Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MPIAKLKRE-------KRKDPLWG-----IILSIIVGSVLMIYPLSYDIS-GWRPLFMLMIMLFWVVCQPTWCGVWFAFGMGIF-------TDLLLDAPLGLNALSFVIVTFITRFLIRERRILTF----GNLWTIATLVIIAHLAFMWVTQTMGGIHFSIARHWQPLMTSILTWPVVYYCLAKWRI------- 4MT5 Chain:A ((0-183)) MQTAYVKYVDDTTGETLRQDDLHGYTDETIPYSTAEGIKKYEGDGYVLVSDGFKPGTK------FGVGTPTYE-VHFKHGMTHTDATDKNAEQKTVTETIHYVDENNQTVQPDSTTAVTFKRGYTTDNVTGKVVSYDPWTVDGNQAD---SKTFAAVPSPAVEGYTPNHQQINEFTVTPDSKDIVKTVVYVGDP

General information: TITO was launched using: RESULT: Template: 4MT5.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 : 556 -18238 -32.80 -119.20 target 2D structure prediction score : 0.18 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : -32.80 2D Compatibility (Sec. Struct. Predict.) : 0.18 1D Compatibility (Hydrophobicity) : 0.61 QMean score : -0.165

(partial model without unconserved sides chains): PDB file : Tito_4MT5.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4MT5-query.scw PDB file : Tito_Scwrl_4MT5.pdb: