Project name: 22-9.PDB

Chain sequence(s)	H: QVQLVESGGGLVQPGGSLRLSCAASGSISSHNDMSWYREALGNQLELVSFIASGGSTNYADSVKGRFTISRDNSKNTLYLQMNSLRAEDTAVYYCNSRTYDGEKTYWGQGTTVTVSS
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]                                                (00:00:01)
[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 H 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                                          (00:00:52)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:53)

• Minimal score value: -2.9815
• Maximal score value: 1.2064
• Average score: -0.786
• Total score value: -91.9592

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	-1.5649
2	V	H	-1.0949
3	Q	H	-1.1721
4	L	H	0.0000
5	V	H	0.6641
6	E	H	0.0000
7	S	H	-0.4840
8	G	H	-1.0340
9	G	H	-0.4216
11	G	H	0.2617
12	L	H	1.2064
13	V	H	-0.0883
14	Q	H	-1.4677
15	P	H	-1.8619
16	G	H	-1.6224
17	G	H	-1.0741
18	S	H	-1.2431
19	L	H	-0.8487
20	R	H	-1.9979
21	L	H	0.0000
22	S	H	-0.3228
23	C	H	0.0000
24	A	H	-0.1946
25	A	H	-0.6269
26	S	H	-0.7034
27	G	H	-0.8216
28	S	H	-0.8988
29	I	H	0.0000
30	S	H	-1.4948
35	S	H	-1.2030
36	H	H	-1.2849
37	N	H	-0.8772
38	D	H	-0.7694
39	M	H	0.0000
40	S	H	0.0000
41	W	H	0.0000
42	Y	H	0.5163
43	R	H	0.0000
44	E	H	-0.8268
45	A	H	-0.6501
46	L	H	0.4768
47	G	H	-0.6630
48	N	H	-1.7289
49	Q	H	-1.6406
50	L	H	-0.3338
51	E	H	-0.5405
52	L	H	0.3982
53	V	H	0.0000
54	S	H	0.0000
55	F	H	-0.0246
56	I	H	0.0000
57	A	H	-0.9888
58	S	H	-1.2691
59	G	H	-1.0768
63	G	H	-0.9748
64	S	H	-0.8399
65	T	H	-0.8476
66	N	H	-1.4989
67	Y	H	-1.2703
68	A	H	-1.3462
69	D	H	-2.6138
70	S	H	-1.7878
71	V	H	0.0000
72	K	H	-2.7844
74	G	H	-1.7441
75	R	H	-1.7397
76	F	H	0.0000
77	T	H	-0.8707
78	I	H	0.0000
79	S	H	-0.4355
80	R	H	-1.2411
81	D	H	-1.9590
82	N	H	-2.4989
83	S	H	-1.9525
84	K	H	-2.5885
85	N	H	-2.0884
86	T	H	-1.1472
87	L	H	0.0000
88	Y	H	-0.3120
89	L	H	0.0000
90	Q	H	-1.0471
91	M	H	0.0000
92	N	H	-1.4171
93	S	H	-1.4290
94	L	H	0.0000
95	R	H	-2.9815
96	A	H	-2.0128
97	E	H	-2.3045
98	D	H	0.0000
99	T	H	-0.5488
100	A	H	0.0000
101	V	H	0.3452
102	Y	H	0.0000
103	Y	H	0.3844
104	C	H	0.0000
105	N	H	0.0000
106	S	H	0.0000
107	R	H	-1.1906
108	T	H	-1.1892
109	Y	H	-0.9259
110	D	H	-2.1080
113	G	H	-2.2036
114	E	H	-2.7348
115	K	H	-2.3460
116	T	H	-0.8610
117	Y	H	-0.4912
118	W	H	0.2492
119	G	H	-0.1197
120	Q	H	-0.8878
121	G	H	-0.2788
122	T	H	-0.1879
123	T	H	-0.0384
124	V	H	0.0000
125	T	H	-0.0685
126	V	H	0.0000
127	S	H	-0.8796
128	S	H	-0.7524