Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRKVAPILKPIAVLTISTIVATTTGIVNSSSYRAPSSSSSTVEETTPTTSVSTSEPTTTESLNETTTTSTWDDTTTSSSYDETYTTD----SS-SETSNTVPDGTPSDSTNPSTSPDTSASSETI--PSSTTVDDNTQNDDAARTAQQNQDSGNTQTYNQQAGDSQ 2XC8 Chain:A ((1-121)) --------------GIEIVNRKAVWYL-----------TSEIKETETGIEVSAGELHKGDE-----EVFPVEEVSFDLTPDDTYPVEYMLYLHMNVQTKKVSWSLCKAYLDGEGYCDYQGNERLIMYPVSVTVFPN------------GTREGTIFLYEKEDR---

General information: TITO was launched using: RESULT: Template: 2XC8.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 : 505 39536 78.29 346.81 target 2D structure prediction score : 0.47 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : 78.29 2D Compatibility (Sec. Struct. Predict.) : 0.47 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.248

(partial model without unconserved sides chains): PDB file : Tito_2XC8.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2XC8-query.scw PDB file : Tito_Scwrl_2XC8.pdb: