Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKQLPKISTTSKALAKSLLLAQGVLDQAKKYSTLPFTQTHIILPRIDEKYYSWTHYGIFFPLLPEPHRYLNIMILIGTPGALAFDHDDIITGNPRKTATFFSSTAALEQALLKAYIIPEDTKINKDGTLIELGQEISIQGKFPHIHINGHYDGFDFDFDIDITSHVSWFIKTPIYDHFSLLAKFKGFLNYQAKHIETQGLCTYEYARAVGPHSITNKLIPDAYKLPLDFFTYQIINLNEATQLLLTKADIAGQTAAYTLHIRHLDQPAEIYTDVSFDIISHQVDDFVSPSGQKMRLPKYFSWIARNDAKQIILNIQAEIDCPFRYGHGRGYASSYIFTGHYFGNEVQGRGYIEYVDIENPQAFEDE 3UIO Chain:D ((2646-2662)) --------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------AKADTLKLPPTFF-YKN------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3UIO.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain D - contact count / total energy / energy per contact / energy per residue : 17 -3079 -181.12 -192.44 target 2D structure prediction score : 0.31 Monomeric hydrophicity matching model chain D : 0.50 3D Compatibility (PKB) : -181.12 2D Compatibility (Sec. Struct. Predict.) : 0.31 1D Compatibility (Hydrophobicity) : 0.50 QMean score : 0.746

(partial model without unconserved sides chains): PDB file : Tito_3UIO.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3UIO-query.scw PDB file : Tito_Scwrl_3UIO.pdb: