Project name: 3ec1a91be414b26

Chain sequence(s)	P: HHHH; L: DILMTQTPSSLPVSLGDQASISCRSSQSIVHSNGNTYLKWYLQKPGQSPKLLIYKVSNRFSGVPDRFSGSGSGTDFTLKISRVEAEDLGVYYCFQGSHVPFTFGSGTKLEIKRGGQVQLQQSGPEDVKPGASVKISCKASGYTFTDYWMMWVKQSPGKGLEWIGDINPNNGGTFYNQKFKGRATLTVDKSSSTAYMELRSLTSEDSSVYYCESQSGAYWGQGTTVTVSA
Selected Chain(s)	P,L
Distance of aggregation	10 Å
FoldX usage	Yes
Dynamic mode	No
Automated mutations	No

Simulation log

[INFO]       Logger:   Verbosity set to: 2 - [INFO]                                                (00:00:01)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:01)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with all chain(s) selected           (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:01:55)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:56)

• Minimal score value: -3.0941
• Maximal score value: 0.6089
• Average score: -0.817
• Total score value: -190.3713

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	D	L	-1.5012
2	I	L	0.0000
3	L	L	0.6089
4	M	L	0.0000
5	T	L	-0.5540
6	Q	L	0.0000
7	T	L	-0.5164
8	P	L	-0.4181
9	S	L	-0.5416
10	S	L	-0.8131
11	L	L	-0.8175
12	P	L	-1.4909
13	V	L	0.0000
14	S	L	-1.3028
15	L	L	-0.2208
16	G	L	-1.5438
17	D	L	-2.4349
18	Q	L	-2.8369
19	A	L	0.0000
20	S	L	-1.0762
21	I	L	0.0000
22	S	L	-1.1377
23	C	L	0.0000
24	R	L	-2.2739
25	S	L	0.0000
26	S	L	-0.8870
27	Q	L	-1.3025
28	S	L	-0.7456
29	I	L	0.0000
30	V	L	0.5393
31	H	L	0.0000
32	S	L	-0.9461
33	N	L	-1.5845
34	G	L	-0.9810
35	N	L	-0.8475
36	T	L	-0.3213
37	Y	L	0.0000
38	L	L	0.0000
39	K	L	0.0000
40	W	L	0.0000
41	Y	L	0.0000
42	L	L	0.0000
43	Q	L	0.0000
44	K	L	-1.1710
45	P	L	-0.8068
46	G	L	-1.1895
47	Q	L	-1.5609
48	S	L	-1.1186
49	P	L	0.0000
50	K	L	-1.1674
51	L	L	0.0000
52	L	L	0.0000
53	I	L	0.0000
54	Y	L	-0.4660
55	K	L	-1.1009
56	V	L	-0.7448
57	S	L	-0.9613
58	N	L	-1.5298
59	R	L	-1.5227
60	F	L	-0.6041
61	S	L	-0.4803
62	G	L	-0.7116
63	V	L	-0.7892
64	P	L	-1.2488
65	D	L	-2.4258
66	R	L	-2.3130
67	F	L	0.0000
68	S	L	-1.5703
69	G	L	-1.2609
70	S	L	-1.1443
71	G	L	-1.3070
72	S	L	-1.0157
73	G	L	-0.8884
74	T	L	-1.7241
75	D	L	-2.7512
76	F	L	0.0000
77	T	L	-1.2706
78	L	L	0.0000
79	K	L	-2.4277
80	I	L	0.0000
81	S	L	-2.6389
82	R	L	-3.0541
83	V	L	0.0000
84	E	L	-1.9993
85	A	L	-1.0940
86	E	L	-2.1210
87	D	L	0.0000
88	L	L	-0.8423
89	G	L	0.0000
90	V	L	-0.3285
91	Y	L	0.0000
92	Y	L	0.0000
93	C	L	0.0000
94	F	L	0.0000
95	Q	L	0.0000
96	G	L	0.0000
97	S	L	0.0000
98	H	L	-0.5233
99	V	L	-0.0194
100	P	L	0.0000
101	F	L	0.0000
102	T	L	0.0416
103	F	L	0.0000
104	G	L	0.0000
105	S	L	-0.5032
106	G	L	0.0000
107	T	L	0.0000
108	K	L	-1.0673
109	L	L	0.0000
110	E	L	-1.8586
111	I	L	-1.4606
112	K	L	-2.7068
113	R	L	-3.0941
131	G	L	-1.9025
132	G	L	-1.2575
134	Q	L	-1.4393
135	V	L	-0.8770
136	Q	L	-1.8800
137	L	L	0.0000
138	Q	L	-2.2151
139	Q	L	0.0000
140	S	L	-1.2486
141	G	L	-0.9631
142	P	L	-1.2139
143	E	L	-2.0795
144	D	L	-2.5242
145	V	L	-1.8851
146	K	L	-2.2435
147	P	L	-1.8070
148	G	L	-1.3944
149	A	L	-1.2980
150	S	L	-1.9429
151	V	L	0.0000
152	K	L	-2.4785
153	I	L	0.0000
154	S	L	-0.9588
155	C	L	0.0000
156	K	L	-1.7238
157	A	L	0.0000
158	S	L	-1.1999
159	G	L	-0.9701
160	Y	L	-0.6180
161	T	L	-0.5398
162	F	L	0.0000
163	T	L	-1.7276
164	D	L	-1.8350
165	Y	L	-0.5842
166	W	L	-0.2742
167	M	L	0.0000
168	M	L	0.0000
169	W	L	0.0000
170	V	L	0.0000
171	K	L	-0.5130
172	Q	L	-0.7430
173	S	L	-1.1910
174	P	L	-1.0630
175	G	L	-1.7798
176	K	L	-2.2494
177	G	L	-1.4466
178	L	L	0.0000
179	E	L	-0.8841
180	W	L	0.0000
181	I	L	0.0000
182	G	L	0.0000
183	D	L	0.0000
184	I	L	0.0000
185	N	L	-1.1469
186	P	L	0.0000
187	N	L	-2.6627
188	N	L	-2.1616
189	G	L	-1.3799
190	G	L	-0.9294
191	T	L	-0.0495
192	F	L	0.5487
193	Y	L	-0.0071
194	N	L	0.0000
195	Q	L	-2.3610
196	K	L	-2.6786
197	F	L	0.0000
198	K	L	-2.8490
199	G	L	-2.0644
200	R	L	-2.2178
201	A	L	0.0000
202	T	L	-0.9260
203	L	L	0.0000
204	T	L	-0.1823
205	V	L	-0.8274
206	D	L	-1.5500
207	K	L	-2.2601
208	S	L	-1.2389
209	S	L	-1.1103
210	S	L	-1.1964
211	T	L	0.0000
212	A	L	0.0000
213	Y	L	-0.5573
214	M	L	0.0000
215	E	L	-2.2242
216	L	L	0.0000
217	R	L	-2.6114
218	S	L	-1.5516
219	L	L	0.0000
220	T	L	-1.4792
221	S	L	-1.4527
222	E	L	-2.0598
223	D	L	0.0000
224	S	L	-1.0898
225	S	L	0.0000
226	V	L	0.0568
227	Y	L	0.0000
228	Y	L	0.0000
229	C	L	0.0000
230	E	L	0.0000
231	S	L	0.0000
232	Q	L	-0.1854
233	S	L	0.0216
234	G	L	0.0000
235	A	L	-0.0233
236	Y	L	-0.1207
237	W	L	-0.6541
238	G	L	0.0000
239	Q	L	-1.7361
240	G	L	-1.0059
241	T	L	0.0000
242	T	L	-0.7115
243	V	L	0.0000
244	T	L	-1.4173
245	V	L	0.0000
246	S	L	-1.3093
247	A	L	-0.9018
3	H	P	-1.3171
4	H	P	-0.6325
5	H	P	-0.7171
6	H	P	0.0000