Project name: SH3_E107W

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	EA107W
Energy difference between WT (input) and mutated protein (by FoldX)	0.0929425 kcal/mol Changes in protein stability upon mutation are calculated using the FoldX forcefield. Computational prediction of protein stability is used with the intention of preventing the experimental characterization of proteins bearing mutations that significantly destabilize their structure. Mutations resulting in a predicted reduction in protein stability ≥ 1 kcal/mol are considered disruptive.

• Minimal score value: -3.1004
• Maximal score value: 1.8012
• Average score: -0.9235
• Total score value: -52.6415

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
85	T	A	0.5173
86	L	A	0.7949
87	F	A	1.0012
88	V	A	0.5887
89	A	A	0.0000
90	L	A	-0.0762
91	Y	A	-0.5133
92	D	A	-2.4904
93	Y	A	-1.9247
94	E	A	-2.6366
95	A	A	-2.6176
96	R	A	-2.9820
97	T	A	-2.6584
98	E	A	-3.1004
99	D	A	-3.0392
100	D	A	0.0000
101	L	A	0.0000
102	S	A	-2.1833
103	F	A	0.0000
104	H	A	-2.5734
105	K	A	-2.2511
106	G	A	-1.2144
107	W	A	-0.8236	mutated: EA107W
108	K	A	-0.3961
109	F	A	0.0000
110	Q	A	-0.5094
111	I	A	-0.0524
112	L	A	0.1449
113	N	A	-0.8883
114	S	A	-1.1799
115	S	A	-1.5966
116	E	A	-2.5603
117	G	A	-2.1347
118	D	A	-2.4456
119	W	A	-1.1053
120	W	A	-1.0569
121	E	A	-1.1502
122	A	A	0.0000
123	R	A	-1.7127
124	S	A	0.0000
125	L	A	0.1367
126	T	A	-0.3603
127	T	A	-0.7679
128	G	A	-1.3617
129	E	A	-2.2344
130	T	A	-1.6790
131	G	A	-1.4891
132	Y	A	-0.8622
133	I	A	0.0000
134	P	A	0.0000
135	S	A	-0.9214
136	N	A	-1.1508
137	Y	A	-0.1246
138	V	A	0.0000
139	A	A	0.4194
140	P	A	0.7786
141	V	A	1.8012