Project name: SH3_W119M

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	WA119M
Energy difference between WT (input) and mutated protein (by FoldX)	0.397101 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: -3.1052
• Maximal score value: 1.7964
• Average score: -0.9934
• Total score value: -56.6261

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	0.7932
87	F	A	0.9231
88	V	A	0.4313
89	A	A	0.0000
90	L	A	-0.1484
91	Y	A	-0.5692
92	D	A	-2.5491
93	Y	A	-1.9129
94	E	A	-2.6344
95	A	A	-2.6255
96	R	A	-2.9827
97	T	A	-2.6608
98	E	A	-3.1052
99	D	A	-3.0487
100	D	A	0.0000
101	L	A	0.0000
102	S	A	-2.2013
103	F	A	0.0000
104	H	A	-2.7226
105	K	A	-2.4021
106	G	A	-1.4581
107	E	A	-1.3078
108	K	A	-0.6426
109	F	A	0.0000
110	Q	A	-0.5085
111	I	A	-0.0584
112	L	A	0.1419
113	N	A	-0.9296
114	S	A	-1.2446
115	S	A	-1.6449
116	E	A	-2.6338
117	G	A	-2.2659
118	D	A	-2.5950
119	M	A	-1.3631	mutated: WA119M
120	W	A	-1.1913
121	E	A	-1.2222
122	A	A	0.0000
123	R	A	-1.7176
124	S	A	0.0000
125	L	A	0.0592
126	T	A	-0.4730
127	T	A	-0.8207
128	G	A	-1.3572
129	E	A	-2.2401
130	T	A	-1.6968
131	G	A	-1.5350
132	Y	A	-0.9601
133	I	A	0.0000
134	P	A	-0.6795
135	S	A	-1.0214
136	N	A	-1.1947
137	Y	A	-0.1543
138	V	A	0.0000
139	A	A	0.4149
140	P	A	0.7757
141	V	A	1.7964