Project name: 5_i20e6_x4e7_i14e7_x11e6

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

Simulation log

[INFO]       Logger:   Verbosity set to: 2 - [INFO]                                                (00:00:00)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:00)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with A chain(s) selected             (00:00:00)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:00)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:00)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:03:55)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:57)

• Minimal score value: -4.6943
• Maximal score value: 3.8495
• Average score: -0.3662
• Total score value: -95.2224

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	A	A	1.1443
2	A	A	1.4069
3	Y	A	2.5490
4	V	A	3.0572
5	Y	A	2.2721
6	D	A	0.5234
7	F	A	1.4023
8	A	A	1.1514
9	F	A	1.4283
10	R	A	-1.2197
11	D	A	-1.3270
12	L	A	-0.1312
13	A	A	-0.3617
14	A	A	-0.3820
15	Y	A	0.1729
16	R	A	-1.0464
17	F	A	0.2466
18	H	A	-0.4229
19	N	A	-0.3864
20	I	A	1.1728
21	A	A	0.6017
22	G	A	-0.3101
23	H	A	0.1798
24	Y	A	1.1665
25	A	A	1.2573
26	A	A	1.3218
27	Y	A	2.1536
28	C	A	2.1034
29	Y	A	2.5426
30	S	A	1.8050
31	L	A	2.3767
32	Y	A	2.1966
33	G	A	0.9616
34	T	A	0.9317
35	T	A	1.0095
36	L	A	1.5039
37	A	A	0.6267
38	A	A	0.6428
39	Y	A	0.7960
40	K	A	-0.4336
41	T	A	-0.3198
42	V	A	0.2929
43	L	A	-0.2211
44	E	A	-1.1655
45	L	A	0.9446
46	T	A	0.2387
47	E	A	-0.3736
48	V	A	1.8996
49	A	A	1.5669
50	A	A	1.4830
51	Y	A	2.0893
52	L	A	1.8189
53	L	A	1.7220
54	C	A	1.2231
55	H	A	-0.5282
56	E	A	-1.7674
57	Q	A	-1.8190
58	L	A	-0.5922
59	S	A	-2.3690
60	D	A	-3.6935
61	S	A	-2.9193
62	E	A	-3.9734
63	E	A	-4.6943
64	E	A	-4.6015
65	N	A	-4.0146
66	D	A	-3.4505
67	G	A	-2.1429
68	P	A	-1.3470
69	G	A	-1.2796
70	P	A	-1.1041
71	G	A	-1.3899
72	Q	A	-1.8073
73	S	A	-1.0695
74	T	A	-0.6469
75	H	A	-0.3764
76	V	A	1.2355
77	D	A	0.0551
78	I	A	0.8038
79	R	A	-1.3910
80	T	A	-0.2408
81	L	A	0.8764
82	E	A	-1.1760
83	D	A	-1.1352
84	L	A	1.2427
85	L	A	1.7152
86	M	A	1.0228
87	G	A	0.0445
88	P	A	-0.4673
89	G	A	-0.8399
90	P	A	-0.8198
91	G	A	-0.8374
92	T	A	-0.7081
93	P	A	-0.3126
94	T	A	0.0976
95	L	A	1.4713
96	H	A	-0.2879
97	E	A	-0.5605
98	Y	A	1.0404
99	M	A	1.0441
100	L	A	0.7555
101	D	A	-0.9698
102	L	A	0.2760
103	Q	A	-1.0112
104	P	A	-1.5688
105	E	A	-2.5621
106	T	A	-1.5925
107	G	A	-1.3827
108	P	A	-1.0714
109	G	A	-0.9465
110	P	A	-0.6954
111	G	A	-0.2216
112	L	A	1.2978
113	Q	A	0.0199
114	D	A	-0.2436
115	I	A	2.4533
116	V	A	2.7354
117	L	A	2.0249
118	H	A	0.6016
119	L	A	1.0649
120	E	A	-1.4922
121	P	A	-1.9652
122	Q	A	-2.3877
123	N	A	-2.4813
124	E	A	-1.9038
125	I	A	0.3505
126	P	A	-0.3046
127	G	A	-0.5808
128	P	A	-0.5333
129	G	A	-0.7188
130	P	A	-0.7578
131	G	A	-0.6407
132	Y	A	-0.1691
133	R	A	-1.4520
134	A	A	-0.7734
135	H	A	-0.7395
136	Y	A	1.1423
137	N	A	1.0620
138	I	A	3.1405
139	V	A	3.2828
140	T	A	2.6854
141	F	A	3.7210
142	A	A	2.4398
143	A	A	2.1785
144	Y	A	2.1859
145	T	A	1.8468
146	L	A	2.2369
147	Q	A	0.7317
148	D	A	0.3073
149	I	A	2.4220
150	V	A	3.0278
151	L	A	2.5567
152	H	A	2.0737
153	L	A	3.2973
154	A	A	2.9176
155	A	A	2.8178
156	Y	A	3.5330
157	L	A	3.6219
158	L	A	3.5959
159	M	A	3.2122
160	G	A	2.5242
161	T	A	2.9337
162	L	A	3.6716
163	G	A	2.5825
164	I	A	3.8191
165	V	A	3.8495
166	A	A	2.4246
167	A	A	2.0658
168	Y	A	2.1949
169	L	A	1.0288
170	P	A	-0.6221
171	A	A	-1.2158
172	R	A	-2.8875
173	R	A	-3.2630
174	A	A	-2.6577
175	E	A	-3.1780
176	P	A	-2.2751
177	Q	A	-2.3954
178	A	A	-1.6095
179	A	A	-1.3494
180	Y	A	-0.7717
181	A	A	-1.4705
182	E	A	-3.1147
183	K	A	-3.0349
184	L	A	-2.1554
185	R	A	-4.0365
186	H	A	-4.1310
187	L	A	-3.3542
188	N	A	-4.0544
189	E	A	-4.5283
190	K	A	-4.2523
191	R	A	-4.5660
192	R	A	-3.8813
193	F	A	-1.5755
194	H	A	-2.7323
195	N	A	-2.6733
196	G	A	-1.4939
197	P	A	-0.9059
198	G	A	-1.1348
199	P	A	-0.7829
200	G	A	-0.9365
201	L	A	-1.3924
202	D	A	-2.3969
203	K	A	-3.1413
204	K	A	-3.2132
205	Q	A	-2.6510
206	R	A	-1.9129
207	F	A	-0.8281
208	H	A	-2.2304
209	N	A	-1.7346
210	I	A	0.0132
211	R	A	-1.9170
212	G	A	-1.8665
213	R	A	-2.1060
214	W	A	-0.9204
215	T	A	-1.0723
216	G	A	-1.4125
217	P	A	-0.8850
218	G	A	-1.1092
219	P	A	-1.1073
220	G	A	-1.8419
221	N	A	-2.2773
222	P	A	-1.8408
223	A	A	-1.8338
224	E	A	-3.4900
225	K	A	-3.0128
226	L	A	-2.1475
227	R	A	-4.0419
228	H	A	-4.1416
229	L	A	-3.3274
230	N	A	-4.1493
231	E	A	-4.6522
232	K	A	-4.2548
233	R	A	-4.3125
234	R	A	-3.3984
235	F	A	-0.9124
236	G	A	-1.4560
237	P	A	-1.2015
238	G	A	-0.8072
239	P	A	-1.0751
240	G	A	-1.0753
241	S	A	-1.1879
242	K	A	-1.4762
243	I	A	0.4044
244	S	A	-0.8713
245	E	A	-1.7030
246	Y	A	0.1668
247	R	A	-1.0202
248	H	A	-0.7670
249	Y	A	0.5479
250	C	A	0.9354
251	Y	A	1.4821
252	S	A	0.8004
253	L	A	1.6156
254	Y	A	1.7938
255	G	A	0.3539
256	G	A	-0.4039
257	P	A	-0.8371
258	G	A	-1.0351
259	P	A	-0.8197
260	G	A	-0.7423