Project name: 22-8.pdb

Chain sequence(s)	H: QVQLVESGGGLVQPGGSLRLSCAASGSISSHNDMSWYREALGNQLELVSFIASGGSTYYADSVKGRFTISRDHAKNTLYLQMNSLRAEDTALYYCNSRTYDGEKTYWGQGTTVTVSS
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]                                                (00:00:00)
[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 H 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                                          (00:00:55)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:56)

• Minimal score value: -2.8302
• Maximal score value: 1.1945
• Average score: -0.5977
• Total score value: -69.9366

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	-1.7009
2	V	H	0.0000
3	Q	H	-1.1806
4	L	H	0.0000
5	V	H	1.1922
6	E	H	0.0000
7	S	H	-0.3124
8	G	H	-0.8624
9	G	H	-0.2961
11	G	H	0.3262
12	L	H	1.1945
13	V	H	0.0025
14	Q	H	-1.3419
15	P	H	-1.5836
16	G	H	-1.4053
17	G	H	-0.9452
18	S	H	-0.8423
19	L	H	-0.4952
20	R	H	-1.3444
21	L	H	0.0000
22	S	H	-0.1726
23	C	H	0.0000
24	A	H	-0.0309
25	A	H	-0.3823
26	S	H	-0.8194
27	G	H	-0.8867
28	S	H	-0.7777
29	I	H	0.0000
30	S	H	-1.2377
35	S	H	-1.0767
36	H	H	-1.2943
37	N	H	-0.9935
38	D	H	-0.9483
39	M	H	0.0000
40	S	H	0.0000
41	W	H	0.0000
42	Y	H	0.6511
43	R	H	0.0000
44	E	H	-0.4614
45	A	H	-0.4738
46	L	H	0.7443
47	G	H	-0.5995
48	N	H	-1.6210
49	Q	H	-1.4668
50	L	H	-0.0331
51	E	H	-0.3626
52	L	H	0.8387
53	V	H	0.0000
54	S	H	0.0000
55	F	H	0.8649
56	I	H	0.0000
57	A	H	-0.6785
58	S	H	-1.1375
59	G	H	-1.0608
63	G	H	-0.6676
64	S	H	-0.2608
65	T	H	0.3935
66	Y	H	0.9861
67	Y	H	0.0394
68	A	H	-0.7757
69	D	H	-2.2919
70	S	H	-1.7609
71	V	H	0.0000
72	K	H	-2.3786
74	G	H	-1.6732
75	R	H	-1.5423
76	F	H	0.0000
77	T	H	-0.5071
78	I	H	0.0000
79	S	H	-0.3843
80	R	H	-1.0513
81	D	H	-1.5932
82	H	H	-1.6504
83	A	H	-1.3428
84	K	H	-2.2410
85	N	H	-1.6675
86	T	H	0.0000
87	L	H	0.0000
88	Y	H	-0.3956
89	L	H	0.0000
90	Q	H	-0.8096
91	M	H	0.0000
92	N	H	-1.1696
93	S	H	-1.1773
94	L	H	0.0000
95	R	H	-2.1731
96	A	H	-1.6462
97	E	H	-2.2091
98	D	H	0.0000
99	T	H	-0.3803
100	A	H	0.0000
101	L	H	0.4688
102	Y	H	0.0000
103	Y	H	0.4728
104	C	H	0.0000
105	N	H	0.0000
106	S	H	0.0000
107	R	H	-1.2246
108	T	H	-1.3858
109	Y	H	-1.0780
110	D	H	-2.1091
113	G	H	-2.2520
114	E	H	-2.8302
115	K	H	-2.5815
116	T	H	-1.1197
117	Y	H	-0.6983
118	W	H	0.1616
119	G	H	-0.0128
120	Q	H	-0.7690
121	G	H	-0.1672
122	T	H	-0.1349
123	T	H	-0.0253
124	V	H	0.0000
125	T	H	0.0181
126	V	H	0.0000
127	S	H	-0.7603
128	S	H	-0.5678