Project name: 5ae96eeb7187ce5

Chain sequence(s)	A: YDNREIVMKYIHYKLSQRGYEWDASEVVHLTLRQAGDDFSRRYRRDFAEMSSQLHLTPFTARGRFATVVEELFRDGVNWGRIVAFFEFGGVMCVESVNREMSPLVDNIALWMTEYLNRHLHTWIQDNGGWDAFVELYGP
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                                          (00:02:18)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:18)

• Minimal score value: -3.8811
• Maximal score value: 1.3412
• Average score: -1.1288
• Total score value: -156.9075

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
7	Y	A	-0.1813
8	D	A	-1.7773
9	N	A	0.0000
10	R	A	-1.8917
11	E	A	-1.8942
12	I	A	0.0000
13	V	A	0.0000
14	M	A	-1.0325
15	K	A	-1.2519
16	Y	A	0.0000
17	I	A	0.0000
18	H	A	-1.0033
19	Y	A	-0.5889
20	K	A	-1.0588
21	L	A	0.0000
22	S	A	-1.7885
23	Q	A	-2.3361
24	R	A	-2.7865
25	G	A	-2.0528
26	Y	A	-1.7467
27	E	A	-2.6224
28	W	A	0.0000
29	D	A	-2.4227
30	A	A	-1.6342
87	S	A	-0.9465
88	E	A	-1.3339
89	V	A	-0.0759
90	V	A	0.0000
91	H	A	-0.4045
92	L	A	0.4291
93	T	A	0.0000
94	L	A	0.0000
95	R	A	-1.0782
96	Q	A	-1.6692
97	A	A	0.0000
98	G	A	0.0000
99	D	A	-2.8385
100	D	A	0.0000
101	F	A	-1.8957
102	S	A	0.0000
103	R	A	-3.7351
104	R	A	-3.2324
105	Y	A	-2.1724
106	R	A	-3.8403
107	R	A	-3.8811
108	D	A	-3.3783
109	F	A	-2.2080
110	A	A	-2.2288
111	E	A	-2.6251
112	M	A	-1.6604
113	S	A	-1.2120
114	S	A	-1.1619
115	Q	A	-1.6278
116	L	A	0.0000
117	H	A	-1.4984
118	L	A	0.0000
119	T	A	-0.2959
120	P	A	0.2146
121	F	A	1.3412
122	T	A	-0.1643
123	A	A	0.0000
124	R	A	-2.0260
125	G	A	-1.2646
126	R	A	-1.1696
127	F	A	0.0000
128	A	A	-1.3196
129	T	A	-1.4014
130	V	A	-1.1794
131	V	A	0.0000
132	E	A	-2.9721
133	E	A	-3.1901
134	L	A	-1.9920
135	F	A	0.0000
136	R	A	-3.6731
137	D	A	-3.2315
138	G	A	-1.9129
139	V	A	-1.0928
140	N	A	-1.2920
141	W	A	-0.4644
142	G	A	-0.8728
143	R	A	-0.9308
144	I	A	0.0000
145	V	A	0.0000
146	A	A	-0.3074
147	F	A	0.0000
148	F	A	0.0000
149	E	A	0.0000
150	F	A	0.0000
151	G	A	0.0000
152	G	A	0.0000
153	V	A	0.0000
154	M	A	0.0000
155	C	A	0.0000
156	V	A	-0.7437
157	E	A	-1.1909
158	S	A	0.0000
159	V	A	-1.4541
160	N	A	-2.3544
161	R	A	-2.3697
162	E	A	-2.5162
163	M	A	-1.3045
164	S	A	-1.2528
165	P	A	-1.1273
166	L	A	0.0000
167	V	A	0.0000
168	D	A	-2.2147
169	N	A	-1.7161
170	I	A	0.0000
171	A	A	0.0000
172	L	A	-0.1736
173	W	A	-0.7415
174	M	A	0.0000
175	T	A	-1.5570
176	E	A	-2.3417
177	Y	A	-1.6472
178	L	A	0.0000
179	N	A	-2.6702
180	R	A	-3.1073
181	H	A	-2.2807
182	L	A	0.0000
183	H	A	-1.9987
184	T	A	-1.7364
185	W	A	-1.3636
186	I	A	0.0000
187	Q	A	-2.5394
188	D	A	-2.8111
189	N	A	-2.4096
190	G	A	-2.1520
191	G	A	-1.6733
192	W	A	0.0000
193	D	A	-1.9901
194	A	A	-1.4514
195	F	A	0.0000
196	V	A	0.0000
197	E	A	-1.6150
198	L	A	0.4244
199	Y	A	0.0961
200	G	A	-0.5734
201	P	A	-0.8084