Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------MIHKNWLEKETIKKVKCVQTNAK----KYIVNRVLTPGKEYEVKNETEEFLFVVDNTNKVGGYYKEYFEEM------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------ 3WMT Chain:A ((18-522)) SFQAECESFKAKINVTNANVHSVTYVPAGVNISMADNPSICGGDPITSTFAFCRIALNVTTSSKSQIFMEAWLPSNYSGRFLSTGNGGLGGCVKYDDMAYAAGYGFATVGTNNGHFGNNGVSFYQNTEVVEDFAYRALHTGVVVGKELTKNFYPQGYNKSYYLGCSTGGRQGWKSVQTFPDDFDGVVAGAPAFNFINLTSWGARFLTLTGDSSAETFVTETQWTAVHNEIIRQCDSLDGAKDGIIEDPDLCQPIIEALLCNATQSSTSGTCLTGAQVKTVNGVFSATYGLNGSFLYPR-MQPGSELAAYSSY------------YSGTPFAYAEDWYRYVVFNNTNWDVATWTVQDAAIANAQDPYQISTWNGDLSPFQKKGGKVLHYHGMEDAIISSESSKVYYKHVADTMNLSPSELDSFYRFFPISGMAHCANADGPSAIGQGTGTFAGNNPQDNVLLAMVQWVEEGVAPDFVRGAKLNGSTVEYRRKHCKYPKRNRYVGPGSYTDENAWECV

General information: TITO was launched using: RESULT: Template: 3WMT.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 : 117 -562 -4.80 -10.41 target 2D structure prediction score : 0.46 Monomeric hydrophicity matching model chain A : 0.52 3D Compatibility (PKB) : -4.80 2D Compatibility (Sec. Struct. Predict.) : 0.46 1D Compatibility (Hydrophobicity) : 0.52 QMean score : 0.482

(partial model without unconserved sides chains): PDB file : Tito_3WMT.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3WMT-query.scw PDB file : Tito_Scwrl_3WMT.pdb: