Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ----------------------------------------------MSLT-----DILVCLSEKQNGRRNNMSDIIIGILLVISF--------FFMVWYCVKGYNLMVGFAIMATVWMGLALVGNTFSPNPAMEGQGVIDVLTHIYTTGPAEYAKSILVNVFFGAFFGRVLVDSGIAATLI--RKVVELGGDKPRITMSLLCIVTAVIFMSMTGIGPV--------ISIAVIVLPILMSLG----------------ISVPVALF-------SFMGSIMAGIFANIVNFKQYQTIY------AGFNPAAESYTYNDYFQIGMIGM-------IVSLVVVLTVANISMNK------------KKRYAMAANVPAEGGDAPMISWLA------VLLPVLGVVLLDLPIILGFILAGIWALLF--TGKLRGGYKEICRQFAKLFTDGAVD------VAPMVGFLMTLAMFNNSAAYASPYFS----AIFGDWIPQSPLVLAIVFAILTPLGFFRGPMNLVGSGSAILAVVLAVNPTMS-----PAFLFPLFAITTIAPQHLDITQSWVAWGLGYTKVTSREYMKKSIPTGWIIGAILCLITFLLYGNA----------- 4WWX Chain:B ((1-618)) APRQHLLSLTRRAQKHRLRELKIQVKEFADKEEGGDVKAVCLTLFLLALRARNEHRQADELEAIMQGRGSGLQPAVCLAIRVNTFLSCSQYHKMYRTVKAITGRQIFQPLHALRNAEKVLLPGYHPFEWQPPLKN---VSSRTDVGIIDGLSGLASSVDEYPVDTIAKRFRYDSALVSALMDMEEDILEGMRSQDLDDYLNGPFTVVVKESCDGMGDVSEKVPEKAVRFSFTVMRITIEHGSQNVKVFEEPKPNSELCCKPLCLMLADESDHETLTAILSPLIAEREAMKSSELTLEMGGIPRTFKFIFRGTGYDEKLVREVEGLEASGSVYICTLCDT-TRLEASQNLVFHSITRSHAENLQRYEVWRSNPYHESVEELRDRVKGVSAKPFIETVPSIDALHCDIGNAAEFYKIFQLEIGEVYKHPNASKEERKRWQATLDKHLRKRMNLKPIMRMNGNFARKLMTQETVDAVCELIPSEERHEALRELMDLYLKMKPVWRSSCPAKECPESLCQYSFNSQRFAELLSTKFKYRYEGKITNYFHKTLAHVPEIIERDGSIGAWASEGNESGNKLFRRFRKMNARQSKCYEMEDVLKHHWLYTSKYLQKFMNAHNA

General information: TITO was launched using: RESULT: Template: 4WWX.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 1716 -114936 -66.98 -249.32 target 2D structure prediction score : 0.46 Monomeric hydrophicity matching model chain B : 0.64 3D Compatibility (PKB) : -66.98 2D Compatibility (Sec. Struct. Predict.) : 0.46 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.128

(partial model without unconserved sides chains): PDB file : Tito_4WWX.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4WWX-query.scw PDB file : Tito_Scwrl_4WWX.pdb: