Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSNHDLIHSTAIIDPSAVIASDVQIGPYCIIGPQVTIGAGTKLHSHVVVGGFTRIGQNNEIFQFASVGEVCQDLKYKGEETWLEIGNNNLIREHCSLHRGTVQDNALTKIGSHNLLMVNTHIAHDCIVGDHNIFANNVGVAGHVHIGDHVIVGGNSGIHQFCKIDSYSMIGGASLILKDVPAYVMASGNPAHAFGINIEGMRRKGWSKNTIQGLREAYKLIFKSGLTSVQAIDQIKSEI---LPSVPEAQLLIDSLEQSERGIVR 1LXA Chain:A ((7-262)) -----FVHPTAIVEEGASIGANAHIGPFCIVGPHVEIGEGTVLKSHVVVNGHTKIGRDNEIYQFASIGEVNQDLKYAGEPTRVEIGDRNRIRESVTIHRGTVQGGGLTKVGSDNLLMINAHIAHDCTVGNRCILANNATLAGHVSVDDFAIIGGMTAVHQFCIIGAHVMVGGCSGVAQDVPPYVIAQGNHATPFGVNIEGLKRRGFSREAITAIRNAYKLIYRSGKT----LDEVKPEIAELAETYPEVKAFTDFFARSTRGLIR

General information: TITO was launched using: RESULT: Template: 1LXA.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 : 1553 -205347 -132.23 -811.65 target 2D structure prediction score : 0.44 Monomeric hydrophicity matching model chain A : 0.88 3D Compatibility (PKB) : -132.23 2D Compatibility (Sec. Struct. Predict.) : 0.44 1D Compatibility (Hydrophobicity) : 0.88 QMean score : 0.571

(partial model without unconserved sides chains): PDB file : Tito_1LXA.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1LXA-query.scw PDB file : Tito_Scwrl_1LXA.pdb: