Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MVKSPDLPVLPGSDQVAPASAIWSSETWRWEAVRWMDTALARRGLE--RVPTTPLQPRVRPWSTVLVAETTDQGRVWFKATSPE-------M-SPEAAILRALRSVTPDAVPVVWADD--------PERGWLLMPD-QGPVLRDVQRDDDAVSLMSSVVRRYARLQRSSTRVVDQLRDAGVPDMS--PRESARRWQRL---------GLKP---DTTREVRR---AAQRLDAVGLPLTIQHDDLHAGNVFADGTSAGAHDARIFDWGDASVGNPLCSLLVPLERIGEGLDDD----AARAARERILRAYLSVWSDVVSSTALSAAVDDALLIARVGRVFTWQRALTRASADERHAWGVHGRRLIAEINRSLGHAPEPSHD 4OCV Chain:A ((24-298)) -------------------------------TNEALFDVASHFALEGTVDS--IEPYGDGHINTTYLVT-TDGPRYILQRMNTGIFPDTVNLMRNVELVTSTLKAQG-KETLDIVRTTSGDTWAEIDGGAWRVYKFIEHTMSYNLV---PNPDVFREAGRAFGDFQNFLSGFDANQLTETIAHFHDTPHRFEDFKKALAADELGRAAGCGPEIEFYLSHADQYAVVMDGLRDGSIPLRVTHNDTKLNNILMDATT--GKARAIIDLDTIMPGSMLFDFGDSIRFGASTALEDERDLDKVHFSTELFRAYTEGFVG-----------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4OCV.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 : 922 -13238 -14.36 -56.33 target 2D structure prediction score : 0.69 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : -14.36 2D Compatibility (Sec. Struct. Predict.) : 0.69 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.333

(partial model without unconserved sides chains): PDB file : Tito_4OCV.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4ocv-query.scw PDB file : Tito_Scwrl_4OCV.pdb: