Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSKDERIIQNQDNKKTIRHEDYIAGIGKGMAILDSFSSNQHRLKISMAAEKTGLTRAAARRHLLTLEYLGYLESD-G-HYYYLTPKVLKFSGAYLGAAQLPKVSQPLLNLLTNQTSLIYSVMVLDGYEAITIARSAAHQQTDRVNPYGLHLGNRLPAHATSAGKILLAHLSQEEQLDWLQKYPLQRLTKYTHVENDKFLELLKEIREQDWCYSREEHELGFHALAVPIYGQDFKVVAALNIVSPTMRTTEGYLIQYILPLLQETARDLRQVL 2XRN Chain:A ((15-251)) -----------------------QVIARAASIMRALGSHPHGLSLAAIAQLVGLPRSTVQRIINALEEEFLVEALGPAGGFRLGPALGQLINQA--QTDILSLVKPYLRSLAEELDESVSLASLAGDKIYVLDRIVSE----RELRVVFPIGINVPAAATAAGKVLLAALPDETLQAALGE-QLPVLTSNT-LGRKALVKQLSEVRQSGVASDLDEHIDGVSSFATLLDTYLG--YYSLAIVMPSSRAS-K-QSDLIKKALLQSKLNIERAI

General information: TITO was launched using: RESULT: Template: 2XRN.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 : 1111 -32685 -29.42 -139.08 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain A : 0.73 3D Compatibility (PKB) : -29.42 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.73 QMean score : 0.408

(partial model without unconserved sides chains): PDB file : Tito_2XRN.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2XRN-query.scw PDB file : Tito_Scwrl_2XRN.pdb: