Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence METFKSILHEAQRIVVLTGAGMSTESGIPDFRSA-GGIWTEDASRMEAMSLDYFLSYPRLFWPKFKELFQMKMSGSFEPNEGHLLLAELEKQGKQVDIFTQNIDGLHKKAGSRHVYELHGSIQTAACPACGARYD-LPHL--------LEREVPECTAAGNNGDICGTVLKTDVVLFGDAVMH--FDTLYEKLDQADLLLVIGTSLEVAPARFVPEDASLIP-GMKKVIINLEPTYCDS-LFDMVIHQKIGEFARSLGMKK 3U31 Chain:A ((35-277)) LEELAKIIKKCKHVVALTGSGTSAESNIPSFRGSSNSIWSK-YDPRIYGTIWGFWKYPEKIWEVIRDISSD---YEIEINNGHVALSTLESLGYLKSVVTQNVDGLHEASGNTKVISLHGNVFEAVCCTCNKIVKLNKIMLQKTSHFMHQ-LPPEC--------PCGGIFKPNIILFGEVVSSDLLKEAEEEIAKCDLLLVIGTSSTVSTATNLCHFAC--KKKKKIVEINISKTYITNKMSDYHVCAKFSE-LTKVAN--

General information: TITO was launched using: RESULT: Template: 3U31.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 : 1208 -143251 -118.58 -625.55 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain A : 0.74 3D Compatibility (PKB) : -118.58 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.74 QMean score : 0.430

(partial model without unconserved sides chains): PDB file : Tito_3U31.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3U31-query.scw PDB file : Tito_Scwrl_3U31.pdb: