Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSSKVSGFQDKNGKVLKIMIEWWKEKFRRVVVTQNVESLLVSIVISAYNEEKYLPGLIEDLKNQTYPKEDIEILFINAMSTDGTTAIIQQFIKEDTEFNSIRLYNNPKKNQASGFNLGVKHSVGDLILKIDAHSKVTESFVMNNVAIIQQ--GEFVCGGPRPTIVEGKGKWAETLHLVEENMFGSSIANYRNSSEDRYVSSIFHGMYKREVFQKVGLVNEQLGRTEDNDIHYRIREHGYKIRYSPSILSYQYIRPTFKKMLHQKYSNGLWIGLTSHVQFKCLSLFHYVPCLFVLSLVFSLALLPITFVFITLLLGAYFLLLSLLTLLTLLKHKNGFLIVMPFLLFSIHFAYGLGTIVGLIRGFKWKKEYKGTIIYLDKISQINKNML 2Z86 Chain:C ((371-576)) ----------------------------------LKRVPLVSIYIPAYNCSKYIVRCVESALNQTIT--DLEVCICDDGSTDDTLRILQEHYAN---HPRVRFISQKNKGIGSASNTAVRLCRGFYIGQLDSDDFLEPDAVELCLDEFRKDLSLACVYTTNRNIDREGNLISNGYNW---PIYS---REK--L--TSAMICHHFRMFTARAWNLTEGFNESISNAVDYDMYLKLSEVG-PFKHINKICYNRVLHGE-----------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 2Z86.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 1153 -69775 -60.52 -342.03 target 2D structure prediction score : 0.50 Monomeric hydrophicity matching model chain C : 0.56 3D Compatibility (PKB) : -60.52 2D Compatibility (Sec. Struct. Predict.) : 0.50 1D Compatibility (Hydrophobicity) : 0.56 QMean score : 0.404

(partial model without unconserved sides chains): PDB file : Tito_2Z86.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2Z86-query.scw PDB file : Tito_Scwrl_2Z86.pdb: