Project name: accf67d0e98f8fe

Chain sequence(s)	A: GPPFARYYNMDMETFDVEFGFPVEPGVEGSGRIVVGETPSGKAASCLYIGPYDEIEKVYDALMKWVRDNGYELSGEAYEIYLDAPAETPPDQLRTQVVLMLKNAGPETETLESQPALLIRTRTT
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]                                                (00:00:01)
[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 A 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                                          (00:01:46)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:47)

• Minimal score value: -3.811
• Maximal score value: 1.7979
• Average score: -0.9423
• Total score value: -116.8464

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
28	G	A	-0.1866
29	P	A	0.3608
30	P	A	0.9181
31	F	A	0.0000
32	A	A	0.0000
33	R	A	-0.3520
34	Y	A	-0.0315
35	Y	A	-0.4338
36	N	A	-1.3035
37	M	A	-0.8745
38	D	A	-1.9075
39	M	A	-1.1196
40	E	A	-1.7368
41	T	A	-1.1667
42	F	A	-0.4802
43	D	A	0.0000
44	V	A	0.0000
45	E	A	-0.7668
46	F	A	0.7948
47	G	A	1.3706
48	F	A	1.7979
49	P	A	0.1908
50	V	A	-0.6614
51	E	A	-2.1547
52	P	A	-1.3797
53	G	A	-1.1309
54	V	A	-0.9121
55	E	A	-1.2463
56	G	A	-0.0577
57	S	A	-0.4878
58	G	A	-0.8723
59	R	A	-1.3699
60	I	A	0.4738
61	V	A	1.4826
62	V	A	1.4216
63	G	A	0.3921
64	E	A	-1.5750
65	T	A	0.0000
66	P	A	-1.2674
67	S	A	-1.4343
68	G	A	-1.4034
69	K	A	-1.7385
70	A	A	0.0000
71	A	A	0.0000
72	S	A	0.0537
73	C	A	0.7358
74	L	A	1.0307
75	Y	A	0.0000
76	I	A	0.8840
77	G	A	0.0000
78	P	A	-1.5846
79	Y	A	-1.3857
80	D	A	-2.9373
81	E	A	-3.1669
82	I	A	-2.3655
83	E	A	-3.7302
84	K	A	-3.6696
85	V	A	0.0000
86	Y	A	-1.8825
87	D	A	-3.0154
88	A	A	-1.8363
89	L	A	0.0000
90	M	A	-2.0411
91	K	A	-3.0420
92	W	A	-2.0272
93	V	A	0.0000
94	R	A	-3.8110
95	D	A	-3.6026
96	N	A	-2.9236
97	G	A	-2.2887
98	Y	A	-2.5975
99	E	A	-3.0860
100	L	A	-1.6456
101	S	A	-1.3611
102	G	A	-1.1535
103	E	A	-0.7418
104	A	A	0.0000
105	Y	A	0.0000
106	E	A	0.0000
107	I	A	0.4528
108	Y	A	0.0621
109	L	A	0.3119
110	D	A	-0.8552
111	A	A	-0.8296
112	P	A	-1.1081
113	A	A	-1.0358
114	E	A	-1.9891
115	T	A	-1.8823
116	P	A	-1.7248
117	P	A	-1.8873
118	D	A	-2.1949
119	Q	A	-1.9944
120	L	A	0.0000
121	R	A	-0.5635
122	T	A	0.0000
123	Q	A	0.3325
124	V	A	0.0000
125	V	A	0.0000
126	L	A	0.0000
127	M	A	0.0000
128	L	A	0.0000
129	K	A	-2.6563
130	N	A	-2.0631
131	A	A	-1.6607
132	G	A	-1.2662
133	P	A	-1.3206
134	E	A	-2.2287
135	T	A	-1.6618
136	E	A	-1.6265
137	T	A	-1.1482
138	L	A	-1.2757
139	E	A	-2.3729
140	S	A	-1.8606
141	Q	A	-1.8118
142	P	A	-0.9626
143	A	A	0.0000
144	L	A	1.2733
145	L	A	0.0000
146	I	A	0.1356
147	R	A	-1.9847
148	T	A	-1.8006
149	R	A	-2.0827
150	T	A	-0.7632
151	T	A	-0.7634