Project name: 8_i14e7_i20e6_x4e7_x11e6

Chain sequence(s)	A: AAYRAHYNIVTFAAYTLQDIVLHLAAYLLMGTLGIVAAYLPARRAEPQAAYVYDFAFRDLAAYRFHNIAGHYAAYCYSLYGTTLAAYKTVLELTEVAAYLLCHEQLSDSEEENDGPGPGQSTHVDIRTLEDLLMGPGPGTPTLHEYMLDLQPETGPGPGLQDIVLHLEPQNEIPGPGPGAEKLRHLNEKRRFHNGPGPGLDKKQRFHNIRGRWTGPGPGNPAEKLRHLNEKRRFGPGPGSKISEYRHYCYSLYGGPGPG
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                                          (00:02:40)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:41)

• Minimal score value: -4.5217
• Maximal score value: 3.3865
• Average score: -0.3289
• Total score value: -85.1814

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	-0.2425
2	A	A	0.0391
3	Y	A	0.2979
4	R	A	-0.8220
5	A	A	-0.0275
6	H	A	0.5709
7	Y	A	1.5944
8	N	A	1.2248
9	I	A	2.8936
10	V	A	3.1719
11	T	A	2.6281
12	F	A	3.3865
13	A	A	2.2737
14	A	A	1.7542
15	Y	A	1.8450
16	T	A	1.1398
17	L	A	0.9377
18	Q	A	0.1499
19	D	A	-0.1848
20	I	A	1.6537
21	V	A	1.4940
22	L	A	1.4497
23	H	A	0.7364
24	L	A	1.5693
25	A	A	1.6608
26	A	A	1.7741
27	Y	A	2.3281
28	L	A	2.0042
29	L	A	2.2325
30	M	A	2.5910
31	G	A	1.7362
32	T	A	1.7874
33	L	A	2.7460
34	G	A	1.5929
35	I	A	2.2157
36	V	A	2.0688
37	A	A	1.4586
38	A	A	1.3001
39	Y	A	1.0709
40	L	A	0.3704
41	P	A	-0.6802
42	A	A	-1.1039
43	R	A	-2.1263
44	R	A	-2.6116
45	A	A	-1.8434
46	E	A	-2.0887
47	P	A	-1.4737
48	Q	A	-0.8490
49	A	A	-0.1329
50	A	A	0.0000
51	Y	A	1.8311
52	V	A	2.7442
53	Y	A	1.3029
54	D	A	0.9925
55	F	A	1.7966
56	A	A	0.6922
57	F	A	0.3333
58	R	A	-1.6051
59	D	A	-1.6099
60	L	A	-0.4626
61	A	A	-0.7116
62	A	A	-0.5693
63	Y	A	-0.1799
64	R	A	-1.3488
65	F	A	-0.1424
66	H	A	-0.8214
67	N	A	-0.9536
68	I	A	-0.0712
69	A	A	0.0794
70	G	A	-0.7155
71	H	A	-0.4411
72	Y	A	0.4712
73	A	A	0.8725
74	A	A	0.9327
75	Y	A	1.7059
76	C	A	0.0000
77	Y	A	1.7358
78	S	A	1.3325
79	L	A	1.9075
80	Y	A	1.7597
81	G	A	0.6800
82	T	A	0.7768
83	T	A	1.1138
84	L	A	1.6406
85	A	A	0.9054
86	A	A	0.0000
87	Y	A	1.3247
88	K	A	-0.3878
89	T	A	-0.4071
90	V	A	0.1629
91	L	A	-0.2316
92	E	A	-1.4405
93	L	A	0.1997
94	T	A	-0.1826
95	E	A	-0.6201
96	V	A	1.5110
97	A	A	1.3900
98	A	A	1.3067
99	Y	A	1.8653
100	L	A	1.5728
101	L	A	1.4687
102	C	A	1.1088
103	H	A	-0.5824
104	E	A	-1.8134
105	Q	A	-1.6782
106	L	A	-0.6630
107	S	A	-2.2963
108	D	A	-3.3697
109	S	A	-2.9294
110	E	A	-3.8283
111	E	A	-4.5217
112	E	A	-4.3297
113	N	A	-3.9498
114	D	A	-3.3852
115	G	A	-2.1189
116	P	A	-1.3210
117	G	A	-1.3818
118	P	A	-1.0902
119	G	A	-1.3814
120	Q	A	-1.8056
121	S	A	-1.0505
122	T	A	-0.6926
123	H	A	-0.4630
124	V	A	0.9618
125	D	A	-0.1392
126	I	A	0.6214
127	R	A	-1.5398
128	T	A	-0.5699
129	L	A	0.1965
130	E	A	-1.2911
131	D	A	-1.0985
132	L	A	1.1160
133	L	A	1.5877
134	M	A	0.9756
135	G	A	0.0739
136	P	A	-0.3760
137	G	A	-0.6135
138	P	A	-0.8854
139	G	A	-0.8620
140	T	A	-0.3522
141	P	A	-0.1760
142	T	A	-0.0165
143	L	A	0.6740
144	H	A	-0.7739
145	E	A	-0.7637
146	Y	A	1.0759
147	M	A	1.5330
148	L	A	1.5335
149	D	A	-0.1843
150	L	A	0.3267
151	Q	A	-1.2915
152	P	A	-1.6427
153	E	A	-2.1984
154	T	A	-1.4951
155	G	A	-1.2058
156	P	A	-0.8410
157	G	A	-0.7681
158	P	A	-0.6249
159	G	A	-0.4916
160	L	A	0.4056
161	Q	A	-0.7311
162	D	A	-0.3579
163	I	A	2.1875
164	V	A	2.7684
165	L	A	2.4619
166	H	A	0.7148
167	L	A	0.6095
168	E	A	-1.7132
169	P	A	-1.9552
170	Q	A	-2.6702
171	N	A	-2.6055
172	E	A	-1.8616
173	I	A	0.5981
174	P	A	0.1474
175	G	A	-0.4016
176	P	A	-0.6420
177	G	A	-0.9074
178	P	A	-0.9801
179	G	A	-1.3007
180	A	A	-1.3913
181	E	A	-2.5454
182	K	A	-2.4671
183	L	A	-0.7357
184	R	A	-1.9661
185	H	A	-1.5066
186	L	A	-0.5061
187	N	A	-2.5447
188	E	A	-3.7245
189	K	A	-3.8536
190	R	A	-3.8242
191	R	A	-2.8046
192	F	A	-0.5622
193	H	A	-1.4156
194	N	A	-1.7071
195	G	A	-1.2953
196	P	A	-1.0412
197	G	A	-0.9000
198	P	A	-0.4641
199	G	A	-0.2664
200	L	A	0.0209
201	D	A	-2.3064
202	K	A	-3.5836
203	K	A	-3.7704
204	Q	A	-2.9932
205	R	A	-2.4884
206	F	A	0.0454
207	H	A	-0.9521
208	N	A	-1.0762
209	I	A	-0.0264
210	R	A	-1.8675
211	G	A	-1.5322
212	R	A	-1.6569
213	W	A	-0.1902
214	T	A	-0.4331
215	G	A	-0.6543
216	P	A	-0.7074
217	G	A	-0.9376
218	P	A	-1.0155
219	G	A	-1.4060
220	N	A	-1.6666
221	P	A	-1.3450
222	A	A	-1.5096
223	E	A	-2.4639
224	K	A	-2.3513
225	L	A	-0.6457
226	R	A	-1.9416
227	H	A	-1.4985
228	L	A	-0.4517
229	N	A	-2.4678
230	E	A	-3.7136
231	K	A	-3.8324
232	R	A	-3.7658
233	R	A	-2.5640
234	F	A	-0.0396
235	G	A	-0.4084
236	P	A	-0.5165
237	G	A	-0.6475
238	P	A	-0.8075
239	G	A	-0.9842
240	S	A	-0.9593
241	K	A	-1.1654
242	I	A	0.6803
243	S	A	-0.2369
244	E	A	-1.3543
245	Y	A	-0.3641
246	R	A	-1.7969
247	H	A	-0.6335
248	Y	A	1.2268
249	C	A	1.8905
250	Y	A	2.3078
251	S	A	1.6200
252	L	A	2.3315
253	Y	A	1.8257
254	G	A	0.2022
255	G	A	-0.4644
256	P	A	-0.9167
257	G	A	-0.9835
258	P	A	-0.7658
259	G	A	-0.7177