Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKLKNAKIKILDLDLRGCLYLNNFSHSQRVALFFKIISRAGDGPFWYLMLAIVWG-MQGITYSLQIIYLLLGGSVGTAIYKFLKHKTTRPRPYQVHQVIVLGERPLDHFSFPSGHTLHAVMVTIVLGYIQP-------V----LLAAMLPFMVLVALSRMVLGLHYPSDVIVGALIGAAVASLIIFVAPLFGIAL 5JKI Chain:A ((39-216)) ------TNAVQSADEAISKAAV-LIRQPWLNEVMTGITHLGASSFLLPLIVIIGAGMFFYRKTWDGLLMLLVFGTDRLLNKVLKEWIERVRPDFAP------LVHESSFSFPSGHSMNAACVYPVIAYFLVKHLPFLSKHKKMVYIIAGVIAVLVGISRVYLGVHFVTDVLGGFSLGLLLFFLVKGFDEKI----

General information: TITO was launched using: RESULT: Template: 5JKI.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 : 669 -83733 -125.16 -504.42 target 2D structure prediction score : 0.68 Monomeric hydrophicity matching model chain A : 0.67 3D Compatibility (PKB) : -125.16 2D Compatibility (Sec. Struct. Predict.) : 0.68 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.294

(partial model without unconserved sides chains): PDB file : Tito_5JKI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5JKI-query.scw PDB file : Tito_Scwrl_5JKI.pdb: