Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKVNGIHHVSALTADAQKNLDFYKKVLGLKLVKKSVNQDEPTMYHLFYGDEVANPGTELTFFEIPRIAPFHAGTNSISSIGLRVPGTEALHYWKERFEEQQVTHSGIS-----KRAGRDILAFQDHEGQRLVLTADEEGKGYG--LPVKQSGIPEEFSFRGLGPVELTVPYAEPTLHVLTNILGFTEISREPVEG---------QG-TAVILESGEGGAATEIHLIERNDLPRERQGKGSVHHVAFRVRDEEELAGWHRIISREGFSNSGIV-E--RYYFKALYFREPNGILFELSTDGPGFMVD-ENLDELGQTIALPPYLEHRRAEIEAKLKPIQ 2ZYQ Chain:A ((2-285)) -SIRSLGYLRIEATDMAAWREYGLKVLGMVEGKGAPE------GALYLRMDDF--PARLVVVP--------GEHDRLLEAGWECANAEGLQEIRNRLDLEGTPYKEATAAELADRRVDEMIRFADPSGNCLEVFHGTALEHRRVVSPY--G-HRFVTGEQGMGHVVLSTRDDAEALHFYRDVLGFRLRDSMRLPPQMVGRPADGPPAWLRFFGCN--PRHHSLAFLP-------MPTSSGIVHLMVEVEQADDVGLCLDRALRRKVPMSATLGRHVNDLMLSFYMKTPGGFDIEFGCEGRQVDDRDWIAREST------------------------

General information: TITO was launched using: RESULT: Template: 2ZYQ.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 : 1485 -120265 -80.99 -457.28 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain A : 0.67 3D Compatibility (PKB) : -80.99 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.556

(partial model without unconserved sides chains): PDB file : Tito_2ZYQ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2ZYQ-query.scw PDB file : Tito_Scwrl_2ZYQ.pdb: