Project name: 11.40B9

Chain sequence(s)	H: EVQLQQSGPELVKPGASVKISCKASGYTFTDYNMDWVKQSHGKSLEWIGDINPKIGTTFYNQKFKGKAALTLDKSSSTAYMELRSLASEDSAVYYCATMTYDGYGGWGQGTSVTVSS; L: DIQMNQSPSSLSASLGDTITITCHASQNINVWLRWYQQKPGNIPKLLIYKASNLHTGVPSRFSGSGSGTGFTLTISSLQPEDIATYYCQQGQSYPRTFGGGTKLEIK
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                                          (00:01:33)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:35)

• Minimal score value: -2.9041
• Maximal score value: 1.0379
• Average score: -0.6049
• Total score value: -135.4866

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	E	H	-1.7757
2	V	H	-0.6338
3	Q	H	-1.8871
4	L	H	0.0000
5	Q	H	-2.1774
6	Q	H	0.0000
7	S	H	-1.0383
8	G	H	-0.8484
9	P	H	-0.2852
11	E	H	0.0511
12	L	H	0.9764
13	V	H	-0.1092
14	K	H	-1.6022
15	P	H	-1.3543
16	G	H	-1.1725
17	A	H	-0.9950
18	S	H	-1.1296
19	V	H	0.0000
20	K	H	-1.2409
21	I	H	0.0000
22	S	H	-0.6225
23	C	H	0.0000
24	K	H	-1.5363
25	A	H	0.0000
26	S	H	-1.1428
27	G	H	-0.9741
28	Y	H	-0.5673
29	T	H	-0.4667
30	F	H	0.0000
35	T	H	-1.5894
36	D	H	-2.0710
37	Y	H	-0.6990
38	N	H	-0.6116
39	M	H	0.0000
40	D	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	K	H	0.0000
44	Q	H	-1.0274
45	S	H	-1.6294
46	H	H	-1.9425
47	G	H	-1.7760
48	K	H	-2.4948
49	S	H	-1.5185
50	L	H	0.0000
51	E	H	-1.1677
52	W	H	0.0000
53	I	H	0.0000
54	G	H	0.0000
55	D	H	0.0000
56	I	H	0.0000
57	N	H	-0.4741
58	P	H	0.0000
59	K	H	-1.6242
62	I	H	0.7755
63	G	H	-0.1619
64	T	H	0.3156
65	T	H	0.6947
66	F	H	1.0379
67	Y	H	-0.2653
68	N	H	0.0000
69	Q	H	-2.5820
70	K	H	-2.9041
71	F	H	0.0000
72	K	H	-2.6790
74	G	H	-1.9313
75	K	H	-1.7583
76	A	H	0.0000
77	A	H	-0.6995
78	L	H	0.0000
79	T	H	-0.3674
80	L	H	-0.6432
81	D	H	-1.6716
82	K	H	-2.2008
83	S	H	-1.2403
84	S	H	-1.0008
85	S	H	-1.1645
86	T	H	0.0000
87	A	H	0.0000
88	Y	H	-0.1345
89	M	H	0.0000
90	E	H	-0.9219
91	L	H	0.0000
92	R	H	-1.3032
93	S	H	-1.1135
94	L	H	0.0000
95	A	H	-1.2400
96	S	H	-1.4189
97	E	H	-2.0460
98	D	H	0.0000
99	S	H	-0.6845
100	A	H	0.0000
101	V	H	-0.1567
102	Y	H	0.0000
103	Y	H	0.0000
104	C	H	0.0000
105	A	H	0.0000
106	T	H	0.0000
107	M	H	0.0000
108	T	H	0.0977
109	Y	H	0.9714
113	D	H	-0.1365
114	G	H	0.0000
115	Y	H	0.0000
116	G	H	-0.4667
117	G	H	-0.3379
118	W	H	0.0000
119	G	H	0.0000
120	Q	H	-1.7942
121	G	H	-0.8998
122	T	H	0.0000
123	S	H	-0.2855
124	V	H	0.0000
125	T	H	-0.0879
126	V	H	0.0000
127	S	H	-0.5097
128	S	H	-0.6744
1	D	L	-2.3130
2	I	L	0.0000
3	Q	L	-2.3461
4	M	L	0.0000
5	N	L	-1.7886
6	Q	L	-1.2154
7	S	L	-0.7646
8	P	L	-0.6536
9	S	L	-0.8669
10	S	L	-0.9997
11	L	L	-0.7091
12	S	L	-1.0303
13	A	L	0.0000
14	S	L	-0.6730
15	L	L	0.1277
16	G	L	-0.5143
17	D	L	-0.9088
18	T	L	-0.5390
19	I	L	0.0000
20	T	L	-0.1896
21	I	L	0.0000
22	T	L	-0.5949
23	C	L	0.0000
24	H	L	-1.9165
25	A	L	0.0000
26	S	L	-2.0448
27	Q	L	-2.6550
28	N	L	-2.3294
29	I	L	0.0000
36	N	L	-1.4350
37	V	L	-0.3831
38	W	L	-0.2608
39	L	L	0.0000
40	R	L	0.0000
41	W	L	0.0000
42	Y	L	0.0000
43	Q	L	0.0000
44	Q	L	-1.0500
45	K	L	-1.4736
46	P	L	-0.9776
47	G	L	-1.3735
48	N	L	-1.9051
49	I	L	-0.9423
50	P	L	0.0000
51	K	L	-1.2956
52	L	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	-0.4456
56	K	L	-0.7289
57	A	L	0.0000
65	S	L	-0.6700
66	N	L	-0.9740
67	L	L	-0.1391
68	H	L	-0.4944
69	T	L	-0.3637
70	G	L	-0.4377
71	V	L	-0.2627
72	P	L	-0.2883
74	S	L	-0.3761
75	R	L	-0.6105
76	F	L	0.0000
77	S	L	-0.4113
78	G	L	-0.4825
79	S	L	-0.6081
80	G	L	-0.6870
83	S	L	-0.8877
84	G	L	-1.3055
85	T	L	-1.4697
86	G	L	-1.0037
87	F	L	0.0000
88	T	L	-0.4433
89	L	L	0.0000
90	T	L	-0.2603
91	I	L	0.0000
92	S	L	-0.7779
93	S	L	-0.7093
94	L	L	0.0000
95	Q	L	-0.8875
96	P	L	-0.9631
97	E	L	-1.3050
98	D	L	0.0000
99	I	L	-0.4755
100	A	L	0.0000
101	T	L	-0.8843
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	-0.1440
108	Q	L	-0.7565
109	S	L	-0.6299
114	Y	L	0.0705
115	P	L	0.0000
116	R	L	0.0000
117	T	L	-0.8210
118	F	L	0.0000
119	G	L	0.0000
120	G	L	-1.4509
121	G	L	0.0000
122	T	L	0.0000
123	K	L	-1.6754
124	L	L	0.0000
125	E	L	-1.5402
126	I	L	-0.8214
127	K	L	-1.5972