Project name: Test

Chain sequence(s)	H: QVQLVESGGGPVEAGGSLRLSCAASGRSFSNSVMAWFRQAPGKEREFLSVLNWSSGRTSIADSVKGRFTMSRDPAKITVYLQMNGLKPEDTAVYYCAASNRGSLYTLDNQNRYEDWGQGTQVTVSS
Selected Chain(s)	H
Distance of aggregation	10 Å
FoldX usage	Yes
Dynamic mode	No
Automated mutations	No

Simulation log

[INFO]       Logger:   Verbosity set to: 2 - [INFO]                                                (00:00:02)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:02)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with H chain(s) selected             (00:00:02)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:02)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:02)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:01:09)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:10)

• Minimal score value: -2.8934
• Maximal score value: 1.7619
• Average score: -0.8167
• Total score value: -102.8982

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	Q	H	-1.7688
2	V	H	-1.4861
3	Q	H	-1.4008
4	L	H	0.0000
5	V	H	0.8381
6	E	H	0.0000
7	S	H	-0.4398
8	G	H	-0.9742
9	G	H	-0.8382
11	G	H	-0.6631
12	P	H	-0.7477
13	V	H	-1.1547
14	E	H	-2.3085
15	A	H	-2.0308
16	G	H	-1.5959
17	G	H	-1.3770
18	S	H	-1.3195
19	L	H	-0.9331
20	R	H	-1.7732
21	L	H	0.0000
22	S	H	-0.3699
23	C	H	0.0000
24	A	H	0.0742
25	A	H	0.0000
26	S	H	-1.0137
27	G	H	-1.5996
28	R	H	-1.7502
29	S	H	-1.1055
30	F	H	0.0000
35	S	H	-1.0543
36	N	H	-1.8271
37	S	H	0.0000
38	V	H	0.0000
39	M	H	0.0000
40	A	H	0.0000
41	W	H	0.0000
42	F	H	0.0000
43	R	H	0.0000
44	Q	H	-1.3947
45	A	H	-1.4597
46	P	H	-1.0944
47	G	H	-1.6939
48	K	H	-2.6827
49	E	H	-2.8934
50	R	H	-1.8485
51	E	H	-1.3829
52	F	H	-0.7774
53	L	H	0.0000
54	S	H	0.0000
55	V	H	0.0000
56	L	H	0.0000
57	N	H	-1.4142
58	W	H	0.0000
59	S	H	-1.2074
62	S	H	-1.2621
63	G	H	-1.5281
64	R	H	-2.2552
65	T	H	-1.1271
66	S	H	-0.9320
67	I	H	-0.7861
68	A	H	-1.3359
69	D	H	-2.4907
70	S	H	-1.5236
71	V	H	0.0000
72	K	H	-2.7032
74	G	H	-1.8872
75	R	H	-1.8293
76	F	H	0.0000
77	T	H	-0.9231
78	M	H	0.0000
79	S	H	-0.6922
80	R	H	-0.7776
81	D	H	-0.9991
82	P	H	-0.7834
83	A	H	-0.7711
84	K	H	-1.5437
85	I	H	-0.3050
86	T	H	0.0000
87	V	H	0.0000
88	Y	H	-0.5541
89	L	H	0.0000
90	Q	H	-1.2267
91	M	H	0.0000
92	N	H	-1.5431
93	G	H	-1.5166
94	L	H	0.0000
95	K	H	-2.6614
96	P	H	-1.9911
97	E	H	-2.3325
98	D	H	0.0000
99	T	H	-1.0508
100	A	H	0.0000
101	V	H	-0.1121
102	Y	H	0.0000
103	Y	H	0.0218
104	C	H	0.0000
105	A	H	0.0000
106	A	H	0.0000
107	S	H	0.0000
108	N	H	-1.7771
109	R	H	-2.4373
110	G	H	-1.0501
111	S	H	-0.0045
111A	L	H	1.7619
111B	Y	H	0.8825
111C	T	H	0.1079
112C	L	H	-0.2072
112B	D	H	-1.2583
112A	N	H	-1.5735
112	Q	H	-1.5246
113	N	H	-1.7865
114	R	H	0.0000
115	Y	H	0.0000
116	E	H	-1.3848
117	D	H	-0.7712
118	W	H	-0.2336
119	G	H	-0.2617
120	Q	H	-0.9543
121	G	H	0.0000
122	T	H	0.0000
123	Q	H	-0.8852
124	V	H	0.0000
125	T	H	-0.9769
126	V	H	0.0000
127	S	H	-1.4331
128	S	H	-1.2397