Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNVVIIGAGMGGLTTGIALKKFGHQVRIFEQTEKIL-PVGAAISLWSNGVKCLNYLGLTEKIAKLGGQMDDLAYVDGLTGDVMTQFSLRPLIEEVGQRPYPVARADLQNMLMDEFGRDQIYLGKKMVGLEDKADFVEVHFADGSSTQADLLIGADGTHSMTRAYVLGQQVQRRYAGYVNWNGLVEISEDLAP-----AQQWTTYVGEGKRASLMPVADG------R--FYFFLDVPLPAGLE---NNR------------DEYKKLLKQYF---ADWCQPVQQLIERLDPQKTNRVEIHDIEPFTQFYKGCVVILGDAAHSTTPDIGQGGCQAMEDAIYLARSLQINTLGLEDALRRYQNKRNERANELVLRARKRCDVTHMKDETVTQAWYAELRREQGGHIMQGIISNIVGNPLD 2VOU Chain:C ((6-367)) DRIAVVGGSISGLTAALMLRDAGVDVDVYERSPQPLSGFGTGIVVQPELVHYLLEQGVELDS--ISVPSSSMEYVDALTGERVGSV---------PADWRFTSYDSIYGGLYELFGPERYHTSKCLVGLSQDSETVQMRFSDGTKAEANWVIGADGGASVVRKRLLGIEP--TYAGYVTWRGVLQPGEVADDVWNYFNDKFTYGLLDDGHLIAYPIPGRENAESPRLNFQWYWNVAEGPDLDELMTDVRGIRLPTSVHNNSLNPHNLRQFHSKGESLFKPFRDLVLNAS--SPFVTVVA-DATVDRMVHGRVLLIGDAAVTPRPHAAAGGAKASDDARTLAEVFTKN-HDLRGSLQSWETRQLQQGHAYLNKVKKMASR--------------------------------------

General information: TITO was launched using: RESULT: Template: 2VOU.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 1852 -13298 -7.18 -40.30 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain C : 0.72 3D Compatibility (PKB) : -7.18 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.72 QMean score : 0.488

(partial model without unconserved sides chains): PDB file : Tito_2VOU.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2VOU-query.scw PDB file : Tito_Scwrl_2VOU.pdb: