Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence --MKIDYVSDLHINHWIPWNVNQIKWEKRTREIVNR---------------LISNGN----------GEVLVIAGDFTEW-NQQTLWVLDEAAKQ--YEKVYFTYGNHDLYLLSKSQKRKYSDSLGRLNDLIQKAADMKNVTPLIKTTETY---KGKVFAGDVMWYLPKGIEGWDFFKGVSNDSNYIWLNGYNKVDGVRAMWKESMDWYETLENTQVDVFVSHVPPV----HNPYSPFEPNTCYMVDVPF--INAKHWVCGHDHLQAEFDKDGTSFHMNC--IGYPYDYDNYPSVNVIPGEEVDSYKTFELKTFEI 3RL5 Chain:A ((13-293)) VTITVDEYSSNPTQAFTHYNINQSRFQPPHVHMVDPIPYDTPKPAGHTRFVCISDTRSRTDGIQMPYGDILLHTGDFTELGLPSEVKKFNDWLGNLPYEYKIVIAGNHELTFDKEFMADLVKQDYYRFPSVSKLKPEDFDNVQSLLTNSIYLQDSEVTVKGFRIYGAPWTPWGWGFNLPRG---------------------QSLLDKWNLIPE-GTDILMTHGPPLGFRDWVPKELQRVGCVELLNTVQRRVRPKLHVFGGIHEGYGTMTDGYTTYINASTCTVSFQPTNPPIIFDLPNP---------------

General information: TITO was launched using: RESULT: Template: 3RL5.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 : 1210 10184 8.42 42.79 target 2D structure prediction score : 0.51 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : 8.42 2D Compatibility (Sec. Struct. Predict.) : 0.51 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.295

(partial model without unconserved sides chains): PDB file : Tito_3RL5.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3RL5-query.scw PDB file : Tito_Scwrl_3RL5.pdb: