Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNLIFLPG--ASGSTTFWHPLIEKLPQQYRAKII----GY----PSFGDTPESLEVKSFEDLTNYVVNQIHDESVIIAQSMGGIFAVTAALQKPQLVKGLVLIATSGGINLEP-------FNVQDWREAYR---QAFLKYPDWFITTNANY----------------EEFLSDINIKTLLIWGDNDPVSPVQVGQYLNQKFENSTLYVVKGGDHQLAEKYADEVAVQIKNYLKGLM 2OCK Chain:A ((26-254)) --VLLLPGMLGSGETDFG-PQLKNLNKKLFTVVAWDPRGYGHSRPPDRDFPADFFERDAKDAVDLMKALKFKKVSLLGWSNGGITALIAAAKYPSYIHKMVIWGANAYVTDEDSMIYEGIRDVSKWSERTRKPLEALYGY-DYFARTCEKWVDGIRQFKHLPDGNICRHLLPRVQCPALIVHGEKDPLVPRFHADFIHKHVKGSRLHLMPEGKHNLHLRFADEFNKLAEDFLQ---

General information: TITO was launched using: RESULT: Template: 2OCK.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 : 970 26644 27.47 138.05 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain A : 0.72 3D Compatibility (PKB) : 27.47 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.72 QMean score : 0.457

(partial model without unconserved sides chains): PDB file : Tito_2OCK.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2OCK-query.scw PDB file : Tito_Scwrl_2OCK.pdb: