Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIRLETMKVVAQEEIAPAIFELVLE-GEMVEAMRAGQFLHLRVPDDAHLLRRPISISSIDKANKQCHLIYRIEGAGTAIFS-TLSQGDTL-DVMGPQGNGFDLSDLDEQNQVLLVGGGIGVPPLLEVAKELHERGVKVVTVLGFANKDAVILKTELAQYG-QVFVTT---D--DGSYGIK----GNVSVVINDL--DSQFDAVYSCGAPGMMKYINQTFDD-HPRAYLSLESRMACGMGACYACVLKVPESETVSQRVCEDGPVFRTGTVVL 5VJ7 Chain:B ((1-258)) -----MYKILEKKEIAMRNTWYKVYAPHVAKKVQPGQFVIVRAFP--NGERIPLTPVMWDREEGWIVLIVFTRGKTTMRMAVELKEGDSLLNVAGPLGTPVPMEK---FGKILAIGAYTGIVEVYPIAKAWQEIGNDVTTLHVTF-EPMVILKEELEKAVTRHIVEPVPLNPNQDFLAN-KNVSQRLKEKVRELLESEDWDLVFMVGPVGDQKQVFEVVKEYGVPMKVDLHPIMVDGTGMCGACRVTVGG---EVKFACVDGPEFDAYQVDW

General information: TITO was launched using: RESULT: Template: 5VJ7.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 : 1248 -53870 -43.16 -223.52 target 2D structure prediction score : 0.53 Monomeric hydrophicity matching model chain B : 0.69 3D Compatibility (PKB) : -43.16 2D Compatibility (Sec. Struct. Predict.) : 0.53 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.458

(partial model without unconserved sides chains): PDB file : Tito_5VJ7.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5VJ7-query.scw PDB file : Tito_Scwrl_5VJ7.pdb: