Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence --MLMI-------HSVANGLNHFCTWVMRLAYLNVL-------WILFSLAGLVVFGLMPA-TAAMFTVAREWAKGNTDAPVFSVFFRTFKKEWRASQILGLIVVTAALFLFADMRIAAQMDQPVLVNVFVSISLIFAFV------------VLYVFPVFSHFDVK--IREVLSI-SFFIAFSRPAVTLLMAA--GAVGVLCLVLFHVTFLLFF--SGSLLSLILTKLSFKAFRSMDQRQEKEKAA 5FMR Chain:A ((12-270)) EVRILFSTAKGESHTHKAGFKQLFRRLRSTYRPDKVDKDDFTLDTLRSAHILVLGGPKEKFTAPEVDMLKKFVKNG---GSILILMSEGGEEKAGTNINYFLEQFGMSVNNDAVVRTTHYKYLHPKEVLISDGILNRAVITDEFRVFDGTGLEYVFPFGATLSVQKPAVPVLSSGKIAYPMNRPVGAVWAQPGYGRIAVLGSCAMFDDKWLDKEENSKIMDFFFKFLEPHSKIQLNDIDAEEPDV

General information: TITO was launched using: RESULT: Template: 5FMR.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 : 1199 -232409 -193.84 -1128.20 target 2D structure prediction score : 0.30 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -193.84 2D Compatibility (Sec. Struct. Predict.) : 0.30 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.191

(partial model without unconserved sides chains): PDB file : Tito_5FMR.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5FMR-query.scw PDB file : Tito_Scwrl_5FMR.pdb: