Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRASTVTIKTEQDLEKLRVSGRLAAQVLEMIGEYVKPGVTTEYLDNICNDYIVNTLKVIPANVGYHGFTKTICISVNEVVCHGIPSQNKILKDGDIINIDVAIIKDGYFGDTSRMYYVGNVNPHAKKLVETTYEAMVAGIHAVKPGATLGDIGYAIQSVAHREGYSIVREYCGHGIGKVYHEQPNILHYGQRGQGLVLKKGMVFTIEPMVNAGKPQVKE-LNDGWTVITQDHSLSAQWEHMVAVTDTGFELLTPWPEGVGNYPEI 3MX6 Chain:A ((6-260)) -----IKIHTEKDFIKMRAAGKLAAETLDFITDHVKPNVTTNSLNDLCHNFI-TSHNAIPAPLNYKGFPKSICTSINHVVCHGIPNDK-PLKNGDIVNIDVTVILDGWYGDTSRMYYVGDVAIKPKRLIQVTYDAMMKGIEVVRPGAKLGDIGYAIQSYAEKHNYSVVRDYTGHGIGRVFHDKPSILNYGRNGTGLTLKEGMFFTVEPMINAGNYDTILSKLDGWTVTTRDKSLSAQFEHTIGVTKDGFEIFTLSPKKLDYP---

General information: TITO was launched using: RESULT: Template: 3MX6.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 : 1517 -142776 -94.12 -562.11 target 2D structure prediction score : 0.69 Monomeric hydrophicity matching model chain A : 0.88 3D Compatibility (PKB) : -94.12 2D Compatibility (Sec. Struct. Predict.) : 0.69 1D Compatibility (Hydrophobicity) : 0.88 QMean score : 0.616

(partial model without unconserved sides chains): PDB file : Tito_3MX6.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3MX6-query.scw PDB file : Tito_Scwrl_3MX6.pdb: