Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKHSFSRFFGLGEKEQEPEIAEHDTNKEEILEIPVNAIVPNRFQPRTIFSDEKIKELAMTIHTHGIIQPIVVRHTEEEGQYELIAGERRWRAVQSLEWEKIPAIIKDFSDTETASVALIEN------LQREEL-----SSIEEAHAYARLLELHDLTQEALAQRLGKGQSTIANKLRLLKLPQPVQEAIMEKKITERHARALIPLKQPELQVTLLTEIIEKSLNVKQTEDRVVKMLEQGQRKPKPRRKAFSRDTRIAMNTIRQSLSMVEDSGVKLNTEEEEFEEYIQLTIRIPK 2Q01 Chain:A ((119-280)) LNHVFSQVFGFTEFLEA-------SNADDYFDRITAALATDAFRPRALFDRFNIETLATTEGPHESLQHHAA--IRESGWGGHVITAYRPDAVIDFEDERSPRAFERFAETSGQDVYSWKSYLEAHRLRRQAFIDAGATSSDHGHPTAATADLSDVEAEALFNSLVKGDVT---------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 2Q01.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 : 437 -14392 -32.93 -95.31 target 2D structure prediction score : 0.37 Monomeric hydrophicity matching model chain A : 0.68 3D Compatibility (PKB) : -32.93 2D Compatibility (Sec. Struct. Predict.) : 0.37 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.197

(partial model without unconserved sides chains): PDB file : Tito_2Q01.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2Q01-query.scw PDB file : Tito_Scwrl_2Q01.pdb: