Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAYPNGKLSEEKVFKDPVHRYVHVRDKLIWDLIGTREFQRLRRIKQLGTTYLTFHGAEHSRFNHSLGVYEIVRRMVDDVFKGRP--EWDDSERELCLAAALLHDLGHGPFSHSFEKVF--------HLDHEDFTRGIILGD---TEVNQVLRKVSP---GFPQDVAEVIAKTY---------KNKQVVSLISS---QIDADRMDYLQRDAYYTGVSYGHFDMERILRVMRPRE----DQIVIKESGMHAVEDYIMSRYQMYWQVYFHPVTRSAEVILTKILHRAKQLHDEGYVFTHAPVHFYSIFEGKLTLEDYVKLDESIILYYFQAWEDEEDAILSDLCRRFINRQLFQYVEFNPNEEMSAY-----FELT-SLFK-------EAGIDPSYYLVVDSSSDLPYDFYRPGEEEERLPIHLLTQNG--QIKELSRQSAIVESISGKRRTDHKLYYPKDLICDGTKHPEAKMKIRQLLGLT 5AO0 Chain:A ((95-557)) --------DTMKVINDPIHGHIELH-PLLVRIIDTPQFQRLRYIKQLGGGYYVFPGASHNRFEHSLGVGYLAGCLVHALGEKQPELQISERDVLCVQIAGLCHDLGHGPFSHMFDGRFIPLARPEVKWTHEQGSVMMFEHLINSNGIKPVMEQYGLIPEEDICFIKEQIVGP-LWPYKGRPENKSFLYEIVSNKRNGIDVDKWDYFARDCHHLGIQ-NNFDYKRFIKFARVCEVDNELRICARDKEVGNLYDMFHTRNSLHRRAYQHKVGNIIDTMITDAFLKADDYIEITGA----GGKKYRISTAIDDMEAYTKLTDNIFLEILYST-DPKLKDAREILKQIEYRNLFKYVGETQPTGQIKIKREDYESLPKEVASAKPKVLLDVKLKAED-FIVDVINM---------------HVSFYCKTAPNRAIR-------------E--QLIRVYCKKVDRKSLY---AARQYFVQWCAD-

General information: TITO was launched using: RESULT: Template: 5AO0.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 : 1827 -47625 -26.07 -124.67 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : -26.07 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.360

(partial model without unconserved sides chains): PDB file : Tito_5AO0.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5AO0-query.scw PDB file : Tito_Scwrl_5AO0.pdb: