Project name: SH3_S135K

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	SA135K
Energy difference between WT (input) and mutated protein (by FoldX)	-0.524974 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: -1.015
• Total score value: -57.8537

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	0.8171
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	-0.5117
111	I	A	-0.1536
112	L	A	0.1369
113	N	A	-0.8921
114	S	A	-1.3176
115	S	A	-1.5857
116	E	A	-2.5407
117	G	A	-2.2000
118	D	A	-2.6995
119	W	A	-1.3823
120	W	A	-1.3250
121	E	A	-1.2710
122	A	A	0.0000
123	R	A	-1.7188
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	-1.5055
132	Y	A	-0.9972
133	I	A	0.0000
134	P	A	0.0000
135	K	A	-1.7757	mutated: SA135K
136	N	A	-1.5641
137	Y	A	-0.3978
138	V	A	0.0000
139	A	A	0.2726
140	P	A	0.7746
141	V	A	1.7956