Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAYDSRFDEWVQKLKEESFQNNTFDRRKFIQGAGKIAGLSLGLTIAQSVGAFEVNAAPNFSSYPFTLGVASGDPLSDSVVLWTRLAPDPLNGGGMPKQAVPVKWEVAKDEHFRKIVRKGTEMAKPSLAHSVHVEADGLEPNKVYYYRFKTG-----HELSPVGKTKTLPAPGANVPQMTFAFASCQQYEHG------------YYTAYKHMAK--EKLDLVFHLGDYIYEYGPNEYVSKTGNVRTHNSAEIITLQDYRNRHAQYRSDANLKAAHAAFPWVVTWDDHEVENNYANKIPEKGQSVEAFVLRRAAAYQAYYEHMPLRISSLPNGPDMQLYRHFTYGNLASFNVLDTRQYRDDQANNDGNKPPSDESRNPNRTLLGKEQEQWLFNNLGSS---TAHWNVLAQQIFFA-KWNFGTSASPIYSMDSWDGYPAQRERVINFIKSKNLNNVVVLTGDVHASWASNLHVDFEKTS-------SKIFGAEFVGTSITSGGNGADKRADTDQILKEN-PHIQFFNDYRGYVRCTVTP-HQWKADYRVMPFVTEPGAAISTRASFVYQKDQTGLRKVSSTTIQGGVKQSDEVEEDRFFSHNKAHEKQMIKKRAKITN 3ZK4 Chain:A ((196-555)) ----------------------------------------------------------------------------------------------------------------------------PGYIHTSF--LKELWPNREYTYKLGHRLFNGTTIWSKEYHFKASPYPGQ-SSVQRVVIFGDMGKAEADGSNEYNNFQPGSLNTTKQIIQDLEDIDIVFHIGDLCYANGYI--------------------SQWDQFT------AQIEPIASTVPYMTASGNHERDWPGTGSFYGNLDSGGEC----GVPAQTMFF-VPAE-------NREKFWYSTDYGM-FRFCIAHTELDW----------------------RKGTEQYEFIEKCLASVDRQKQPWLIFLAHRVLGYSSAGF-----YVQEGSF-EEPMGREDLQHLWQKYKV--DIAMYGHVHNYERTCPIYQNVCTNKEKHNYKGNLNGTIHVVVGGGGASLAE--------FAPINTTWSIFKDHDFGFVKLTAFDHSNLLLEYRKSSD-------GQVYDSFTISRDYRD--------------------------------------------

General information: TITO was launched using: RESULT: Template: 3ZK4.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 : 1945 -154740 -79.56 -471.77 target 2D structure prediction score : 0.51 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : -79.56 2D Compatibility (Sec. Struct. Predict.) : 0.51 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.473

(partial model without unconserved sides chains): PDB file : Tito_3ZK4.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3ZK4-query.scw PDB file : Tito_Scwrl_3ZK4.pdb: