Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKLALFDLDHTLLNTDSDHSWGEFLVNEGLVDPVHHRQMNDKFYEDYKAGQLDPYAYNEFVFGFLTKHDNNYLTELHQLFMEKVIRPKMRPKGFDAIKKHQDLGHTIVGITATSDFITAPIFREFGITEILATNAEVADGKYTGKVAGLACYQKGKLARLEAWLDGRS--VSESWAYSDSINDRFLLEYATHAIAVNPDDRLEKLAQEHNWEIQDWSI 5IS2 Chain:A ((177-363)) KRLIVFDVDSTLVQGEVIEMLAAKAGAEGQ-VA--I-------TDAAMRGELDFAQSLQQRVATLAGLPATVIDEVA-----GQL--ELMPGARTTLRTLRRLGYACGVVSGGFRRIIEPLAEELMLDYVAANELEIVDGTLTGRVVGPIIDRAGKATALREFAQRAGVPMAQTVAVGDGANDIDMLAAAGLGIAFNAKPALR---------------

General information: TITO was launched using: RESULT: Template: 5IS2.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 : 1003 -83529 -83.28 -453.96 target 2D structure prediction score : 0.68 Monomeric hydrophicity matching model chain A : 0.70 3D Compatibility (PKB) : -83.28 2D Compatibility (Sec. Struct. Predict.) : 0.68 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.396

(partial model without unconserved sides chains): PDB file : Tito_5IS2.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5IS2-query.scw PDB file : Tito_Scwrl_5IS2.pdb: