Project name: 14.40G6

Chain sequence(s)	H: EVQLQQSGPELVKPGASVKISCKASGYTFTDYYMNWVKQSHGKSLEWIGDIYPKNGGTRYNQKFKGKATLTVDKSSSTAYMDLRSLTSEDSAVYYCAKTGDWTVGNFNVWGTGTTVTVSS; L: QIVLTQSPAIMSASPGEKVTISCSASSSVSYMYWYQQKPGSSPKPWIFRTSNLASGVPARFSGSGSGTSYSLTISSMEAEDAATYYCQQFHSYPRTFGGGTKLEIK
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                                          (00:01:36)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:37)

• Minimal score value: -2.9371
• Maximal score value: 1.5549
• Average score: -0.5381
• Total score value: -121.6126

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	-1.9692
2	V	H	-1.0383
3	Q	H	-1.9727
4	L	H	0.0000
5	Q	H	-2.0506
6	Q	H	0.0000
7	S	H	-1.0473
8	G	H	-0.7562
9	P	H	-0.3635
11	E	H	-0.4145
12	L	H	0.8489
13	V	H	-0.2682
14	K	H	-1.7541
15	P	H	-1.5164
16	G	H	-1.2933
17	A	H	-1.0530
18	S	H	-1.2139
19	V	H	0.0000
20	K	H	-1.7940
21	I	H	0.0000
22	S	H	-0.8071
23	C	H	0.0000
24	K	H	-1.8943
25	A	H	0.0000
26	S	H	-1.3443
27	G	H	-1.0698
28	Y	H	-0.4845
29	T	H	-0.2382
30	F	H	0.0000
35	T	H	-1.3745
36	D	H	-0.8357
37	Y	H	0.1026
38	Y	H	0.3235
39	M	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	-1.0175
45	S	H	-1.5114
46	H	H	-1.8957
47	G	H	-1.8265
48	K	H	-2.4701
49	S	H	-1.4718
50	L	H	0.0000
51	E	H	-1.1560
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	Y	H	-0.8350
58	P	H	0.0000
59	K	H	-2.6283
62	N	H	-2.3460
63	G	H	-1.6957
64	G	H	-1.3589
65	T	H	-1.1150
66	R	H	-2.1129
67	Y	H	-1.6932
68	N	H	-1.9593
69	Q	H	-2.7208
70	K	H	-2.4896
71	F	H	0.0000
72	K	H	-2.9371
74	G	H	-1.8810
75	K	H	-1.6581
76	A	H	0.0000
77	T	H	-0.8852
78	L	H	0.0000
79	T	H	-0.3004
80	V	H	-0.9048
81	D	H	-1.3480
82	K	H	-2.2441
83	S	H	-1.0966
84	S	H	-0.9863
85	S	H	-1.1488
86	T	H	0.0000
87	A	H	0.0000
88	Y	H	-0.2097
89	M	H	0.0000
90	D	H	0.0000
91	L	H	0.0000
92	R	H	-1.3460
93	S	H	-1.1517
94	L	H	0.0000
95	T	H	-1.1795
96	S	H	-1.2359
97	E	H	-1.6638
98	D	H	0.0000
99	S	H	-0.5941
100	A	H	0.0000
101	V	H	-0.0089
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	0.0000
108	G	H	-0.1855
109	D	H	-0.0485
110	W	H	0.9523
111	T	H	0.5187
112	V	H	0.2707
113	G	H	0.0000
114	N	H	-0.2336
115	F	H	0.0000
116	N	H	-0.7457
117	V	H	-0.4150
118	W	H	0.0000
119	G	H	0.0000
120	T	H	-0.6019
121	G	H	-0.3778
122	T	H	0.0000
123	T	H	-0.1628
124	V	H	0.0000
125	T	H	-0.1232
126	V	H	0.0000
127	S	H	-0.6223
128	S	H	-0.7423
1	Q	L	-0.8753
2	I	L	0.0000
3	V	L	1.2465
4	L	L	0.0000
5	T	L	0.0796
6	Q	L	0.0000
7	S	L	-0.1082
8	P	L	0.2319
9	A	L	0.5654
10	I	L	1.5549
11	M	L	0.6405
12	S	L	-0.2553
13	A	L	0.0000
14	S	L	-1.4476
15	P	L	-1.6663
16	G	L	-1.8125
17	E	L	-2.4228
18	K	L	-2.5827
19	V	L	0.0000
20	T	L	-0.6273
21	I	L	0.0000
22	S	L	-0.3456
23	C	L	0.0000
24	S	L	-0.1921
25	A	L	0.0000
26	S	L	0.0428
27	S	L	-0.2545
28	S	L	-0.5728
29	V	L	0.0000
37	S	L	-0.3023
38	Y	L	0.2094
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	0.0000
45	K	L	-0.8571
46	P	L	-0.7342
47	G	L	-0.7352
48	S	L	-0.6495
49	S	L	-0.4586
50	P	L	0.0000
51	K	L	-1.0044
52	P	L	-0.5495
53	W	L	0.0000
54	I	L	0.0000
55	F	L	-0.1156
56	R	L	-0.5166
57	T	L	0.0000
65	S	L	-0.6042
66	N	L	-0.7795
67	L	L	-0.0421
68	A	L	-0.2604
69	S	L	-0.4323
70	G	L	-0.4166
71	V	L	-0.0494
72	P	L	-0.2387
74	A	L	-0.0875
75	R	L	-0.7031
76	F	L	0.0000
77	S	L	-0.3735
78	G	L	-0.4752
79	S	L	-0.6264
80	G	L	-0.6043
83	S	L	-0.5125
84	G	L	-0.5057
85	T	L	-0.5036
86	S	L	-0.6443
87	Y	L	0.0000
88	S	L	-0.3949
89	L	L	0.0000
90	T	L	-0.5927
91	I	L	0.0000
92	S	L	-1.3980
93	S	L	-1.7479
94	M	L	0.0000
95	E	L	-1.9366
96	A	L	-1.1695
97	E	L	-1.4590
98	D	L	0.0000
99	A	L	-0.8150
100	A	L	0.0000
101	T	L	-0.4094
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	F	L	-0.1521
108	H	L	-0.7047
109	S	L	-0.5430
114	Y	L	-0.4660
115	P	L	-0.9961
116	R	L	-0.3076
117	T	L	0.0000
118	F	L	0.0000
119	G	L	0.0000
120	G	L	-0.7496
121	G	L	0.0000
122	T	L	0.0000
123	K	L	-0.3901
124	L	L	0.0000
125	E	L	-0.2659
126	I	L	-0.4183
127	K	L	-1.4427