Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIQQQVKNEFPTLEDIHAAAERLDGLVVKTPFVFSETISKTLGAEMWLKFENLQFTASFKERGALNKLLSLSEQEKQHGVIAASAGNHAQGVAYHAQRTGVTATIVMPKSTPNVKVQRVREYGARVILHGQDFSEAAAEMHRVAQEES-LTIIHPFDDAEIIAGQGTIALEMLEAVPDLDIL----VVPIGGGGLISGIAIAAKSINPKIKIIGVQSVVYPSMAKLLCNYQLAV--SMGSTVAEGIAVKTPGELTTQIAKHFVDDIVVVTEDMIEEAIALLLNIEKTVCEGAGATGIAAIMSRSDLFLGHKVGVVLSGGNIDTRVMVSVLQRHLTRTGRMVRICVELSDNPGALARLTAIIAEQGGNIYELRHERFAATSRAKESAVSVDIELKSAPDLEPLIQAMQLEGYIVRKEEI 1VE5 Chain:D ((2-308)) ----------PSLQDLYAAFRRIAPYTHRTPLLTSRLLDGLLGKRLLLKAEHLQKTGSFKARGALSKALAL---ENPKGLLAVSSGNHAQGVAYAAQVLGVKALVVMP-------------------------------VARALQEETGYALIHPFDDPLVIAGQGTAGLELLAQAGRMGVFPGAVLAPVGGGGLLAGLATAVKALSPTTLVLGVEPEAADDAKRSLEAGRILRLEAPPRTRADGVRTLSLGERTFPILRERVDGILTVSEEALLEAERLLFTRTKQVVEPTGALPLAAVLEHGA-RLPQTLALLLSGGNRD------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 1VE5.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain D - contact count / total energy / energy per contact / energy per residue : 1688 -49756 -29.48 -184.28 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain D : 0.72 3D Compatibility (PKB) : -29.48 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.72 QMean score : 0.447

(partial model without unconserved sides chains): PDB file : Tito_1VE5.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1VE5-query.scw PDB file : Tito_Scwrl_1VE5.pdb: