Project name: 16cdcd3e56ff31a

Chain sequence(s)	H: EVQLVERLSCAASGFNLYSSSIHWVRQALEWVAYIYSSSGSTSYADSVKGRFTISADTSKNTAYLQVYYCARGYYSWYKASWALADYW; L: DIQMTQSPSVTITCRASQSVSSAVAWYQQKPGKAPKLLIYSASSLYSGVPSRFSGSRSGTDFTLTISSLQPEDFATYYCQQGSSLGLLTFGQGTKV
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]                                                (00:00:00)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:00)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with all chain(s) selected           (00:00:00)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:00)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:00)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:01:25)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:26)

• Minimal score value: -3.0296
• Maximal score value: 1.656
• Average score: -0.4424
• Total score value: -81.4017

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
4	E	H	-1.8618
5	V	H	-1.0086
6	Q	H	-1.2060
7	L	H	0.0000
8	V	H	0.5649
9	E	H	-0.5105
22	R	H	-2.1804
23	L	H	-1.0159
24	S	H	-0.6965
25	C	H	0.0000
26	A	H	-0.6177
27	A	H	0.0000
28	S	H	-0.9685
29	G	H	-1.1860
30	F	H	-0.7792
31	N	H	-1.1041
32	L	H	0.0000
33	Y	H	0.4807
34	S	H	0.0700
35	S	H	0.0415
36	S	H	0.0000
37	I	H	0.0000
38	H	H	0.0000
39	W	H	0.0000
40	V	H	0.0000
41	R	H	-0.2380
42	Q	H	-0.0802
43	A	H	0.1137
48	L	H	-0.6471
49	E	H	-1.4274
50	W	H	0.0000
51	V	H	0.0000
52	A	H	0.0000
53	Y	H	0.0000
54	I	H	0.0000
55	Y	H	0.2391
56	S	H	-0.1180
57	S	H	-0.0034
58	S	H	-0.3288
59	G	H	-0.4497
60	S	H	-0.3477
61	T	H	-0.1550
62	S	H	-0.1996
63	Y	H	-0.7510
64	A	H	-1.4614
65	D	H	-2.4787
66	S	H	-1.7711
67	V	H	0.0000
68	K	H	-3.0296
69	G	H	-2.3550
70	R	H	-2.6460
71	F	H	-1.7711
72	T	H	-1.3152
73	I	H	0.0000
74	S	H	-0.5634
75	A	H	-0.7012
76	D	H	-1.4884
77	T	H	-1.2186
78	S	H	-1.4420
79	K	H	-2.3458
80	N	H	-1.4965
81	T	H	0.0000
82	A	H	0.0000
83	Y	H	-0.9311
84	L	H	0.0000
85	Q	H	-2.1833
96	V	H	1.6481
97	Y	H	0.7526
98	Y	H	0.0000
99	C	H	0.0000
100	A	H	0.0000
101	R	H	-0.2906
102	G	H	0.1305
103	Y	H	0.9375
104	Y	H	1.5836
105	S	H	0.0000
106	W	H	1.6560
107	Y	H	1.1582
108	K	H	-0.6610
109	A	H	0.3850
110	S	H	0.0000
111	W	H	0.0000
112	A	H	0.0000
113	L	H	0.0000
114	A	H	-0.3585
115	D	H	-0.9203
116	Y	H	0.0000
117	W	H	0.2173
1	D	L	-2.0442
2	I	L	-1.3953
3	Q	L	-1.9969
4	M	L	0.0000
5	T	L	-1.3658
6	Q	L	0.0000
7	S	L	-0.7929
8	P	L	-0.6045
9	S	L	-0.8470
19	V	L	1.4846
20	T	L	0.4795
21	I	L	0.0000
22	T	L	-0.6407
23	C	L	0.0000
24	R	L	-2.7029
25	A	L	0.0000
26	S	L	-1.7735
27	Q	L	-1.9352
28	S	L	-1.0870
29	V	L	-0.4235
36	S	L	-0.8432
37	S	L	-0.8184
38	A	L	-0.3247
39	V	L	0.0000
40	A	L	0.0000
41	W	L	0.0000
42	Y	L	0.0000
43	Q	L	-0.8611
44	Q	L	-1.1500
45	K	L	-1.4539
46	P	L	-0.9652
47	G	L	-1.2853
48	K	L	-2.1061
49	A	L	-1.0207
50	P	L	0.0000
51	K	L	-1.5714
52	L	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	0.5259
56	S	L	0.0000
57	A	L	0.0000
65	S	L	-0.4263
66	S	L	0.1842
67	L	L	0.4152
68	Y	L	0.2003
69	S	L	-0.1747
70	G	L	-0.4721
71	V	L	0.0000
72	P	L	-0.4095
74	S	L	-0.4675
75	R	L	-0.5454
76	F	L	0.0000
77	S	L	-0.3759
78	G	L	-0.5147
79	S	L	-1.1196
80	R	L	-2.0995
83	S	L	-1.5049
84	G	L	-1.3237
85	T	L	-1.6363
86	D	L	-1.8361
87	F	L	0.0000
88	T	L	-0.7761
89	L	L	0.0000
90	T	L	0.1581
91	I	L	0.0000
92	S	L	-0.0732
93	S	L	0.0193
94	L	L	0.5770
95	Q	L	-0.6291
96	P	L	-0.7873
97	E	L	-1.4278
98	D	L	0.0000
99	F	L	1.2007
100	A	L	0.0000
101	T	L	0.0000
102	Y	L	0.0000
103	Y	L	0.0000
104	C	L	0.0000
105	Q	L	0.0000
106	Q	L	0.0000
107	G	L	0.0000
108	S	L	0.5238
109	S	L	0.7156
113	L	L	1.6499
114	G	L	0.0000
115	L	L	0.8665
116	L	L	0.0000
117	T	L	-0.5570
118	F	L	0.0000
119	G	L	-1.2403
120	Q	L	-1.6121
121	G	L	-1.0263
122	T	L	0.0000
123	K	L	-1.0886
124	V	L	1.0623