Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MPGRSCVALVLLAAAVSCAVAQHAPPWTEDCRKSTYPPSGPTYRGAVPWYTINLDLPPYKRWHELMLDKAPVLKVIVNSLKNMINTF--VPSGKIMQVVDEKLPGLLGNFPGPFEEEMKGIAAVTDIPLGEIISFNIFYELF-------TICTSIVAEDKKGHLIHGRNMDFGVFLGWNINNDTWVITEQLKPLTVNLDFQRNNKTVFKASSFAGYVGMLTGFKPGLFSLTLNERFSINGGYLGILEWILGKKDVMWIGFLTRTVLENSTSYEEAKNLLTKTKILAPAYFILGGNQSGEGCVITRDRKESLDVYELDAKQGRWYVVQTNYDRWKHP-----------FFLDDRRTPAKMCLNRTSQENISFETMYDVLSTK-----PVLN--------KLTVYTTLIDVTKGQFETYLRDCPDPCIGW 2X1C Chain:B ((2-333)) -------------------------------------------------LHILCQGTPFEIGYEHGSAAKAVIARSIDFAVDLIRGKTKKTDEELKQVLSQLGRVIEERWPK-YYEEIRGIAKGAERDVSEIVMLNTRTEFAYGLKAARDGATTAYCQL-PNGALQGQNWDFFSA---------------TKENLIRLTIRQAGLPTIKFITEAGIIGK-VGFNSAGVAVNYNALHLQG-----------LRPTGVPSHIALRIALEST-SPSQAYDRIVEQGGMAASAFIMV-GNGHEAFGLEFSPTSIRKQVL-D---ANGRMVHTNH--CLLQHGKNEKELDPLPDSWNRHQRMEFLLDGF---DGTKQAFAQLWADEDNYPFSICRAYEEGKSRGATLFNIIYDHARREATVRLGRP-------

General information: TITO was launched using: RESULT: Template: 2X1C.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 1691 21205 12.54 70.92 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain B : 0.64 3D Compatibility (PKB) : 12.54 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.367

(partial model without unconserved sides chains): PDB file : Tito_2X1C.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2X1C-query.scw PDB file : Tito_Scwrl_2X1C.pdb: