Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSQLFKSFDASEKTQLICFPFAGGYSASFRPLHAFLQGECEMLAAEPPG-HGTNQTSAIEDLEELTDLYKQEL-NLRPDRPFVLFGHSMGGMITFRLAQKLEREGIFPQAVIISAIQPPHIQ--RKKVSHLPDDQFLDHIIQLGGMPAELVENKEVMSFFLP---SFRSDYRALEQFELYDLAQIQSPVHVFNGLDDKKCIRDAE-----------GWKKWAKDITFHQFDGGHMFLLSQT--EEVAERIFAILNQHPIIQP 3TEJ Chain:A ((1068-1293)) ---------------LFCFHPASGFAWQFSVLSRYLDPQWSIIGIQSPRPNGPMQTAA--NLDEVCEAHLATLLEQQPHGPYYLLGYSLGGTLAQGIAARLRARGEQVAFLGLLDTWPPETQNWQ-----GLDPEVLAEI------------NREREAFLAAQQGSTSTELFTTIEGNYADAVRLLTTAHSVP-FDGKATLFVAERTLQEGMSPERAWSPWIAELDIYRQDCAHVDIISPGTFEKIGPIIRATLNR------

General information: TITO was launched using: RESULT: Template: 3TEJ.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 : 983 -136844 -139.21 -680.81 target 2D structure prediction score : 0.61 Monomeric hydrophicity matching model chain A : 0.71 3D Compatibility (PKB) : -139.21 2D Compatibility (Sec. Struct. Predict.) : 0.61 1D Compatibility (Hydrophobicity) : 0.71 QMean score : 0.391

(partial model without unconserved sides chains): PDB file : Tito_3TEJ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3TEJ-query.scw PDB file : Tito_Scwrl_3TEJ.pdb: