Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAYPNGKLSEEKVFKDPVHRYVHVRDKLIWDLIGTREFQRLRRIKQLGTTYLTFHGAEHSRFNHSLGVYEIVRRMVDDVFKGRPEWDDSERE-LCLA-AALLHDLGHGPFSHSFE------------------KVFHLDHEDFTRGI--------ILGDTEVNQVLRKVSPGFPQDVAEVIAKTYKNK--------QVVSLISSQIDADRMDYLQRDAYYTGVSYGHFDMERILRVMR----PREDQIVIKESGMHAVEDYIMSRYQMYWQVYFHPVTRSAEVILTKILHRAKQLHDEGYVFTHAPVHFYSIFEGKLTLEDYVKLDESIILYYFQAWEDE-EDAILSDLCRRFINRQLFQYVEFNPNEEMSAYFELTSLFKEAGIDPSYYLVVDSSSDLPYDFYRPGEEEERLPIHLLTQNGQIKELSRQSAIVESISGKRRTDHKLYYPKDLICDGTKHPEAKMKIRQLLGLT 4MZ7 Chain:A ((29-370)) -----------KVINDPIHGHIELHPLLV-RIIDTPQFQRLRYIKQLGGGYYVFPGASHNRFEHSLGVGYLAGCLVHALGEKQPELQISERDVLCVQIAGLCHDLGHGPFSHMFDGRFIPLARPEVKWTHEQGSVMMFEHLINSNGIKPVMEQYGLIPEEDIYFIKEQIVGPLE------LW-PYKGRPENKSFLYEIVSNKRNGIDVDKWDYFARDCHHLGIQ-NNFDYKRFIKFARVCEVDNELRICARDKEVGNLYDMFHTRNSLHRRAYQHKVGNIIDTMITDAFLKA----DDYIEITGAGGKKYRISTAIDDMEAYTKLTDNIFLEILYSTDPKLKDA--REILKQIEYRNLFKYV----------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4MZ7.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 : 1431 -77951 -54.47 -264.24 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain A : 0.68 3D Compatibility (PKB) : -54.47 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.319

(partial model without unconserved sides chains): PDB file : Tito_4MZ7.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4MZ7-query.scw PDB file : Tito_Scwrl_4MZ7.pdb: