Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MARLNVNPTRMELTRLKKQLTTATRGHKLLKDKQDELMRQFILLIRKNNQLRQEMEESMTEAMSDFVLANASITEPFIEELFVLPAENVDLSIVDKNIMSVKVPVMNFEYDEQLTDTPLEYGYLNSSAELDRSIDRFTTLLPKLLELTEIEKTCQLMASEIEKTRRRVNALEYMTIPQLEETIYYIRMKLEENERAEVTRLIKVKNMGTTD 3VR4 Chain:G ((13-213)) ------NPTRMELTRLKKQLTTATRGHKLLKDKQDELMRQFILLIRKNNELRQAIEKETQTAMKDFVLAKS-VEEAFIDELLAL--ENVSISVVEKNIMSVKVPLMNFQ-----------------NAELDRSIDGFTQLLPKLLKLAEVEKTCQLMAEEIEKTRRRVNALEYMTIPQLEETIYYIKMKLEENERAEVTRLIKVKNM----

General information: TITO was launched using: RESULT: Template: 3VR4.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain G - contact count / total energy / energy per contact / energy per residue : 405 -38835 -95.89 -214.56 target 2D structure prediction score : 0.72 Monomeric hydrophicity matching model chain G : 0.90 3D Compatibility (PKB) : -95.89 2D Compatibility (Sec. Struct. Predict.) : 0.72 1D Compatibility (Hydrophobicity) : 0.90 QMean score : 0.603

(partial model without unconserved sides chains): PDB file : Tito_3VR4.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3VR4-query.scw PDB file : Tito_Scwrl_3VR4.pdb: