Project name: 7_i14e7_i20e6_x11e6_x4e7

Chain sequence(s)	A: AAYRAHYNIVTFAAYTLQDIVLHLAAYLLMGTLGIVAAYLPARRAEPQAAYVYDFAFRDLAAYRFHNIAGHYAAYCYSLYGTTLAAYKTVLELTEVAAYAEKLRHLNEKRRFHNGPGPGLDKKQRFHNIRGRWTGPGPGNPAEKLRHLNEKRRFGPGPGSKISEYRHYCYSLYGGPGPGLLCHEQLSDSEEENDGPGPGQSTHVDIRTLEDLLMGPGPGTPTLHEYMLDLQPETGPGPGLQDIVLHLEPQNEIPGPGPG
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                                          (00:03:39)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:41)

• Minimal score value: -4.6142
• Maximal score value: 3.5187
• Average score: -0.3638
• Total score value: -94.2142

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	-0.2615
2	A	A	-0.1105
3	Y	A	0.2975
4	R	A	-1.0931
5	A	A	-0.4320
6	H	A	-0.0094
7	Y	A	0.9054
8	N	A	-0.0325
9	I	A	1.6926
10	V	A	2.1560
11	T	A	1.7386
12	F	A	1.9221
13	A	A	1.6926
14	A	A	1.4038
15	Y	A	1.7970
16	T	A	1.3234
17	L	A	1.7224
18	Q	A	0.4477
19	D	A	-0.0505
20	I	A	1.4057
21	V	A	2.3049
22	L	A	2.0024
23	H	A	1.3535
24	L	A	2.3034
25	A	A	2.4688
26	A	A	2.5410
27	Y	A	3.2551
28	L	A	3.5187
29	L	A	3.5041
30	M	A	3.2497
31	G	A	2.3610
32	T	A	2.4561
33	L	A	3.1245
34	G	A	2.0198
35	I	A	2.0408
36	V	A	2.5562
37	A	A	1.8145
38	A	A	1.1717
39	Y	A	1.2839
40	L	A	1.3505
41	P	A	-0.0989
42	A	A	-1.0688
43	R	A	-2.5338
44	R	A	-2.8872
45	A	A	-2.4204
46	E	A	-2.8656
47	P	A	-1.7080
48	Q	A	-0.8930
49	A	A	0.1390
50	A	A	0.8971
51	Y	A	2.3458
52	V	A	3.3226
53	Y	A	2.7105
54	D	A	0.0000
55	F	A	2.7149
56	A	A	1.6055
57	F	A	1.2260
58	R	A	-0.5495
59	D	A	-0.8864
60	L	A	0.4620
61	A	A	0.0328
62	A	A	-0.3061
63	Y	A	0.2407
64	R	A	-0.9984
65	F	A	0.0446
66	H	A	-0.6179
67	N	A	-0.6630
68	I	A	0.9319
69	A	A	0.5415
70	G	A	-0.3149
71	H	A	-0.0783
72	Y	A	0.7692
73	A	A	1.0021
74	A	A	1.0714
75	Y	A	1.7727
76	C	A	1.6015
77	Y	A	1.8101
78	S	A	1.3547
79	L	A	1.9599
80	Y	A	1.6028
81	G	A	0.7521
82	T	A	0.9314
83	T	A	0.7642
84	L	A	1.4677
85	A	A	0.7547
86	A	A	0.5812
87	Y	A	1.0534
88	K	A	-0.1557
89	T	A	0.0804
90	V	A	0.9349
91	L	A	0.1920
92	E	A	-0.8551
93	L	A	1.2654
94	T	A	0.2897
95	E	A	-0.6879
96	V	A	1.1225
97	A	A	0.2494
98	A	A	-0.6285
99	Y	A	0.0641
100	A	A	-0.9745
101	E	A	-2.8799
102	K	A	-2.7252
103	L	A	-2.1357
104	R	A	-3.9714
105	H	A	-3.9147
106	L	A	-3.1344
107	N	A	-4.0094
108	E	A	-4.6142
109	K	A	-4.0263
110	R	A	-4.5428
111	R	A	-3.9770
112	F	A	-1.6011
113	H	A	-2.7430
114	N	A	-2.9530
115	G	A	-1.6586
116	P	A	-1.2041
117	G	A	-1.0314
118	P	A	-0.6627
119	G	A	-0.7616
120	L	A	-0.5047
121	D	A	-2.6894
122	K	A	-3.5671
123	K	A	-3.6758
124	Q	A	-3.1384
125	R	A	-2.4479
126	F	A	-0.0141
127	H	A	-0.8799
128	N	A	-0.9938
129	I	A	0.1287
130	R	A	-1.8114
131	G	A	-1.5486
132	R	A	-1.7294
133	W	A	-0.1500
134	T	A	-0.2012
135	G	A	-0.3595
136	P	A	-0.5790
137	G	A	-1.0509
138	P	A	-1.1471
139	G	A	-1.9188
140	N	A	-2.4521
141	P	A	-1.9160
142	A	A	-1.9834
143	E	A	-3.3318
144	K	A	-2.9467
145	L	A	-1.2527
146	R	A	-3.3764
147	H	A	-3.4185
148	L	A	-2.4674
149	N	A	-3.4575
150	E	A	-4.1587
151	K	A	-4.0689
152	R	A	-3.9485
153	R	A	-3.1408
154	F	A	-0.5472
155	G	A	-1.0528
156	P	A	-1.0975
157	G	A	-1.4403
158	P	A	-0.9590
159	G	A	-1.0286
160	S	A	-1.1584
161	K	A	-1.6177
162	I	A	0.2665
163	S	A	-0.9210
164	E	A	-1.7155
165	Y	A	0.2927
166	R	A	-0.8119
167	H	A	-0.3964
168	Y	A	1.2436
169	C	A	1.3566
170	Y	A	1.9558
171	S	A	1.3522
172	L	A	2.4582
173	Y	A	2.1764
174	G	A	0.4854
175	G	A	-0.3829
176	P	A	-0.8277
177	G	A	-0.8341
178	P	A	-0.5074
179	G	A	0.5168
180	L	A	2.0380
181	L	A	2.1022
182	C	A	0.7780
183	H	A	-1.1078
184	E	A	-2.1859
185	Q	A	-1.7391
186	L	A	-0.1694
187	S	A	-1.0724
188	D	A	-2.3506
189	S	A	-2.3184
190	E	A	-3.6484
191	E	A	-4.2735
192	E	A	-4.1084
193	N	A	-3.5577
194	D	A	-3.3523
195	G	A	-1.9009
196	P	A	-1.2153
197	G	A	-1.2283
198	P	A	-1.0852
199	G	A	-1.3837
200	Q	A	-1.7737
201	S	A	-1.0277
202	T	A	-0.7575
203	H	A	-0.6022
204	V	A	0.6864
205	D	A	-0.7445
206	I	A	0.7798
207	R	A	-1.2812
208	T	A	-0.7576
209	L	A	0.5508
210	E	A	-1.2777
211	D	A	-1.0566
212	L	A	1.4356
213	L	A	1.9303
214	M	A	1.2921
215	G	A	0.4444
216	P	A	-0.4241
217	G	A	-0.7895
218	P	A	-0.7820
219	G	A	-0.8152
220	T	A	-0.5105
221	P	A	-0.1346
222	T	A	0.3619
223	L	A	0.6064
224	H	A	-0.8958
225	E	A	-1.1205
226	Y	A	1.0520
227	M	A	1.7661
228	L	A	1.8749
229	D	A	-0.3080
230	L	A	0.3126
231	Q	A	-1.3814
232	P	A	-1.4333
233	E	A	-2.1666
234	T	A	-1.2963
235	G	A	-1.1719
236	P	A	-0.7747
237	G	A	-0.7525
238	P	A	-0.5883
239	G	A	-0.4455
240	L	A	0.4241
241	Q	A	-0.7519
242	D	A	-0.4067
243	I	A	2.1855
244	V	A	2.7942
245	L	A	2.4635
246	H	A	0.7244
247	L	A	0.6003
248	E	A	-1.7126
249	P	A	-1.9858
250	Q	A	-2.4829
251	N	A	-2.5512
252	E	A	-1.9361
253	I	A	0.4086
254	P	A	-0.2366
255	G	A	-0.5516
256	P	A	-0.6602
257	G	A	-0.9675
258	P	A	-0.8159
259	G	A	-0.7286