Project name: seed8

Chain sequence(s)	A: NASCEYSASHKQDLLLGSTGSISCPSLSCQSDAQSPAVTWYKNGKLLSVERSNRIVVDEVYDYHQGTYVCDYTQSDTVSSWTVRAVVQVRTIVGDTKDKTHTCPPCPAPEAAGGPSVFLFPPKPKDTLMISRTPEVTCVVVDVSHEDPEVKFNWYVDGVEVHNAKTKPREEQYNSTYRVVSVLTVLHQDWLNGKEYKCKVSNKALGAPIEKTISKAKGQPREPQVYTLPPSRDELTKNQVSLTCLVKGFYPSDIAVEWESNGQPENNYKTTPPVLDSDGSFFLYSKLTVDKSRWQQGNVFSCSVMHEALHNHYTQKSLSLSPGK; B: NASCEYSASHKQDLLLGSTGSISCPSLSCQSDAQSPAVTWYKNGKLLSVERSNRIVVDEVYDYHQGTYVCDYTQSDTVSSWTVRAVVQVRTIVGDTKDKTHTCPPCPAPEAAGGPSVFLFPPKPKDTLMISRTPEVTCVVVDVSHEDPEVKFNWYVDGVEVHNAKTKPREEQYNSTYRVVSVLTVLHQDWLNGKEYKCKVSNKALGAPIEKTISKAKGQPREPQVYTLPPSRDELTKNQVSLTCLVKGFYPSDIAVEWESNGQPENNYKTTPPVLDSDGSFFLYSKLTVDKSRWQQGNVFSCSVMHEALHNHYTQKSLSLSPGK
Selected Chain(s)	A,B
Distance of aggregation	10 Å
FoldX usage	Yes
Dynamic mode	No
Automated mutations	No

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                                          (00:13:19)
[INFO]       Main:     Simulation completed successfully.                                          (00:13:29)

• Minimal score value: -4.014
• Maximal score value: 1.8084
• Average score: -0.6804
• Total score value: -440.9237

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
1	N	A	-1.2388
2	A	A	-0.7642
3	S	A	-0.7015
4	C	A	-0.2977
5	E	A	-1.0259
6	Y	A	0.5069
7	S	A	-0.0597
8	A	A	-0.1072
9	S	A	-0.4082
10	H	A	-0.8700
11	K	A	-1.0391
12	Q	A	-1.0752
13	D	A	-0.7629
14	L	A	0.0000
15	L	A	1.1269
16	L	A	1.3097
17	G	A	0.2709
18	S	A	0.0699
19	T	A	-0.2145
20	G	A	0.0091
21	S	A	-0.1210
22	I	A	0.0000
23	S	A	-0.4352
24	C	A	0.0000
25	P	A	0.0000
26	S	A	-0.1437
27	L	A	0.0000
28	S	A	-0.1865
29	C	A	0.1455
30	Q	A	-0.7450
31	S	A	-1.0201
32	D	A	-1.5767
33	A	A	-1.3331
34	Q	A	-1.8091
35	S	A	0.0000
36	P	A	-0.8066
37	A	A	-0.4039
38	V	A	0.0000
39	T	A	0.0000
40	W	A	0.0000
41	Y	A	0.0000
42	K	A	-0.5778
43	N	A	-0.6593
44	G	A	0.0000
45	K	A	-0.4753
46	L	A	0.1403
47	L	A	0.2875
48	S	A	0.2348
49	V	A	0.2763
50	E	A	-0.2329
51	R	A	-1.0216
52	S	A	0.0000
53	N	A	0.0000
54	R	A	-0.7774
55	I	A	0.1176
56	V	A	0.2860
57	V	A	0.0000
58	D	A	-0.4245
59	E	A	0.0000
60	V	A	0.0000
61	Y	A	-0.0105
62	D	A	-0.3311
63	Y	A	-0.6116
64	H	A	-0.7719
65	Q	A	-1.4898
66	G	A	-0.9399
67	T	A	0.0000
68	Y	A	0.0000
69	V	A	0.0000
70	C	A	0.0000
71	D	A	0.0000
72	Y	A	0.0000
73	T	A	-0.1782
74	Q	A	-0.8327
75	S	A	-0.9952
76	D	A	-1.4782
77	T	A	-0.1801
78	V	A	1.0430
79	S	A	0.0233
80	S	A	-0.3143
81	W	A	0.0222
82	T	A	0.0597
83	V	A	0.1938
84	R	A	-0.0918
85	A	A	0.0000
86	V	A	0.0000
87	V	A	0.0000
88	Q	A	-0.8312
89	V	A	0.0000
90	R	A	-1.3659
91	T	A	0.0025
92	I	A	1.0839
93	V	A	1.8084
94	G	A	-0.0572
95	D	A	-2.2750
96	T	A	-2.5137
97	K	A	-3.7683
98	D	A	-4.0140
99	K	A	-3.5502
100	T	A	-2.0754
101	H	A	-1.9278
102	T	A	-1.2432
103	C	A	-0.0934
104	P	A	-0.0308
105	P	A	0.2881
106	C	A	0.7329
107	P	A	-0.4833
108	A	A	-0.7117
109	P	A	-1.1247
110	E	A	-2.2098
111	A	A	-1.3873
112	A	A	-1.0054
113	G	A	-1.3060
114	G	A	-0.8871
115	P	A	0.0000
116	S	A	-0.2471
117	V	A	0.0000
118	F	A	-0.1091
119	L	A	0.0000
120	F	A	0.0000
121	P	A	-0.1469
122	P	A	0.0000
123	K	A	0.0000
124	P	A	0.0000
125	K	A	-0.0953
126	D	A	0.0000
127	T	A	0.0000
128	L	A	0.0000
129	M	A	0.7374
130	I	A	1.7414
131	S	A	0.7103
132	R	A	0.3503
133	T	A	0.3908
134	P	A	0.0000
135	E	A	-0.2303
136	V	A	0.0000
137	T	A	0.0000
138	C	A	0.0000
139	V	A	0.0000
140	V	A	0.0000
141	V	A	0.0000
142	D	A	-1.0765
143	V	A	0.0000
144	S	A	-1.9242
145	H	A	-2.3625
146	E	A	-2.9062
147	D	A	-2.6038
148	P	A	-2.5753
149	E	A	-3.1089
150	V	A	-1.9598
151	K	A	-2.2384
152	F	A	-1.1316
153	N	A	-1.0766
154	W	A	0.0000
155	Y	A	-0.5934
156	V	A	-0.7895
157	D	A	-1.8785
158	G	A	-0.7494
159	V	A	0.6908
160	E	A	-0.5708
161	V	A	-0.5146
162	H	A	-1.8469
163	N	A	-2.1355
164	A	A	-1.7394
165	K	A	-2.2565
166	T	A	-1.8465
167	K	A	-2.0116
168	P	A	-2.0077
169	R	A	-2.7690
170	E	A	-2.4105
171	E	A	-2.7087
172	Q	A	0.0000
173	Y	A	-0.8527
174	N	A	-1.3631
175	S	A	-1.1117
176	T	A	-1.4756
177	Y	A	-1.7995
178	R	A	0.0000
179	V	A	0.0000
180	V	A	0.0000
181	S	A	0.0000
182	V	A	0.0000
183	L	A	0.0000
184	T	A	-0.3437
185	V	A	0.0000
186	L	A	0.9234
187	H	A	0.1358
188	Q	A	-1.1410
189	D	A	-1.4270
190	W	A	0.0000
191	L	A	-1.0482
192	N	A	-2.1479
193	G	A	-2.2357
194	K	A	-2.2492
195	E	A	-2.3176
196	Y	A	0.0000
197	K	A	-1.4761
198	C	A	0.0000
199	K	A	-1.2493
200	V	A	0.0000
201	S	A	-1.4449
202	N	A	0.0000
203	K	A	-2.6538
204	A	A	-1.5660
205	L	A	-0.7683
206	G	A	-0.7780
207	A	A	-0.4128
208	P	A	-0.8079
209	I	A	-0.4201
210	E	A	-1.4393
211	K	A	-1.0620
212	T	A	-1.1064
213	I	A	0.0000
214	S	A	0.0000
215	K	A	-1.3539
216	A	A	-1.3398
217	K	A	-2.4959
218	G	A	-2.1244
219	Q	A	-2.2430
220	P	A	-1.9902
221	R	A	-2.4707
222	E	A	-2.8440
223	P	A	0.0000
224	Q	A	-1.4112
225	V	A	0.0000
226	Y	A	0.0000
227	T	A	-0.8146
228	L	A	0.0000
229	P	A	-0.3928
230	P	A	-0.8612
231	S	A	0.0000
232	R	A	-2.6691
233	D	A	-2.7771
234	E	A	0.0000
235	L	A	-1.7410
236	T	A	-1.4668
237	K	A	-1.9271
238	N	A	-2.3127
239	Q	A	-2.0906
240	V	A	0.0000
241	S	A	0.0000
242	L	A	0.0000
243	T	A	0.0000
244	C	A	0.0000
245	L	A	0.0000
246	V	A	0.0000
247	K	A	-0.8136
248	G	A	-1.3667
249	F	A	0.0000
250	Y	A	0.0000
251	P	A	0.0000
252	S	A	-0.4773
253	D	A	-0.6309
254	I	A	0.0000
255	A	A	0.0000
256	V	A	0.0000
257	E	A	-0.6717
258	W	A	0.0000
259	E	A	-1.5219
260	S	A	0.0000
261	N	A	-1.8718
262	G	A	-1.7517
263	Q	A	-2.1401
264	P	A	-1.5977
265	E	A	0.0000
266	N	A	-1.5603
267	N	A	-1.3472
268	Y	A	0.0000
269	K	A	0.0000
270	T	A	0.0000
271	T	A	0.0000
272	P	A	0.0216
273	P	A	-0.1544
274	V	A	0.0000
275	L	A	-0.2796
276	D	A	-0.9864
277	S	A	-1.4025
278	D	A	-2.0592
279	G	A	-1.1256
280	S	A	0.0000
281	F	A	0.0000
282	F	A	0.0000
283	L	A	0.0000
284	Y	A	0.0000
285	S	A	0.0000
286	K	A	0.0000
287	L	A	0.0000
288	T	A	-0.7521
289	V	A	0.0000
290	D	A	-2.3866
291	K	A	-2.4343
292	S	A	-2.1676
293	R	A	-1.9543
294	W	A	0.0000
295	Q	A	-2.3387
296	Q	A	-2.1231
297	G	A	-1.2623
298	N	A	-0.8937
299	V	A	-0.0050
300	F	A	0.0000
301	S	A	0.0000
302	C	A	0.0000
303	S	A	0.0000
304	V	A	0.0000
305	M	A	0.0000
306	H	A	0.0000
307	E	A	-1.1825
308	A	A	-1.6996
309	L	A	0.0000
310	H	A	-1.8383
311	N	A	-1.5189
312	H	A	-1.0099
313	Y	A	-0.5496
314	T	A	-0.8287
315	Q	A	-1.1717
316	K	A	-1.1890
317	S	A	-0.6165
318	L	A	0.0000
319	S	A	-0.2189
320	L	A	-0.3592
321	S	A	-0.6334
322	P	A	-1.1077
323	G	A	-1.4149
324	K	A	-2.0331
1	N	B	-1.1962
2	A	B	-0.6475
3	S	B	-0.5311
4	C	B	0.0269
5	E	B	-0.8595
6	Y	B	0.6112
7	S	B	0.0309
8	A	B	-0.1039
9	S	B	-0.5178
10	H	B	-0.9929
11	K	B	-1.1861
12	Q	B	-1.1429
13	D	B	-0.8611
14	L	B	0.0000
15	L	B	0.8089
16	L	B	1.0844
17	G	B	-0.0457
18	S	B	-0.1503
19	T	B	-0.3632
20	G	B	-0.0447
21	S	B	-0.0705
22	I	B	0.0000
23	S	B	-0.3871
24	C	B	0.0000
25	P	B	0.0000
26	S	B	0.0706
27	L	B	0.0000
28	S	B	-0.0451
29	C	B	0.4122
30	Q	B	-0.6265
31	S	B	-0.8938
32	D	B	-1.4553
33	A	B	-1.3324
34	Q	B	-1.8449
35	S	B	0.0000
36	P	B	-0.9098
37	A	B	-0.4828
38	V	B	0.0000
39	T	B	0.0000
40	W	B	0.0000
41	Y	B	0.0000
42	K	B	-0.5644
43	N	B	-0.6337
44	G	B	0.0000
45	K	B	-0.5492
46	L	B	0.1182
47	L	B	0.3057
48	S	B	0.2949
49	V	B	0.3857
50	E	B	-0.3565
51	R	B	-1.0771
52	S	B	0.0000
53	N	B	0.0000
54	R	B	-0.5886
55	I	B	0.2162
56	V	B	0.3708
57	V	B	0.0000
58	D	B	-0.5983
59	E	B	0.0000
60	V	B	0.0000
61	Y	B	-0.0863
62	D	B	-0.4315
63	Y	B	-0.5710
64	H	B	-0.7415
65	Q	B	-1.4430
66	G	B	-0.8961
67	T	B	0.0000
68	Y	B	0.0000
69	V	B	0.0000
70	C	B	0.0000
71	D	B	0.0000
72	Y	B	0.0000
73	T	B	-0.1903
74	Q	B	-0.9501
75	S	B	-1.0529
76	D	B	-1.4957
77	T	B	-0.1796
78	V	B	1.0463
79	S	B	0.0240
80	S	B	-0.3252
81	W	B	0.0108
82	T	B	0.1250
83	V	B	0.2918
84	R	B	0.0000
85	A	B	0.0000
86	V	B	0.0000
87	V	B	0.0000
88	Q	B	-0.8781
89	V	B	0.0000
90	R	B	-1.3750
91	T	B	-0.0809
92	I	B	0.9755
93	V	B	1.6412
94	G	B	-0.1603
95	D	B	-2.3820
96	T	B	-2.5540
97	K	B	-3.6531
98	D	B	-3.9970
99	K	B	-3.5329
100	T	B	-2.0662
101	H	B	-1.7108
102	T	B	-1.0020
103	C	B	0.1230
104	P	B	-0.0288
105	P	B	0.1047
106	C	B	0.5220
107	P	B	-0.4997
108	A	B	-0.7160
109	P	B	-1.2716
110	E	B	-2.1566
111	A	B	-1.3729
112	A	B	-1.0613
113	G	B	-1.3332
114	G	B	-0.8691
115	P	B	0.0000
116	S	B	-0.2301
117	V	B	0.0000
118	F	B	-0.1531
119	L	B	0.0000
120	F	B	0.0000
121	P	B	-0.1175
122	P	B	0.0000
123	K	B	0.0000
124	P	B	-0.3830
125	K	B	-0.1477
126	D	B	0.0000
127	T	B	0.0000
128	L	B	0.0000
129	M	B	0.7697
130	I	B	1.8052
131	S	B	0.8059
132	R	B	0.0000
133	T	B	0.5196
134	P	B	0.0000
135	E	B	-0.0459
136	V	B	0.0000
137	T	B	0.0000
138	C	B	0.0000
139	V	B	0.0000
140	V	B	0.0000
141	V	B	0.0000
142	D	B	-1.0296
143	V	B	0.0000
144	S	B	-1.8918
145	H	B	-2.3596
146	E	B	-2.8866
147	D	B	-2.5602
148	P	B	-2.5024
149	E	B	-3.0582
150	V	B	-1.9165
151	K	B	-2.2334
152	F	B	-1.1841
153	N	B	-1.1261
154	W	B	0.0000
155	Y	B	-0.4940
156	V	B	-0.5846
157	D	B	-1.5920
158	G	B	-0.6170
159	V	B	0.7673
160	E	B	-0.5516
161	V	B	-0.5112
162	H	B	-1.8721
163	N	B	-2.1776
164	A	B	-1.8144
165	K	B	-2.4402
166	T	B	-1.9065
167	K	B	-1.9936
168	P	B	-1.8685
169	R	B	-2.4328
170	E	B	-2.1776
171	E	B	-2.6159
172	Q	B	0.0000
173	Y	B	-0.8950
174	N	B	-1.3280
175	S	B	-1.0884
176	T	B	-1.4436
177	Y	B	-1.7026
178	R	B	0.0000
179	V	B	0.0000
180	V	B	0.0000
181	S	B	0.0000
182	V	B	0.0000
183	L	B	0.0000
184	T	B	-0.3023
185	V	B	0.0000
186	L	B	1.0171
187	H	B	0.2089
188	Q	B	-1.1002
189	D	B	-1.2623
190	W	B	0.0000
191	L	B	-1.0125
192	N	B	-1.9534
193	G	B	-1.8401
194	K	B	-1.8677
195	E	B	-1.7595
196	Y	B	0.0000
197	K	B	-1.4540
198	C	B	0.0000
199	K	B	-1.3903
200	V	B	0.0000
201	S	B	-1.4853
202	N	B	0.0000
203	K	B	-2.6376
204	A	B	-1.5438
205	L	B	-0.7808
206	G	B	-0.9717
207	A	B	-0.4883
208	P	B	-0.8217
209	I	B	-0.4986
210	E	B	-1.7611
211	K	B	-1.2083
212	T	B	-1.0408
213	I	B	0.0000
214	S	B	0.0000
215	K	B	0.0000
216	A	B	0.0000
217	K	B	-1.7603
218	G	B	-1.7079
219	Q	B	-2.0024
220	P	B	-1.7082
221	R	B	-2.0719
222	E	B	-2.6264
223	P	B	0.0000
224	Q	B	-1.2326
225	V	B	0.0000
226	Y	B	0.0000
227	T	B	-0.8534
228	L	B	0.0000
229	P	B	-0.3773
230	P	B	-0.8421
231	S	B	0.0000
232	R	B	-2.6367
233	D	B	-2.7898
234	E	B	0.0000
235	L	B	-1.7231
236	T	B	-1.5251
237	K	B	-2.0825
238	N	B	-2.3610
239	Q	B	-2.1488
240	V	B	0.0000
241	S	B	0.0000
242	L	B	0.0000
243	T	B	0.0000
244	C	B	0.0000
245	L	B	0.0000
246	V	B	0.0000
247	K	B	-0.7097
248	G	B	-1.1945
249	F	B	0.0000
250	Y	B	-1.2530
251	P	B	0.0000
252	S	B	-0.4326
253	D	B	-0.6977
254	I	B	0.0000
255	A	B	0.0000
256	V	B	0.0000
257	E	B	-0.7174
258	W	B	0.0000
259	E	B	-1.7341
260	S	B	0.0000
261	N	B	-1.8930
262	G	B	-1.7773
263	Q	B	-2.2261
264	P	B	-1.7150
265	E	B	0.0000
266	N	B	-2.0452
267	N	B	-1.4634
268	Y	B	0.0000
269	K	B	0.0000
270	T	B	0.0000
271	T	B	0.0000
272	P	B	0.0209
273	P	B	-0.2056
274	V	B	0.0000
275	L	B	-0.2499
276	D	B	-0.9554
277	S	B	-1.4817
278	D	B	-2.0287
279	G	B	-1.0663
280	S	B	0.0000
281	F	B	0.0000
282	F	B	0.0000
283	L	B	0.0000
284	Y	B	0.0000
285	S	B	0.0000
286	K	B	0.0000
287	L	B	0.0000
288	T	B	-0.7484
289	V	B	0.0000
290	D	B	-2.2102
291	K	B	-2.3759
292	S	B	-2.1528
293	R	B	-2.0189
294	W	B	0.0000
295	Q	B	-2.3045
296	Q	B	-2.1507
297	G	B	-1.2518
298	N	B	-0.9023
299	V	B	-0.0420
300	F	B	0.0000
301	S	B	0.0000
302	C	B	0.0000
303	S	B	0.0000
304	V	B	0.0000
305	M	B	0.0000
306	H	B	0.0000
307	E	B	-1.2068
308	A	B	-1.6039
309	L	B	0.0000
310	H	B	-1.8266
311	N	B	-1.5041
312	H	B	-1.0004
313	Y	B	-0.5752
314	T	B	-0.9824
315	Q	B	-1.5755
316	K	B	-1.3833
317	S	B	-0.7290
318	L	B	0.0000
319	S	B	-0.1985
320	L	B	-0.2987
321	S	B	-0.5956
322	P	B	-1.0798
323	G	B	-1.4032
324	K	B	-2.0323