Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKSLRFQSVFDIIGPVMIGPSSSHTAGAVRIGKIV------SSIFDDTPTEVEFQLFNSFAKTYRGHGTDLALVAGILGM--DTDDP--EIP--------NSLEIAHKRGIKI-----VWTIQKDSNAPHPNTTKITV--KNAHKTISVTGISIGGGNIQVTELNGFAVSLNMNTPTIIIVHQDIPGMIALVTEALSRYGINIAQMNVTREKAGEKAIMIIEVDSRNCDEAIEEIRKIPHLHNVNFFK 2IQQ Chain:A ((17-157)) ---------------------SSHTVGPMLAANAFLQLLEQKNLFDKT-QRVKVELYGSLALTGKGHGTDKAILNGLENKAPETVDPASMIPRMHEILDSNLLNLAGKKEIPFHEATDFLFLQKELLPKHSNGMRFSAFDGNANLLIEQVYYSIGGGFITTEE-------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 2IQQ.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 : 499 14423 28.90 124.33 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : 28.90 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.418

(partial model without unconserved sides chains): PDB file : Tito_2IQQ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2IQQ-query.scw PDB file : Tito_Scwrl_2IQQ.pdb: