Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLIQLYLLKLELFWFELHQHYHFSEPQKILNELIAAYSAAYSEKQRAYHTVQHLYECLSLIETVQSE--------LNDPYAVALALWFHDVVYEPQA------------------LDNELKSAELFEQLMAQ-DL------QLD----TMQKIKRWILATQKHAPTD---------------------ETDLQFLLDIDLAILAATPERFMQYEQQIQQEYSWADPEVYSIKRKEVLMNFYQSEPLYQTAYFQKNFELNAKQNLKKILE 4GH6 Chain:B ((57-245)) ---------------------------RWLFCVHDN----YR--NNPFHNFRHCFCVAQMMYSMVWLCSLQEKFSQTDILILMTAAICHDLDHPGYNNTYQINARTELAVRYNDISPLENHHCAVAFQILAEPECNIFSNIPPDGFKQIRQGMITLILATDMARHAEIMDSFKEKMENFDYSNEEHMTLLKMILIKCCDISNEVRPMEVAEPWVDCLLEEYF-----------------------------------------------

General information: TITO was launched using: RESULT: Template: 4GH6.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 473 -11800 -24.95 -90.07 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain B : 0.58 3D Compatibility (PKB) : -24.95 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.58 QMean score : 0.530

(partial model without unconserved sides chains): PDB file : Tito_4GH6.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4GH6-query.scw PDB file : Tito_Scwrl_4GH6.pdb: