Project name: L33P

Chain sequence(s)	D: VHLTPEEKSAVTALWGKVNVDEVGGEALGRLPVVYPWTQRFFESFGDLSTPDAVMGNPKVKAHGKKVLGAFSDGLAHLDNLKGTFATLSELHCDKLHVDPENFRLLGNVLVCVLAHHFGKEFTPPVQAAYQKVVAGVANALAHKYH
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]                                                (00:00:00)
[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 D chain(s) selected             (00:00:00)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:00)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:03:13)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:14)

• Minimal score value: -3.3834
• Maximal score value: 0.9553
• Average score: -1.0519
• Total score value: -153.578

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
2	V	D	0.5907
3	H	D	-0.6934
4	L	D	0.0000
5	T	D	-1.3217
6	P	D	-1.6788
7	E	D	-2.4241
8	E	D	-1.9541
9	K	D	-1.8267
10	S	D	-1.4120
11	A	D	-0.9917
12	V	D	0.0000
13	T	D	-0.6291
14	A	D	-0.6210
15	L	D	0.0000
16	W	D	-0.5649
17	G	D	-1.1768
18	K	D	-1.8574
19	V	D	0.0000
20	N	D	-1.8236
21	V	D	-0.7090
22	D	D	-2.6376
23	E	D	-2.9044
24	V	D	0.0000
25	G	D	0.0000
26	G	D	0.0000
27	E	D	-1.9309
28	A	D	0.0000
29	L	D	0.0000
30	G	D	0.0000
31	R	D	-0.4903
32	L	D	0.0000
33	P	D	0.0000
34	V	D	0.3729
35	V	D	0.9553
36	Y	D	0.7430
37	P	D	0.0612
38	W	D	0.1987
39	T	D	0.0000
40	Q	D	-1.0726
41	R	D	-1.9231
42	F	D	-0.5329
43	F	D	-1.2751
44	E	D	-2.4713
45	S	D	-1.5113
46	F	D	-1.3476
47	G	D	-1.9646
48	D	D	-2.6898
49	L	D	0.0000
50	S	D	-1.1069
51	T	D	-1.0572
52	P	D	-1.0491
53	D	D	-2.1157
54	A	D	-1.5928
55	V	D	0.0000
56	M	D	-1.1648
57	G	D	-1.5284
58	N	D	0.0000
59	P	D	-1.3217
60	K	D	-1.8310
61	V	D	0.0000
62	K	D	-2.4002
63	A	D	-1.9815
64	H	D	-1.5674
65	G	D	0.0000
66	K	D	-2.5276
67	K	D	-2.1630
68	V	D	-0.8118
69	L	D	0.0000
70	G	D	-1.2045
71	A	D	-0.9463
72	F	D	0.0000
73	S	D	-0.7762
74	D	D	-1.6438
75	G	D	0.0000
76	L	D	-0.8664
77	A	D	-1.0022
78	H	D	-2.0169
79	L	D	-1.6153
80	D	D	-2.5575
81	N	D	-2.7655
82	L	D	0.0000
83	K	D	-2.6150
84	G	D	-1.8765
85	T	D	-1.5004
86	F	D	0.0000
87	A	D	-1.1232
88	T	D	-0.6485
89	L	D	-0.6163
90	S	D	0.0000
91	E	D	-2.9772
92	L	D	-1.4829
93	H	D	-1.6333
94	C	D	0.0000
95	D	D	-3.3834
96	K	D	-2.7182
97	L	D	-1.2928
98	H	D	-2.0842
99	V	D	-1.7784
100	D	D	-2.6104
101	P	D	-2.3275
102	E	D	-2.8852
103	N	D	0.0000
104	F	D	0.0000
105	R	D	-2.5683
106	L	D	-1.1160
107	L	D	-0.7737
108	G	D	0.0000
109	N	D	-1.2162
110	V	D	0.0000
111	L	D	0.0000
112	V	D	0.0000
113	C	D	-0.3562
114	V	D	0.0000
115	L	D	0.0000
116	A	D	-1.2859
117	H	D	-1.5704
118	H	D	-1.8976
119	F	D	-1.8613
120	G	D	-2.2475
121	K	D	-2.9275
122	E	D	-2.7871
123	F	D	-1.7228
124	T	D	-1.2807
125	P	D	-0.8945
126	P	D	-0.7165
127	V	D	-0.9595
128	Q	D	-0.9810
129	A	D	-0.6638
130	A	D	0.0000
131	Y	D	0.0000
132	Q	D	-1.1682
133	K	D	-0.7105
134	V	D	0.0000
135	V	D	0.0000
136	A	D	-0.7206
137	G	D	-0.4736
138	V	D	0.0000
139	A	D	0.0000
140	N	D	-1.5586
141	A	D	0.0000
142	L	D	0.0000
143	A	D	0.0000
144	H	D	-2.3775
145	K	D	-2.6326
146	Y	D	-1.8790
147	H	D	-1.5498