Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDNKYHLVGQIDLENLNKIIIPVTKNVFNSRISEIKRFPTGSCH-FVYDAVLESWENL-VFRIGYSDSNKAKIGWSVFWHGKLKELGIKIPALLYHDVSCI-----EYGKPFTVSERIRWDDIWNAIDSLTDENLDLIAKEIAG--------IQNRISTLEPWRWFWEMTSYDDANLKG-----KWREFVLEKFEKAKMAL-SEGGIFDDSYIERVREALDRNSWY-LENVKGTMFFDD--ITSKNII-------VDNSE---FSWVVDFDTMTCWDRLYWLGLCNMAFIYLE---REIYISYLIRYLGCSE--DDISAMNLYTLLFCLDFMSEIGQKFNK--EEAIIDYIKAERYKSIFERICNNIK------------------ 5F86 Chain:A ((30-394)) NEDEFSFKIRRQIEKANADYKPCSSDPQDSD---------CSCHANVLKRDLAPYKSTGVTRQMIESSARYGTKYKIYGH------------RLYRDANCMFPARCEGIEHFLLPLVATLPDMDLIINTRDYPQLNAAWGNAAGGPVFSFSKTKEYRDIMYPAWTFWAGGPATKLHPRGIGRWDQMREKLEKRAAAIPWSQKRSLGFFRGSRTSDERDSLILLSRRNPELVEAQYTKNQGWKSPKDTLDAPAADEVSFEDHCKYKYLFNFRGVAASFRLKHLFLCKSLVFHVGDEWQEFFYDQLKPWVHYVPLKSYPSQQEYEHILSFFKKNDALAQEIAQRGYDFIWEHLRMKDIKCYWRKLLKRYVKLLQYEVKPEDQLIYIGP

General information: TITO was launched using: RESULT: Template: 5F86.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 : 1387 5609 4.04 18.33 target 2D structure prediction score : 0.44 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : 4.04 2D Compatibility (Sec. Struct. Predict.) : 0.44 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.191

(partial model without unconserved sides chains): PDB file : Tito_5F86.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5f86-query.scw PDB file : Tito_Scwrl_5F86.pdb: