Project name: design2

Chain sequence(s)	A: SREIILLDRATFERLAASELPDVIAAADFAILAAGRIGRTYGPLFVEAGVPVMIVGMDPEKVKAIADELGTDYYVALDRFGDAETLKKILESLKDKKRILVALGSAEDTFIEVALKLGHKITDLRVYPKLTNKTKELKKKYPV
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                                          (00:04:53)
[INFO]       Main:     Simulation completed successfully.                                          (00:04:54)

• Minimal score value: -4.3596
• Maximal score value: 0.6428
• Average score: -1.1874
• Total score value: -169.8027

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	S	A	-1.3499
2	R	A	-2.7174
3	E	A	-2.1291
4	I	A	0.0000
5	I	A	-0.2660
6	L	A	0.0000
7	L	A	0.0000
8	D	A	0.0000
9	R	A	-1.7383
10	A	A	-1.0697
11	T	A	0.0000
12	F	A	0.0000
13	E	A	-2.4881
14	R	A	-2.7568
15	L	A	-2.0338
16	A	A	-1.6593
17	A	A	-1.2278
18	S	A	-1.7255
19	E	A	-2.6355
20	L	A	0.0000
21	P	A	-1.7151
22	D	A	-2.3187
23	V	A	-1.2279
24	I	A	0.0000
25	A	A	-0.8580
26	A	A	-0.9595
27	A	A	0.0000
28	D	A	-1.5113
29	F	A	0.0000
30	A	A	0.0000
31	I	A	0.0000
32	L	A	0.0000
33	A	A	-0.4427
34	A	A	-1.2964
35	G	A	-1.6386
36	R	A	-2.5725
37	I	A	-1.6433
38	G	A	0.0000
39	R	A	-2.6923
40	T	A	-1.5659
41	Y	A	0.0000
42	G	A	0.0000
43	P	A	-0.7717
44	L	A	-0.1785
45	F	A	0.0000
46	V	A	-0.0314
47	E	A	-1.3868
48	A	A	-0.9661
49	G	A	-0.7174
50	V	A	0.0000
51	P	A	-0.3728
52	V	A	0.0000
53	M	A	0.1934
54	I	A	0.0000
55	V	A	0.0000
56	G	A	0.0000
57	M	A	-1.1919
58	D	A	-2.7505
59	P	A	-2.4938
60	E	A	-3.2643
61	K	A	-3.0292
62	V	A	0.0000
63	K	A	-3.1381
64	A	A	-2.9522
65	I	A	0.0000
66	A	A	0.0000
67	D	A	-3.4773
68	E	A	-3.2999
69	L	A	0.0000
70	G	A	-1.9909
71	T	A	-1.5618
72	D	A	-1.8592
73	Y	A	-0.2030
74	Y	A	-0.1234
75	V	A	-0.3625
76	A	A	-1.3818
77	L	A	0.0000
78	D	A	-2.5031
79	R	A	-1.9197
80	F	A	0.3811
81	G	A	-0.8059
82	D	A	-1.4845
83	A	A	-1.7522
84	E	A	-2.6599
85	T	A	-1.9291
86	L	A	0.0000
87	K	A	-2.7088
88	K	A	-3.0338
89	I	A	0.0000
90	L	A	0.0000
91	E	A	-3.0279
92	S	A	-2.3151
93	L	A	0.0000
94	K	A	-3.7512
95	D	A	-3.6803
96	K	A	-3.2345
97	K	A	-3.4890
98	R	A	-2.8096
99	I	A	0.0000
100	L	A	0.0000
101	V	A	0.0000
102	A	A	0.0000
103	L	A	0.0000
104	G	A	-0.5305
105	S	A	-0.7640
106	A	A	-0.3159
107	E	A	0.0000
108	D	A	-1.6493
109	T	A	-0.9835
110	F	A	0.0000
111	I	A	0.0000
112	E	A	-1.7623
113	V	A	0.0000
114	A	A	0.0000
115	L	A	0.0000
116	K	A	-1.4386
117	L	A	-0.7976
118	G	A	-0.4008
119	H	A	-1.2128
120	K	A	-1.4766
121	I	A	0.0000
122	T	A	-0.4362
123	D	A	-0.1815
124	L	A	0.5631
125	R	A	0.0000
126	V	A	0.5574
127	Y	A	0.0510
128	P	A	-0.9512
129	K	A	-1.9765
130	L	A	-1.6928
131	T	A	-1.7268
132	N	A	-2.6915
133	K	A	-3.6205
134	T	A	0.0000
135	K	A	-3.9883
136	E	A	-4.3596
137	L	A	-3.5216
138	K	A	-3.1592
139	K	A	-3.6168
140	K	A	-3.2426
141	Y	A	-1.6480
142	P	A	-1.1980
143	V	A	0.6428