Project name: d4b98623ba73dfd

Chain sequence(s)	A: IKLQQSGAELARPGASVKMSCKTSGYTFTRYTMHWVKQRPGQGLEWIGYINPSRGYTNYNQKFKDKATLTTDKSSSTAYMQLSSLTSEDSAVYYCARYYDDHYCLDYWGQGTTLTVSSVEGGSGGSGGSGGSGGVDDIQLTQSPAIMSASPGEKVTMTCRASSSVSYMNWYQQKSGTSPKRWIYDTSKVASGVPYRFSGSGSGTSYSLTISSMEAEDAATYYCQQWSSNPLTFGAGTKLELK
Selected Chain(s)	A
Distance of aggregation	10 Å
FoldX usage	No
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 A chain(s) selected             (00:00:00)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:00)
[INFO]       runJob:   FoldX not utilized. Treating input pdb file as it was already optimized.    (00:00:00)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:00:00)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:02)

• Minimal score value: -3.3509
• Maximal score value: 1.4408
• Average score: -0.5844
• Total score value: -141.4292

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
3	I	A	1.0588
4	K	A	-1.2911
5	L	A	0.0000
6	Q	A	-2.0680
7	Q	A	0.0000
8	S	A	-1.1344
9	G	A	-0.8998
10	A	A	-0.2635
11	E	A	-0.4980
12	L	A	0.6914
13	A	A	-0.4186
14	R	A	-1.7258
15	P	A	-1.6229
16	G	A	-1.2102
17	A	A	-1.0059
18	S	A	-1.2273
19	V	A	0.0000
20	K	A	-2.1335
21	M	A	0.0000
22	S	A	-1.0406
23	C	A	0.0000
24	K	A	-2.2218
25	T	A	0.0000
26	S	A	-0.8018
27	G	A	-0.0238
28	Y	A	-0.1175
29	T	A	-0.8049
30	F	A	0.0000
31	T	A	-1.7716
32	R	A	-1.5733
33	Y	A	-0.3434
34	T	A	-0.0322
35	M	A	0.0000
36	H	A	0.0000
37	W	A	0.0000
38	V	A	0.0000
39	K	A	0.0000
40	Q	A	-0.7193
41	R	A	-1.1468
42	P	A	-0.9894
43	G	A	-1.2928
44	Q	A	-1.7395
45	G	A	-0.9724
46	L	A	0.0000
47	E	A	-0.8127
48	W	A	0.0000
49	I	A	0.0000
50	G	A	0.0000
51	Y	A	0.1847
52	I	A	0.0000
53	N	A	-0.8960
54	P	A	0.0000
55	S	A	-1.8407
56	R	A	-1.8882
57	G	A	-1.1739
58	Y	A	0.3119
59	T	A	0.1722
60	N	A	-0.2243
61	Y	A	-1.0058
62	N	A	0.0000
63	Q	A	-2.3949
64	K	A	-2.7398
65	F	A	0.0000
66	K	A	-3.3509
67	D	A	-3.0780
68	K	A	-2.2904
69	A	A	0.0000
70	T	A	-1.1648
71	L	A	0.0000
72	T	A	-0.3190
73	T	A	-1.1315
74	D	A	-1.7099
75	K	A	-2.2168
76	S	A	-1.2711
77	S	A	-1.1741
78	S	A	-1.4524
79	T	A	0.0000
80	A	A	0.0000
81	Y	A	-0.6807
82	M	A	0.0000
83	Q	A	-1.5271
84	L	A	0.0000
85	S	A	-1.1810
86	S	A	-1.0241
87	L	A	0.0000
88	T	A	-1.2044
89	S	A	-1.1991
90	E	A	-1.0877
91	D	A	0.0000
92	S	A	-0.3478
93	A	A	0.0000
94	V	A	0.0977
95	Y	A	0.0000
96	Y	A	0.0000
97	C	A	0.0000
98	A	A	0.0000
99	R	A	0.0000
100	Y	A	0.0000
101	Y	A	0.1007
102	D	A	-0.9941
103	D	A	-2.0247
104	H	A	-1.3069
105	Y	A	-0.1167
106	C	A	0.0000
107	L	A	0.0000
108	D	A	0.1065
109	Y	A	0.2123
110	W	A	-0.5287
111	G	A	0.0000
112	Q	A	-1.4372
113	G	A	-0.6861
114	T	A	0.0000
115	T	A	-0.1204
116	L	A	0.0000
117	T	A	-0.1319
118	V	A	0.0000
119	S	A	-0.4243
120	S	A	-0.9104
121	V	A	0.1941
122	E	A	-1.5729
123	G	A	-1.3601
124	G	A	-1.2306
125	S	A	-0.9656
126	G	A	-1.1839
127	G	A	-1.1825
128	S	A	-1.0410
129	G	A	-1.0375
130	G	A	-1.2240
131	S	A	-1.5030
132	G	A	-1.3106
133	G	A	-1.2711
134	S	A	0.0000
135	G	A	-1.3887
136	G	A	-0.6752
137	V	A	-0.2110
138	D	A	-1.6451
139	D	A	0.0000
140	I	A	-0.8537
141	Q	A	-1.5146
142	L	A	0.0000
143	T	A	-0.8569
144	Q	A	0.0000
145	S	A	-0.2179
146	P	A	0.3151
147	A	A	0.6523
148	I	A	1.4408
149	M	A	0.5121
150	S	A	-0.3706
151	A	A	0.0000
152	S	A	-1.2958
153	P	A	-1.5350
154	G	A	-1.6866
155	E	A	-2.0701
156	K	A	-2.4488
157	V	A	0.0000
158	T	A	-0.4913
159	M	A	0.0000
160	T	A	-0.5304
161	C	A	0.0000
162	R	A	-1.8174
163	A	A	0.0000
164	S	A	-1.1728
165	S	A	-0.9326
166	S	A	-0.5433
167	V	A	0.0000
168	S	A	-0.0422
169	Y	A	0.1024
170	M	A	0.0000
171	N	A	0.0000
172	W	A	0.0000
173	Y	A	0.0000
174	Q	A	0.0000
175	Q	A	-0.9544
176	K	A	-1.3102
177	S	A	-0.7714
178	G	A	-0.8938
179	T	A	-0.9199
180	S	A	-0.7373
181	P	A	0.0000
182	K	A	-1.0163
183	R	A	-0.5153
184	W	A	0.0000
185	I	A	0.0000
186	Y	A	-0.2920
187	D	A	-0.7788
188	T	A	-0.4681
189	S	A	-0.8012
190	K	A	-1.1262
191	V	A	0.0265
192	A	A	0.0000
193	S	A	-0.4864
194	G	A	-0.3813
195	V	A	0.0000
196	P	A	0.4236
197	Y	A	1.1706
198	R	A	0.0116
199	F	A	0.0000
200	S	A	-0.1530
201	G	A	0.0000
202	S	A	-0.7307
203	G	A	-0.6814
204	S	A	-0.6187
205	G	A	-0.5957
206	T	A	-0.8789
207	S	A	-0.9533
208	Y	A	0.0000
209	S	A	-0.5190
210	L	A	0.0000
211	T	A	-0.5434
212	I	A	0.0000
213	S	A	-1.1255
214	S	A	-1.4516
215	M	A	0.0000
216	E	A	-1.8983
217	A	A	-1.1016
218	E	A	-1.6604
219	D	A	0.0000
220	A	A	-0.8972
221	A	A	0.0000
222	T	A	-0.5448
223	Y	A	0.0000
224	Y	A	0.0000
225	C	A	0.0000
226	Q	A	0.0000
227	Q	A	0.0000
228	W	A	-0.4683
229	S	A	-0.4794
230	S	A	-0.5610
231	N	A	-0.8329
232	P	A	0.0000
233	L	A	0.0000
234	T	A	-0.3508
235	F	A	-0.0714
236	G	A	0.0000
237	A	A	-0.5005
238	G	A	-0.2303
239	T	A	0.0000
240	K	A	-0.5597
241	L	A	0.0000
242	E	A	-0.3671
243	L	A	-0.2807
244	K	A	-1.3649