Project name: bb76bb83cdb3d3f

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

Simulation log

[INFO]       Logger:   Verbosity set to: 2 - [INFO]                                                (00:00:01)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:01)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with D chain(s) selected             (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:01:22)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:23)

• Minimal score value: -2.7608
• Maximal score value: 4.06
• Average score: 0.0019
• Total score value: 0.2843

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
42	V	D	0.6490
43	E	D	-1.1240
44	D	D	-0.5524
45	F	D	2.4716
46	F	D	3.6038
47	I	D	4.0600
48	V	D	3.7288
49	P	D	2.1222
50	V	D	1.8141
51	S	D	-0.0554
52	G	D	-1.2995
53	D	D	-2.6857
54	P	D	-1.8592
55	A	D	-1.6475
56	I	D	0.0000
57	D	D	-2.2023
58	L	D	-0.6939
59	L	D	-0.4949
60	Q	D	-0.4002
61	A	D	-0.3275
62	D	D	-2.0784
63	G	D	-1.8334
64	N	D	-1.8351
65	A	D	-0.8154
66	L	D	0.2464
67	P	D	-0.0460
68	S	D	0.1583
69	A	D	0.1238
70	V	D	0.1943
71	K	D	-0.9566
72	L	D	0.2149
73	A	D	0.2434
74	Y	D	0.2595
75	S	D	-0.2698
76	P	D	-0.5335
77	A	D	-0.3890
78	S	D	-0.7321
79	K	D	-1.1178
80	T	D	-0.4468
81	N	D	0.2055
82	T	D	0.6489
83	L	D	1.5319
84	V	D	0.9279
85	G	D	0.8132
86	V	D	1.1848
87	L	D	1.7325
88	T	D	0.0000
89	L	D	0.0000
90	V	D	0.0000
91	H	D	-1.3185
92	T	D	-1.7385
93	N	D	-2.2844
94	D	D	-1.6878
95	A	D	-1.0301
96	T	D	-1.1745
97	K	D	-2.0452
98	K	D	-2.4697
99	N	D	0.0000
100	V	D	-0.9547
101	L	D	0.0000
102	V	D	0.8513
103	K	D	0.0000
104	L	D	2.8152
105	V	D	2.8569
106	T	D	1.2269
107	P	D	0.0000
108	Q	D	-0.2198
109	L	D	0.0170
110	T	D	0.1075
111	D	D	0.0000
112	V	D	1.8611
113	L	D	1.8685
114	N	D	0.4835
115	P	D	0.2721
116	T	D	0.0409
117	L	D	0.0289
118	Q	D	-1.1874
119	I	D	0.0000
120	P	D	-0.9193
121	V	D	0.0000
122	S	D	-0.1106
123	V	D	0.0000
124	Q	D	0.4364
125	V	D	0.0000
126	T	D	1.7070
127	V	D	2.4212
128	Y	D	1.9214
129	P	D	0.4964
130	V	D	0.0000
131	S	D	0.4313
132	T	D	0.8641
133	T	D	0.0305
134	A	D	-0.2323
135	K	D	-0.9845
136	E	D	-2.5258
137	F	D	0.0000
138	E	D	-2.7608
139	A	D	-1.5916
140	A	D	-0.6188
141	A	D	-0.5424
142	L	D	0.0000
143	G	D	0.2256
144	Y	D	0.6728
145	S	D	-0.0623
146	A	D	0.1495
147	S	D	-0.2656
148	G	D	-0.4497
149	V	D	0.0896
150	N	D	-1.0763
151	G	D	-0.8183
152	L	D	0.0338
153	V	D	0.0000
154	S	D	0.9359
155	I	D	1.8308
156	V	D	0.0000
157	L	D	2.0568
158	T	D	0.0000
159	V	D	1.2004
160	I	D	0.7023
161	S	D	0.4728
162	A	D	0.0000
163	A	D	-0.5131
164	P	D	-1.2585
165	K	D	-1.9639
166	T	D	-1.0117
167	A	D	-0.7581
168	G	D	-0.9232
169	T	D	-0.7361
170	A	D	-0.5700
171	P	D	-0.5813
172	T	D	-0.3146
173	A	D	-0.4417
174	G	D	-0.5249
175	N	D	-0.7271
176	Y	D	-0.0432
177	S	D	-0.0906
178	G	D	0.5688
179	V	D	1.9940
180	V	D	1.9284
181	S	D	1.9646
182	L	D	1.9380
183	V	D	1.6258
184	M	D	0.5689
185	T	D	-0.1790
186	L	D	-0.8572
187	G	D	-1.3879