Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTHVRFDYSKALTFFNEHELTYLRDFVKTAHHNIHEKTGAGSDFLGWVDLPEHYDKEEFARIKKSAEKIKSDSDVLLVVGIGGSYLGARAAIEALNHAFYNTLPKAKRGNPQVIFIGNNISSSYMRDVMDLLEDVDFSINVISKSGTTTEPAIAFRIFRK--LLEEKYGKEEAKARIYATTDKERGALKTLSNEEGFESFVIPDDVGGRYSVLTAVGL-LPIAVSGVNIDDMMKGALDASKDFATSELEDNPAYQYAVVRNVLYNK-GKTIEMLINYEPALQYFAEWWKQLFGESEGK----------DEKGIYPSSANYSTDLHSLGQYVQEGRRDL---FETVLNVEKP-----KHEL----------------TIEEADNDLDGLNYLAGKTVDFVNKKAFQGTMLAHT--DGNVPNLIVNIPELNAYTFGYLVYFFEKACAMSGYLLGVNPFDQPGVEAYKVNMFALLGKPGFEEKKAELEKRLED 1G98 Chain:A ((147-519)) ---------------------------------------------------------------------KTITDVI-NIGIGGSDLGPLMVTEALK--------PYSSGGPRVWFV-SNIDGTHIAKTLACLNPESSLFIIASKTFTTQETITNAKTAKDWFLLSAKDPSTVAKHFVALSTNTAKVKEFGIDPQNMFEFW---DWVGGRYSLWSAIGLSIALHVGFDNFEQLLSGAHWMDQHFRTTPLEKNAPVLLAMLGIWYINCFGCETQAVLPYDQYLHRFAAYFQQGDMESNGKYITKSGARVDHQTGPIVWGEPGTNGQHAFYQLIHQGTKMIPCDFLIPVQTQHPIRKGLHHKILLANFLAQTEALMKGKSTEEARKELQA----AGKSPEDLMK------LLPHKVFEGNRPTNSIVFTKLTPFILGALIAMYEHKIFVQGVVWDINSFDQWGVELGK-------------------------

General information: TITO was launched using: RESULT: Template: 1G98.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 : 1447 -35234 -24.35 -105.81 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : -24.35 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.445

(partial model without unconserved sides chains): PDB file : Tito_1G98.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1G98-query.scw PDB file : Tito_Scwrl_1G98.pdb: