Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNTYHPFSLTTPSTLMIQDWAQTNQNNKEVIAGFTTKNGGVSQKPFESLNTGLHVHDKDADVVKNREYIADMFNTDLQSWVFADQTHDNRVQKVTQRDRGKGAREYHTALKATDGIYTNEKNVFLALCFADCVPLFFYDPVKSLVGVAHAGWKGTVKQIGREMVKQWTEKEGSNPSDIYAVIGPSISGACYTVDDRVMDAVRALPVSADLAANQTAKAQYQLDLKELNRLILMDSGLASEQISVSGLCTESEPSLFYSHRRDQGKTGRMMSFIGMKEA 1XAF Chain:A ((5-245)) ------------SKLIVPQWPLP----KGVAACSSTRIGGVSLPPYDSLNLGAHCGDNPDHVEENRKRLFAAGNLPSKP-VWLEQVHGKDVLKLTGEP---------YASKRADASYSNTPGTVCAVMTADCLPVLFCNRAGTEVAAVHAGWRGLCAGVLEETVSCFADK----PENILAWLGPAIGPRAFEVGAEVREAFMAVDAKASAAFIQHGD-KYLADIYQLARQRLANVGV--EQIFGGDRCTYTENETFFSYRRDK-TTGRMASFIWL---

General information: TITO was launched using: RESULT: Template: 1XAF.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 : 1465 -141806 -96.80 -588.40 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain A : 0.76 3D Compatibility (PKB) : -96.80 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.76 QMean score : 0.368

(partial model without unconserved sides chains): PDB file : Tito_1XAF.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1XAF-query.scw PDB file : Tito_Scwrl_1XAF.pdb: