Project name: a1d8ad3ed3c6280

Chain sequence(s)	H: QVQLVQSGAEVKKPGASVKVSCKASGFTLTNYGMNWVRQARGQRLEWIGWINTDTGEPTYADDFKGRFVFSLDTSVSTAYLQISSLKAEDTAVYYCARNPPYYYGTNNAEAMDYWGQGTTVTVSS; L: DIQMTQSPSSLSASVGDRVTITCSSSQDISNYLNWYLQKPGQSPQLLIYYTSTLHLGVPSRFSGSGSGTEFTLTISSLQPDDFATYYCQQYYNLPWTFGQGTKVEIK
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                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:01:55)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:57)

• Minimal score value: -3.2992
• Maximal score value: 2.1527
• Average score: -0.4932
• Total score value: -114.4165

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	Q	H	-1.4819
2	V	H	-0.8524
3	Q	H	-1.1733
4	L	H	0.0000
5	V	H	0.4162
6	Q	H	0.0000
7	S	H	-0.4513
8	G	H	-0.5753
9	A	H	-0.0002
11	E	H	0.1078
12	V	H	0.9400
13	K	H	-0.8370
14	K	H	-2.0562
15	P	H	-1.9680
16	G	H	-1.4233
17	A	H	-1.1985
18	S	H	-1.1814
19	V	H	0.0000
20	K	H	-1.2154
21	V	H	0.0000
22	S	H	-0.3513
23	C	H	0.0000
24	K	H	-0.3716
25	A	H	0.0000
26	S	H	-0.6508
27	G	H	-0.9943
28	F	H	-0.5755
29	T	H	-0.4123
30	L	H	0.0000
35	T	H	-1.3431
36	N	H	-1.1505
37	Y	H	-0.6465
38	G	H	0.0000
39	M	H	0.0000
40	N	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	R	H	-0.7173
44	Q	H	-1.2643
45	A	H	0.0000
46	R	H	-2.6692
47	G	H	-2.0781
48	Q	H	-2.4518
49	R	H	-1.8482
50	L	H	0.0000
51	E	H	-1.0888
52	W	H	0.0000
53	I	H	0.0000
54	G	H	0.0000
55	W	H	-0.2315
56	I	H	0.0000
57	N	H	-1.7436
58	T	H	0.0000
59	D	H	-2.4348
62	T	H	-1.6719
63	G	H	-1.7246
64	E	H	-2.2953
65	P	H	-0.8431
66	T	H	-0.6026
67	Y	H	-0.9837
68	A	H	0.0000
69	D	H	-3.2992
70	D	H	-3.2724
71	F	H	0.0000
72	K	H	-2.9318
74	G	H	-1.8063
75	R	H	-1.2253
76	F	H	0.0000
77	V	H	0.3805
78	F	H	0.0000
79	S	H	-0.2441
80	L	H	-0.5228
81	D	H	-0.4643
82	T	H	-0.5389
83	S	H	0.0443
84	V	H	0.5337
85	S	H	-0.0416
86	T	H	0.0000
87	A	H	0.0000
88	Y	H	-0.0977
89	L	H	0.0000
90	Q	H	-0.5877
91	I	H	0.0000
92	S	H	-0.8002
93	S	H	-1.1339
94	L	H	0.0000
95	K	H	-2.2882
96	A	H	-1.8046
97	E	H	-2.3829
98	D	H	0.0000
99	T	H	-1.0266
100	A	H	0.0000
101	V	H	-0.2943
102	Y	H	0.0000
103	Y	H	0.0000
104	C	H	0.0000
105	A	H	0.0000
106	R	H	0.0000
107	N	H	0.0000
108	P	H	0.1548
109	P	H	0.5450
110	Y	H	1.6668
111	Y	H	2.1527
111A	Y	H	1.8408
111B	G	H	0.3222
112C	T	H	-0.0916
112B	N	H	-1.0726
112A	N	H	-0.8493
112	A	H	-0.5293
113	E	H	-0.3183
114	A	H	0.0000
115	M	H	0.0000
116	D	H	0.1165
117	Y	H	0.1211
118	W	H	-0.0722
119	G	H	0.0000
120	Q	H	-1.2493
121	G	H	-0.5965
122	T	H	0.0000
123	T	H	-0.1957
124	V	H	0.0000
125	T	H	-0.1690
126	V	H	0.0000
127	S	H	-0.8100
128	S	H	-0.8507
1	D	L	-2.2521
2	I	L	0.0000
3	Q	L	-1.7512
4	M	L	0.0000
5	T	L	-0.7527
6	Q	L	0.0000
7	S	L	-0.3926
8	P	L	-0.5376
9	S	L	-0.6982
10	S	L	-0.9174
11	L	L	-0.5062
12	S	L	-0.6814
13	A	L	0.0000
14	S	L	-0.0403
15	V	L	0.8618
16	G	L	-0.3777
17	D	L	-1.3950
18	R	L	-2.0922
19	V	L	0.0000
20	T	L	-0.5797
21	I	L	0.0000
22	T	L	-0.5791
23	C	L	0.0000
24	S	L	-1.4031
25	S	L	0.0000
26	S	L	-1.6574
27	Q	L	-2.0156
28	D	L	-2.3046
29	I	L	0.0000
36	S	L	-0.6275
37	N	L	-0.4215
38	Y	L	0.3556
39	L	L	0.0000
40	N	L	0.0000
41	W	L	0.0000
42	Y	L	0.0000
43	L	L	0.0000
44	Q	L	-1.0571
45	K	L	-1.4482
46	P	L	-1.0037
47	G	L	-1.3790
48	Q	L	-1.9753
49	S	L	-1.2665
50	P	L	0.0000
51	Q	L	-0.9934
52	L	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	0.6136
56	Y	L	0.8084
57	T	L	0.0000
65	S	L	0.0205
66	T	L	0.4944
67	L	L	0.7027
68	H	L	0.6269
69	L	L	1.3505
70	G	L	0.3409
71	V	L	0.2364
72	P	L	-0.1020
74	S	L	-0.4156
75	R	L	-0.8199
76	F	L	0.0000
77	S	L	-0.3296
78	G	L	-0.1455
79	S	L	-0.6816
80	G	L	-1.0669
83	S	L	-1.2268
84	G	L	-1.6172
85	T	L	-1.9075
86	E	L	-2.4071
87	F	L	0.0000
88	T	L	-0.6472
89	L	L	0.0000
90	T	L	0.0000
91	I	L	0.0000
92	S	L	-1.3158
93	S	L	-0.9946
94	L	L	0.0000
95	Q	L	-0.5834
96	P	L	-0.5843
97	D	L	-1.8417
98	D	L	0.0000
99	F	L	-0.3945
100	A	L	0.0000
101	T	L	-0.8229
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	0.0000
108	Y	L	0.2695
109	N	L	-0.3171
114	L	L	0.3280
115	P	L	-0.4755
116	W	L	0.0000
117	T	L	-0.6207
118	F	L	0.0000
119	G	L	0.0000
120	Q	L	-1.1776
121	G	L	0.0000
122	T	L	0.0000
123	K	L	-1.2443
124	V	L	0.0000
125	E	L	-0.7742
126	I	L	0.7991
127	K	L	-0.8212