Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -----------------MISKEKRTSILYSFIALLFSIALYFNANGQSVPNTLSGNEAYNQTVTGVPIKISYDSKRYYIHGYENAVTVKLSSANRVQLNAEANEDTRMFRVTADITKLGEGTH---EVPLKIQNLSSAVTAKIEPSTITVTVEK-----KVIKDFDVETLIPSTFTPSGYELDDT-----SVSPKKVSITTGDKTLAEIKRVVADVDASMVTDDGINSEVPIQALNAAGEVLSIVSDPVQVTVRADSIKPSKSVRLYGIQQGTPAAGVESYDFSFSKLEAEVSGSSDLLASIGDSIAVPINVSGINHRTTRKIEIPVEEGLSIKPESVSVEITPVLQTSSSSSASTSSRTQENTSTSRSISSADSGTEPSTTTISSSSESGTSSSTTST-----------EETSETSESTQMSRTNSSEN 4CZB Chain:A ((1-415)) MELMMAIGYLGLALVLGSLVAKIAEKLKIPDIPLLLLLGLIIGPFLQIIP-----------SDSAMEIFEYAGPIGLIFILLGGAFTMRISLLKRV-IKTVVRLDTITFLITLLISGFIFNMVLNLPYTSPVGYLFGAITAATDPATLIPVFSRVRTNPEVAITLEAESIFNDPLGIVSTSVILGLFGLFSSSNPLIDLITLAGGAIVVGLLLAKIYEKIIIHCDFHEYVAPLVLGGAMLLLYVG-DDLLPSICGYGFSGYMAVAIMGLYLGDALFRADDIDYKYIVSFCD-DLSLLARVFIFVFLGACIKLSMLENYFIPGLLVALGSIFLARPLGVFLGLIGSKHSFKEKLYFALEGPRGVVPAALAVTVGIEILKNADKIPASITKYITPTDIAGTIIIGTFMTILLSVILEASWAGMLALKLLGE-

General information: TITO was launched using: RESULT: Template: 4CZB.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 : 1811 -7201 -3.98 -19.25 target 2D structure prediction score : 0.32 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : -3.98 2D Compatibility (Sec. Struct. Predict.) : 0.32 1D Compatibility (Hydrophobicity) : 0.64 QMean score : -0.030

(partial model without unconserved sides chains): PDB file : Tito_4CZB.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4CZB-query.scw PDB file : Tito_Scwrl_4CZB.pdb: