Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEDKKMLHILNNLYNINFKTMEFLREGGCISYRLSSENSSYFMKIISSAFMDTAKQSLSIISYLTQKGFPSPRIIHTKEGLPYVEIEELNKKTLIVLFEFIEGSEPN--EGEDIETIGKLVGQLHNILKGYKEPL--PVHG-KEFFIDRY---IKILEQKNY------DQN-------KI----DTFREYGDVLWE-------NVKNLPHGFCHGDLHRGNLLKTTTKKYYLLDFDTSSYAFPMYDIMVMCNSTDYFNFNEIGYQKSKNTYETFLKGYTKYRSLSKDELNSFYDFIAIYHYQLQATIIEIYGLNCVDIEFLDNQLNWLMKWREQCKAR 2Q83 Chain:A ((26-305)) ---------VLQGWDVQAEKIDVIQ---ALVWKVHTDSGAVCLKRIHRPE-KKALFSIFAQDYLAKKGMNVPGILPNKKGSLYSKHG----SFLFVVYDWIEGRPFELTVKQDLEFIMKGLADFHTASVGYQPPNGVPIFTKLGRWPNHYTKRCKQMETWKLMAEAEKEDPFSQLYLQEIDGFIEDGLRIKDRLLQSTYVPWTEQLKKSPNLCHQDYGTGNTLLGENEQIWVIDLDTVSFDLPIRDLRKMIIPLLDTT-----GVWDDETFNVMLNAYESRAPLTEEQKQVMFIDMLF----------------------------------------

General information: TITO was launched using: RESULT: Template: 2Q83.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 : 932 -24837 -26.65 -101.79 target 2D structure prediction score : 0.55 Monomeric hydrophicity matching model chain A : 0.67 3D Compatibility (PKB) : -26.65 2D Compatibility (Sec. Struct. Predict.) : 0.55 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.374

(partial model without unconserved sides chains): PDB file : Tito_2Q83.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2q83-query.scw PDB file : Tito_Scwrl_2Q83.pdb: