Project name: 11_i14e7_x4e7_i20e6_x11e6

Chain sequence(s)	A: AAYRAHYNIVTFAAYTLQDIVLHLAAYLLMGTLGIVAAYLPARRAEPQAAYLLCHEQLSDSEEENDGPGPGQSTHVDIRTLEDLLMGPGPGTPTLHEYMLDLQPETGPGPGLQDIVLHLEPQNEIPGPGPGVYDFAFRDLAAYRFHNIAGHYAAYCYSLYGTTLAAYKTVLELTEVAAYAEKLRHLNEKRRFHNGPGPGLDKKQRFHNIRGRWTGPGPGNPAEKLRHLNEKRRFGPGPGSKISEYRHYCYSLYGGPGPG
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                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:05:07)
[INFO]       Main:     Simulation completed successfully.                                          (00:05:10)

• Minimal score value: -4.366
• Maximal score value: 3.7589
• Average score: -0.33
• Total score value: -85.4802

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	-0.2406
2	A	A	0.0171
3	Y	A	0.2053
4	R	A	-1.0730
5	A	A	-0.1182
6	H	A	0.4781
7	Y	A	1.4953
8	N	A	1.0331
9	I	A	2.8332
10	V	A	3.2959
11	T	A	2.7113
12	F	A	3.5287
13	A	A	2.7525
14	A	A	1.9364
15	Y	A	2.2565
16	T	A	1.7410
17	L	A	2.3811
18	Q	A	1.0220
19	D	A	0.4411
20	I	A	2.5501
21	V	A	2.9683
22	L	A	2.5134
23	H	A	1.7430
24	L	A	3.2144
25	A	A	2.8096
26	A	A	2.7307
27	Y	A	3.4623
28	L	A	3.4956
29	L	A	3.3183
30	M	A	3.3205
31	G	A	2.4705
32	T	A	2.7788
33	L	A	3.3895
34	G	A	2.4513
35	I	A	3.7138
36	V	A	3.7589
37	A	A	2.3313
38	A	A	2.2236
39	Y	A	2.8166
40	L	A	1.6366
41	P	A	-0.1732
42	A	A	-1.1260
43	R	A	-3.0064
44	R	A	-3.3732
45	A	A	-2.5846
46	E	A	-3.1956
47	P	A	-1.7834
48	Q	A	-1.6164
49	A	A	-0.1262
50	A	A	1.1416
51	Y	A	2.5020
52	L	A	3.2773
53	L	A	2.5439
54	C	A	1.0302
55	H	A	-0.9571
56	E	A	-2.0531
57	Q	A	-1.8160
58	L	A	-0.3712
59	S	A	-1.2152
60	D	A	-2.3960
61	S	A	-2.5059
62	E	A	-3.8916
63	E	A	-4.3598
64	E	A	-4.2709
65	N	A	-3.8854
66	D	A	-3.3682
67	G	A	-2.1467
68	P	A	-1.3322
69	G	A	-1.4915
70	P	A	-1.1175
71	G	A	-1.5772
72	Q	A	-1.8756
73	S	A	-1.5305
74	T	A	-1.3196
75	H	A	-1.2621
76	V	A	-0.5603
77	D	A	-1.3960
78	I	A	0.5144
79	R	A	-1.3064
80	T	A	-0.4694
81	L	A	0.9959
82	E	A	-0.9244
83	D	A	-1.1376
84	L	A	1.2404
85	L	A	1.9830
86	M	A	1.1923
87	G	A	-0.0455
88	P	A	-0.7394
89	G	A	-0.8370
90	P	A	-0.7823
91	G	A	-0.8299
92	T	A	-0.4103
93	P	A	-0.1757
94	T	A	0.0592
95	L	A	0.6417
96	H	A	-0.7867
97	E	A	-1.6535
98	Y	A	-0.3502
99	M	A	-0.5924
100	L	A	-0.1684
101	D	A	-1.0230
102	L	A	-0.4410
103	Q	A	-1.8377
104	P	A	-1.9812
105	E	A	-2.4289
106	T	A	-1.8261
107	G	A	-1.5800
108	P	A	-0.8398
109	G	A	-0.7771
110	P	A	-0.6035
111	G	A	-0.5230
112	L	A	-0.0585
113	Q	A	-1.5982
114	D	A	-1.4249
115	I	A	0.9169
116	V	A	1.4975
117	L	A	1.8353
118	H	A	0.2531
119	L	A	0.5794
120	E	A	-1.6623
121	P	A	-2.1845
122	Q	A	-2.4100
123	N	A	-2.4715
124	E	A	-1.8687
125	I	A	0.3817
126	P	A	-0.3077
127	G	A	-0.6373
128	P	A	-0.6550
129	G	A	-0.7654
130	P	A	-0.2027
131	G	A	0.1850
132	V	A	1.8000
133	Y	A	1.7067
134	D	A	0.4893
135	F	A	2.0313
136	A	A	1.0069
137	F	A	1.3352
138	R	A	-1.0702
139	D	A	-1.3478
140	L	A	1.0376
141	A	A	0.3380
142	A	A	0.6500
143	Y	A	1.1645
144	R	A	-0.3637
145	F	A	1.1333
146	H	A	-0.4721
147	N	A	-0.6020
148	I	A	1.0944
149	A	A	0.1164
150	G	A	-0.5398
151	H	A	-0.6677
152	Y	A	0.5776
153	A	A	0.5932
154	A	A	0.8602
155	Y	A	2.1204
156	C	A	1.8385
157	Y	A	1.9561
158	S	A	0.7803
159	L	A	0.6114
160	Y	A	0.3006
161	G	A	0.1039
162	T	A	0.3021
163	T	A	0.4334
164	L	A	0.4148
165	A	A	0.2941
166	A	A	0.6096
167	Y	A	0.9248
168	K	A	-0.4095
169	T	A	0.5141
170	V	A	1.9646
171	L	A	1.4924
172	E	A	0.0729
173	L	A	1.4320
174	T	A	0.6450
175	E	A	-0.0635
176	V	A	1.1754
177	A	A	0.1510
178	A	A	-0.0808
179	Y	A	-0.0387
180	A	A	-0.7740
181	E	A	-2.4583
182	K	A	-2.5665
183	L	A	-1.7539
184	R	A	-3.5758
185	H	A	-3.0698
186	L	A	-1.9199
187	N	A	-3.6550
188	E	A	-4.2359
189	K	A	-4.0152
190	R	A	-3.7285
191	R	A	-3.1702
192	F	A	-0.6977
193	H	A	-1.5020
194	N	A	-1.8396
195	G	A	-1.3563
196	P	A	-1.2350
197	G	A	-0.9968
198	P	A	-1.0640
199	G	A	-0.8675
200	L	A	-0.5798
201	D	A	-2.5544
202	K	A	-3.4583
203	K	A	-3.0811
204	Q	A	-2.5224
205	R	A	-1.5326
206	F	A	0.0308
207	H	A	-0.1117
208	N	A	0.1243
209	I	A	0.4321
210	R	A	-1.5821
211	G	A	-1.6206
212	R	A	-1.9521
213	W	A	-0.3795
214	T	A	-0.3623
215	G	A	-0.8570
216	P	A	-1.0352
217	G	A	-1.2340
218	P	A	-1.1812
219	G	A	-1.9759
220	N	A	-2.4339
221	P	A	-2.0278
222	A	A	-2.0631
223	E	A	-3.3618
224	K	A	-3.2131
225	L	A	-1.9226
226	R	A	-3.7225
227	H	A	-3.7384
228	L	A	-2.9312
229	N	A	-3.8148
230	E	A	-4.3660
231	K	A	-4.1854
232	R	A	-3.9795
233	R	A	-3.1463
234	F	A	-0.7983
235	G	A	-1.0170
236	P	A	-0.9714
237	G	A	-0.6883
238	P	A	-1.0656
239	G	A	-0.9978
240	S	A	-0.8569
241	K	A	-1.2532
242	I	A	0.4919
243	S	A	-0.9403
244	E	A	-1.6135
245	Y	A	0.2298
246	R	A	-0.8571
247	H	A	-0.6175
248	Y	A	1.2192
249	C	A	1.7467
250	Y	A	2.0572
251	S	A	1.4532
252	L	A	2.5096
253	Y	A	2.0584
254	G	A	0.4438
255	G	A	-0.3884
256	P	A	-0.8065
257	G	A	-1.0110
258	P	A	-0.8236
259	G	A	-0.7415