Project name: 10.39E11

Chain sequence(s)	H: EVQLQQSGPELVKPGASVKIPCKASGYTFSDYNIDWVKQSQGKSPEWIGDINPNFGTTIYNQKFKGKATLTVDKSSNTAYMELRSLTSEDTAVYYCAKLQYGGGYWGQGTTLTVSS; L: DIQMNQSPSSLSASLGDTITITCHASQNINIWLTWYQQKPGNIPKLLIYKASNLPTGVPSRFSGSGSGTRFTLTISSLQPEDIATYYCQQGQSYPRTFGGGTKLEIK
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                                          (00:01:12)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:13)

• Minimal score value: -2.9099
• Maximal score value: 1.4288
• Average score: -0.5945
• Total score value: -132.5682

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	-2.1766
2	V	H	-1.3379
3	Q	H	-2.1143
4	L	H	0.0000
5	Q	H	-2.1399
6	Q	H	0.0000
7	S	H	-1.0521
8	G	H	-0.7903
9	P	H	-0.2922
11	E	H	0.0798
12	L	H	1.0116
13	V	H	-0.1022
14	K	H	-1.6799
15	P	H	-1.5112
16	G	H	-1.2614
17	A	H	-1.0629
18	S	H	-1.2656
19	V	H	0.0000
20	K	H	-1.6351
21	I	H	0.0000
22	P	H	-0.8254
23	C	H	0.0000
24	K	H	-1.7276
25	A	H	0.0000
26	S	H	-1.4170
27	G	H	-1.2813
28	Y	H	-0.7685
29	T	H	-0.7164
30	F	H	0.0000
35	S	H	-1.1814
36	D	H	-1.8860
37	Y	H	-0.9956
38	N	H	-0.8476
39	I	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	-0.7275
45	S	H	-1.1611
46	Q	H	-1.6318
47	G	H	-1.4348
48	K	H	-1.4523
49	S	H	-0.9131
50	P	H	0.0000
51	E	H	-0.7917
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	-0.1484
58	P	H	0.0000
59	N	H	-0.5396
62	F	H	1.4288
63	G	H	0.1780
64	T	H	0.4366
65	T	H	0.4925
66	I	H	0.6303
67	Y	H	-0.4899
68	N	H	-1.5235
69	Q	H	-2.6137
70	K	H	-2.9099
71	F	H	0.0000
72	K	H	-2.7243
74	G	H	-1.9861
75	K	H	-1.7382
76	A	H	0.0000
77	T	H	-0.7846
78	L	H	0.0000
79	T	H	-0.2888
80	V	H	-0.3824
81	D	H	-1.3578
82	K	H	-1.8484
83	S	H	-1.1015
84	S	H	-1.0521
85	N	H	-1.3327
86	T	H	0.0000
87	A	H	0.0000
88	Y	H	-0.2787
89	M	H	0.0000
90	E	H	-1.0952
91	L	H	0.0000
92	R	H	-1.3944
93	S	H	-1.1535
94	L	H	0.0000
95	T	H	-1.1291
96	S	H	-1.1234
97	E	H	-1.2158
98	D	H	0.0000
99	T	H	-0.4452
100	A	H	0.0000
101	V	H	-0.1872
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	L	H	-0.0770
108	Q	H	-0.3837
109	Y	H	0.5793
114	G	H	0.2085
115	G	H	0.0000
116	G	H	-0.1382
117	Y	H	-0.0945
118	W	H	0.0000
119	G	H	0.0000
120	Q	H	-1.3740
121	G	H	-0.7843
122	T	H	0.0000
123	T	H	-0.1160
124	L	H	0.0000
125	T	H	0.0023
126	V	H	0.0000
127	S	H	-0.5782
128	S	H	-0.7044
1	D	L	-2.2319
2	I	L	0.0000
3	Q	L	-2.2717
4	M	L	0.0000
5	N	L	-1.9222
6	Q	L	-1.3439
7	S	L	-0.7478
8	P	L	-0.7225
9	S	L	-0.9022
10	S	L	-1.0799
11	L	L	-0.8686
12	S	L	-1.2363
13	A	L	0.0000
14	S	L	-0.7773
15	L	L	0.1397
16	G	L	-0.5597
17	D	L	-0.7959
18	T	L	-0.4559
19	I	L	0.0000
20	T	L	-0.1957
21	I	L	0.0000
22	T	L	-0.8380
23	C	L	0.0000
24	H	L	-2.0664
25	A	L	0.0000
26	S	L	-2.0211
27	Q	L	-2.2991
28	N	L	-2.1062
29	I	L	0.0000
36	N	L	-1.2829
37	I	L	-0.2617
38	W	L	0.0334
39	L	L	0.0000
40	T	L	0.0514
41	W	L	0.0000
42	Y	L	0.0000
43	Q	L	0.0000
44	Q	L	-1.0426
45	K	L	-1.2775
46	P	L	-0.8585
47	G	L	-1.1820
48	N	L	-1.7466
49	I	L	-0.9396
50	P	L	0.0000
51	K	L	-1.3220
52	L	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	0.0367
56	K	L	-0.3121
57	A	L	0.0000
65	S	L	-0.5367
66	N	L	-0.4558
67	L	L	0.1347
68	P	L	0.1383
69	T	L	-0.2092
70	G	L	-0.3381
71	V	L	-0.1180
72	P	L	-0.2305
74	S	L	-0.3563
75	R	L	-0.6331
76	F	L	0.0000
77	S	L	-0.4356
78	G	L	-0.4748
79	S	L	-0.8486
80	G	L	-1.1172
83	S	L	-1.2496
84	G	L	-1.5609
85	T	L	-1.9052
86	R	L	-2.6048
87	F	L	0.0000
88	T	L	-0.7568
89	L	L	0.0000
90	T	L	-0.2777
91	I	L	0.0000
92	S	L	-0.7524
93	S	L	-0.7076
94	L	L	0.0000
95	Q	L	-0.9550
96	P	L	-0.9668
97	E	L	-1.1777
98	D	L	0.0000
99	I	L	-0.3454
100	A	L	0.0000
101	T	L	-0.8565
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	-0.2668
108	Q	L	-0.5588
109	S	L	-0.1548
114	Y	L	0.4603
115	P	L	0.0000
116	R	L	-0.5247
117	T	L	-0.8131
118	F	L	0.0000
119	G	L	0.0000
120	G	L	-1.2872
121	G	L	0.0000
122	T	L	0.0000
123	K	L	-1.6391
124	L	L	0.0000
125	E	L	-1.7588
126	I	L	-1.0809
127	K	L	-1.7127