Project name: 1D6B2

Chain sequence(s)	H: QVQLQQSGPELVKPGALVKISCKTSGFTFTSYDINWVKQRPGQGLEWIGWIYPGDGSTKYNEKFKDKATLTADKSSSTAYMQLSSLTSDNSAVYFCARQHYGYGDGAFVYWGQGTLVTVST; L: DIVMSQSPSSLAVSVGEKVTMSCKSSQSLLHSSNQNNYLAWYQQKPGQSPKLLIYWASTRESGVPDRFTGSGSGTDFTLTISSVKAEDLAVYYCQQYYSYPRTFGGGTKLEIK
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                                          (00:03:10)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:12)

• Minimal score value: -3.8094
• Maximal score value: 1.0747
• Average score: -0.5866
• Total score value: -137.2695

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	-1.5195
2	V	H	-0.9847
3	Q	H	-2.0644
4	L	H	0.0000
5	Q	H	-2.2911
6	Q	H	0.0000
7	S	H	-0.9569
8	G	H	-0.6255
9	P	H	0.1431
11	E	H	0.0639
12	L	H	1.0747
13	V	H	0.0837
14	K	H	-1.4009
15	P	H	-1.0368
16	G	H	-0.7293
17	A	H	-0.1279
18	L	H	0.6299
19	V	H	0.0000
20	K	H	-0.8585
21	I	H	0.0000
22	S	H	-0.7775
23	C	H	0.0000
24	K	H	-1.9238
25	T	H	0.0000
26	S	H	-1.2813
27	G	H	-0.9941
28	F	H	-0.2994
29	T	H	-0.0426
30	F	H	0.0000
35	T	H	-0.6160
36	S	H	-0.1919
37	Y	H	0.2481
38	D	H	0.0000
39	I	H	0.0000
40	N	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	K	H	0.0000
44	Q	H	-0.8936
45	R	H	-1.7536
46	P	H	-1.0449
47	G	H	-1.2524
48	Q	H	-1.5573
49	G	H	-1.1307
50	L	H	0.0000
51	E	H	-0.8923
52	W	H	0.0000
53	I	H	0.0000
54	G	H	0.0000
55	W	H	0.1773
56	I	H	0.0000
57	Y	H	-0.2265
58	P	H	0.0000
59	G	H	-1.2158
62	D	H	-2.1102
63	G	H	-1.3763
64	S	H	-0.7733
65	T	H	-0.4291
66	K	H	-0.7338
67	Y	H	-1.5013
68	N	H	0.0000
69	E	H	-3.6879
70	K	H	-3.3742
71	F	H	0.0000
72	K	H	-3.8094
74	D	H	-3.3445
75	K	H	-2.1103
76	A	H	0.0000
77	T	H	-0.8669
78	L	H	0.0000
79	T	H	-0.3599
80	A	H	-0.9323
81	D	H	-1.3635
82	K	H	-1.9085
83	S	H	-1.0309
84	S	H	-0.9577
85	S	H	-1.0951
86	T	H	0.0000
87	A	H	0.0000
88	Y	H	-0.3217
89	M	H	0.0000
90	Q	H	-0.4223
91	L	H	0.0000
92	S	H	-0.3219
93	S	H	-0.5170
94	L	H	0.0000
95	T	H	-1.0655
96	S	H	-1.4269
97	D	H	-2.0958
98	N	H	0.0000
99	S	H	-0.5772
100	A	H	0.0000
101	V	H	0.2523
102	Y	H	0.0000
103	F	H	0.0000
104	C	H	0.0000
105	A	H	0.0000
106	R	H	0.0000
107	Q	H	0.0000
108	H	H	0.0937
109	Y	H	0.4590
110	G	H	0.2165
111	Y	H	0.9054
112A	G	H	0.0202
112	D	H	0.0539
113	G	H	0.0000
114	A	H	0.0000
115	F	H	0.0000
116	V	H	0.0000
117	Y	H	-0.0696
118	W	H	-0.4708
119	G	H	0.0000
120	Q	H	-1.7755
121	G	H	-0.7095
122	T	H	0.0000
123	L	H	0.9637
124	V	H	0.0000
125	T	H	0.2053
126	V	H	0.0000
127	S	H	-0.4465
128	T	H	-0.5418
1	D	L	-1.6098
2	I	L	0.0000
3	V	L	0.6854
4	M	L	0.0000
5	S	L	-0.7405
6	Q	L	-0.7965
7	S	L	-0.8699
8	P	L	-0.5841
9	S	L	-0.7056
10	S	L	-0.7223
11	L	L	-0.4501
12	A	L	-0.5684
13	V	L	0.0000
14	S	L	-0.9801
15	V	L	-0.2026
16	G	L	-1.0063
17	E	L	-2.3419
18	K	L	-2.5248
19	V	L	0.0000
20	T	L	-0.4685
21	M	L	0.0000
22	S	L	-0.9078
23	C	L	0.0000
24	K	L	-2.1454
25	S	L	0.0000
26	S	L	-0.9376
27	Q	L	-1.4726
28	S	L	-1.0039
29	L	L	0.0000
30	L	L	-0.7230
31	H	L	-1.2835
32	S	L	-1.3454
33	S	L	-1.3452
34	N	L	-2.0923
35	Q	L	-2.1455
36	N	L	-1.4713
37	N	L	-0.6470
38	Y	L	0.0115
39	L	L	0.0000
40	A	L	0.0000
41	W	L	0.0000
42	Y	L	0.0000
43	Q	L	0.0000
44	Q	L	-0.8135
45	K	L	-1.1921
46	P	L	-0.8990
47	G	L	-1.4145
48	Q	L	-2.0099
49	S	L	-1.2760
50	P	L	0.0000
51	K	L	-0.7496
52	L	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	-0.1632
56	W	L	-0.3425
57	A	L	0.0000
65	S	L	-0.6034
66	T	L	-0.6267
67	R	L	-1.5355
68	E	L	0.0000
69	S	L	-0.7052
70	G	L	-0.9023
71	V	L	-0.9739
72	P	L	-1.2655
74	D	L	-2.1402
75	R	L	-1.4854
76	F	L	0.0000
77	T	L	-0.7516
78	G	L	0.0000
79	S	L	-0.5777
80	G	L	-1.0334
83	S	L	-1.0436
84	G	L	-1.1394
85	T	L	-1.5443
86	D	L	-2.1105
87	F	L	0.0000
88	T	L	-0.7365
89	L	L	0.0000
90	T	L	-0.5049
91	I	L	0.0000
92	S	L	-1.6910
93	S	L	-1.6680
94	V	L	0.0000
95	K	L	-1.2315
96	A	L	-0.8616
97	E	L	-1.5973
98	D	L	0.0000
99	L	L	-0.1733
100	A	L	0.0000
101	V	L	-0.3644
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	0.0000
108	Y	L	0.5123
109	S	L	0.2428
114	Y	L	0.0184
115	P	L	0.0000
116	R	L	0.0000
117	T	L	0.0340
118	F	L	0.0000
119	G	L	0.0000
120	G	L	-0.7476
121	G	L	0.0000
122	T	L	0.0000
123	K	L	-1.0676
124	L	L	0.0000
125	E	L	-0.9390
126	I	L	-0.7164
127	K	L	-1.4584