Project name: 6.33E12

Chain sequence(s)	H: QVQLQQSGAELVRPGTSVKVTCKASGYAFTNYLIEWIKQRPGQGLEWIGVINPGSGGTNYNGKFKGKATLTADKSSNTAHMQVSSLTSEDSAVYFCTRLGHYDYNYFDFWGQGTTLTVSS; L: QIVLTQSPAIMSASPGEKVTISCSASSSISYMYWYQQKPGSSPKPWIYRTSNLASGVPARFSGSGSGTSYSLTISSMEAEDAATYYCQQYHSYPRTFGGGTKLEIK
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                                          (00:01:24)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:25)

• Minimal score value: -2.7779
• Maximal score value: 1.4152
• Average score: -0.5536
• Total score value: -125.1147

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	-1.5234
2	V	H	-0.9255
3	Q	H	-1.7508
4	L	H	0.0000
5	Q	H	-1.8924
6	Q	H	0.0000
7	S	H	-1.0540
8	G	H	-0.6554
9	A	H	0.0754
11	E	H	0.2076
12	L	H	1.0560
13	V	H	-0.1358
14	R	H	-1.7915
15	P	H	-1.4515
16	G	H	-1.1857
17	T	H	-0.9457
18	S	H	-1.0176
19	V	H	0.0000
20	K	H	-1.8530
21	V	H	0.0000
22	T	H	-0.9989
23	C	H	0.0000
24	K	H	-1.6470
25	A	H	0.0000
26	S	H	-1.1901
27	G	H	-0.9991
28	Y	H	-0.5525
29	A	H	-0.5299
30	F	H	0.0000
35	T	H	-1.2564
36	N	H	-1.2686
37	Y	H	-0.3013
38	L	H	-0.1515
39	I	H	0.0000
40	E	H	0.0000
41	W	H	0.0000
42	I	H	0.0000
43	K	H	0.0000
44	Q	H	-0.8367
45	R	H	-1.4332
46	P	H	-1.0494
47	G	H	-1.3391
48	Q	H	-1.9231
49	G	H	-1.2869
50	L	H	0.0000
51	E	H	-1.0429
52	W	H	0.0000
53	I	H	0.0000
54	G	H	0.0000
55	V	H	0.0000
56	I	H	0.0000
57	N	H	-1.0584
58	P	H	0.0000
59	G	H	-1.2405
62	S	H	-0.9760
63	G	H	-1.2230
64	G	H	-1.0683
65	T	H	-0.9704
66	N	H	-1.4202
67	Y	H	-1.2594
68	N	H	-1.4644
69	G	H	-1.9780
70	K	H	-2.5719
71	F	H	0.0000
72	K	H	-2.7779
74	G	H	-1.7599
75	K	H	-1.5227
76	A	H	0.0000
77	T	H	-0.9891
78	L	H	0.0000
79	T	H	-0.8545
80	A	H	-1.2733
81	D	H	-1.9053
82	K	H	-2.3859
83	S	H	-1.4138
84	S	H	-1.2473
85	N	H	-1.5856
86	T	H	0.0000
87	A	H	0.0000
88	H	H	-0.9641
89	M	H	0.0000
90	Q	H	-1.2214
91	V	H	0.0000
92	S	H	-0.8529
93	S	H	-0.8770
94	L	H	0.0000
95	T	H	-1.3165
96	S	H	-1.4862
97	E	H	-2.0221
98	D	H	0.0000
99	S	H	-0.6162
100	A	H	0.0000
101	V	H	0.0510
102	Y	H	0.0000
103	F	H	0.0000
104	C	H	0.0000
105	T	H	0.0000
106	R	H	0.0000
107	L	H	0.0000
108	G	H	0.0000
109	H	H	-0.6273
110	Y	H	0.1532
111	D	H	-1.2983
112	Y	H	-0.4418
113	N	H	-0.4638
114	Y	H	-0.0262
115	F	H	0.0000
116	D	H	-0.2205
117	F	H	0.0194
118	W	H	-0.5161
119	G	H	0.0000
120	Q	H	-1.5782
121	G	H	-0.7955
122	T	H	0.0000
123	T	H	0.0077
124	L	H	0.0000
125	T	H	-0.0170
126	V	H	0.0000
127	S	H	-0.6884
128	S	H	-0.8161
1	Q	L	-0.6826
2	I	L	0.0000
3	V	L	1.2981
4	L	L	0.0000
5	T	L	0.0947
6	Q	L	0.0000
7	S	L	-0.0746
8	P	L	0.2729
9	A	L	0.5900
10	I	L	1.4152
11	M	L	0.4562
12	S	L	-0.5710
13	A	L	0.0000
14	S	L	-1.5742
15	P	L	-1.5207
16	G	L	-1.9235
17	E	L	-2.6239
18	K	L	-2.6119
19	V	L	0.0000
20	T	L	-0.6761
21	I	L	0.0000
22	S	L	-0.3187
23	C	L	0.0000
24	S	L	-0.1937
25	A	L	0.0000
26	S	L	0.0197
27	S	L	-0.3612
28	S	L	-0.5856
29	I	L	0.0000
37	S	L	-0.3555
38	Y	L	-0.0805
39	M	L	0.0000
40	Y	L	0.0000
41	W	L	0.0000
42	Y	L	0.0000
43	Q	L	0.0000
44	Q	L	-1.1157
45	K	L	-1.4762
46	P	L	-0.8503
47	G	L	-0.9719
48	S	L	-1.1245
49	S	L	-0.9746
50	P	L	0.0000
51	K	L	-1.5210
52	P	L	-0.6129
53	W	L	0.0000
54	I	L	0.0000
55	Y	L	0.0376
56	R	L	-0.4857
57	T	L	0.0000
65	S	L	-0.3946
66	N	L	-0.3396
67	L	L	0.1411
68	A	L	-0.2754
69	S	L	-0.3475
70	G	L	-0.4234
71	V	L	-0.2701
72	P	L	-0.3476
74	A	L	-0.1354
75	R	L	-0.7764
76	F	L	0.0000
77	S	L	-0.3264
78	G	L	0.0000
79	S	L	-0.5598
80	G	L	-0.6513
83	S	L	-0.5838
84	G	L	-0.5624
85	T	L	-0.5291
86	S	L	-0.6293
87	Y	L	0.0000
88	S	L	-0.3733
89	L	L	0.0000
90	T	L	-0.6161
91	I	L	0.0000
92	S	L	-1.4809
93	S	L	-1.8314
94	M	L	0.0000
95	E	L	-1.8758
96	A	L	-1.5133
97	E	L	-2.1773
98	D	L	0.0000
99	A	L	-1.3457
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	Y	L	-0.1322
108	H	L	-0.6948
109	S	L	-0.2359
114	Y	L	0.2708
115	P	L	-0.3635
116	R	L	0.0000
117	T	L	0.0868
118	F	L	0.0000
119	G	L	0.0000
120	G	L	-0.7480
121	G	L	0.0000
122	T	L	0.0000
123	K	L	-0.6242
124	L	L	0.0000
125	E	L	-1.1391
126	I	L	-0.5572
127	K	L	-1.4405