Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKVRFLQISDLHFQFQNYD--------------------TIVMRDKLLDFIEVLRRESDFDFLLLTGDIAHKGDVYNEDVKEYLNGIIKSMGLSKNNVHLVPGNHDISRDMTRTLLIDSIMKSPNPSEMLDKLDQKATNILVEGQRKFFDFYEDFMGVKYPEEDLHFLYQSEKYNVLSINTCLLSDKK-----GEEGTLLTAQMKLYKAIRKMNKEKNKGKVLNIAIGHHTLGCIES------SERESIKAHFDDYFIDLYLAGHVHDSSFNITANTN-ENPFLELVSGAIIKDEYATPEFISVDVNLDNGETEVTYYIWNTEYKYWSKNNQGGRRLQEGKLNYKINRLESLIEKEIEDNDDKIDEDEFKSFIIDFHEYRESYKTFTSNFDNQIGLDKKFYDMKSGETFKRKFDSYSEYFGVINHIMDSTSYVSADKKELIAETIVDKYLEFHNQYNNGDEIFVKIVNEIYLECHSVLPYSKALTKKYIKILTCWCIYECEIFNDNKRSVKND 2XMO Chain:A ((39-341)) -NLSMVVTTDVHYFAPSLTDNGKAFEKYVAAGDGKQLAYSDEITDAFLADVES----KKTDVLIISGDLTNNGEKTS---HEELAKKLTQVEKNGTQVFVVPGNHDINNPWARKFEKDKQ--LPT--DTI---SPTDFSKIYSDFG----YEDAISSDEFSL-S-YLAAPSSKVWLLMLDTAIYKTNMQQGNPTTEGG--LTAGTLDWIKESSALAKK-NGAKLIPVLHHNLTDHNDVKGYTINYNQQVIDALTEGAMDFSLSGHIHTQNIRS-AKSTDGKEITDIVTNALS---VFPHKYGNITYSAKNKNFT--YQSQKLDMEAWAKAQ--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 2XMO.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 : 1559 50352 32.30 187.18 target 2D structure prediction score : 0.61 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : 32.30 2D Compatibility (Sec. Struct. Predict.) : 0.61 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.364

(partial model without unconserved sides chains): PDB file : Tito_2XMO.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2XMO-query.scw PDB file : Tito_Scwrl_2XMO.pdb: