Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTVEQNEFLSSVQLQILAEQAIKQYPNEYQGSVKLLCQSENATFLVTTAQ----------AKYALRIHRPNYHHLQDIESELAWLDALNQSGIEVPLAIADQDGQRVITLKLAEGISRYAVLFNWVNGSMPTTDV--DPTAFQQLGQITAALHQHSKSWKRPEQFNRIVWNHDTMVGAQGHWGNWKHA----PHLDQADHAVVEEAIARISTELCQY---GAGEDRYGLIHADLRLTNLLLQDQQIGVIDFDDCGMSWFMHDLAAAISFNEH---------------LDAAPQWVEHWLTGYEKTGHVQNHDYVMIPTFIMQRRIQMMAWNGSHAHTEMALSLGDQWSNETVRLCKKYLNGEMPVGRSNA 3C5I Chain:D ((37-293)) -------------------------------RVKQIL-LTNQLFEVGLKEETANNYNSIRTRVLFRIYGKHVDELYNTISEFEVYKTMSKYKI-APQLLNTF---------------NGGRIEEWLYGDPLRIDDLKNPTILIGIANVLGKFHTLSRKRHLPEHWDRTP-CIF---KMMEKWKNQLFKYKNIEKYN-CDIHKYIKESDKFIKFMKVYSKSDNLANTIVFCHNDLQENNIINTNKCLRLIDFEYSGFNFLATDIANFFIETSIDYSVSSYPFFEIDKKKYISYENRKLFITAYLSNY----------------------------------------------------------------

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 : 770 -5748 -7.46 -26.24 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain D : 0.61 3D Compatibility (PKB) : -7.46 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.226

(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: