Project name: SH3_T130Q

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	TA130Q
Energy difference between WT (input) and mutated protein (by FoldX)	-0.280175 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: -3.1265
• Maximal score value: 1.7964
• Average score: -0.9973
• Total score value: -56.8458

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	0.4749
86	L	A	0.7324
87	F	A	0.8751
88	V	A	0.4066
89	A	A	0.0000
90	L	A	-0.1511
91	Y	A	-0.5748
92	D	A	-2.5599
93	Y	A	-1.9315
94	E	A	-2.6452
95	A	A	-2.6255
96	R	A	-2.9852
97	T	A	-2.6608
98	E	A	-3.1023
99	D	A	-3.1265
100	D	A	0.0000
101	L	A	0.0000
102	S	A	-2.2831
103	F	A	0.0000
104	H	A	-2.7282
105	K	A	-2.4059
106	G	A	-1.4581
107	E	A	-1.3042
108	K	A	-0.6643
109	F	A	0.0000
110	Q	A	-0.7344
111	I	A	-0.1812
112	L	A	0.0613
113	N	A	-0.8548
114	S	A	-1.1433
115	S	A	-1.5782
116	E	A	-2.5379
117	G	A	-2.1175
118	D	A	-2.4264
119	W	A	-1.0647
120	W	A	-0.9853
121	E	A	-1.1707
122	A	A	0.0000
123	R	A	-1.9372
124	S	A	0.0000
125	L	A	0.0137
126	T	A	-0.4139
127	T	A	-0.8396
128	G	A	-1.4122
129	E	A	-2.5026
130	Q	A	-2.3676	mutated: TA130Q
131	G	A	-1.7811
132	Y	A	-0.9460
133	I	A	0.0000
134	P	A	0.0000
135	S	A	-0.9008
136	N	A	-1.1504
137	Y	A	-0.1243
138	V	A	0.0000
139	A	A	0.4158
140	P	A	0.7547
141	V	A	1.7964