Project name: fc7c51d4df04f1b

Chain sequence(s)	C: MDVTIQHPWFKRTLGPFYPSRLFDQFFGEGLFEYDLLPFLSSTISPYYRQSLFRTVLDSGISEVRSDRDKFVIFLDVKHFSPEDLTVKVQDDFVEIHGKHNERQDDHGYISREFHRRYRLPSNVDQSALSCSLSADGMLTFCGPKIQTGLDATHAERAIPVSREEKPTSAPSS
Selected Chain(s)	C
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 C 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                                          (00:01:33)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:34)

• Minimal score value: -3.8377
• Maximal score value: 1.4918
• Average score: -0.6879
• Total score value: -119.0012

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	M	C	-1.1089
2	D	C	-1.6004
3	V	C	-0.4304
4	T	C	0.0808
5	I	C	1.2324
6	Q	C	-0.6631
7	H	C	-1.1074
8	P	C	0.0000
9	W	C	0.4239
10	F	C	0.9743
11	K	C	0.0000
12	R	C	0.0000
13	T	C	0.0000
14	L	C	0.6930
15	G	C	0.3580
16	P	C	0.4796
17	F	C	0.6329
18	Y	C	0.4394
19	P	C	0.1336
20	S	C	0.0000
21	R	C	-0.7877
22	L	C	0.2442
23	F	C	0.0000
24	D	C	-0.6722
25	Q	C	-0.9599
26	F	C	-0.0449
27	F	C	0.0193
28	G	C	-0.8344
29	E	C	-1.6937
30	G	C	-0.6733
31	L	C	0.6508
32	F	C	-0.0056
33	E	C	-1.2422
34	Y	C	-0.0596
35	D	C	-0.7505
36	L	C	1.1855
37	L	C	0.8752
38	P	C	0.6218
39	F	C	0.6267
40	L	C	1.4918
41	S	C	0.8451
42	S	C	0.6916
43	T	C	0.4500
44	I	C	0.7372
45	S	C	0.5519
46	P	C	0.4252
47	Y	C	0.4565
48	Y	C	0.2483
49	R	C	-1.0640
50	Q	C	0.0000
51	S	C	-0.4826
52	L	C	0.4801
53	F	C	0.0000
54	R	C	-1.7976
55	T	C	-0.5959
56	V	C	-0.3112
57	L	C	0.0000
58	D	C	-1.6384
59	S	C	-0.9661
60	G	C	-0.6573
61	I	C	0.3210
62	S	C	0.0000
63	E	C	-1.3816
64	V	C	0.0000
65	R	C	-1.3434
66	S	C	0.0000
67	D	C	-1.9757
68	R	C	-2.7110
69	D	C	-1.8711
70	K	C	-1.7323
71	F	C	0.0000
72	V	C	0.0000
73	I	C	0.0000
74	F	C	-0.2479
75	L	C	0.0000
76	D	C	-2.1370
77	V	C	-1.7947
78	K	C	-2.6978
79	H	C	-2.8120
80	F	C	0.0000
81	S	C	-1.9503
82	P	C	-1.6735
83	E	C	-2.1170
84	D	C	-2.2255
85	L	C	0.0000
86	T	C	-0.4999
87	V	C	0.0000
88	K	C	-1.8008
89	V	C	0.0000
90	Q	C	-1.8977
91	D	C	-1.4925
92	D	C	0.0000
93	F	C	-1.0306
94	V	C	0.0000
95	E	C	0.0000
96	I	C	0.0000
97	H	C	-1.7731
98	G	C	0.0000
99	K	C	-3.6240
100	H	C	-2.9344
101	N	C	-2.4770
102	E	C	-2.0824
103	R	C	-3.2747
104	Q	C	-3.4290
105	D	C	-3.8377
106	D	C	-3.6485
107	H	C	-2.7603
108	G	C	-1.7525
109	Y	C	-0.4017
110	I	C	-0.5967
111	S	C	-1.5904
112	R	C	-2.4866
113	E	C	-3.2541
114	F	C	-1.6553
115	H	C	-2.0722
116	R	C	-1.2933
117	R	C	-2.3739
118	Y	C	-0.8235
119	R	C	-0.4694
120	L	C	0.0000
121	P	C	0.0000
122	S	C	0.2425
123	N	C	-0.3920
124	V	C	0.0000
125	D	C	-0.5216
126	Q	C	0.0000
127	S	C	-1.1497
128	A	C	-0.4291
129	L	C	0.0000
130	S	C	-0.2921
131	C	C	0.0000
132	S	C	-0.8220
133	L	C	0.0000
134	S	C	-1.5407
135	A	C	-1.4673
136	D	C	-2.3095
137	G	C	0.0000
138	M	C	-1.0097
139	L	C	0.0000
140	T	C	0.0000
141	F	C	0.0000
142	C	C	-0.4769
143	G	C	0.0000
144	P	C	-0.1815
145	K	C	0.0679
146	I	C	1.1540
147	Q	C	-0.8428
148	T	C	-1.0159
149	G	C	-0.2576
150	L	C	0.4803
151	D	C	-0.2639
152	A	C	0.2389
153	T	C	0.2031
154	H	C	0.0000
155	A	C	-0.7520
156	E	C	-2.2667
157	R	C	-2.5729
158	A	C	-1.3647
159	I	C	0.0000
160	P	C	-0.2209
161	V	C	0.3663
162	S	C	-0.7340
163	R	C	-2.2455
164	E	C	-2.0449
165	E	C	-2.6177
166	K	C	-1.6851
167	P	C	-0.9242
168	T	C	-0.5487
169	S	C	-0.4231
170	A	C	-0.6608
171	P	C	-0.6208
172	S	C	-0.9081
173	S	C	-0.4116