Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSARRSRLRRVRWLPHQRIVVLKEVDLWAEDCVTEGVDVVAERLWRMRMDASRNGRAQYLAEYLALHVDSSRHYQWLLSNY--GPSLRDVLLTSSLTPFTEERCKGVLRRVLLALDQLHRVSMYVHADVSLGNVLTSPSSCDDVVLGDLESVSPIG--AVPRGCL-GSYLFMAPERLVDGALPLAPHDDIWAFGIVCYNLLTWDVTHPWCALGTESDHSENYWAFLDLMSKAKDVPPCQLLLQSPLSRCSKEALTFVAVCLSWDPACRPSAAELLQHSWMLSP 3A7G Chain:A ((81-275)) ----------------------------------------------------------YVTKYYGSYLKDTK--LWIIMEYLGGGSALDLLEPG---PLDETQIATILREILKGLDYLHS-EKKIHRDIKAANVLLSEHG--EVKLADFGVAGQLTDTQIKRNTFVGTPFWMAPEVIKQSAY--DSKADIWSLGITAIEL----------ARG-EPPHSELHPMKV-LFLIPKNNPPT---LEGNYSKPLKE---FVEACLNKEPSFRPTAKELLKHKFIL--

General information: TITO was launched using: RESULT: Template: 3A7G.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 : 900 3045 3.38 16.02 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain A : 0.70 3D Compatibility (PKB) : 3.38 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.353

(partial model without unconserved sides chains): PDB file : Tito_3A7G.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3A7G-query.scw PDB file : Tito_Scwrl_3A7G.pdb: