Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSEVLDVVIVGGGLVGGLTALLLAQGGVQPTVLDAAPVLDVEKTLSVMNPRVLALSQATIHLLKTVNVWDDL-ARQMPYTGMQVWNLNGYGEINFGHESVQRPISEQALGSMVEPSVLNVAIQQKMLEQLTDYRTQVRVTCIEQGVGCWHIQLADGTALKTKLLIGADGANSFVREQAFIDLDVLDYKQAAISCAIKTSKPHHY---VARQIFLPTGPLAYLPMASLEESENGYWQSIVWTLPDDYADEYSALSDREFMQLLTRESQHMLGEVLDVRSRAQFPLKARAAKQYVKAGLALIGDAAHVIHPLAGQGVNIGCLDAAVLCDALLHDLGRGVWAHEQTLMRYEHRRKGQNDAMMHSMSAIGWLESSELFPLIWARNVGLKQVEQISFLKERFMQQANGLGALQNTQYSR 5KOX Chain:A ((4-375)) ---MIDVIIAGGGPTGLMLAGELRLHGVRTVVLEKEPTP-------NQHSRSRGLHARSIEVMDQRGLLERFLAHGEQFRVGGFFAGLA---AEWPA----DLDTAHSYVLAIPQVVTERLLTEHATELGAEIRRGCEVAGLDQDADGVTAELADGTRLRARYLVGCDGGRSTVRRLLGVDFPGEPTRVETLLADVRIDVPVETLTAVVAEVRKTQLRFGAVPAGD-------GFFRLIVPAQGLSADR-AAPTLDELKRCLHATAGTDF-GVHSPRWLSRFGDATRLAERYRTGRVLLAGDAAHIHPPTGGQGLNLGIQDAFNLGWKLAAAIGGW--APPDLLDSYHDERHPVAAEVLDNTRAQMTLLSLDP-GPRAVRRL-MAELVEFPDVNRHLIEKIT------------

General information: TITO was launched using: RESULT: Template: 5KOX.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 : 2033 -51398 -25.28 -139.67 target 2D structure prediction score : 0.53 Monomeric hydrophicity matching model chain A : 0.70 3D Compatibility (PKB) : -25.28 2D Compatibility (Sec. Struct. Predict.) : 0.53 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.369

(partial model without unconserved sides chains): PDB file : Tito_5KOX.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5KOX-query.scw PDB file : Tito_Scwrl_5KOX.pdb: