Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MGPVNTVRMREGEVGIDAPLVGRLIARQFPGWAALPVRRVDSSGTENAMFRLGTGLVVRLPRHPGAVADVTHEQRWLPRLGPLLPVATPEPAGLGAPDEDFPWPWSVYRWLDG-----RNPVAGAVAEPECLAERLGSFVAALRRIDPHDGPPASRGAPLATRDEPTRAALARLTG--LTGLTDRIDTAAVTALWEEALRAPAHCG-PPAWAHGDLSPGNVLVD--GDGLGAVIDFGCAGVGDPAVDLIVAWNLLPASARDTFREAVGADDAEWARGRGWALSISLIQLPYYRHTN-PALAENSRHVIAEILAEAGRR 3SG8 Chain:A ((9-265)) --------------------VEKAIEQLYPDFTINTIE-ISGEGNDCIAYEINRDFIFKFPKHSRGSTNLFNEVNILKRIHNKLPLPIPEVVFTGMPSETYQMSFAGFTKIKGVPLTPLLLNNLPKQSQNQAAKDLARFLSELHSINI-SGFKSNLVLDFREKINEDNKKIKKLLSRELKGPQ----MKKVDDFYRDILENEIYFKYYPCLIHNDFSSDHILFDTEKNTICGIIDFGDAAISDPDNDFI----------------SLMEDDEEY--GMEFVSKI----LNHYKHKDIPTVLEKYR-------------

General information: TITO was launched using: RESULT: Template: 3SG8.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain A - contact count / total energy / energy per contact / energy per residue : 1064 -11896 -11.18 -48.36 target 2D structure prediction score : 0.70 Monomeric hydrophicity matching model chain A : 0.70 3D Compatibility (PKB) : -11.18 2D Compatibility (Sec. Struct. Predict.) : 0.70 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.303

(partial model without unconserved sides chains): PDB file : Tito_3SG8.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3sg8-query.scw PDB file : Tito_Scwrl_3SG8.pdb: