Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTQVDIAALSPQVVWQHFQTLCTIPRPSKHEQQLREFLQNWAESRNLETYV---DEVGNLIIRKNATPGKKHVSGVILQGHLDMVTQANTGTVHDFFKDPIRPVLEEGWLIAKDTTLGADNGIGVALALAVLDSND-----IHGPIEVLLTVDEEAGM-SGARLLETGV----LKGKWLFNIDTEEWG----ELYLGCAGSIDVEVEQPLNYEPIPENLNIVNIQVAGLKGGHSGVDIHLGRGNANVILARFLNQHLASLG-----------GHLVEFTGGTARNALPREAVATIAISPNQLSSLEKLLAEYQAAWKEQLKGIDDNLQLSIQSTGAKVTEVINQQQQNEWLQALATSPYGVASMSQVLPDVVETSNNIGVVRLNREGGKAILMVRSMVNQEAQDFAEKIQAHFSQFNIGS--TLTPLVSGWTPNPDSAALKCLQQAYQNAFNIEPNLKVIHAGLECGIIAEHYPHLQMVSFGPDIQGAHAPGERVKVDTVEKCWKLLVTALASVE 4PQA Chain:A ((2-375)) ---------TETQSLELAKELISRPSVTPDDRDCQKLLAERLHKIGFAAEELHFGDTKNIWLRRGT-----KAPVVCFAGHTDVVPTGP---VEKWDSPPFEPAERDGRLYGRGA---ADMKTSIACFVTACERFVAKHPNHQGSIALLITSDEEGDALDGTTKVVDVLKARDELIDYCIVGEPTAVDKLGDMIKNGR------------------RGSLSGNLTVKGK-QGHIAYP-H-LAINPVHTFAPALLELTQEVWDEGNEYFPPTSFQISNINGGT---------------------------------------------------------------------------------------------GATNVIP---GELNVKFNFRFSTESTEAGLKQRVHAILDKHGVQYDLQWSCSGQPFLTQ-AGKLTDVARAAIAETCGIEAELSTTGGTSDGRFIKAI--AQELIELGPSNATIHQINENVRLNDIPKLSAVYEGILARL-

General information: TITO was launched using: RESULT: Template: 4PQA.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 : 1836 -4021 -2.19 -11.69 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : -2.19 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.416

(partial model without unconserved sides chains): PDB file : Tito_4PQA.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4PQA-query.scw PDB file : Tito_Scwrl_4PQA.pdb: