Project name: apo sod1

Chain sequence(s)	A: ATKAVCVLKGDGPVQGIINFEQKESNGPVKVWGSIKGLTEGLHGFHVHEFGDNTAGCTSAGPHFNPLSRKHGGPKDEERHVGDLGNVTADKDGVADVSIEDSVISLSGDHCITGRTLVVHEKADDLGKGGNEESTKTGNAGSRLACGVIGIAQ
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                                          (00:02:37)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:38)

• Minimal score value: -4.3823
• Maximal score value: 1.4502
• Average score: -1.1967
• Total score value: -183.0956

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	-1.5561
2	T	A	-1.2504
3	K	A	-1.3237
4	A	A	0.0000
5	V	A	0.9340
6	C	A	0.0000
7	V	A	1.2230
8	L	A	0.0000
9	K	A	-1.9432
10	G	A	0.0000
11	D	A	-2.7687
12	G	A	-1.7736
13	P	A	-1.7499
14	V	A	0.0000
15	Q	A	-2.0714
16	G	A	-0.8801
17	I	A	0.5118
18	I	A	0.0000
19	N	A	-0.1971
20	F	A	0.0000
21	E	A	-2.1642
22	Q	A	0.0000
23	K	A	-3.2890
24	E	A	-3.2235
25	S	A	-2.2391
26	N	A	-2.2523
27	G	A	-1.7202
28	P	A	-1.8249
29	V	A	0.0000
30	K	A	-2.4309
31	V	A	0.0000
32	W	A	-0.5679
33	G	A	-0.2425
34	S	A	-1.0688
35	I	A	0.0000
36	K	A	-2.6035
37	G	A	-1.9962
38	L	A	0.0000
39	T	A	-2.0325
40	E	A	-3.2164
41	G	A	-1.4401
42	L	A	-0.0466
43	H	A	0.0000
44	G	A	0.0000
45	F	A	0.0000
46	H	A	0.0000
47	V	A	0.0000
48	H	A	-0.0779
49	E	A	-0.2860
50	F	A	0.6465
51	G	A	-0.6439
52	D	A	-2.1004
53	N	A	-1.9546
54	T	A	-1.3678
55	A	A	-1.0255
56	G	A	-1.4165
57	C	A	-1.1947
58	T	A	-0.7152
59	S	A	-0.4742
60	A	A	0.0000
61	G	A	-0.2665
62	P	A	-0.2878
63	H	A	-0.6225
64	F	A	0.0000
65	N	A	-0.9962
66	P	A	0.0000
67	L	A	-0.3928
68	S	A	-1.8491
69	R	A	-3.1401
70	K	A	-3.1268
71	H	A	-2.5156
72	G	A	-1.7831
73	G	A	-1.3901
74	P	A	-2.4383
75	K	A	-3.9536
76	D	A	-4.3823
77	E	A	-3.7723
78	E	A	-3.7971
79	R	A	-3.4894
80	H	A	-1.7021
81	V	A	0.3705
82	G	A	0.1484
83	D	A	-0.4780
84	L	A	0.0000
85	G	A	-0.5632
86	N	A	-0.3824
87	V	A	0.0000
88	T	A	-0.7286
89	A	A	0.0000
90	D	A	-4.1625
91	K	A	-4.0649
92	D	A	-3.7562
93	G	A	-2.9252
94	V	A	-2.8524
95	A	A	0.0000
96	D	A	-2.1799
97	V	A	0.0000
98	S	A	-0.9207
99	I	A	-1.1885
100	E	A	-2.8550
101	D	A	-2.6388
102	S	A	-0.7901
103	V	A	1.0459
104	I	A	0.0000
105	S	A	0.0000
106	L	A	0.0000
107	S	A	-1.3068
108	G	A	-1.7095
109	D	A	-2.3701
110	H	A	-1.4759
111	C	A	-0.8111
112	I	A	0.0000
113	T	A	0.2591
114	G	A	0.0257
115	R	A	-0.2664
116	T	A	0.0000
117	L	A	0.0000
118	V	A	0.0000
119	V	A	0.0000
120	H	A	-1.5562
121	E	A	-1.9876
122	K	A	-2.5351
123	A	A	-1.2947
124	D	A	-1.5546
125	D	A	-1.9412
126	L	A	0.1078
127	G	A	-1.2057
128	K	A	-2.3378
129	G	A	-2.3374
130	G	A	-3.7548
131	N	A	-3.3514
132	E	A	-3.6245
133	E	A	-3.2042
134	S	A	-2.1031
135	T	A	-2.0864
136	K	A	0.0000
137	T	A	-2.8208
138	G	A	-2.1813
139	N	A	-2.4123
140	A	A	-1.8553
141	G	A	-1.7870
142	S	A	-1.7514
143	R	A	-2.5071
144	L	A	-1.9619
145	A	A	0.0000
146	C	A	-0.7668
147	G	A	-0.0401
148	V	A	0.5819
149	I	A	0.0000
150	G	A	0.9023
151	I	A	1.4502
152	A	A	0.0282
153	Q	A	-0.9108