Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDIKKQDTRRFKEIKPKIMYYGTSTFLLTTLNEDGTTNISPMSSSWALG--H-YIILGVGLGGKAIDNLERHKECVINLPGPDLWENVERISSYSGKKSIPPLKKQIGFTYKKEKYEAAGLTPLQSKTVSPTRIKECPIQIEAEVKHIRLPEYESSFAIVETQALHFHAEESIILDENHINPSKWSPLIYN--FRHYFGLGREVGKTFRSET 3BNK Chain:A ((2-182)) --------AEKIKINNNVFIYPMPVTLLGAN-VKGKANLMALGWVSRVNANPPMLGVGVNKSHYTPEGIAENGSFSVNFPYSGMVKKTDYCGLVSGEK--------------VDKSGLFEVF--YGELKTAPMIKECTLNLECRVVETLEF---PTNYFFVGEIIAAYSEEQYLI-QGKPDIKKMDPLLLTMPDNSYWTVGDYAGAALKT--

General information: TITO was launched using: RESULT: Template: 3BNK.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 : 865 -84048 -97.16 -477.54 target 2D structure prediction score : 0.55 Monomeric hydrophicity matching model chain A : 0.72 3D Compatibility (PKB) : -97.16 2D Compatibility (Sec. Struct. Predict.) : 0.55 1D Compatibility (Hydrophobicity) : 0.72 QMean score : 0.341

(partial model without unconserved sides chains): PDB file : Tito_3BNK.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3BNK-query.scw PDB file : Tito_Scwrl_3BNK.pdb: