Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEYRKINLEELEKLKNLYVYENFEEIKKQIIDDISNGIKDIYVITENENLIGEITVTYKSDLPNETIPDIRVYLSAFRVHKDYQDQGLGQKLLKYVISELENKGITEFTVGVEDDNENAKHIYEKFDFTEIIDRGEETVKGRTYQYNLLLRKSNTKKMEKLIKKFDLGS-----QIIKVTQIHGGLSNRLYRVETDQ----------AKYAIKKLNKTLMQNKAEFERIIFAEKVARIAEENGILVVRALEFENKIIHKIDGDYYMIFNWNYGSHIQPEDV-TDEICNIIGELLAKIHNLDFSKIEAEKS---KEMQIRTIDWNSLAKIAKEQNKYYYKDLV---ENIEILYEINKKTNEALEYAKSNLIISHRDLIKKNILWNNNIPTVIDWESSGYVNPTVELVQVCWNWANGD------------VGKFEFEKFEIIVNSYLQNIKN---YKKE----DMKKLIYANLWEAIEWLEYNLKRSLCIESTYRKEEIELAEEQINYLNYEIRYAMTQIKAVADSLQI 3C5I Chain:D ((11-328)) -------------------------------------------------------------------------------------------------------------------------------------------------------LTDPLYIKKICLEKVPEWNHFTEDNLRVKQIL--LTNQLFEVGLKEETANNYNSIRTRVLFRIYGKHV---D-ELYNTISEFEVYKTMSKYKI-APQLLNTF---------NGGRIEEWLYGDPLRIDDLKNPTILIGIANVLGKFHTLSRKRHLPEHWDRTPCIFKMMEKWKNQLFKYKNIE-KYNCDIHKYIKESDKFIKFMKVYS-KSDNLANTIVFCHNDLQENNIINTNKCLRLIDFEYSGFNFLATDIANFFIETSIDYSVSSYPFFEIDKKKYISYENRKLFITAYLSNYLDKVVPTPKLIDEILEAVEVQALGAHLLWGFWSII--------------------------------------------

General information: TITO was launched using: RESULT: Template: 3C5I.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain D - contact count / total energy / energy per contact / energy per residue : 1055 20297 19.24 74.35 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain D : 0.61 3D Compatibility (PKB) : 19.24 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.182

(partial model without unconserved sides chains): PDB file : Tito_3C5I.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3c5i-query.scw PDB file : Tito_Scwrl_3C5I.pdb: