Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFKLLTTFRAVYETRNFSRAAEVLFLSQPAVSNQIKQLERELNIDLFQRNGRKEMLPTKQADLLYERTLVLLEEWEETQQKLLNEQNE-EEVCRIVASHTFAVYLLPQLMKHLIKRFPKVHFEIEITNSHESLEQVAKHESDFGFIEKPLETSGVQRYSLMEDQLVIAGDPK---------------SKLWLVREANSGVFHYTQRYFEE--MNIQDK-KMIVKSNDVIVALLKEGIGRSILSKRSVPENV---PMTPL--N----FHRYFYFIQR-TNLVSDQLLEIAEEILRYNESTETSHSEENLSW 3HHG Chain:E ((4-297)) NSEELTVFVQVVESGSFSRAAEQLAMANSAVSRIVKRLEEKLGVNLLNRTTRQ-LSLTEEGAQYFRRAQRILQEMAAAETEMLAVHEIPQGVLSVDSAMPMVLHLLAPLAAKFNERYPHIRLSLVSSE---GYINLIERKVDIALRAGELDDSGLRARHLFDSRFRVIASPEYLAKHGTPQSTEELAGHQCLGFTEPGSLNTW--AVLDAQGNPYKISPHFTASSGEILRSLCLSGCGIVCLSDFLVDNDIAEGKLIPLLAEQTSDKTHPFNAVYYSDKAVNLRLRVFLDFLVEELGNNL----------

General information: TITO was launched using: RESULT: Template: 3HHG.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain E - contact count / total energy / energy per contact / energy per residue : 1068 -52496 -49.15 -198.10 target 2D structure prediction score : 0.69 Monomeric hydrophicity matching model chain E : 0.71 3D Compatibility (PKB) : -49.15 2D Compatibility (Sec. Struct. Predict.) : 0.69 1D Compatibility (Hydrophobicity) : 0.71 QMean score : 0.421

(partial model without unconserved sides chains): PDB file : Tito_3HHG.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3HHG-query.scw PDB file : Tito_Scwrl_3HHG.pdb: