Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSMLALISPAKTLDYETALPTDEFTQPRLLEHSAQLIDVCRKLSASEIASLMSVSEKIATLNADRFRDWKPEFDFSNARQAIYAFKGDVYTGLDAYHLKDKDIDFAQQHLRMLSGLYGLLRPLDLMMPYRLEMGTKLKNTHGHNLYEFWGDIITNQI---NEDLAAIKSELLVNLAS--DEYYKSVNEKKIKAEIVK--PVFLD------------QKNGKYKVISFYAKKARGLMARFIVENQLNKVE---DIKAFNTEGYYFDADNSSAKELVFKRDEQ-- 3WZM Chain:A ((15-278)) MRTRSTISTPNGITWYYEQEG---TGPDVVLVPDGLGE--CQMFDSSVSQIAAQGFRVTTFDM---------PGMSRSAKA----PPETYTEVTAQKLASYVISVLDALDIKHATVWGCASGASTVVALLLGYPDRIRNAMCHELPTKLLDHLSNTAVLEDEEISKILANVMLNDVSGGSEAWQAMG-DEVHARLHKNYPVWARGYPRTIPPSAPVKDLEALRGKPLDWTVGAATPTESFFDNIVTATKAGVNIGLLPGMHFPYVSHPDVFAKYVVETTQKHL

General information: TITO was launched using: RESULT: Template: 3WZM.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 : 1317 -36295 -27.56 -151.23 target 2D structure prediction score : 0.45 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : -27.56 2D Compatibility (Sec. Struct. Predict.) : 0.45 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.154

(partial model without unconserved sides chains): PDB file : Tito_3WZM.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3WZM-query.scw PDB file : Tito_Scwrl_3WZM.pdb: