Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MPYLKRVLLLLVTGLFMSLFAVTATASAQTGGSFFDPFNGYNSGFWQKADGYSNGNMFNCTWRANNVSMTSLGEMRLALTSPAYNKFDCGENRSVQTYGYGLYEVRMKPAKNTGIVSSFFTYTGPT---DGTPWDEIDIEFLGKDTTKVQFNYYTNGAGNH---EKIVDLGFDAANAYHTYAFDWQPNSIKWYVDGQ-LKHTATNQIPTTPGK--IMMNLWNGTGVDEWLGSYNGVN-PLYAHYDWVRYTKK 3HR9 Chain:A ((5-168)) --------------------------------------------------------------------------------------FSGAELYTLEEVQYGKFEARMKMAAASGTVSSMILYQNGSEIADGRPWVEVDIEVLGKNPGSFQSNIITGKAGAQKTSEKHHAVSPAADQAFHTYGLEWTPNYVRWTVDGQEVRKTEGGQVSNLTGTQGLRFNLWSSESA-AWVGQFDESKLPLFQFINWVKVYK-

General information: TITO was launched using: RESULT: Template: 3HR9.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 : 787 14556 18.50 94.52 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain A : 0.68 3D Compatibility (PKB) : 18.50 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.360

(partial model without unconserved sides chains): PDB file : Tito_3HR9.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3HR9-query.scw PDB file : Tito_Scwrl_3HR9.pdb: