Project name: SH3_Y132F

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	YA132F
Energy difference between WT (input) and mutated protein (by FoldX)	0.370305 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: -3.0746
• Maximal score value: 1.7964
• Average score: -0.9658
• Total score value: -55.0534

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	0.9238
88	V	A	0.4313
89	A	A	0.0000
90	L	A	-0.1510
91	Y	A	-0.5746
92	D	A	-2.5594
93	Y	A	-1.9306
94	E	A	-2.6448
95	A	A	-2.5952
96	R	A	-2.9851
97	T	A	-2.6608
98	E	A	-3.0746
99	D	A	-3.0166
100	D	A	0.0000
101	L	A	0.0000
102	S	A	-2.1758
103	F	A	0.0000
104	H	A	-2.7280
105	K	A	-2.4058
106	G	A	-1.4581
107	E	A	-1.3078
108	K	A	-0.6426
109	F	A	0.0000
110	Q	A	-0.5301
111	I	A	-0.0678
112	L	A	0.1518
113	N	A	-0.8768
114	S	A	-1.1911
115	S	A	-1.6116
116	E	A	-2.5971
117	G	A	-2.1761
118	D	A	-2.4790
119	W	A	-1.1661
120	W	A	-1.1303
121	E	A	-1.3347
122	A	A	0.0000
123	R	A	-1.7386
124	S	A	0.0000
125	L	A	0.0589
126	T	A	-0.4730
127	T	A	-0.8210
128	G	A	-1.3582
129	E	A	-2.2422
130	T	A	-1.7098
131	G	A	-1.4917
132	F	A	-0.7682	mutated: YA132F
133	I	A	0.0000
134	P	A	0.0000
135	S	A	-0.9497
136	N	A	-1.1616
137	Y	A	-0.1321
138	V	A	0.0000
139	A	A	0.4158
140	P	A	0.7757
141	V	A	1.7964