Project name: 2510-10.pdb

Chain sequence(s)	H: EVQLQQSGAELARPGASVKMSCKASGYTFTSYTIHWVKQRPGQGLEWIGYINPSSGYTNYNQKFKDKATLTADKSSSTAYMQLSSLTSEDSAVYYCARVAMDYWGQGTSVTVSS; L: DIQMTQSPSSLSASLGERVSLTCRASQEISGYLSWLQQKPDGTIKRLIYAASTLDSGVPKRFSGSRSGSDYSLTISSLESEDFADYYCLQYASYPYTFGGGTKLELK
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]                                                (00:00:02)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:02)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with all chain(s) selected           (00:00:02)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:02)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:02)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:02:13)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:15)

• Minimal score value: -3.3548
• Maximal score value: 1.2203
• Average score: -0.645
• Total score value: -142.537

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	-1.9550
2	V	H	-1.0319
3	Q	H	-1.4778
4	L	H	0.0000
5	Q	H	-2.1102
6	Q	H	-1.4294
7	S	H	-1.1457
8	G	H	-0.8590
9	A	H	-0.2288
11	E	H	-0.3441
12	L	H	0.6380
13	A	H	-0.6003
14	R	H	-1.9486
15	P	H	-1.7110
16	G	H	-1.2102
17	A	H	-1.0523
18	S	H	-1.0919
19	V	H	0.0000
20	K	H	-1.3628
21	M	H	0.0000
22	S	H	-0.8071
23	C	H	0.0000
24	K	H	-1.7668
25	A	H	0.0000
26	S	H	-1.1762
27	G	H	-1.0092
28	Y	H	-0.3393
29	T	H	-0.2411
30	F	H	0.0000
35	T	H	-0.6297
36	S	H	-0.1169
37	Y	H	0.3562
38	T	H	0.2869
39	I	H	0.0000
40	H	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	K	H	0.0000
44	Q	H	-0.8412
45	R	H	-1.4235
46	P	H	-1.0453
47	G	H	-1.3435
48	Q	H	-1.9200
49	G	H	-1.3170
50	L	H	0.0000
51	E	H	-1.0935
52	W	H	0.0000
53	I	H	0.0000
54	G	H	0.0000
55	Y	H	0.1996
56	I	H	0.0000
57	N	H	-0.0867
58	P	H	0.0000
59	S	H	-0.5390
62	S	H	-0.1952
63	G	H	-0.1012
64	Y	H	0.8572
65	T	H	0.1849
66	N	H	-0.6117
67	Y	H	-1.2320
68	N	H	-1.9773
69	Q	H	-3.0528
70	K	H	-3.0693
71	F	H	0.0000
72	K	H	-3.3548
74	D	H	-3.1500
75	K	H	-2.1576
76	A	H	0.0000
77	T	H	-0.9516
78	L	H	0.0000
79	T	H	-0.3222
80	A	H	-0.7662
81	D	H	-1.5298
82	K	H	-1.9072
83	S	H	-1.1232
84	S	H	-0.9687
85	S	H	-1.1319
86	T	H	0.0000
87	A	H	0.0000
88	Y	H	-0.3814
89	M	H	0.0000
90	Q	H	-1.0461
91	L	H	0.0000
92	S	H	-1.0656
93	S	H	-1.0492
94	L	H	0.0000
95	T	H	-1.2831
96	S	H	-1.3135
97	E	H	-1.7219
98	D	H	0.0000
99	S	H	-0.5932
100	A	H	0.0000
101	V	H	0.0230
102	Y	H	0.0000
103	Y	H	0.0000
104	C	H	0.0000
105	A	H	0.0000
106	R	H	0.0000
107	V	H	0.6750
108	A	H	0.4461
115	M	H	0.0000
116	D	H	-0.0267
117	Y	H	0.3216
118	W	H	-0.2514
119	G	H	0.0000
120	Q	H	-1.7570
121	G	H	-0.7972
122	T	H	0.0000
123	S	H	-0.1667
124	V	H	0.0000
125	T	H	-0.2042
126	V	H	0.0000
127	S	H	-0.6762
128	S	H	-0.7875
1	D	L	-2.2755
2	I	L	0.0000
3	Q	L	-2.2855
4	M	L	0.0000
5	T	L	-1.3462
6	Q	L	-1.0686
7	S	L	-0.7016
8	P	L	-0.5813
9	S	L	-0.8245
10	S	L	-0.9915
11	L	L	-0.4800
12	S	L	-0.6663
13	A	L	0.0000
14	S	L	-0.8247
15	L	L	-0.5596
16	G	L	-1.3367
17	E	L	-1.8958
18	R	L	-2.3379
19	V	L	0.0000
20	S	L	-0.5844
21	L	L	0.0000
22	T	L	-0.8757
23	C	L	0.0000
24	R	L	-2.8225
25	A	L	0.0000
26	S	L	-2.2360
27	Q	L	-2.6943
28	E	L	-2.2793
29	I	L	0.0000
36	S	L	-0.5536
37	G	L	0.0549
38	Y	L	1.2203
39	L	L	0.0000
40	S	L	0.0000
41	W	L	0.0000
42	L	L	0.0000
43	Q	L	0.0000
44	Q	L	0.0000
45	K	L	-1.5097
46	P	L	-1.3676
47	D	L	-2.2455
48	G	L	-1.4933
49	T	L	-1.2226
50	I	L	0.0000
51	K	L	-0.7234
52	R	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	0.6863
56	A	L	0.5164
57	A	L	0.0000
65	S	L	-0.1973
66	T	L	0.0533
67	L	L	-0.1634
68	D	L	-0.5039
69	S	L	-0.4789
70	G	L	-0.7335
71	V	L	-0.7049
72	P	L	-1.1943
74	K	L	-1.8753
75	R	L	-1.5389
76	F	L	0.0000
77	S	L	-0.5893
78	G	L	-0.4526
79	S	L	-0.9804
80	R	L	-1.8335
83	S	L	-1.3718
84	G	L	-1.4472
85	S	L	-1.9728
86	D	L	-1.9329
87	Y	L	0.0000
88	S	L	-0.9082
89	L	L	0.0000
90	T	L	-0.6121
91	I	L	0.0000
92	S	L	-1.5654
93	S	L	-1.7364
94	L	L	0.0000
95	E	L	-2.1686
96	S	L	-1.3530
97	E	L	-2.0617
98	D	L	0.0000
99	F	L	-0.8344
100	A	L	0.0000
101	D	L	-1.2406
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	Y	L	0.8905
108	A	L	0.4414
109	S	L	0.1847
114	Y	L	0.1677
115	P	L	-0.5474
116	Y	L	0.0000
117	T	L	-0.6275
118	F	L	0.0000
119	G	L	0.0000
120	G	L	-1.0382
121	G	L	0.0000
122	T	L	0.0000
123	K	L	-1.7426
124	L	L	0.0000
125	E	L	-0.9005
126	L	L	0.4239
127	K	L	-1.0952