Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLNSANTTAPSLLSAYGLNSYTSSNSGSVTKAAESTETAVADSASNKHEANQIRSGDFSIDSAIKKAADKYGVDEKLIRAVIKQESGFNAKAVSGAGAMGLMQLMPSTA-----SSLGVSNP------LDPQQNVEGGTKYLKQMLDKYDGNVS-------MALAAYNAGPGNVDRYGGIPPFQETQNYVKKITSVYYA 4CHX Chain:A ((178-290)) ---------------------------------------------------------------VRQASRKYGVDESLILAIMQTQSSFNPYAVSRSDALGLMQVVQHTAGKDVFRSQGKSGTPSRSFLFDPASNIDTGTAYLAMLNNVYLGGIDNPTSRRYAVITAYNGGAGSVLR-----------------------

General information: TITO was launched using: RESULT: Template: 4CHX.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 : 356 -42702 -119.95 -449.49 target 2D structure prediction score : 0.67 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -119.95 2D Compatibility (Sec. Struct. Predict.) : 0.67 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.464

(partial model without unconserved sides chains): PDB file : Tito_4CHX.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4CHX-query.scw PDB file : Tito_Scwrl_4CHX.pdb: