Project name: 431b6b45fb18d45

Chain sequence(s)	D: VSVALGQTVRITCQGDSLRSYYASWYQQKSGQAPVLVIYSYNNFSGSNSGNTASLTITGAQAEDEADYYCNSRDSSGHHLVFGGGTKLTVL
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                                        (00:00:00)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:00:27)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:28)

• Minimal score value: -3.7568
• Maximal score value: 3.6724
• Average score: -0.0655
• Total score value: -5.9632

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
11	V	D	2.2874
12	S	D	1.5056
13	V	D	2.4298
14	A	D	1.5321
15	L	D	1.3872
16	G	D	-0.1189
17	Q	D	-1.0732
18	T	D	-0.1504
19	V	D	1.0159
20	R	D	-0.1725
21	I	D	1.5412
22	T	D	0.7229
23	C	D	0.0776
24	Q	D	-1.4639
25	G	D	-1.4144
26	D	D	-1.8690
27	S	D	-0.5744
28	L	D	0.0218
29	R	D	-0.9701
36	S	D	0.3012
37	Y	D	1.6207
38	Y	D	1.8533
39	A	D	1.2592
40	S	D	1.1558
41	W	D	1.8350
42	Y	D	0.9905
43	Q	D	-1.2935
44	Q	D	-2.4122
45	K	D	-2.9419
46	S	D	-2.0559
47	G	D	-1.6682
48	Q	D	-1.7682
49	A	D	-0.2252
50	P	D	0.7145
51	V	D	2.6102
52	L	D	3.2417
53	V	D	3.6724
54	I	D	3.1735
55	Y	D	2.0990
56	S	D	1.4553
65	Y	D	0.9984
74	N	D	-0.9102
75	N	D	-1.6048
76	F	D	1.6611
77	S	D	0.0803
78	G	D	-0.6246
79	S	D	-1.2476
80	N	D	-1.7860
83	S	D	-1.1349
84	G	D	-0.2039
85	N	D	-0.4095
86	T	D	-0.0871
87	A	D	0.0454
88	S	D	0.4427
89	L	D	1.8896
90	T	D	1.5807
91	I	D	2.4482
92	T	D	0.5805
93	G	D	0.1543
94	A	D	-0.5248
95	Q	D	-1.8364
96	A	D	-2.1624
97	E	D	-3.5520
98	D	D	-3.7568
99	E	D	-3.2098
100	A	D	-2.4533
101	D	D	-2.4207
102	Y	D	-0.1897
103	Y	D	0.1993
104	C	D	0.1947
105	N	D	-1.7628
106	S	D	-1.6329
107	R	D	-3.4122
108	D	D	-3.0010
109	S	D	-1.8340
110	S	D	-1.6961
113	G	D	-1.3656
114	H	D	-1.1164
115	H	D	-0.4167
116	L	D	1.7114
117	V	D	2.0246
118	F	D	2.0563
119	G	D	0.0032
120	G	D	-1.1186
121	G	D	-1.0687
122	T	D	-0.5537
123	K	D	-1.1177
124	L	D	1.0537
125	T	D	1.4271
126	V	D	2.9855
127	L	D	2.3788