Project name: 2fdf0eca16d54ab

Chain sequence(s)	H: QVQLVQSGAEVKKPGSSVKVSCKASGYSITDDLIHWVRQAPGQGLEWMGWIDPEDGETNYAQKFQGRVTLTADTSTSTAYMELSSLRSEDTAVYYCARSLDSTWIYPFAYWGQGTLVTVSS; L: DIVMTQSPDSLAVSLGERATINCKSSQSLLRRGNQKNHLAWYQQKPGQPPKLLIYDASTGQSGVPDRFSGSGSGTDFTLTISSLQAEDVAVYYCLQSYITPPTFGAGTKVEIK
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                                          (00:03:23)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:25)

• Minimal score value: -3.4093
• Maximal score value: 1.0659
• Average score: -0.6631
• Total score value: -155.1646

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	-1.4661
2	V	H	-0.8427
3	Q	H	-1.1496
4	L	H	0.0000
5	V	H	0.4848
6	Q	H	0.0000
7	S	H	-0.3762
8	G	H	-0.4921
9	A	H	0.1218
11	E	H	0.0336
12	V	H	0.9470
13	K	H	-0.9739
14	K	H	-2.2434
15	P	H	-2.3948
16	G	H	-1.7099
17	S	H	-1.3644
18	S	H	-1.2596
19	V	H	0.0000
20	K	H	-1.3088
21	V	H	0.0000
22	S	H	-0.2851
23	C	H	0.0000
24	K	H	-0.6281
25	A	H	0.0000
26	S	H	-0.7775
27	G	H	-1.0749
28	Y	H	-0.7596
29	S	H	-0.6534
30	I	H	0.0000
35	T	H	-1.8602
36	D	H	-1.9977
37	D	H	0.0000
38	L	H	0.0000
39	I	H	0.0000
40	H	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	R	H	0.0000
44	Q	H	-0.5459
45	A	H	-0.9325
46	P	H	-0.9438
47	G	H	-1.2113
48	Q	H	-1.6502
49	G	H	-0.9055
50	L	H	0.0000
51	E	H	-0.7775
52	W	H	0.0000
53	M	H	0.0000
54	G	H	0.0000
55	W	H	0.0000
56	I	H	0.0000
57	D	H	-2.1746
58	P	H	0.0000
59	E	H	-3.4093
62	D	H	-3.3544
63	G	H	-2.5901
64	E	H	-2.5056
65	T	H	-1.1852
66	N	H	-0.9089
67	Y	H	-1.1134
68	A	H	0.0000
69	Q	H	-2.7435
70	K	H	-2.7429
71	F	H	0.0000
72	Q	H	-2.4649
74	G	H	-1.6465
75	R	H	-1.5108
76	V	H	0.0000
77	T	H	-0.6422
78	L	H	0.0000
79	T	H	-0.5045
80	A	H	-0.6890
81	D	H	-0.9202
82	T	H	-0.9040
83	S	H	-0.4779
84	T	H	-0.5228
85	S	H	-0.6082
86	T	H	0.0000
87	A	H	0.0000
88	Y	H	-0.2828
89	M	H	0.0000
90	E	H	-1.0157
91	L	H	0.0000
92	S	H	-1.0846
93	S	H	-1.3433
94	L	H	0.0000
95	R	H	-3.1930
96	S	H	-2.3986
97	E	H	-2.5432
98	D	H	0.0000
99	T	H	-0.7785
100	A	H	0.0000
101	V	H	0.4341
102	Y	H	0.0000
103	Y	H	0.0000
104	C	H	0.0000
105	A	H	0.0000
106	R	H	-0.1985
107	S	H	0.0000
108	L	H	-0.0786
109	D	H	-1.0877
110	S	H	-0.8422
111	T	H	-0.1722
112A	W	H	0.7114
112	I	H	0.8963
113	Y	H	0.4054
114	P	H	0.0000
115	F	H	0.0000
116	A	H	0.0687
117	Y	H	0.2663
118	W	H	-0.1110
119	G	H	0.0000
120	Q	H	-0.9801
121	G	H	-0.3621
122	T	H	0.0000
123	L	H	0.5516
124	V	H	0.0000
125	T	H	-0.2149
126	V	H	0.0000
127	S	H	-0.9852
128	S	H	-1.0440
1	D	L	-1.3943
2	I	L	0.0000
3	V	L	0.8813
4	M	L	0.0000
5	T	L	-0.4125
6	Q	L	0.0000
7	S	L	-1.1826
8	P	L	-1.2691
9	D	L	-2.1362
10	S	L	-1.4511
11	L	L	-0.7887
12	A	L	-0.4358
13	V	L	-1.0170
14	S	L	-0.9953
15	L	L	-0.0731
16	G	L	-1.2153
17	E	L	-2.7114
18	R	L	-2.7735
19	A	L	0.0000
20	T	L	-0.5922
21	I	L	0.0000
22	N	L	-1.2127
23	C	L	0.0000
24	K	L	-1.6664
25	S	L	0.0000
26	S	L	-0.8113
27	Q	L	-1.3032
28	S	L	-1.1879
29	L	L	0.0000
30	L	L	-1.4877
31	R	L	-2.0755
32	R	L	-3.0360
33	G	L	-2.2489
34	N	L	-2.3530
35	Q	L	-2.7512
36	K	L	-1.8947
37	N	L	0.0000
38	H	L	0.0000
39	L	L	0.0000
40	A	L	0.0000
41	W	L	0.0000
42	Y	L	0.0000
43	Q	L	0.0000
44	Q	L	0.0000
45	K	L	-1.1144
46	P	L	-0.8316
47	G	L	-1.2581
48	Q	L	-1.6937
49	P	L	-1.0869
50	P	L	0.0000
51	K	L	-1.0557
52	L	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	-0.0926
56	D	L	-0.4877
57	A	L	0.0000
65	S	L	-0.6194
66	T	L	-0.4694
67	G	L	-1.0156
68	Q	L	-0.6679
69	S	L	-0.6023
70	G	L	-0.8330
71	V	L	-0.8746
72	P	L	-1.2126
74	D	L	-2.0984
75	R	L	-1.5421
76	F	L	0.0000
77	S	L	-0.8349
78	G	L	-0.5044
79	S	L	-0.7275
80	G	L	-1.0353
83	S	L	-1.0519
84	G	L	-1.1221
85	T	L	-1.3917
86	D	L	-1.9666
87	F	L	0.0000
88	T	L	-0.8194
89	L	L	0.0000
90	T	L	-0.6479
91	I	L	0.0000
92	S	L	-1.7567
93	S	L	-1.8434
94	L	L	0.0000
95	Q	L	-1.4092
96	A	L	-0.6381
97	E	L	-1.4825
98	D	L	0.0000
99	V	L	-0.3529
100	A	L	0.0000
101	V	L	-0.4575
102	Y	L	0.0000
103	Y	L	0.0000
104	C	L	0.0000
105	L	L	0.0000
106	Q	L	0.0000
107	S	L	0.7667
108	Y	L	0.7106
109	I	L	1.0659
114	T	L	0.2043
115	P	L	-0.3486
116	P	L	0.0000
117	T	L	0.2681
118	F	L	0.3374
119	G	L	0.0000
120	A	L	-0.4571
121	G	L	-0.7995
122	T	L	0.0000
123	K	L	-1.3699
124	V	L	0.0000
125	E	L	-0.7860
126	I	L	-0.2449
127	K	L	-1.3195