Project name: test

Chain sequence(s)	H: EVQLLESGGGLVQPGGSLRLSCAASGFTFSSYAMSWVRQAPGKGLEWVSAISGSGGSTYYADSVKGRFTISRDNSKNTLYLQMNSLRAEDTAVYYCAILGATSLSAFDIWGQGTMVTVSS; L: EIVLTQSPGTLSLSPGERATLSCRASQSVSSSYLAWYQQKPGQAPRLLIYGASSRATGIPDRFSGSGSGTDFTLTISRLEPEDFAVYYCQQYGSSPLTFGQGTKVEIK
Selected Chain(s)	H,L
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 all 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                                          (00:01:42)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:44)

• Minimal score value: -3.118
• Maximal score value: 1.2516
• Average score: -0.6209
• Total score value: -141.5732

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	E	H	-2.0825
2	V	H	-1.1906
3	Q	H	-1.2458
4	L	H	0.0000
5	L	H	0.5836
6	E	H	0.0000
7	S	H	-0.3494
8	G	H	-0.6631
9	G	H	-0.0670
10	G	H	0.4608
11	L	H	1.2516
12	V	H	-0.0318
13	Q	H	-1.3354
14	P	H	-1.6012
15	G	H	-1.4116
16	G	H	-0.9825
17	S	H	-1.0117
18	L	H	-0.5177
19	R	H	-1.1802
20	L	H	0.0000
21	S	H	-0.2145
22	C	H	0.0000
23	A	H	-0.1824
24	A	H	0.0000
25	S	H	-0.8599
26	G	H	-1.2061
27	F	H	-0.4981
28	T	H	-0.2202
29	F	H	0.0000
30	S	H	-0.5883
31	S	H	-0.2391
32	Y	H	0.1312
33	A	H	0.0103
34	M	H	0.0000
35	S	H	0.0000
36	W	H	0.0000
37	V	H	0.0000
38	R	H	0.0000
39	Q	H	-0.7451
40	A	H	-1.1287
41	P	H	-0.9246
42	G	H	-1.4552
43	K	H	-2.3845
44	G	H	-1.5892
45	L	H	0.0000
46	E	H	-0.9619
47	W	H	0.0000
48	V	H	0.0000
49	S	H	0.0000
50	A	H	0.0000
51	I	H	0.0000
52	S	H	-0.1988
52A	G	H	-0.4441
53	S	H	-0.6821
54	G	H	-0.7468
55	G	H	-0.6959
56	S	H	-0.1890
57	T	H	0.3641
58	Y	H	0.7180
59	Y	H	-0.3802
60	A	H	-1.1808
61	D	H	-2.3757
62	S	H	-1.7347
63	V	H	0.0000
64	K	H	-2.4288
65	G	H	-1.7237
66	R	H	-1.4273
67	F	H	0.0000
68	T	H	-0.5621
69	I	H	0.0000
70	S	H	-0.3952
71	R	H	-0.9945
72	D	H	-1.5061
73	N	H	-1.7248
74	S	H	-1.5723
75	K	H	-2.3326
76	N	H	-1.6912
77	T	H	-0.9901
78	L	H	0.0000
79	Y	H	-0.2747
80	L	H	0.0000
81	Q	H	-0.7378
82	M	H	0.0000
82A	N	H	-1.1560
82B	S	H	-1.2136
82C	L	H	0.0000
83	R	H	-2.1558
84	A	H	-1.6416
85	E	H	-2.1934
86	D	H	0.0000
87	T	H	-0.5044
88	A	H	0.0000
89	V	H	0.3571
90	Y	H	0.0000
91	Y	H	0.0000
92	C	H	0.0000
93	A	H	0.0000
94	I	H	0.0000
95	L	H	0.0329
96	G	H	-0.2001
97	A	H	-0.0803
98	T	H	-0.0448
99	S	H	-0.0397
100	L	H	0.1102
100A	S	H	-0.0174
100B	A	H	0.0000
100C	F	H	0.0000
101	D	H	-0.9571
102	I	H	-0.3340
103	W	H	-0.4963
104	G	H	0.0000
105	Q	H	-1.3230
106	G	H	-0.4498
107	T	H	0.0301
108	M	H	0.6425
109	V	H	0.0000
110	T	H	0.1317
111	V	H	0.0000
112	S	H	-0.7214
113	S	H	-0.5639
1	E	L	-1.6135
2	I	L	0.0000
3	V	L	0.6394
4	L	L	0.0000
5	T	L	-0.7854
6	Q	L	0.0000
7	S	L	-1.0031
8	P	L	-0.6585
9	G	L	-1.1199
10	T	L	-1.0424
11	L	L	-0.7753
12	S	L	-0.7784
13	L	L	-1.0831
14	S	L	-1.5331
15	P	L	-1.5531
16	G	L	-1.8048
17	E	L	-2.4393
18	R	L	-2.9788
19	A	L	0.0000
20	T	L	-0.7905
21	L	L	0.0000
22	S	L	-0.9066
23	C	L	0.0000
24	R	L	-2.3553
25	A	L	0.0000
26	S	L	-1.0317
27	Q	L	-1.7479
28	S	L	-1.4250
29	V	L	0.0000
30	S	L	-0.5204
30A	S	L	-0.5178
31	S	L	-0.0965
32	Y	L	0.2694
33	L	L	0.0000
34	A	L	0.0000
35	W	L	0.0000
36	Y	L	0.0000
37	Q	L	0.0000
38	Q	L	0.0000
39	K	L	-1.2122
40	P	L	-0.8128
41	G	L	-1.4113
42	Q	L	-2.0600
43	A	L	-1.3324
44	P	L	0.0000
45	R	L	-1.7123
46	L	L	0.0000
47	L	L	0.0000
48	I	L	0.0000
49	Y	L	-0.1914
50	G	L	-0.1975
51	A	L	0.0000
52	S	L	-0.7166
53	S	L	-0.8524
54	R	L	-1.7462
55	A	L	0.0000
56	T	L	-0.6931
57	G	L	-0.8715
58	I	L	-1.0877
59	P	L	-1.3083
60	D	L	-2.4137
61	R	L	-1.9129
62	F	L	0.0000
63	S	L	-0.9671
64	G	L	0.0000
65	S	L	-0.6588
66	G	L	-1.1043
67	S	L	-1.0633
68	G	L	-1.2279
69	T	L	-1.8058
70	D	L	-2.2068
71	F	L	0.0000
72	T	L	-0.7646
73	L	L	0.0000
74	T	L	-0.8023
75	I	L	0.0000
76	S	L	-2.2780
77	R	L	-3.1180
78	L	L	0.0000
79	E	L	-1.6066
80	P	L	-1.3947
81	E	L	-1.6000
82	D	L	0.0000
83	F	L	0.0013
84	A	L	0.0000
85	V	L	-0.5931
86	Y	L	0.0000
87	Y	L	0.0000
88	C	L	0.0000
89	Q	L	0.0000
90	Q	L	0.0000
91	Y	L	0.0000
92	G	L	-0.3436
93	S	L	-0.6485
94	S	L	-0.4961
95	P	L	-0.7350
96	L	L	-0.0446
97	T	L	-0.1192
98	F	L	0.0778
99	G	L	0.0000
100	Q	L	-1.4129
101	G	L	0.0000
102	T	L	0.0000
103	K	L	-1.6189
104	V	L	0.0000
105	E	L	-1.1028
106	I	L	-0.9852
107	K	L	-1.6442