Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIIWINGAFGSGKTQTAFELHRRLNPSYVYDPEKMGFALRSMVPQEIAKDDFQSYPLWRAFNYSLLASLTDTYRGILIVPMTIVHPEYFNEIIGRLRQEGRIVHHFTLMASKETLLKRLRTRAEGKNSWAAKQIDRCVEGLSSPIFEDHIQTDNLSIQDVAENIAARAELPLDPDTRGSLRRFADRLMVKLNHIRIK 2VLI Chain:A ((6-176)) PIIWINGPF----THTAHTLHERLPGSFVFEPEEMGQALRKLTPGFS-G-DPQEHPMWIPLMLDALQYASREAAGPLIVPVSISDTARHRRLMSGLKDRGLSVHHFTLIAPLNVVLERLRRD------VNVGTVEDRLNELRGEQFQTHIDTAGLGTQQVAEQIAAQVGLTLAPP----------------------

General information: TITO was launched using: RESULT: Template: 2VLI.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 : 677 -123017 -181.71 -754.71 target 2D structure prediction score : 0.80 Monomeric hydrophicity matching model chain A : 0.77 3D Compatibility (PKB) : -181.71 2D Compatibility (Sec. Struct. Predict.) : 0.80 1D Compatibility (Hydrophobicity) : 0.77 QMean score : 0.603

(partial model without unconserved sides chains): PDB file : Tito_2VLI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2VLI-query.scw PDB file : Tito_Scwrl_2VLI.pdb: