Project name: SH3_R123A

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	RA123A
Energy difference between WT (input) and mutated protein (by FoldX)	1.03641 kcal/mol CAUTION: Your mutation/s can destabilize the protein structure 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: -3.103
• Maximal score value: 1.7964
• Average score: -0.8905
• Total score value: -50.7589

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	0.4407
86	L	A	0.7814
87	F	A	0.8342
88	V	A	0.3849
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	-2.6260
96	R	A	-2.9852
97	T	A	-2.6608
98	E	A	-3.1030
99	D	A	-3.0486
100	D	A	0.0000
101	L	A	0.0000
102	S	A	-2.2087
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	-0.5410
109	F	A	0.0000
110	Q	A	-0.4456
111	I	A	0.1790
112	L	A	0.5618
113	N	A	-0.7968
114	S	A	-1.1181
115	S	A	-1.5640
116	E	A	-2.5617
117	G	A	-2.1354
118	D	A	-2.4460
119	W	A	-1.1061
120	W	A	-0.9175
121	E	A	-0.8883
122	A	A	0.0000
123	A	A	-0.6623	mutated: RA123A
124	S	A	0.0000
125	L	A	0.2432
126	T	A	-0.3408
127	T	A	-0.7089
128	G	A	-1.1956
129	E	A	-1.9526
130	T	A	-1.2456
131	G	A	-1.2337
132	Y	A	-0.6860
133	I	A	0.0000
134	P	A	0.0000
135	S	A	-0.9220
136	N	A	-1.1504
137	Y	A	-0.1243
138	V	A	0.0000
139	A	A	0.4158
140	P	A	0.7376
141	V	A	1.7964