Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRKKELFDFTNITPKLF-TELRVADKTVLQSFNFDEKNHQIYTTQVASGLGKDNTQSYRITRLSLEGLQLDSMLLKHGGHGTNIGIENRNGTIYIWSLYDKPNETDKSELVCFPYKAGATLDENSKELQRFSNMPFDHRVTPALDMKNRQLAIRQYDTKNNNNKQWVTIFNLDDAIANKNNPLYTINIPDELHYLQGFFLDDGYLYWYTGDTNSKSYPNLITVFDSDNKIVLQKEITVGKDLSTRYENNFREPEGICMYTNPETGAKSLMVGITSGKEGNRISRIYAYHSYE-NFMNHVPMLRSPLLKTVGHQDTPPERFQPFIQTFILEYNAQNKKWMVPTSGYLPSYTSNLVRNITINADGNLQVTLNERYISLLHQSIEGDFRLKQKDIRMGSWYFAG--GEKSNVLEIGFMKGSTKIRPDDAAISNASRMSIFMIVADKIEV 4O6M Chain:A ((29-370)) MRLAYVKNHEIYGEKLLGLTLRERIEKTLQRAGFDVRFFD--------ELSLEEAEDYLIILEPVLILERDLLL-----EGRKILVSDGFTVGYFFG----------------------------GDFRT----VFDG---------NLQSSIEKYLSLNNLESYEIWAIKLSN-------------------------------------DNLKTAEKLLLSSLIDGWIAREINRKVSLRISRLLADTSVTPNQITVFSFFLSLVGSALFLLNSYLTTLLAGVIIQLHSIIDGCDGEIARLKFMESKYGAWLDGVLDRYSDFIIVFSITYVLSASN----PVYWIIGFLAAFASLMIAYTGDKFVAAYMRTY------SPEGFAIPITRDFRLLIIFACSVVNLPSLALVIIALLGNFEALRRIVALRSY---------------

General information: TITO was launched using: RESULT: Template: 4O6M.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 : 1551 -56099 -36.17 -172.08 target 2D structure prediction score : 0.35 Monomeric hydrophicity matching model chain A : 0.60 3D Compatibility (PKB) : -36.17 2D Compatibility (Sec. Struct. Predict.) : 0.35 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.110

(partial model without unconserved sides chains): PDB file : Tito_4O6M.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4O6M-query.scw PDB file : Tito_Scwrl_4O6M.pdb: