Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDYRRDGQNDQHQTEPSHTEQQNTENQKLIGHSEQELLDAPVSYEAGRQETASALEMEKQETAVKKEKKRRAAWLSPILGGIIGGGLMLGIAPYLPSDQNQATETASANKQVQSDNFTTAPITNASNIADMVEDLEPTIVGISNIQTSQNNTFGTGGGSSSESESGTGSGVIFKKDSDKAYIITNNHVVEGANKLTVTLYNGETETAKLVGSDTITDLAVLEISGKNVKKVASFGDSSQLRTGEKVIAIGNPLGQQFSG--TVTQGIISGLNRTIDVDTTQGTVEMNVLQTDAAINPGNSGGPLINASGQVIGINSLKVSESGVE-SLGFAIPSNDVEPIVDQLLQNGKVDRPFLGVQMIDMSQVPETYQENTLGLFGDQLGKGVYVKEVQANSPAEKAGIKSEDVIVKLNGKDVESSADIRQILYKDLKVGDKTTIQVLRKGKTKTLNATLTKQTESSSS 3PV3 Chain:A ((79-351)) -----------------------------------------------------------------------------------------------------------------------------------------------------------------------GSGVII--DPNNGVIITNDHVIRNASLITVTLQDGRRLKARLIGGDSETDLAVLKIDAKNLKSLV-IGDSDKLEVGDFVVAIGNPFGLN---SQSATFGIVSALKRS---D------E-NFIQTDAAINPGNAGGALVNAKGELIGINTAILS-----VGIGFAIPINMVKDVAQQIIKFGSIHRGLMGIFVQHLT--PELAQ--AMGYPEDF--QGALVSQVNPNSPAELAGLKAGDIITQINDTKITQATQVKTTISL-LRVGSTVKIIVERDNKPLTLSAVVT--------

General information: TITO was launched using: RESULT: Template: 3PV3.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 : 1383 -19200 -13.88 -75.29 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain A : 0.73 3D Compatibility (PKB) : -13.88 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.73 QMean score : 0.519

(partial model without unconserved sides chains): PDB file : Tito_3PV3.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3PV3-query.scw PDB file : Tito_Scwrl_3PV3.pdb: