Project name: 7DUN

Chain sequence(s)	H: EVQLLESGGGLVQPGGSLRLSCAVSGFTFNSFAMSWVRQAPGKGLEWVSAISGSGGGTYYADSVKGRFTISRDNSKNTLYLQMNSLRAEDTAVYFCAKDKILWFGEPVFDYWGQGTLVTVSS; L: EIVLTQSPATLSLSPGERATLSCRASQSVSSYLAWYQQKPGQAPRLLIYDASNRATGIPARFSGSGSGTDFTLTISSLEPEDFAVYYCQQRSNWPPTFGQGTKVEIK
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                                          (00:00:59)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:00)

• Minimal score value: -2.4402
• Maximal score value: 2.3726
• Average score: -0.4699
• Total score value: -107.6081

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	-1.9724
2	V	H	-0.9308
3	Q	H	-0.7288
4	L	H	0.0000
5	L	H	0.9637
6	E	H	0.3121
7	S	H	-0.2604
8	G	H	-0.7120
9	G	H	0.1513
11	G	H	0.8632
12	L	H	1.4288
13	V	H	-0.0082
14	Q	H	-1.2904
15	P	H	-1.5428
16	G	H	-1.3787
17	G	H	-1.1195
18	S	H	-1.1175
19	L	H	-0.7669
20	R	H	-1.5847
21	L	H	0.0000
22	S	H	-0.3251
23	C	H	0.0000
24	A	H	-0.1638
25	V	H	0.0000
26	S	H	-0.8236
27	G	H	-1.1328
28	F	H	-0.4866
29	T	H	-0.3363
30	F	H	0.0000
35	N	H	-1.0718
36	S	H	0.2644
37	F	H	1.1295
38	A	H	0.0000
39	M	H	0.0000
40	S	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	R	H	0.0000
44	Q	H	-0.6528
45	A	H	-1.0270
46	P	H	-0.8266
47	G	H	-1.4858
48	K	H	-2.3993
49	G	H	-1.6050
50	L	H	0.0000
51	E	H	-0.9139
52	W	H	0.0000
53	V	H	0.0000
54	S	H	0.0000
55	A	H	0.0000
56	I	H	0.0000
57	S	H	0.8042
58	G	H	0.0000
59	S	H	-0.3423
62	G	H	-0.5738
63	G	H	-0.5137
64	G	H	-0.0714
65	T	H	0.2263
66	Y	H	0.3064
67	Y	H	-0.6370
68	A	H	0.0000
69	D	H	-2.3954
70	S	H	-1.7002
71	V	H	0.0000
72	K	H	-2.3937
74	G	H	-1.6435
75	R	H	-1.3861
76	F	H	0.0000
77	T	H	-0.6947
78	I	H	0.0000
79	S	H	-0.4502
80	R	H	-1.0295
81	D	H	-1.5229
82	N	H	-1.7513
83	S	H	-1.6294
84	K	H	-2.4219
85	N	H	-1.9171
86	T	H	-1.0453
87	L	H	0.0000
88	Y	H	-0.4344
89	L	H	0.0000
90	Q	H	-1.0012
91	M	H	0.0000
92	N	H	-1.2669
93	S	H	-1.1904
94	L	H	0.0000
95	R	H	-2.1647
96	A	H	-1.6544
97	E	H	-2.2025
98	D	H	0.0000
99	T	H	-0.3585
100	A	H	0.0000
101	V	H	0.7402
102	Y	H	0.0000
103	F	H	0.0000
104	C	H	0.0000
105	A	H	0.0000
106	K	H	0.0000
107	D	H	0.0000
108	K	H	-0.0054
109	I	H	1.1658
110	L	H	1.8588
111	W	H	2.3726
111A	F	H	2.2879
112A	G	H	0.4398
112	E	H	-0.5602
113	P	H	0.0000
114	V	H	0.0000
115	F	H	0.0000
116	D	H	-0.2804
117	Y	H	0.1049
118	W	H	-0.0711
119	G	H	0.0000
120	Q	H	-0.9414
121	G	H	0.0000
122	T	H	0.5310
123	L	H	1.5358
124	V	H	0.0000
125	T	H	0.3475
126	V	H	0.0000
127	S	H	-0.6505
128	S	H	-0.4549
1	E	L	-1.5221
2	I	L	0.0000
3	V	L	0.7254
4	L	L	0.0000
5	T	L	-0.7041
6	Q	L	0.0000
7	S	L	-0.7715
8	P	L	-0.3478
9	A	L	-0.4263
10	T	L	-0.5247
11	L	L	-0.2803
12	S	L	-0.4739
13	L	L	-0.6367
14	S	L	-0.8641
15	P	L	-1.2225
16	G	L	-1.5324
17	E	L	-1.9397
18	R	L	-2.4402
19	A	L	0.0000
20	T	L	-0.6540
21	L	L	0.0000
22	S	L	-0.8476
23	C	L	0.0000
24	R	L	-2.2687
25	A	L	0.0000
26	S	L	-0.8527
27	Q	L	-1.4356
28	S	L	-1.1411
29	V	L	0.0000
36	S	L	-0.3860
37	S	L	-0.2417
38	Y	L	0.1782
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	0.0000
45	K	L	-1.1708
46	P	L	-0.9551
47	G	L	-1.3192
48	Q	L	-1.8035
49	A	L	-1.1218
50	P	L	0.0000
51	R	L	-0.9344
52	L	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	-0.6861
56	D	L	-0.8598
57	A	L	0.0000
65	S	L	-1.1047
66	N	L	-1.7067
67	R	L	-1.7615
68	A	L	-1.1309
69	T	L	-0.7329
70	G	L	-0.6896
71	I	L	0.0000
72	P	L	-0.4361
74	A	L	-0.3724
75	R	L	-0.6127
76	F	L	0.0000
77	S	L	-0.6648
78	G	L	0.0000
79	S	L	-0.7780
80	G	L	-0.9888
83	S	L	-0.9322
84	G	L	-0.9820
85	T	L	-1.6239
86	D	L	-2.0520
87	F	L	0.0000
88	T	L	-0.7406
89	L	L	0.0000
90	T	L	-0.5816
91	I	L	0.0000
92	S	L	-1.1975
93	S	L	-1.4759
94	L	L	0.0000
95	E	L	-1.7073
96	P	L	-1.0215
97	E	L	-1.7122
98	D	L	0.0000
99	F	L	-0.3219
100	A	L	0.0000
101	V	L	-0.3292
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	R	L	-0.6064
108	S	L	-0.4561
109	N	L	-1.1165
114	W	L	-0.3609
115	P	L	-0.7242
116	P	L	0.0000
117	T	L	-0.1866
118	F	L	0.0074
119	G	L	0.0000
120	Q	L	-1.2684
121	G	L	0.0000
122	T	L	0.0000
123	K	L	-0.7671
124	V	L	0.0000
125	E	L	-0.5045
126	I	L	0.6512
127	K	L	-0.9727