Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLENIKQTITRWDERNPWTNVYGLARSIIALSSLLTLLINHPSLIMKPASGISSYPACKMNLSLFCLGENNYMMLNLFRWVCIAILVLVVIGWRPRITGVLHWYVSYSLQSSLIVIDGGEQAAAVMTFLLLPITLTDPRKWHWSTRPIEGKRTLGKITAFISYFVIRIQVA----VLYFHSTVAKLSQQEWVDGTAVYYFAQEKTIGFNGFFQALTK-PIVTSPFVVIPTWGTLLVQIVIFAALFAPKKHWRLILIIAVFMHEIFAVMLGLISFSIIMAGILILYLTPIDSTIQFTYIRRLLWNKKHKKGEVSV 3N4P Chain:A ((34-279)) --LITDQSREEFDILRYSTLNTNAYDY---FGKTLYVYLDPAG---------------------------------------TGVAAVGAYRHQFLIYGLEHFFLS----------ESSEVAIAECAAHMIISVLSLHPYLDELRIAVEGNTNQAAAVRIACLIRQSVQSSTLIRVLFYHTPDQNHIEQPF------YLMGRDKALAVEQFISRFNSGYIKASQELVSYTIKLSHDPIEYLLEQIQNLH----------------------RSDDLIIAVIMATYLCDDIHAIRFRVS----------------

General information: TITO was launched using: RESULT: Template: 3N4P.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 : 1077 -194535 -180.63 -921.97 target 2D structure prediction score : 0.49 Monomeric hydrophicity matching model chain A : 0.58 3D Compatibility (PKB) : -180.63 2D Compatibility (Sec. Struct. Predict.) : 0.49 1D Compatibility (Hydrophobicity) : 0.58 QMean score : 0.323

(partial model without unconserved sides chains): PDB file : Tito_3N4P.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3N4P-query.scw PDB file : Tito_Scwrl_3N4P.pdb: