Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRVLVIMDPIETVNLKKDSTMAMLWAASRRGHELGYALQQDLYIDQGKAYGLISPLKVFEDYNHYYELGEKKKESIAAYDVVLMRKDPPFDMNFVYTTYVLEQAEREGSWIINKPQSLRDCNEKLFATQFPE---LQVPTLVTSQQSLIREFITEH-GDVIVKPLDGMGGMGIFRLYQDGVNIGSTLEMLTEL----GTRPIMAQRYIPEIVEGDKRILMVNGEPIPYCLARIPQNGEVRGNLAAGGLGQARPLTENDKLIAAKVGPFLREKGLVFVGLDVIGN----YVTEINVTSPTCIREIDAQFGTSIADDLFDVLEAGRPA 5K2M Chain:C ((1-272)) MRIGITYTVLR------REEMAIKERAGEFGE-VVMLHEDDLLFP---------------------------G--NYDLDVVIIRNVSHF-----KALYTARLFESEGIPTVNSSRLIFEAGDKLFATLRLAGKVPVPEWKAALSEGGALRVPDSLGYPLVSKPVFGSWGRLLAKVNDRDS-LEAVLEHRKWMKNPLY-GIHYFQEFVEKP-GRDIRSYVIGGEFVG-AIYRYS--NHWITNTARGGKAEPC-SDPEVEELSVKAWEAF---GEGALAIDIFESEKGLLVNEVNPN-ME-FKNAARVTGADMAGKLVEYAVEVAK-

General information: TITO was launched using: RESULT: Template: 5K2M.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 1338 -22191 -16.59 -85.35 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain C : 0.67 3D Compatibility (PKB) : -16.59 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.359

(partial model without unconserved sides chains): PDB file : Tito_5K2M.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5K2M-query.scw PDB file : Tito_Scwrl_5K2M.pdb: