Project name: SH3_E129M

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	EA129M
Energy difference between WT (input) and mutated protein (by FoldX)	-0.347294 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: -3.0996
• Maximal score value: 1.7964
• Average score: -0.8048
• Total score value: -45.8756

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	0.9268
88	V	A	0.4376
89	A	A	0.0000
90	L	A	-0.1482
91	Y	A	-0.5723
92	D	A	-2.5521
93	Y	A	-1.9225
94	E	A	-2.6338
95	A	A	-2.6150
96	R	A	-2.9809
97	T	A	-2.6576
98	E	A	-3.0996
99	D	A	-3.0405
100	D	A	0.0000
101	L	A	0.0000
102	S	A	-1.8649
103	F	A	0.0000
104	H	A	-2.7165
105	K	A	-2.3997
106	G	A	-1.4485
107	E	A	-1.2879
108	K	A	-0.6330
109	F	A	0.0000
110	Q	A	-0.5091
111	I	A	-0.0568
112	L	A	0.1429
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	-1.1536
122	A	A	0.0000
123	R	A	-0.8751
124	S	A	0.0000
125	L	A	0.4861
126	T	A	-0.0431
127	T	A	0.0347
128	G	A	-0.0741
129	M	A	0.3992	mutated: EA129M
130	T	A	-0.3921
131	G	A	-0.8955
132	Y	A	-0.8645
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	0.4158
140	P	A	0.7757
141	V	A	1.7964