 A A 0.0000
23 Y A 1.8061
24 I A 1.8635
25 H A 0.0998
26 T A 0.4857
27 T A 0.0000
28 Y A 0.6645
29 L A 0.0000
30 L A 0.0000
31 G A -0.3406
32 S A 0.0000
33 N A -0.3944
34 T A -0.1832
35 E A -0.1950
36 Y A 0.3397
37 V A 0.0000
38 A A -0.2872
39 P A 0.0000
40 P A 0.2502
41 M A 0.5064
42 W A 1.0816
43 E A 0.0000
44 I A 0.0000
45 H A -0.1466
46 H A -0.3251
47 I A 0.0000
48 N A 0.0000
49 S A -0.7807
50 H A -1.5625
51 S A 0.0000
52 Q A -0.8655
53 C A 0.0000
54 Y A -0.7893
55 S A 0.0000
56 S A -0.9738
57 Y A -0.2988
58 S A 0.0583
59 R A -0.1058
60 V A 1.6079
61 I A 0.0000
62 A A -0.0722
63 G A 0.3392
64 T A 0.8587
65 V A 1.9876
66 F A 0.0000
67 V A 0.6410
68 A A 0.0000
69 Y A -0.9608
70 H A -1.4166
71 R A -2.0077
72 D A -1.3118
73 S A -1.4205
74 Y A -0.8315
75 E A -2.5615
76 N A -2.5536
77 K A -2.5219
78 T A -1.3520
79 M A -0.5919
80 Q A -0.9213
81 L A 0.0000
82 M A -0.8685
83 P A -1.0047
84 D A -1.3576
85 D A -1.6754
86 Y A -0.2569
87 S A -0.4041
88 N A -0.7004
89 T A -0.3582
90 H A -0.6318
91 S A -0.3896
92 T A -0.3473
93 R A -0.5287
94 Y A 0.0000
95 V A 0.0000
96 T A 0.0000
97 V A -1.2540
98 K A -2.6713
99 D A -2.8132
100 Q A -1.9031
101 W A -1.2417
102 H A 0.0000
103 S A -1.0661
104 R A -1.1972
105 G A -0.3100
106 S A 0.4794
107 T A 1.2817
108 W A 2.4404
109 L A 2.0121
110 Y A 0.9432
111 R A -0.3734
112 E A -0.5625
113 T A 0.0000
114 C A 0.0000
115 N A 0.0000
116 L A 0.0000
117 N A -0.5041
118 C A 0.0000
119 M A -0.0796
120 V A 0.0000
121 T A 0.0000
122 I A -0.2381
123 T A 0.0000
124 T A 0.0000
125 A A 0.0000
126 R A -0.3937
127 S A 0.0000
128 K A -0.6779
129 Y A 0.5021
130 P A 0.0934
131 Y A 0.0000
132 H A -0.3630
133 F A 0.3617
134 F A 0.0000
135 A A 0.2296
136 T A 0.0000
137 S A -0.1373
138 T A -0.0755
139 G A -0.2299
140 D A 0.0668
141 V A 1.0482
142 V A 0.0000
143 D A 0.0000
144 I A 0.0000
145 S A 0.0000
146 P A 0.0000
147 F A 0.0000
148 Y A 0.0000
149 N A -1.4003
150 G A -1.0480
151 T A -1.3977
152 N A -1.8849
153 R A -2.7237
154 N A -2.1900
155 A A -1.2634
156 S A -1.2890
157 Y A -0.5996
158 F A -0.4468
159 G A 0.0000
160 E A -0.7279
161 N A -0.9781
162 A A -1.0857
163 D A -1.8816
164 K A -1.4063
165 F A -0.4536
166 F A 0.4587
167 I A 0.7097
168 F A 0.3500
169 P A -0.9513
170 N A -2.0680
171 Y A -0.9865
172 T A -0.7368
173 I A 0.0000
174 V A 0.0000
175 S A -1.0246
176 D A -1.5018
177 F A 0.0000
178 G A 0.0000
179 R A -2.6074
180 P A -2.0453
181 N A -1.9292
182 S A -1.4678
183 A A -0.4027
184 L A 0.1857
185 E A -1.6069
186 T A -1.4800
187 H A -1.7425
188 R A -2.6144
189 L A -1.1712
190 V A 0.0000
191 A A 0.0000
192 F A 0.0000
193 L A 0.0000
194 E A -1.0289
195 R A -0.8851
196 A A -0.4429
197 D A -0.6784
198 S A 0.0000
199 V A 0.0000
200 I A 0.0000
201 S A 0.0000
202 W A 0.0000
203 D A -1.2203
204 I A 0.0000
205 Q A -2.1164
206 D A -2.5870
207 E A -2.6207
208 K A -3.1431
209 N A -2.6905
210 V A -1.4203
211 T A -1.1967
212 G A -1.3225
213 G A -1.3700
214 G A -0.9180
215 G A -1.2958
216 S A -0.9996
217 L A 0.0000
218 E A -1.9551
219 E A -3.0912
220 I A 0.0000
221 M A -2.1627
222 R A -3.5199
223 E A -2.9387
224 F A 0.0000
225 N A -2.7150
226 S A -2.0809
227 Y A -1.7937
228 K A -2.0742
229 Q A -2.0778
230 R A -1.6406
231 V A 0.0000
232 K A -2.0983
233 Y A -1.3917
234 V A 0.0000
235 E A -1.7551
236 D A -2.2896
237 K A -1.7855
238 V A 0.0000
239 V A -0.2295
240 D A -1.6777
241 P A -1.6086
242 L A 0.0000
243 P A -0.5597
244 P A -0.4509
245 Y A 0.1217
246 L A 0.0000
247 I A -0.7862
248 K A -2.1545
249 R A -1.9469
250 M A 0.0000
251 K A -2.9213
252 Q A -3.1386
253 I A 0.0000
254 E A -3.4117
255 D A -4.1560
256 K A -3.6852
257 I A 0.0000
258 E A -4.2506
259 E A -4.1945
260 I A 0.0000
261 E A -3.7579
262 S A -3.1961
263 K A -3.5292
264 Q A 0.0000
265 K A -4.0779
266 K A -3.9325
267 I A 0.0000
268 E A -3.8375
269 N A -3.5873
270 E A -3.4303
271 I A 0.0000
272 A A -2.6944
273 R A -3.2617
274 I A 0.0000
275 K A -2.5565
276 K A -3.3313
277 I A -2.0699
278 K A -1.1801
279 G A 0.0000
280 G A -1.6851
281 G A -1.5227
282 S A -1.5677
283 G A -1.3998
284 G A -1.8819
285 G A -1.7737
286 S A -2.0258
287 E A -3.3178
288 K A -3.6954
289 A A -2.8959
290 A A -3.0163
291 K A -4.0071
292 A A 0.0000
293 E A -4.4969
294 E A -4.3179
295 A A -3.2479
296 A A -3.5119
297 R A -4.8734
298 K A -4.5596
299 M A 0.0000
300 E A -4.1555
301 E A -4.7991
302 E A -4.2129
303 L A 0.0000
304 E A -4.0695
305 K A -3.7871
306 E A -2.8457
307 K A -2.2886
308 I A 0.0000
309 V A 0.0000
310 A A 0.0000
311 G A -0.1658
312 I A 0.0000
313 T A -0.7530
314 A A -1.6552
315 D A -2.5139
316 S A -1.9652
317 V A -1.8054
318 E A -2.7320
319 E A -2.5072
320 A A 0.0000
321 L A -1.1579
322 E A -2.6368
323 K A 0.0000
324 A A 0.0000
325 A A -0.5804
326 A A 0.0000
327 V A 0.0000
328 F A -0.6297
329 A A -0.7394
330 G A 0.0000
331 G A -1.1745
332 V A 0.0000
333 K A -1.3111
334 I A 0.0000
335 I A 0.0000
336 A A 0.0000
337 I A 0.0000
338 S A 0.0000
339 A A 0.0000
340 R A -1.2738
341 V A 0.0000
342 P A -1.7571
343 E A -2.2173
344 Y A 0.0000
345 E A -1.8063
346 L A -0.7919
347 V A 0.0000
348 I A 0.0000
349 E A -1.6704
350 L A 0.0398
351 L A 0.0000
352 Q A -1.1932
353 P A -1.3459
354 L A -1.3392
355 K A -2.0677
356 K A -2.8417
357 K A -2.8770
358 G A -1.9238
359 A A 0.0000
360 I A -0.8426
361 I A 0.0000
362 G A 0.0000
363 A A 0.0000
364 A A 0.0000
365 S A 0.0000
366 I A 0.0000
367 T A 0.0000
368 S A -0.9477
369 V A -1.5915
370 E A -2.2176
371 E A -1.8557
372 A A 0.0000
373 E A -2.2079
374 K A -2.6948
375 A A 0.0000
376 I A -1.8199
377 K A -2.5688
378 A A -1.8525
379 G A -1.4125
380 A A 0.0000
381 E A -0.6635
382 F A 0.0000
383 I A 0.0000
384 T A 0.0000
385 S A 0.0000
386 P A 0.0000
387 Y A 0.0000
388 L A 0.0000
389 D A -1.5029
390 E A -2.1965
391 E A -2.7981
392 I A 0.0000
393 I A 0.0000
394 E A -3.0304
395 Y A -1.6653
396 Y A 0.0000
397 K A -2.6415
398 A A -1.8813
399 K A -1.7192
400 G A -2.0821
401 I A -0.8221
402 P A 0.0000
403 Y A 0.0000
404 I A 0.0000
405 P A 0.0000
406 G A 0.0000
407 V A 0.0000
408 A A 0.0000
409 T A 0.0000
410 P A 0.0000
411 T A -0.2606
412 E A 0.0000
413 V A 0.0000
414 K A -1.0578
415 K A -1.5184
416 A A 0.0000
417 M A -1.5733
418 D A -2.2998
419 L A -1.7813
420 G A -1.6283
421 L A 0.0000
422 K A -2.3066
423 I A 0.0000
424 L A 0.0000
425 R A 0.0000
426 L A 0.0000
427 Y A 0.0000
428 P A 0.0000
429 Y A 0.0000
430 S A -0.5977
431 V A -0.0323
432 L A 0.0000
433 G A -0.7658
434 P A -1.5533
435 E A -1.6173
436 F A 0.0000
437 I A 0.0000
438 K A -2.5543
439 A A -1.3689
440 M A 0.0000
441 K A -1.7507
442 T A -1.0781
443 P A 0.0000
444 F A 0.0000
445 P A -1.7007
446 D A -2.3567
447 V A 0.0000
448 K A -1.4705
449 F A 0.0000
450 I A 0.0000
451 P A 0.0000
452 A A 0.0000
453 G A -0.7534
454 G A -1.0062
455 V A 0.0000
456 N A -1.0607
457 L A -1.2536
458 D A -2.1643
459 N A -1.9783
460 I A 0.0000
461 G A -2.0532
462 E A -2.8474
463 V A 0.0000
464 F A -1.2546
465 E A -2.6216
466 A A 0.0000
467 G A -1.3683
468 A A -1.0968
469 L A 0.0000
470 A A 0.0000
471 V A 0.0000
472 V A 0.0000
473 V A 0.0000
474 G A -0.4545
475 S A -0.5347
476 A A -0.4409
477 L A 0.0000
478 V A 0.0000
479 S A -0.7215
480 G A -1.3494
481 T A -1.9526
482 P A -2.5251
483 E A -3.5117
484 E A -3.3588
485 V A 0.0000
486 K A -3.3336
487 E A -3.8964
488 K A -3.0431
489 A A 0.0000
490 K A -3.2192
491 K A -3.4806
492 F A 0.0000
493 V A -2.6171
494 E A -3.7562
495 K A -3.0803
496 M A -2.5361
497 R A -3.5017
498 G A -2.7483
499 G A -2.3827
500 S A -2.3162
501 H A -2.8226
502 H A -3.0875
503 H A -3.0744
504 H A -3.2050
505 H A -3.2228
506 H A -2.9519
507 H A -2.6339
508 H A -2.1648
1 I B 1.4301
2 V B 1.8112
3 A B 0.7446
4 H B 0.0000
5 T B -0.2671
6 F B 0.0000
7 K B -1.7694
8 V B 0.0000
9 R B 0.0000
10 V B 0.0000
11 Y B 0.0000
12 Q B -0.1962
13 K B 0.0000
14 V B 0.0000
15 L B 0.0000
16 T B 0.0000
17 F B 0.0000
18 R B -0.5116
19 R B -0.5545
20 S B 0.0000
21 Y B 0.6305
22 A B 0.0000
23 Y B 1.6378
24 I B 1.9360
25 H B 0.1007
26 T B 0.3925
27 T B 0.0000
28 Y B 0.0000
29 L B 0.0000
30 L B 0.0000
31 G B 0.0000
32 S B -0.4122
33 N B -0.3812
34 T B -0.1640
35 E B -0.1506
36 Y B 0.4146
37 V B 0.0000
38 A B -0.3408
39 P B 0.0000
40 P B 0.2243
41 M B 0.4828
42 W B 1.0717
43 E B 0.0000
44 I B 0.0000
45 H B -0.1477
46 H B -0.3215
47 I B 0.0000
48 N B 0.0000
49 S B -0.7633
50 H B -1.5355
51 S B 0.0000
52 Q B -0.9128
53 C B 0.0000
54 Y B -0.8504
55 S B 0.0000
56 S B -0.9144
57 Y B -0.4304
58 S B -0.1221
59 R B -0.4883
60 V B 1.4922
61 I B 0.4313
62 A B -0.0615
63 G B 0.3498
64 T B 0.8038
65 V B 1.9541
66 F B 0.0000
67 V B 0.6704
68 A B 0.0000
69 Y B -0.7255
70 H B -1.3049
71 R B -1.8881
72 D B -1.0213
73 S B -1.1137
74 Y B -0.2590
75 E B -2.2766
76 N B -2.4641
77 K B -2.5583
78 T B -1.4235
79 M B -0.6645
80 Q B -1.0237
81 L B 0.0000
82 M B -0.9915
83 P B -1.1162
84 D B -1.4012
85 D B -1.6920
86 Y B -0.2743
87 S B -0.4280
88 N B -0.7459
89 T B -0.3703
90 H B -0.6335
91 S B -0.4087
92 T B -0.3751
93 R B -0.5924
94 Y B 0.0000
95 V B 0.0000
96 T B 0.0000
97 V B -1.2936
98 K B -2.7474
99 D B -2.8277
100 Q B -1.8857
101 W B -1.2273
102 H B 0.0000
103 S B -0.9568
104 R B -1.0801
105 G B -0.2838
106 S B 0.4491
107 T B 1.2221
108 W B 2.3142
109 L B 1.8493
110 Y B 0.8176
111 R B -0.3381
112 E B 0.0000
113 T B 0.0000
114 C B 0.0000
115 N B 0.0000
116 L B 0.0000
117 N B -0.5463
118 C B 0.0000
119 M B 0.0000
120 V B 0.0000
121 T B 0.0000
122 I B -0.2885
123 T B 0.0000
124 T B -0.7545
125 A B 0.0000
126 R B -0.2533
127 S B 0.0000
128 K B -0.3260
129 Y B 0.4387
130 P B 0.1309
131 Y B 0.0000
132 H B -0.3425
133 F B 0.3006
134 F B 0.0000
135 A B 0.2049
136 T B 0.0000
137 S B -0.1506
138 T B -0.1192
139 G B -0.3002
140 D B -0.0308
141 V B 0.9051
142 V B 0.0000
143 D B 0.1289
144 I B 0.0000
145 S B 0.0000
146 P B 0.0000
147 F B 0.0000
148 Y B 0.0000
149 N B -1.4419
150 G B -1.0186
151 T B -1.3873
152 N B -1.8764
153 R B -2.7074
154 N B -2.1785
155 A B -1.2396
156 S B 0.0000
157 Y B -0.5915
158 F B -0.4804
159 G B 0.0000
160 E B -0.7848
161 N B -0.9663
162 A B -1.0714
163 D B -1.8857
164 K B -1.4562
165 F B -0.4648
166 F B 0.4708
167 I B 0.7233
168 F B 0.3433
169 P B -0.9802
170 N B -2.0954
171 Y B -1.0069
172 T B -0.7524
173 I B 0.0000
174 V B 0.0000
175 S B -1.2441
176 D B -1.9654
177 F B 0.0000
178 G B -1.6884
179 R B -2.7866
180 P B -2.1304
181 N B -1.9795
182 S B -1.5868
183 A B -0.4736
184 L B 0.1315
185 E B -1.6614
186 T B -1.5072
187 H B -1.7851
188 R B -2.6591
189 L B -1.2533
190 V B 0.0000
191 A B 0.0000
192 F B 0.0000
193 L B 0.0000
194 E B -1.1175
195 R B -0.9614
196 A B -0.5043
197 D B -0.7829
198 S B 0.0000
199 V B 0.0000
200 I B 0.0000
201 S B 0.0000
202 W B 0.0000
203 D B -1.2149
204 I B 0.0000
205 Q B -2.1536
206 D B -2.6451
207 E B -2.5704
208 K B -3.1174
209 N B -2.6353
210 V B -1.2589
211 T B -0.9808
212 G B -1.2725
213 G B -1.3876
214 G B -1.2540
215 G B -1.5588
216 S B -1.4425
217 L B 0.0000
218 E B -2.7405
219 E B -3.6729
220 I B -2.5177
221 M B -2.6130
222 R B -3.7897
223 E B -3.1500
224 F B 0.0000
225 N B -2.8224
226 S B -2.1290
227 Y B -1.8426
228 K B -2.1098
229 Q B -2.0833
230 R B -1.6179
231 V B 0.0000
232 K B -2.0740
233 Y B -1.4568
234 V B 0.0000
235 E B -1.7598
236 D B -2.3584
237 K B -1.9324
238 V B 0.0000
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114 C C 0.0000
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117 N C -0.4489
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119 M C -0.0801
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121 T C 0.0000
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127 S C 0.0000
128 K C -0.6406
129 Y C 0.7632
130 P C 0.4499
131 Y C 0.0000
132 H C 0.1727
133 F C 0.5082
134 F C 0.0000
135 A C 0.0748
136 T C 0.0000
137 S C -0.1051
138 T C -0.1163
139 G C -0.3097
140 D C -0.1033
141 V C 0.7540
142 V C 0.0000
143 D C 0.2397
144 I C 0.0000
145 S C 0.0000
146 P C 0.0000
147 F C 0.0000
148 Y C 0.0000
149 N C -1.4586
150 G C -0.9950
151 T C -1.3696
152 N C -1.8580
153 R C -2.6838
154 N C -2.1641
155 A C -1.1970
156 S C 0.0000
157 Y C -0.3848
158 F C -0.3836
159 G C 0.0000
160 E C -0.7357
161 N C -0.9744
162 A C -1.0814
163 D C -1.9051
164 K C -1.4838
165 F C -0.4864
166 F C 0.4234
167 I C 0.7023
168 F C 0.3262
169 P C -0.9845
170 N C -2.0851
171 Y C -1.0081
172 T C -0.7533
173 I C 0.0000
174 V C 0.0000
175 S C -1.0792
176 D C -1.6047
177 F C 0.0000
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179 R C -2.6239
180 P C -2.0310
181 N C -1.9354
182 S C -1.4980
183 A C -0.4485
184 L C 0.1095
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186 T C -1.4888
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188 R C -2.6415
189 L C -1.2444
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194 E C -1.1222
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275 K C -2.0304
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278 K C -0.7939
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281 G C -1.8229
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308 I C 0.0000
309 V C 0.0000
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311 G C -0.1746
312 I C 0.0000
313 T C -0.7502
314 A C -1.6343
315 D C -2.4996
316 S C -1.9546
317 V C -1.7830
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319 E C -2.4167
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354 L C -1.2716
355 K C -1.9803
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484 E C -3.2811
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486 K C -3.1798
487 E C -3.5132
488 K C -2.7925
489 A C 0.0000
490 K C -2.9557
491 K C -3.1666
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493 V C -2.6172
494 E C -3.7310
495 K C -3.1339
496 M C -2.6244
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498 G C -2.7057
499 G C -2.3986
500 S C -2.3352
501 H C -2.8337
502 H C -3.0725
503 H C -3.0337
504 H C -3.2146
505 H C -3.2197
506 H C -2.9327
507 H C -2.6298
508 H C -2.1649
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Laboratory of Theory of Biopolymers 2018