Project name: dae53a3ef211772

Chain sequence(s)	L: DFVLTQSPHSLSVTPGESASISCKSSHSLIHGDRNNYLAWYVQKPGRSPQLLIYLASSRASGVPDRFSGSGSDKDFTLKISRVETEDVGTYYCMQGRESPWTFGQGTKVDIKDKTHTASELTQDPAVSVALKQTVTITCRGDSLRSHYASWYQKKPGQAPVLLFYGKNNRPSGIPDRFSGSASGNRASLTITGAQAEDEADYYCSSRDKSGSRLSVFGGGTKLTVLDKTHTRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRG
Selected Chain(s)	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 L 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                                          (00:04:44)
[INFO]       Main:     Simulation completed successfully.                                          (00:04:47)

• Minimal score value: -3.9202
• Maximal score value: 1.9565
• Average score: -1.0232
• Total score value: -343.7817

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	-0.7697
2	F	L	1.1422
3	V	L	1.9565
4	L	L	0.7214
5	T	L	-0.3922
6	Q	L	0.0000
7	S	L	-0.9803
8	P	L	-0.9792
9	H	L	-1.6862
10	S	L	-1.4010
11	L	L	-0.9284
12	S	L	-1.1410
13	V	L	-0.9940
14	T	L	-2.1118
15	P	L	-2.3662
16	G	L	-2.4841
17	E	L	-2.9069
18	S	L	-2.2880
19	A	L	-1.2527
20	S	L	-0.8205
21	I	L	0.0000
22	S	L	-0.9375
23	C	L	0.0000
24	K	L	-1.6725
25	S	L	-0.6778
26	S	L	-0.3295
27	H	L	-1.2330
28	S	L	-1.7839
29	L	L	0.0000
30	I	L	-1.5933
31	H	L	-2.1764
32	G	L	-2.3249
34	D	L	-3.1595
35	R	L	-3.3879
36	N	L	-2.1965
37	N	L	-1.1930
38	Y	L	-0.0231
39	L	L	0.0000
40	A	L	0.0000
41	W	L	0.0000
42	Y	L	0.3413
43	V	L	0.0000
44	Q	L	-1.4661
45	K	L	-1.8949
46	P	L	-1.7014
47	G	L	-1.7391
48	R	L	-2.6317
49	S	L	-1.6951
50	P	L	-1.2801
51	Q	L	-0.9675
52	L	L	0.3015
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	0.9459
56	L	L	0.8090
57	A	L	0.0314
65	S	L	-0.2237
66	S	L	-0.2153
67	R	L	-0.9474
68	A	L	-0.4352
69	S	L	-0.5021
70	G	L	-0.7851
71	V	L	-0.8639
72	P	L	-1.3836
74	D	L	-2.3155
75	R	L	-2.2030
76	F	L	0.0000
77	S	L	-1.4509
78	G	L	0.0000
79	S	L	-0.8140
80	G	L	-1.2681
83	S	L	-1.7683
84	D	L	-2.6811
85	K	L	-2.3810
86	D	L	-2.1864
87	F	L	0.0000
88	T	L	-0.9311
89	L	L	0.0000
90	K	L	-1.9914
91	I	L	0.0000
92	S	L	-2.6989
93	R	L	-3.4580
94	V	L	0.0000
95	E	L	-3.0658
96	T	L	-1.8734
97	E	L	-2.3334
98	D	L	0.0000
99	V	L	-1.1902
100	G	L	0.0000
101	T	L	-1.2680
102	Y	L	0.0000
103	Y	L	0.0933
104	C	L	0.0000
105	M	L	1.1964
106	Q	L	0.0000
107	G	L	-0.0566
108	R	L	-1.2099
109	E	L	-1.0756
114	S	L	-0.6903
115	P	L	-0.0546
116	W	L	0.9242
117	T	L	1.2680
118	F	L	1.6720
119	G	L	0.3029
120	Q	L	-1.0567
121	G	L	0.0000
122	T	L	0.0000
123	K	L	-2.3486
124	V	L	-1.3641
125	D	L	-2.0971
126	I	L	-1.8061
127	K	L	-2.4004
128	D	L	-3.3423
129	K	L	-3.0507
130	T	L	-2.1052
131	H	L	-1.7641
132	T	L	-1.7014
133	A	L	-0.9797
134	S	L	-0.8414
135	E	L	-2.2367
136	L	L	0.0000
137	T	L	-1.8462
138	Q	L	0.0000
139	D	L	-2.3945
140	P	L	-1.7215
141	A	L	-0.9956
142	V	L	-0.5218
143	S	L	-0.0583
144	V	L	-0.0576
145	A	L	-0.7548
146	L	L	-1.5071
147	K	L	-2.2864
148	Q	L	-1.6436
149	T	L	-0.8487
150	V	L	-0.0301
151	T	L	0.0288
152	I	L	0.0000
153	T	L	-1.1804
154	C	L	0.0000
155	R	L	-3.6032
156	G	L	0.0000
157	D	L	-3.9202
158	S	L	0.0000
159	L	L	0.0000
160	R	L	-3.2603
161	S	L	-1.6769
162	H	L	-0.9117
163	Y	L	0.1337
164	A	L	0.0000
165	S	L	0.4537
166	W	L	0.0000
167	Y	L	0.7143
168	Q	L	0.0000
169	K	L	-1.2913
170	K	L	-1.8840
171	P	L	-1.2717
172	G	L	-1.3863
173	Q	L	-1.6779
174	A	L	-0.7265
175	P	L	-0.3604
176	V	L	0.7096
177	L	L	0.9407
178	L	L	0.0000
179	F	L	0.0000
180	Y	L	-0.5001
181	G	L	-1.1833
182	K	L	-2.4719
183	N	L	-2.9044
184	N	L	-2.7012
185	R	L	-2.2261
186	P	L	-0.9761
187	S	L	-0.9653
188	G	L	-0.8232
189	I	L	-0.5304
190	P	L	-1.2186
191	D	L	-2.1917
192	R	L	-1.2964
193	F	L	0.0000
194	S	L	-1.0845
195	G	L	0.0000
196	S	L	-0.9032
197	A	L	-1.2838
198	S	L	-1.3026
199	G	L	-2.3631
200	N	L	-3.1821
201	R	L	-3.3706
202	A	L	0.0000
203	S	L	-0.8214
204	L	L	0.0000
205	T	L	-0.1438
206	I	L	0.0000
207	T	L	-1.0430
208	G	L	-1.4066
209	A	L	0.0000
210	Q	L	-1.8955
211	A	L	-1.7233
212	E	L	-2.4274
213	D	L	0.0000
214	E	L	-2.4288
215	A	L	-1.9007
216	D	L	-1.5193
217	Y	L	0.0000
218	Y	L	0.1264
219	C	L	0.0000
220	S	L	0.0000
221	S	L	-0.0818
222	R	L	-1.7342
223	D	L	-2.1717
224	K	L	-3.1554
225	S	L	-2.3917
226	G	L	-1.4594
227	S	L	-1.5519
228	R	L	-1.7327
229	L	L	-0.1130
230	S	L	-0.3407
231	V	L	0.1465
232	F	L	0.8809
233	G	L	-0.3595
234	G	L	-0.9301
235	G	L	0.0000
236	T	L	0.0000
237	K	L	-2.4449
238	L	L	0.0000
239	T	L	-0.6888
240	V	L	-1.0038
241	L	L	-0.4456
242	D	L	-2.2761
243	K	L	-2.4863
244	T	L	-2.2098
245	H	L	-2.2710
246	T	L	-1.6172
247	R	L	-1.6913
248	T	L	-0.2493
249	V	L	0.7292
250	A	L	0.0713
251	A	L	-0.1016
252	P	L	0.0023
253	S	L	0.0303
254	V	L	0.0000
255	F	L	1.8796
256	I	L	1.7052
257	F	L	1.9536
258	P	L	0.0373
259	P	L	0.0000
260	S	L	-1.7316
261	D	L	-3.2486
262	E	L	-3.4312
263	Q	L	-2.6414
264	L	L	-2.6963
265	K	L	-3.0474
266	S	L	-2.0076
267	G	L	-1.2853
268	T	L	-0.9735
269	A	L	0.0000
270	S	L	-0.0510
271	V	L	0.0000
272	V	L	0.8139
273	C	L	0.0000
274	L	L	0.7443
275	L	L	0.0000
276	N	L	-0.6514
277	N	L	-1.4490
278	F	L	0.0000
279	Y	L	0.0000
280	P	L	-1.6449
281	R	L	-2.4903
282	E	L	-3.3099
283	A	L	-2.4514
284	K	L	-2.3073
285	V	L	-1.2906
286	Q	L	-0.6317
287	W	L	0.0000
288	K	L	-0.6557
289	V	L	-1.1211
290	D	L	-2.0504
291	N	L	-1.5295
292	A	L	-0.4431
293	L	L	0.6419
294	Q	L	-0.5187
295	S	L	-0.5829
296	G	L	-1.3281
297	N	L	-1.9028
298	S	L	-1.8893
299	Q	L	-2.4828
300	E	L	-2.1076
301	S	L	-0.6781
302	V	L	0.3186
303	T	L	-0.6710
304	E	L	-2.1874
305	Q	L	-2.5927
306	D	L	-3.4617
307	S	L	-2.6934
308	K	L	-2.9901
309	D	L	-2.7184
310	S	L	-2.6725
311	T	L	0.0000
312	Y	L	-1.5023
313	S	L	-0.8101
314	L	L	0.0000
315	S	L	-0.3960
316	S	L	0.0000
317	T	L	-0.8156
318	L	L	0.0000
319	T	L	-0.7356
320	L	L	-0.8196
321	S	L	-1.1283
322	K	L	-2.0397
323	A	L	-1.5705
324	D	L	-2.2441
325	Y	L	0.0000
326	E	L	-3.5949
327	K	L	-3.5459
328	H	L	-3.0585
329	K	L	-3.1594
330	V	L	-1.7379
331	Y	L	0.0000
332	A	L	-0.5514
333	C	L	0.0000
334	E	L	-0.9284
335	V	L	0.0000
336	T	L	-1.3060
337	H	L	-1.6242
338	Q	L	-1.8278
339	G	L	-0.4689
340	L	L	-0.3023
341	S	L	-0.5867
342	S	L	-0.4449
343	P	L	-0.4813
344	V	L	0.1634
345	T	L	-0.1616
346	K	L	-0.1278
347	S	L	-0.5359
348	F	L	0.0000
349	N	L	-2.4495
350	R	L	-2.5982
351	G	L	-1.4458