Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNQIVEDAGSLDVFRWPSSSPPSPENLEHAARLCQGALGSTSVAVVATPYNHAGWSAQDCIKVSFPSENRSFIAKVPRLVDENSATACKNEAQRASWASQ-HQIG-PAVIAIDDL---S----GAFAMEFLSGQTLSAQM--MLQDHLKTCTIGLLRRIHDAPSQHYMQ-------IYNAPAAVKRMLQAADKERLLDGDDGLLLESLITWTFQKVGCQPTFQTLVPCHNDFHSQNIMLDQQ-GTLWAIDFEDCDLGDPMWDLGYLTANMGLEPLD-LAGIY-GCNME---Q-KKRLEVFYYLAIGHCAVWSAIHGPLWTQHYRDCMLRLRRGWLRL 5IGI Chain:A ((8-295)) -------------------------DTSQLYALAAR-HGLKLH-GPLTVNE-LGLD-YRIVIATVD-DGRRWVLRIPRRAEVS--AKVEPEARVLAMLKNRLPFAVPDWRVANAELVAYPMLEDSTA-VIQPGSSTPDWVVPQDSEVFAESFATALAALHAVPISAAVDAGMLIRTPTQARQKVADDVDRVR-RE-----FVVNDKRLHRWQRWLDDDSSWPDFSVVVHGDLYVGHVLIDNTERVSGMIDWSEARVDDPAIDMAAHLMVFGEEGLAKLLLTYEAAGGRVWPRLAHHIAERLAFGAVTYALFALDSGN---EEYLAAAKA--------

General information: TITO was launched using: RESULT: Template: 5IGI.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 : 1186 -54435 -45.90 -207.77 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : -45.90 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.268

(partial model without unconserved sides chains): PDB file : Tito_5IGI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5igi-query.scw PDB file : Tito_Scwrl_5IGI.pdb: