Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MHSEHPFSQLIPDVIIDAVESSSDQY-TNYQIYPL-NSYENRVYQVGMEDGPALIAKFYRPDRWS--NKQILEEHTALSLLEKKGVPVAAPLAF-NGQTLFEHANFRLSLTNKVIGNAPEA--EDLDDLFQIGELIGETHSVLTKLPLIGRQS--PSLIES---IESQIKWLLASPSDVSKTQTSTLP--HALQKEFITLFDSLMQMSKDVMSQSGSIQRQTIHGDCHASNLLKSI---TGMVLLDFDDIQTGYPCQDIWLHLTAK-E-------------HHQQQLSELIEGYES--HHPFDRRSLALIDAFKLERTVRYAAWLSQRWNDPAFPKAFPWFGTQDYWLGLRKELIDLKAQWRNDTE 4WH3 Chain:A ((5-303)) -----------NEVLFGIASH-FALEGAVTGIEPYGDGHINTTYLVTTDG-PRYILQQMNTSIFPDTVNLMRNVELVTSTLKAQGKETLDIVPTTSGATWAEIDGGAWRVYKFIEHTVSYNLVPNPDVFREAGSAFGDFQNFLSEFDASQLTETIAHFHDTPHRFEDFKAALAADK-------LGRAAACQPEIDFYLSHADQYAVVMDGLRD--GSIPLRVTHNDTKLNNILMDATTGKARAIIDLDTIMPGSMLFDFGDSIRFGASTALEDEKDLSKVHFSTELFRAYTEGFVGELRGSITAREAELLPFSGNLLTMEC---------------------------------------------

General information: TITO was launched using: RESULT: Template: 4WH3.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 : 1104 -4626 -4.19 -17.39 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : -4.19 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.372

(partial model without unconserved sides chains): PDB file : Tito_4WH3.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4wh3-query.scw PDB file : Tito_Scwrl_4WH3.pdb: