Project name: b687c8662faaa36

Chain sequence(s)	H: QIQLVQSGPELKKPGETVKISCKASGYTFTNSGMNWVKQAPGKGLKWMGWIHPNTGEPTYTEEFKGRFAFSLETSATTAYLQINNLKNEDTATYFCARDYRDYFDYWGQGTTLTVSS; L: DIVMTQSPATLSVTPGDRVSLSCRASQSISDYLHWYQQKSHESPRLLIKYASQSISGIPSRFSGSGSGSDFTLSINSVEPEDVGVYYCQNGHSFPPTFGGGTKLEIK
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                                          (00:01:51)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:52)

• Minimal score value: -3.2835
• Maximal score value: 1.1485
• Average score: -0.718
• Total score value: -160.836

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	-1.3776
2	I	H	-0.7388
3	Q	H	-1.0096
4	L	H	0.0000
5	V	H	0.2525
6	Q	H	0.0000
7	S	H	-0.6835
8	G	H	-0.7578
9	P	H	-0.4705
11	E	H	-0.3252
12	L	H	0.6473
13	K	H	-1.0504
14	K	H	-2.4162
15	P	H	-2.6803
16	G	H	-2.3985
17	E	H	-2.0110
18	T	H	-1.8481
19	V	H	0.0000
20	K	H	-1.8931
21	I	H	0.0000
22	S	H	-0.5214
23	C	H	0.0000
24	K	H	-0.9522
25	A	H	0.0000
26	S	H	-0.7576
27	G	H	-0.9039
28	Y	H	-0.5335
29	T	H	-0.4338
30	F	H	0.0000
35	T	H	-1.2432
36	N	H	-1.5930
37	S	H	0.0000
38	G	H	0.0000
39	M	H	0.0000
40	N	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	K	H	-0.9807
44	Q	H	-1.2324
45	A	H	-1.4548
46	P	H	-1.2675
47	G	H	-1.4589
48	K	H	-2.4033
49	G	H	-1.6382
50	L	H	0.0000
51	K	H	-1.7992
52	W	H	0.0000
53	M	H	0.0000
54	G	H	0.0000
55	W	H	-0.0485
56	I	H	0.0000
57	H	H	-1.4897
58	P	H	0.0000
59	N	H	-2.0696
62	T	H	-1.4634
63	G	H	-1.7096
64	E	H	-2.2518
65	P	H	-0.9954
66	T	H	-0.5708
67	Y	H	-0.8710
68	T	H	0.0000
69	E	H	-3.2124
70	E	H	-3.2802
71	F	H	0.0000
72	K	H	-3.0610
74	G	H	-1.9700
75	R	H	-1.7085
76	F	H	0.0000
77	A	H	-0.7692
78	F	H	0.0000
79	S	H	-0.6860
80	L	H	-0.6277
81	E	H	-1.0375
82	T	H	-0.8803
83	S	H	-0.4899
84	A	H	-0.5968
85	T	H	-0.6446
86	T	H	0.0000
87	A	H	0.0000
88	Y	H	-0.4957
89	L	H	0.0000
90	Q	H	-1.1233
91	I	H	0.0000
92	N	H	-1.8212
93	N	H	-2.4347
94	L	H	0.0000
95	K	H	-3.2835
96	N	H	-3.1046
97	E	H	-2.8680
98	D	H	0.0000
99	T	H	-1.2324
100	A	H	0.0000
101	T	H	-0.4323
102	Y	H	0.0000
103	F	H	0.0000
104	C	H	0.0000
105	A	H	0.0000
106	R	H	-0.3490
107	D	H	-0.6352
108	Y	H	-0.4244
109	R	H	-1.6882
113	D	H	-1.0588
114	Y	H	0.0000
115	F	H	0.0000
116	D	H	-0.1815
117	Y	H	0.1452
118	W	H	0.0000
119	G	H	0.0000
120	Q	H	-1.2733
121	G	H	-0.8234
122	T	H	0.0000
123	T	H	-0.3686
124	L	H	0.0000
125	T	H	-0.6090
126	V	H	0.0000
127	S	H	-1.1500
128	S	H	-0.9633
1	D	L	-1.1716
2	I	L	0.0000
3	V	L	0.6998
4	M	L	0.0000
5	T	L	-0.6279
6	Q	L	-0.6774
7	S	L	-0.7222
8	P	L	-0.3444
9	A	L	-0.3307
10	T	L	-0.4002
11	L	L	-0.2792
12	S	L	-0.5999
13	V	L	0.0000
14	T	L	-1.4475
15	P	L	-1.6519
16	G	L	-1.8227
17	D	L	-2.2386
18	R	L	-2.8061
19	V	L	0.0000
20	S	L	-0.8470
21	L	L	0.0000
22	S	L	-0.9287
23	C	L	0.0000
24	R	L	-2.3565
25	A	L	0.0000
26	S	L	-0.9983
27	Q	L	-1.7283
28	S	L	-1.5447
29	I	L	0.0000
36	S	L	-1.1335
37	D	L	-1.3919
38	Y	L	-0.5947
39	L	L	0.0000
40	H	L	0.0000
41	W	L	0.0000
42	Y	L	0.0000
43	Q	L	0.0000
44	Q	L	-0.6675
45	K	L	-0.8939
46	S	L	-0.8861
47	H	L	-1.6744
48	E	L	-1.6628
49	S	L	-1.0937
50	P	L	0.0000
51	R	L	-0.5903
52	L	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	K	L	-0.5467
56	Y	L	-0.7326
57	A	L	0.0000
65	S	L	-0.9741
66	Q	L	-1.0814
67	S	L	-0.7103
68	I	L	-0.3052
69	S	L	-0.2852
70	G	L	-0.4487
71	I	L	-0.1638
72	P	L	-0.2640
74	S	L	-0.5757
75	R	L	-1.2004
76	F	L	0.0000
77	S	L	-0.8208
78	G	L	-0.6067
79	S	L	-0.9228
80	G	L	-1.3354
83	S	L	-1.3652
84	G	L	-1.4297
85	S	L	-1.9978
86	D	L	-2.4627
87	F	L	0.0000
88	T	L	-0.8473
89	L	L	0.0000
90	S	L	0.0000
91	I	L	0.0000
92	N	L	-2.5025
93	S	L	-2.1603
94	V	L	0.0000
95	E	L	-1.7799
96	P	L	-1.1706
97	E	L	-0.9615
98	D	L	0.0000
99	V	L	0.2034
100	G	L	-0.2124
101	V	L	-0.0403
102	Y	L	0.0000
103	Y	L	0.0000
104	C	L	0.0000
105	Q	L	0.0000
106	N	L	0.0000
107	G	L	-0.5497
108	H	L	-0.5635
109	S	L	0.0473
114	F	L	1.1485
115	P	L	0.0542
116	P	L	0.0100
117	T	L	-0.1943
118	F	L	0.0000
119	G	L	0.0000
120	G	L	-0.8864
121	G	L	-0.7149
122	T	L	0.0000
123	K	L	-0.7266
124	L	L	0.0000
125	E	L	-0.4881
126	I	L	-0.6656
127	K	L	-1.6500