Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKSLRFQ--SVFDIIGPVMIGPSSSHTAGAVRIGKIV------SSIFDDTPTEVEFQLFNSFAKTYRGHGTDLALVAGILGM--DTDDPE--IP--------NSLEIAHKRGIKI-----VWTIQKDSNAPHPNTTKITV--KNAHKTISVTGISIGGGNIQVTELNGFAVSLNMNTPTIIIVHQDIPGMIALVTEAL---SRYGINIAQMNVTREKAGEKAIMIIEVDSRNCDEAIEEIRKIPHLHNVNFFK 4RQO Chain:A ((20-225)) -------NISVFDLF-SIGIGPSSSHTVGPMLAANAFLQLLEQKNLFDKT-QRVKVELYGSLALTGKGHGTDKAILNGLENKAPETVDPASMIPRMHEILDSNLLNLAGKKEIPFHEATDFLFLQKELLPKHSNGMRFSAFDGNANLLIEQVYYSIGGGFI-TTEEDFDK-----NPP---------PYPFATATELLKLCKKHHLTIAELMLVNEK------------------------------------

General information: TITO was launched using: RESULT: Template: 4RQO.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 : 801 9785 12.22 60.03 target 2D structure prediction score : 0.50 Monomeric hydrophicity matching model chain A : 0.70 3D Compatibility (PKB) : 12.22 2D Compatibility (Sec. Struct. Predict.) : 0.50 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.323

(partial model without unconserved sides chains): PDB file : Tito_4RQO.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4RQO-query.scw PDB file : Tito_Scwrl_4RQO.pdb: