Project name: SH3_S135M

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	SA135M
Energy difference between WT (input) and mutated protein (by FoldX)	-0.264279 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: -3.1028
• Maximal score value: 1.7956
• Average score: -0.9327
• Total score value: -53.1652

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	0.5174
86	L	A	0.7929
87	F	A	0.9745
88	V	A	0.4304
89	A	A	0.0000
90	L	A	-0.1508
91	Y	A	-0.5743
92	D	A	-2.5596
93	Y	A	-1.9312
94	E	A	-2.6452
95	A	A	-2.6259
96	R	A	-2.9852
97	T	A	-2.6608
98	E	A	-3.1028
99	D	A	-3.0434
100	D	A	0.0000
101	L	A	0.0000
102	S	A	-2.2059
103	F	A	0.0000
104	H	A	-2.7282
105	K	A	-2.4057
106	G	A	-1.4584
107	E	A	-1.3082
108	K	A	-0.6430
109	F	A	0.0000
110	Q	A	-0.5132
111	I	A	-0.0202
112	L	A	0.1342
113	N	A	-0.8934
114	S	A	-1.1108
115	S	A	-1.5814
116	E	A	-2.5336
117	G	A	-2.0145
118	D	A	-2.2887
119	W	A	-0.9710
120	W	A	-0.9733
121	E	A	-1.1191
122	A	A	0.0000
123	R	A	-1.7203
124	S	A	0.0000
125	L	A	0.0589
126	T	A	-0.4730
127	T	A	-0.8207
128	G	A	-1.3572
129	E	A	-2.2401
130	T	A	-1.6922
131	G	A	-1.5079
132	Y	A	-0.8273
133	I	A	0.0000
134	P	A	0.0000
135	M	A	-0.5039	mutated: SA135M
136	N	A	-0.9525
137	Y	A	0.0132
138	V	A	0.0000
139	A	A	0.4860
140	P	A	0.7746
141	V	A	1.7956