Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKAKLGKSDLQVFPIGLGTNAVGGHNLYPNLNEETGKELVREAIRNGVTMLDTAYIYGIGRSEELIGEVLREFNREDVVIATKAAHRKQGNDFVFDNSPDFLKKSVDESLKRLNTDYIDLFYIHFPDEHTPKDEAVNALNEMKKAGKIRSIGVSNFSLEQLKEANKD--GL-VDVLQGEYNLLNREAEKTFFPYTKEHNISFIPYFPLVSGLLAGKYTEDTTFPEGDLRNEQEHFKGERFKENIRKVNKLAPIAEKHNVDIPHIVLAWYLARPEIDILIPGAKRADQLIDNIKTADVTLSQEDISFIDKLFA 4WGH Chain:A ((25-294)) KKTVRFG-EQAAVPAIGLGTWYMGEH-A---AQRQQEVAALRAGIDHGLTVIDTAEMYADGGAEEVVGQAIRGL-RDRVVLVSKVYP--------WHAGKAAMHRACENSLRRLQTDYLDMYLLHWRGDI-PLQETVEAMEKLVAEGKIRRWGVSNLDTEDMQALWRTADGEHCATNQVLYHLASRGIEYDLLPWCQQHSLPVMAYCPLAQAGRLRDGLF--------------------------QHSDIINMANARGITVAQLLLAWVIRHPGVL-AIPKAASIEHVVQNAAALDIVLSGEELAQLDRLY-

General information: TITO was launched using: RESULT: Template: 4WGH.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 : 1492 -90787 -60.85 -340.03 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain A : 0.78 3D Compatibility (PKB) : -60.85 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.78 QMean score : 0.490

(partial model without unconserved sides chains): PDB file : Tito_4WGH.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4WGH-query.scw PDB file : Tito_Scwrl_4WGH.pdb: