Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIEIKRIQQQPDLAQDIYAVMAAVYPVSPWTLEQIQADLSQDQTWYALAYD----------GAEVIGFLTVQETL------FEAEVLQIAVKGAYQGQGIASALFA------Q-LPTDKEIFLEVRQSNQRAQAFYK-KEKMAVIAERKAYYHDPVEDAIIMKREIDEG 5NNP Chain:B ((2-163)) --DIRLL--RPSDIPLIQHANLENLPENYFLKYYLYHALSWP-QLSFVAVDVSRPAKSPYDYPKIVGYVLAKMEEEPADGVPHGHITSLSVMRTHRRLGIAEKLMRQSQLAMVETYNAHYVSLHVRVSNKAAIHLYRDTLGFKTEKVEAKYYADG-EDAYCMKLDLTA-

General information: TITO was launched using: RESULT: Template: 5NNP.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 582 -25226 -43.34 -182.79 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain B : 0.64 3D Compatibility (PKB) : -43.34 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.346

(partial model without unconserved sides chains): PDB file : Tito_5NNP.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5NNP-query.scw PDB file : Tito_Scwrl_5NNP.pdb: