Project name: 8ff0cf87b1194cf

Chain sequence(s)	I: DIQMTQSPSSLSASVGDRVTITCQASQDISNYLNWYQQKPGKAPKLLIYDASNLETGVPSRFSGSGSGTDFTFTISSLQPEDIATYFCQHFDHLPLAFGGGTKVEIK; J: QVQLQESGPGLVKPSETLSLTCTVSGGSVSSGDYYWTWIRQSPGKGLEWIGHIYYSGNTNYNPSLKSRLTISIDTSKTQFSLKLSSVTAADTAIYYCVRDRVTGAFDIWGQGTMVTVSS
Selected Chain(s)	I,J
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                                          (00:01:32)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:33)

• Minimal score value: -2.7252
• Maximal score value: 1.0572
• Average score: -0.629
• Total score value: -142.1464

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	D	I	-2.1444
2	I	I	0.0000
3	Q	I	-1.9462
4	M	I	-1.1389
5	T	I	-0.9736
6	Q	I	0.0000
7	S	I	-0.6134
8	P	I	-0.5838
9	S	I	-0.8264
10	S	I	-1.1170
11	L	I	-0.8254
12	S	I	-0.9492
13	A	I	-1.2004
14	S	I	-1.0565
15	V	I	-0.4100
16	G	I	-1.0607
17	D	I	-1.9616
18	R	I	-2.4784
19	V	I	0.0000
20	T	I	-0.6540
21	I	I	0.0000
22	T	I	-0.6942
23	C	I	0.0000
24	Q	I	-1.9530
25	A	I	0.0000
26	S	I	-1.9081
27	Q	I	-2.3777
28	D	I	-2.6095
29	I	I	0.0000
30	S	I	-1.2067
31	N	I	-1.0450
32	Y	I	-0.2740
33	L	I	0.0000
34	N	I	0.0000
35	W	I	0.0000
36	Y	I	0.0000
37	Q	I	0.0000
38	Q	I	-1.5540
39	K	I	-1.9924
40	P	I	-1.2511
41	G	I	-1.7619
42	K	I	-2.7252
43	A	I	-1.7428
44	P	I	0.0000
45	K	I	-1.8937
46	L	I	0.0000
47	L	I	0.0000
48	I	I	0.0000
49	Y	I	-0.4266
50	D	I	-0.9749
51	A	I	0.0000
52	S	I	-0.9628
53	N	I	-1.0893
54	L	I	-0.2472
55	E	I	-0.5234
56	T	I	-0.4095
57	G	I	-0.5232
58	V	I	0.0000
59	P	I	-0.3870
60	S	I	-0.4526
61	R	I	-0.8088
62	F	I	0.0000
63	S	I	-0.4988
64	G	I	-0.5376
65	S	I	-1.0164
66	G	I	-1.1550
67	S	I	-1.3197
68	G	I	-1.7138
69	T	I	-2.1307
70	D	I	-2.6080
71	F	I	0.0000
72	T	I	-0.7421
73	F	I	0.0000
74	T	I	-0.6161
75	I	I	0.0000
76	S	I	-1.4781
77	S	I	-1.3071
78	L	I	0.0000
79	Q	I	-1.0319
80	P	I	-1.2046
81	E	I	-1.8834
82	D	I	0.0000
83	I	I	-0.7459
84	A	I	0.0000
85	T	I	-1.0726
86	Y	I	0.0000
87	F	I	0.0000
88	C	I	0.0000
89	Q	I	0.0000
90	H	I	0.0000
91	F	I	-0.0044
92	D	I	-0.7642
93	H	I	-0.4883
94	L	I	0.0336
95	P	I	-0.2787
96	L	I	0.0000
97	A	I	-0.5335
98	F	I	0.0000
99	G	I	0.0000
100	G	I	-1.0363
101	G	I	-0.7959
102	T	I	0.0000
103	K	I	-1.9513
104	V	I	0.0000
105	E	I	-1.8382
106	I	I	-1.0889
107	K	I	-1.6333
1	Q	J	-1.5756
2	V	J	-1.2728
3	Q	J	-1.9709
4	L	J	0.0000
5	Q	J	-1.8503
6	E	J	0.0000
7	S	J	-0.6594
8	G	J	-0.4328
9	P	J	0.0024
10	G	J	0.5103
11	L	J	0.9814
12	V	J	0.0000
13	K	J	-1.7793
14	P	J	-1.3736
15	S	J	-1.4497
16	E	J	-2.0815
17	T	J	-1.4843
18	L	J	0.0000
19	S	J	-0.9426
20	L	J	0.0000
21	T	J	-0.6666
22	C	J	0.0000
23	T	J	-1.1539
24	V	J	0.0000
25	S	J	-1.4871
26	G	J	-1.2747
27	G	J	-0.9917
28	S	J	-0.7467
29	V	J	0.0000
30	S	J	-0.3061
31	S	J	-0.5415
32	G	J	-0.5369
33	D	J	-1.3133
34	Y	J	-0.1341
35	Y	J	0.3228
36	W	J	0.0000
37	T	J	0.0000
38	W	J	0.0000
39	I	J	0.0000
40	R	J	0.0000
41	Q	J	-0.3881
42	S	J	-0.5800
43	P	J	-0.8683
44	G	J	-1.2455
45	K	J	-1.7426
46	G	J	-1.1550
47	L	J	0.0000
48	E	J	-0.6281
49	W	J	0.0000
50	I	J	0.0000
51	G	J	0.0000
52	H	J	0.0000
53	I	J	0.0000
54	Y	J	0.0679
55	Y	J	0.3373
56	S	J	-0.2699
57	G	J	-0.7467
58	N	J	-1.4060
59	T	J	-0.8394
60	N	J	-0.8576
61	Y	J	-0.7082
62	N	J	0.0000
63	P	J	-1.1872
64	S	J	-0.8752
65	L	J	0.0000
66	K	J	-2.0748
67	S	J	-1.3209
68	R	J	-1.3740
69	L	J	0.0000
70	T	J	-0.9672
71	I	J	0.0000
72	S	J	-0.4665
73	I	J	-0.2602
74	D	J	-1.1342
75	T	J	-0.9366
76	S	J	-1.3515
77	K	J	-2.0890
78	T	J	-1.3868
79	Q	J	-1.1716
80	F	J	0.0000
81	S	J	-0.5435
82	L	J	0.0000
83	K	J	-1.4067
84	L	J	0.0000
85	S	J	-1.1914
86	S	J	-1.1884
87	V	J	0.0000
88	T	J	-0.6279
89	A	J	-0.2324
90	A	J	-0.2020
91	D	J	0.0000
92	T	J	0.3422
93	A	J	0.0000
94	I	J	0.7044
95	Y	J	0.0000
96	Y	J	0.0000
97	C	J	0.0000
98	V	J	0.0000
99	R	J	0.0000
100	D	J	0.0000
101	R	J	-0.1620
102	V	J	0.4826
103	T	J	0.1051
104	G	J	0.2386
105	A	J	0.0000
106	F	J	0.0000
107	D	J	-0.4313
108	I	J	-0.5694
109	W	J	-0.9214
110	G	J	0.0000
111	Q	J	-1.9466
112	G	J	0.0000
113	T	J	-0.0256
114	M	J	1.0572
115	V	J	0.0000
116	T	J	0.4512
117	V	J	0.0000
118	S	J	-0.4318
119	S	J	-0.6372