Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKWLQIHITVDQEQVEFTETLLMSLGAVSVTLDDAEDQALLEPLPGETPLWNKVIVTGIYQQDEQDPIDVDTLEAFLKAQLPDVPMRHEELEDQVWERAWMDYYEPIQIGEKFWIVPEWLEPPEADATNIKLDPGLAFGTGNHASTFLCLQWLGKTDVKNKIVIDYGCGSGILGVAALLLGAKKVYATDIDPQAVLATKQNAEL----NGVLDRLYVGLPEEFDQEFKPQQADVLVA----------NILAGPLMA---LAPEFAKLLKSDGDFALAGVIEEQVVDVSGVYSEFFDILDVEKREENWCRISGKRKTTN 5IS8 Chain:D ((55-177)) ----------------------------------------------------------------------------------------------------------------------------------------------------------HTDFKDKIVLDVGCGSGILSFFAAQAGARKIYAVEASTMA-----QHAEVLVKSNNLTDRIVV-IPGKVEEVSLPEQVDIIISEPMGYMLFNERMLESYLHAKKYLKPS-GNMFPTIGDVHLAPFTDEQL----------------------------------

General information: TITO was launched using: RESULT: Template: 5IS8.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain D - contact count / total energy / energy per contact / energy per residue : 483 -26665 -55.21 -251.55 target 2D structure prediction score : 0.43 Monomeric hydrophicity matching model chain D : 0.61 3D Compatibility (PKB) : -55.21 2D Compatibility (Sec. Struct. Predict.) : 0.43 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.433

(partial model without unconserved sides chains): PDB file : Tito_5IS8.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5IS8-query.scw PDB file : Tito_Scwrl_5IS8.pdb: