Project name: 12.37C5

Chain sequence(s)	H: EVQLQQSGPELVKPGASVKISCKASGYTFTDYYMNWVRQSHGKSLEWIGDINPNNGGTKYNQKFKGKATATVDKSSSTAYMELRSLTSEDSAVYYCAKTGEWTVGIFDVWGTGTTVTVSS; L: QIVLTQSPAIMSASPGEKVTISCSASSSVSYMYWFQQKPGSSPKPWIYRTSNLASGVPGRFSGSGSGSSYSLTVSYMEAEDAATYYCQQYHSYPRTFGGGTKLEIK
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                                          (00:02:09)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:10)

• Minimal score value: -2.9828
• Maximal score value: 1.4006
• Average score: -0.5526
• Total score value: -124.8867

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	-1.9833
2	V	H	-1.0123
3	Q	H	-1.9091
4	L	H	0.0000
5	Q	H	-1.9596
6	Q	H	0.0000
7	S	H	-1.0860
8	G	H	-0.8254
9	P	H	-0.4904
11	E	H	-0.5055
12	L	H	0.7338
13	V	H	-0.2957
14	K	H	-1.6314
15	P	H	-1.3774
16	G	H	-1.2127
17	A	H	-1.0041
18	S	H	-1.2689
19	V	H	0.0000
20	K	H	-1.9961
21	I	H	0.0000
22	S	H	-0.8588
23	C	H	0.0000
24	K	H	-1.6479
25	A	H	0.0000
26	S	H	-1.2805
27	G	H	-1.1055
28	Y	H	-0.6419
29	T	H	-0.4991
30	F	H	0.0000
35	T	H	-1.5675
36	D	H	-1.9492
37	Y	H	-0.5475
38	Y	H	0.1624
39	M	H	0.0000
40	N	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	R	H	0.0000
44	Q	H	-0.9617
45	S	H	-1.5367
46	H	H	-1.9207
47	G	H	-1.7972
48	K	H	-2.4424
49	S	H	-1.4154
50	L	H	0.0000
51	E	H	-0.9663
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	-1.1235
58	P	H	0.0000
59	N	H	-2.3751
62	N	H	-2.1650
63	G	H	-1.5394
64	G	H	-1.2021
65	T	H	-0.8843
66	K	H	-1.4978
67	Y	H	-1.4085
68	N	H	-1.8445
69	Q	H	-2.7820
70	K	H	-2.9305
71	F	H	0.0000
72	K	H	-2.9828
74	G	H	-1.9209
75	K	H	-1.6355
76	A	H	0.0000
77	T	H	-0.8026
78	A	H	-0.3567
79	T	H	-0.3767
80	V	H	-0.8113
81	D	H	-1.3768
82	K	H	-2.0942
83	S	H	-1.0713
84	S	H	-0.9319
85	S	H	-1.0677
86	T	H	0.0000
87	A	H	0.0000
88	Y	H	-0.3951
89	M	H	0.0000
90	E	H	-1.1937
91	L	H	0.0000
92	R	H	-1.3602
93	S	H	-1.0831
94	L	H	0.0000
95	T	H	-1.2703
96	S	H	-1.4329
97	E	H	-2.0591
98	D	H	0.0000
99	S	H	-0.7435
100	A	H	0.0000
101	V	H	-0.0087
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	T	H	0.1816
108	G	H	0.0000
109	E	H	-1.0051
110	W	H	0.9151
111	T	H	0.5275
112	V	H	1.4006
113	G	H	0.0000
114	I	H	0.2738
115	F	H	0.0000
116	D	H	-0.6699
117	V	H	-0.2042
118	W	H	0.0000
119	G	H	0.0000
120	T	H	-0.5854
121	G	H	-0.3796
122	T	H	0.0000
123	T	H	-0.2205
124	V	H	0.0000
125	T	H	-0.1984
126	V	H	0.0000
127	S	H	-0.5756
128	S	H	-0.7413
1	Q	L	-0.7732
2	I	L	0.0000
3	V	L	1.2481
4	L	L	0.0000
5	T	L	0.0749
6	Q	L	0.0000
7	S	L	-0.1296
8	P	L	0.2383
9	A	L	0.5393
10	I	L	1.3770
11	M	L	0.3538
12	S	L	-0.7392
13	A	L	0.0000
14	S	L	-1.5000
15	P	L	-1.3175
16	G	L	-1.2204
17	E	L	-2.1173
18	K	L	-2.1001
19	V	L	0.0000
20	T	L	-0.6443
21	I	L	0.0000
22	S	L	-0.3282
23	C	L	0.0000
24	S	L	-0.2120
25	A	L	0.0000
26	S	L	0.0190
27	S	L	-0.3044
28	S	L	-0.6478
29	V	L	0.0000
37	S	L	-0.5180
38	Y	L	-0.2129
39	M	L	0.0000
40	Y	L	0.0000
41	W	L	0.0000
42	F	L	0.0000
43	Q	L	0.0000
44	Q	L	-0.9590
45	K	L	-1.2137
46	P	L	-0.7724
47	G	L	-0.7965
48	S	L	-0.8001
49	S	L	-0.6127
50	P	L	0.0000
51	K	L	-1.3282
52	P	L	0.0000
53	W	L	0.0000
54	I	L	0.0000
55	Y	L	-0.2760
56	R	L	-0.9463
57	T	L	0.0000
65	S	L	-0.8188
66	N	L	-1.0013
67	L	L	-0.3211
68	A	L	-0.4689
69	S	L	-0.4752
70	G	L	-0.5688
71	V	L	0.0000
72	P	L	-0.3806
74	G	L	-0.5340
75	R	L	0.0000
76	F	L	0.0000
77	S	L	-0.4719
78	G	L	-0.5705
79	S	L	-0.6827
80	G	L	-0.6302
83	S	L	-0.5738
84	G	L	-0.6054
85	S	L	-0.6133
86	S	L	-0.6716
87	Y	L	0.0000
88	S	L	-0.3855
89	L	L	0.0000
90	T	L	-0.4083
91	V	L	0.0000
92	S	L	-0.7679
93	Y	L	-0.4054
94	M	L	0.0000
95	E	L	-0.9246
96	A	L	-1.1019
97	E	L	-1.4737
98	D	L	0.0000
99	A	L	-1.1837
100	A	L	0.0000
101	T	L	-0.6302
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	0.2341
108	H	L	-0.4660
109	S	L	-0.3283
114	Y	L	0.0303
115	P	L	-0.6543
116	R	L	0.0000
117	T	L	0.0000
118	F	L	0.0000
119	G	L	0.0000
120	G	L	-0.7568
121	G	L	0.0000
122	T	L	0.0000
123	K	L	-0.7266
124	L	L	0.0000
125	E	L	-1.2387
126	I	L	-1.0656
127	K	L	-1.8170