Project name: 22-1.PDB

Chain sequence(s)	H: QVQLVESGGGLVQPGGSLRLSCAASGSISSHNDMSWYRQAPGKQLELVAFIASGGSTYYADSVKGRFTISRDNSKNTLYLQMNSLRAEDTAVYYCNSRTYDGEKTYWGQGTTVTVSS
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                                          (00:01:04)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:04)

• Minimal score value: -3.0731
• Maximal score value: 1.2153
• Average score: -0.6813
• Total score value: -79.7138

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	-1.6075
2	V	H	-1.1514
3	Q	H	-1.0627
4	L	H	0.0000
5	V	H	1.2153
6	E	H	0.0000
7	S	H	-0.3024
8	G	H	-0.9632
9	G	H	-0.3485
11	G	H	0.3067
12	L	H	1.1913
13	V	H	-0.0246
14	Q	H	-1.3718
15	P	H	-1.4461
16	G	H	-1.4461
17	G	H	-0.9700
18	S	H	-0.9683
19	L	H	-0.7242
20	R	H	-1.7548
21	L	H	0.0000
22	S	H	-0.2212
23	C	H	0.0000
24	A	H	0.0511
25	A	H	-0.3265
26	S	H	-0.6127
27	G	H	-0.7887
28	S	H	-0.8857
29	I	H	0.0000
30	S	H	-1.4367
35	S	H	-1.2175
36	H	H	-1.4113
37	N	H	-1.1107
38	D	H	-1.0018
39	M	H	0.0000
40	S	H	0.0000
41	W	H	0.0000
42	Y	H	0.6416
43	R	H	0.0000
44	Q	H	-0.7011
45	A	H	0.0000
46	P	H	-0.8787
47	G	H	-1.2380
48	K	H	-1.7041
49	Q	H	-1.5297
50	L	H	-0.1583
51	E	H	-0.2432
52	L	H	0.7352
53	V	H	0.0000
54	A	H	0.0000
55	F	H	0.6274
56	I	H	0.0000
57	A	H	-0.7047
58	S	H	-1.2637
59	G	H	-1.0269
63	G	H	-0.6333
64	S	H	-0.2110
65	T	H	0.4379
66	Y	H	1.0683
67	Y	H	-0.0002
68	A	H	-0.7962
69	D	H	-2.2715
70	S	H	-1.6860
71	V	H	0.0000
72	K	H	-2.3593
74	G	H	-1.6848
75	R	H	-1.4720
76	F	H	0.0000
77	T	H	-0.6386
78	I	H	0.0000
79	S	H	-0.5025
80	R	H	-1.1984
81	D	H	-1.8415
82	N	H	-2.3915
83	S	H	-1.8762
84	K	H	-2.4768
85	N	H	-1.8702
86	T	H	0.0000
87	L	H	0.0000
88	Y	H	-0.3997
89	L	H	0.0000
90	Q	H	-1.1628
91	M	H	0.0000
92	N	H	-1.3107
93	S	H	-1.2291
94	L	H	0.0000
95	R	H	-2.2300
96	A	H	-1.6677
97	E	H	-2.1853
98	D	H	0.0000
99	T	H	-0.6479
100	A	H	0.0000
101	V	H	0.2383
102	Y	H	0.0000
103	Y	H	0.5429
104	C	H	0.0000
105	N	H	0.0000
106	S	H	0.0000
107	R	H	-1.6931
108	T	H	-1.5679
109	Y	H	-1.4621
110	D	H	-2.3348
113	G	H	-2.4305
114	E	H	-3.0731
115	K	H	-2.9021
116	T	H	-1.2549
117	Y	H	-0.7560
118	W	H	0.1697
119	G	H	0.0169
120	Q	H	-0.7586
121	G	H	-0.1298
122	T	H	-0.1008
123	T	H	0.0099
124	V	H	0.0000
125	T	H	0.0118
126	V	H	0.0000
127	S	H	-0.5923
128	S	H	-0.5761