Project name: SH3_I111D

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	IA111D
Energy difference between WT (input) and mutated protein (by FoldX)	4.58837 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: -3.1028
• Maximal score value: 1.7913
• Average score: -1.0411
• Total score value: -59.3409

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	0.3231
86	L	A	0.5375
87	F	A	0.6839
88	V	A	0.4208
89	A	A	0.0000
90	L	A	-0.1529
91	Y	A	-0.5748
92	D	A	-2.5599
93	Y	A	-1.9315
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	-2.4059
106	G	A	-1.4599
107	E	A	-1.3275
108	K	A	-0.7857
109	F	A	0.0000
110	Q	A	-1.0219
111	D	A	-1.1411	mutated: IA111D
112	L	A	-0.2966
113	N	A	-1.1524
114	S	A	-1.3889
115	S	A	-1.5718
116	E	A	-2.5523
117	G	A	-2.1266
118	D	A	-2.4387
119	W	A	-1.0976
120	W	A	-1.2806
121	E	A	-1.4095
122	A	A	0.0000
123	R	A	-1.9478
124	S	A	0.0000
125	L	A	-0.0073
126	T	A	-0.5096
127	T	A	-0.8391
128	G	A	-1.3664
129	E	A	-2.2420
130	T	A	-1.8024
131	G	A	-1.5961
132	Y	A	-0.9767
133	I	A	0.0000
134	P	A	0.0000
135	S	A	-1.0444
136	N	A	-1.1505
137	Y	A	-0.1261
138	V	A	0.0000
139	A	A	0.4106
140	P	A	0.7738
141	V	A	1.7913