Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIKKAIIPAGGFGTRNLPVTKVIPKEMFPVGSKPVIHYLVEELKESGIEDILMVVSSHKNLIVDYFDSSLALEAFLASKNKLHLLREHPIPDIRIHYVRQPYAKGLGDAISFGKQFAGGEPFAVVLPDDLIFSANQPALGQLIEAYTKYQSSVIGLKETKTEDLHHYGVIKGEPVEKGLYRIQDIVEKPKQNPPSHFAAAGRYIFTPDIFNELEALEADSGGEVQVTDAIKASLGACTVYGKLLEGERYDIGLQKDYLKLIYDMLKTEKNPQ 4HO3 Chain:A ((2-215)) ---KGIILSGGSGTRLYPLTKVVSKQLLPVYDKPMVYYPLSVLMLAGIKDILIISTP---------EDTPRFEQLLGGGSEL---------GISLSYAVQSSPDGLAQAFIIGEEFIGDDNVALVLGDNIFYGHGFTELLQR-AANRKSGATIFGY---NVKDPQRFGVVEFD--EKG--KVISIEEKPEE-PKSSYAVTGLYFYDNRVVDIAKNITPSARGELEITDVNKAYLELGELHVELL----------------------------

General information: TITO was launched using: RESULT: Template: 4HO3.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 : 1129 -131209 -116.22 -613.13 target 2D structure prediction score : 0.52 Monomeric hydrophicity matching model chain A : 0.75 3D Compatibility (PKB) : -116.22 2D Compatibility (Sec. Struct. Predict.) : 0.52 1D Compatibility (Hydrophobicity) : 0.75 QMean score : 0.478

(partial model without unconserved sides chains): PDB file : Tito_4HO3.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4HO3-query.scw PDB file : Tito_Scwrl_4HO3.pdb: