Project name: 18b7705fc4b431e

Chain sequence(s)	H: QVQLKESGPGLVAPSQSLSITCTVSGFSLSRYSVHWVRQPPGKGLEWLGMIWGGGSTDYNSALKSRLRIIKDNSKSQVFLKMNSLQTDDTAMYYCAKDWGPYYAMDYWGQGTSVTVSS; L: QIVLTQSPAVMSASLGEEITLTCSASSSVYFMHWYQQKSGTSPKLLIYSTSNLASGVPSRFSGSGSGTFYSLTISSVEAEDAADYYCHQWSGYLTFGGGTKLELK
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                                          (00:00:58)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:59)

• Minimal score value: -2.5181
• Maximal score value: 1.5852
• Average score: -0.431
• Total score value: -96.1218

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	-1.4745
2	V	H	-1.0600
3	Q	H	-1.8368
4	L	H	0.0000
5	K	H	-2.0679
6	E	H	0.0000
7	S	H	-0.8648
8	G	H	-0.3494
9	P	H	-0.0729
11	G	H	0.2641
12	L	H	1.2310
13	V	H	0.0000
14	A	H	-0.3852
15	P	H	-1.0357
16	S	H	-1.4354
17	Q	H	-1.8585
18	S	H	-1.6913
19	L	H	0.0000
20	S	H	-1.0171
21	I	H	0.0000
22	T	H	-0.3904
23	C	H	0.0000
24	T	H	-1.1725
25	V	H	0.0000
26	S	H	-1.3766
27	G	H	-1.1008
28	F	H	-0.7841
29	S	H	-1.0875
30	L	H	0.0000
35	S	H	-1.5455
36	R	H	-1.9089
37	Y	H	-0.5967
38	S	H	0.0000
39	V	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	-0.6903
45	P	H	0.0000
46	P	H	-1.0776
47	G	H	-1.2414
48	K	H	-1.7991
49	G	H	-1.2111
50	L	H	0.0000
51	E	H	-0.7880
52	W	H	0.0000
53	L	H	0.0000
54	G	H	0.0000
55	M	H	0.0000
56	I	H	0.0000
57	W	H	-0.3323
58	G	H	-1.1285
59	G	H	-0.8895
63	G	H	-0.6318
64	S	H	-0.3500
65	T	H	-0.4931
66	D	H	-0.7848
67	Y	H	0.0000
68	N	H	-0.7726
69	S	H	-0.8118
70	A	H	-0.5646
71	L	H	0.0000
72	K	H	-1.6579
74	S	H	-1.3592
75	R	H	-1.7875
76	L	H	0.0000
77	R	H	-2.4573
78	I	H	0.0000
79	I	H	-0.0399
80	K	H	-0.7454
81	D	H	-1.7185
82	N	H	-2.3892
83	S	H	-1.9096
84	K	H	-2.5181
85	S	H	-1.8212
86	Q	H	-1.4314
87	V	H	0.0000
88	F	H	-0.0899
89	L	H	0.0000
90	K	H	-1.7591
91	M	H	0.0000
92	N	H	-2.5104
93	S	H	-1.6115
94	L	H	0.0000
95	Q	H	-2.2301
96	T	H	-1.6053
97	D	H	-2.2465
98	D	H	0.0000
99	T	H	-0.7595
100	A	H	0.0000
101	M	H	-0.0039
102	Y	H	0.0000
103	Y	H	0.0000
104	C	H	0.0000
105	A	H	0.0000
106	K	H	0.0000
107	D	H	0.0000
108	W	H	0.9437
109	G	H	0.1470
110	P	H	0.2082
112	Y	H	0.6157
113	Y	H	0.8381
114	A	H	0.0000
115	M	H	0.0000
116	D	H	0.2243
117	Y	H	0.0828
118	W	H	-0.4765
119	G	H	0.0000
120	Q	H	-1.6968
121	G	H	-0.9294
122	T	H	-0.6870
123	S	H	-0.1846
124	V	H	0.0000
125	T	H	0.0186
126	V	H	0.0000
127	S	H	-0.3435
128	S	H	-0.1062
1	Q	L	-0.6600
2	I	L	0.4668
3	V	L	1.3933
4	L	L	0.0000
5	T	L	0.3610
6	Q	L	0.0000
7	S	L	-0.2075
8	P	L	0.0050
9	A	L	0.1785
10	V	L	0.5376
11	M	L	-0.0708
12	S	L	-0.9837
13	A	L	0.0000
14	S	L	-1.0701
15	L	L	0.0163
16	G	L	-1.0724
17	E	L	-2.1085
18	E	L	-2.3792
19	I	L	0.0000
20	T	L	-0.4736
21	L	L	0.0000
22	T	L	0.1587
23	C	L	0.0000
24	S	L	0.7170
25	A	L	0.0000
26	S	L	0.3642
27	S	L	0.0499
28	S	L	0.1937
29	V	L	0.0000
37	Y	L	1.4083
38	F	L	1.1236
39	M	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	0.0000
45	K	L	-1.2089
46	S	L	-0.7460
47	G	L	-0.8642
48	T	L	-0.8635
49	S	L	-0.6844
50	P	L	0.0000
51	K	L	-0.7476
52	L	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	0.2927
56	S	L	0.3753
57	T	L	0.0603
65	S	L	-0.4611
66	N	L	-0.6286
67	L	L	-0.0193
68	A	L	-0.2351
69	S	L	-0.3887
70	G	L	-0.5102
71	V	L	-0.1818
72	P	L	-0.2280
74	S	L	-0.3277
75	R	L	-0.7879
76	F	L	0.0000
77	S	L	-0.3987
78	G	L	0.0000
79	S	L	-0.2361
80	G	L	0.2651
83	S	L	0.4147
84	G	L	0.4473
85	T	L	0.7205
86	F	L	1.5852
87	Y	L	0.0000
88	S	L	0.1594
89	L	L	0.0000
90	T	L	-0.5863
91	I	L	0.0000
92	S	L	-1.6503
93	S	L	-1.5255
94	V	L	0.0000
95	E	L	-1.5443
96	A	L	-1.2084
97	E	L	-1.5860
98	D	L	0.0000
99	A	L	-1.4556
100	A	L	0.0000
101	D	L	-1.0741
102	Y	L	0.0000
103	Y	L	0.0000
104	C	L	0.0000
105	H	L	0.0000
106	Q	L	0.0000
107	W	L	0.7336
108	S	L	0.2045
114	G	L	-0.1955
115	Y	L	-0.0384
116	L	L	0.0000
117	T	L	0.1995
118	F	L	0.0000
119	G	L	0.0000
120	G	L	-0.7869
121	G	L	-0.6966
122	T	L	0.0000
123	K	L	-1.4364
124	L	L	0.0000
125	E	L	-2.0429
126	L	L	-1.3215
127	K	L	-1.6806