Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKTASKFSVMFFMLLALCGCWDVKDIEQLSFARGLAIDETNDHQYKLTYQNLLPQSEDSQASGKPEFVNVTSHGKTILEAVSDVSIKDPPVYSDHLKVILLGEKLMRNQNVDQVLNHFIRDDELRRSSYLMAARGNAADVFTKGNPNQQQPMPSEKLIDLTTHSGYNGKIMIPLRIGRASVYSQNGYSYLIQAVKNEKGKAKYDGAGIIKRGSNKLVGFLSADETQTLSWVMGTIQGGVMPTTDKGHPITFEIKKSKTKIKPVIENGKPVFHISVKTKGILTEDQNPNENSFSKSYLHRLENIFEKKLERDVKQVMDKLQHEYKTDPVFLSDHIRIQHPDYWNKVKGHWDEIFSETDFKYDISFKIINFGTVGK 3OC9 Chain:A ((131-208)) ---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GMLPVVDFNGKILYE-KKDKPYMAP---NGHGGLFKALKDNGIL---EFMNEKGIKYSVAHNVDNILCKDVDPNMIGYMDLLQSE----------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3OC9.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 : 112 -5096 -45.50 -65.33 target 2D structure prediction score : 0.38 Monomeric hydrophicity matching model chain A : 0.57 3D Compatibility (PKB) : -45.50 2D Compatibility (Sec. Struct. Predict.) : 0.38 1D Compatibility (Hydrophobicity) : 0.57 QMean score : 0.174

(partial model without unconserved sides chains): PDB file : Tito_3OC9.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3OC9-query.scw PDB file : Tito_Scwrl_3OC9.pdb: