Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAVYTKLSDEYIKNILKSYSFK-KVDRIEEISEGILNTNYFVEGDKGKFIFRILEGE--RDYTEEVKELEFL-EYLNLNGFPCPTAIKNDLGENYTFIDGKMTSVFTFIEGEKVKSI--NENNIKEIGQKLGKMHNLLKDRDIKRNRKIDMQYFYDIISK-ADLRGILKDD-----------YDFIMKYYER-ASKIDY---SNLPFGIIHNDIFPDNVFM--QEGEISGIIDFNDCLRGPLILDLAIVISFWIRNR----------GFSDEVENRLTEVFLNAYESERKITEEEKELMNEALIRIALTFIFLRVNKFHVEDNSSVNMEFKNYKDLLPLLRYF 4OCQ Chain:A ((24-312)) -------SNEVLFGIASHFALEGAVTGIEPYGDGHINTTYLVTTDGPRYILQQMNTSIFPDTVNLMRNVELVTSTLKAQGKETLDIVPTTSGATWAEIDGGAWRVYKFIEHTVSYNLVPNPDVFREAGSAFGDFQNFLSEFDASQLTET-IAHFHDTPHRFEDFKAALAADKLGRAAACQPEIDFYLSHADQYAVVMDGLRDGSIPLRVTHNDTKLNNILMDATTGKARAIIDLDTIMPGSMLFDFGDSIRFGASTALEDEKDLSKVHFSTELFRAYTEGFVG--ELRGSITAREAELL--------------------------------------------

General information: TITO was launched using: RESULT: Template: 4OCQ.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 : 1041 20325 19.52 79.71 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : 19.52 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.409

(partial model without unconserved sides chains): PDB file : Tito_4OCQ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4ocq-query.scw PDB file : Tito_Scwrl_4OCQ.pdb: