Project name: 22-3.pdb

Chain sequence(s)	H: QVQLVESGGGLVQPGGSLRLSCAASGSISSHNDMSWYRQAPGQRLELVSFIASGGSTYYADSVKGRFTISRDNSKNTLYLQMNSLRAEDTAVYYCNSRTYDGEKTYWGQGTTVTVSS
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             (00:00:01)
[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                                          (00:00:42)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:43)

• Minimal score value: -2.9593
• Maximal score value: 1.2217
• Average score: -0.7359
• Total score value: -86.098

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	-1.5988
2	V	H	-1.1467
3	Q	H	-1.0568
4	L	H	0.0000
5	V	H	1.2217
6	E	H	0.0000
7	S	H	-0.3121
8	G	H	-0.9783
9	G	H	-0.3414
11	G	H	0.3076
12	L	H	1.1939
13	V	H	0.0043
14	Q	H	-1.3356
15	P	H	-1.5635
16	G	H	-1.3874
17	G	H	-0.9461
18	S	H	-0.9373
19	L	H	-0.6927
20	R	H	-1.7081
21	L	H	0.0000
22	S	H	-0.2556
23	C	H	0.0000
24	A	H	0.0261
25	A	H	-0.3321
26	S	H	-0.6035
27	G	H	-0.7967
28	S	H	-0.8710
29	I	H	0.0000
30	S	H	-1.3966
35	S	H	-1.1969
36	H	H	-1.5032
37	N	H	-1.1228
38	D	H	-1.0015
39	M	H	0.0000
40	S	H	0.0000
41	W	H	0.0000
42	Y	H	0.2499
43	R	H	0.0000
44	Q	H	-1.4257
45	A	H	-1.6061
46	P	H	-1.2720
47	G	H	-1.6913
48	Q	H	-2.5532
49	R	H	-2.6168
50	L	H	-0.7610
51	E	H	-0.8927
52	L	H	0.2474
53	V	H	0.0000
54	S	H	0.0000
55	F	H	0.6721
56	I	H	0.0000
57	A	H	-0.6872
58	S	H	-1.2449
59	G	H	-1.0315
63	G	H	-0.6310
64	S	H	-0.2195
65	T	H	0.4421
66	Y	H	1.1117
67	Y	H	0.0074
68	A	H	-0.7963
69	D	H	-2.1480
70	S	H	-1.6307
71	V	H	0.0000
72	K	H	-2.1745
74	G	H	-1.6052
75	R	H	-1.3762
76	F	H	0.0000
77	T	H	-0.5745
78	I	H	0.0000
79	S	H	-0.5069
80	R	H	-1.2253
81	D	H	-1.8128
82	N	H	-2.3270
83	S	H	-1.8394
84	K	H	-2.4699
85	N	H	-1.8840
86	T	H	-1.0334
87	L	H	0.0000
88	Y	H	-0.4805
89	L	H	0.0000
90	Q	H	-1.0644
91	M	H	0.0000
92	N	H	-1.2715
93	S	H	-1.2062
94	L	H	0.0000
95	R	H	-2.0788
96	A	H	-1.6020
97	E	H	-2.1699
98	D	H	0.0000
99	T	H	-0.6360
100	A	H	0.0000
101	V	H	0.2574
102	Y	H	0.0000
103	Y	H	0.5906
104	C	H	0.0000
105	N	H	0.0000
106	S	H	0.0000
107	R	H	-1.4785
108	T	H	-1.5895
109	Y	H	-1.6386
110	D	H	-2.4189
113	G	H	-2.2906
114	E	H	-2.9593
115	K	H	-2.7117
116	T	H	-1.2217
117	Y	H	-0.6297
118	W	H	0.2334
119	G	H	0.0491
120	Q	H	-0.7324
121	G	H	-0.0997
122	T	H	-0.0696
123	T	H	0.0262
124	V	H	0.0000
125	T	H	0.0435
126	V	H	0.0000
127	S	H	-0.7402
128	S	H	-0.5710