Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ----------MDIQTVLSDLKLNGKVIPVVGGDVNQTYRIKTEHRAYFLKIHPNVKKGFFEAEVDGLKELSAFV-RVPDTYM------LGETSEGAYLLMEWI-----EPGKGDQRDLA-AALANLHQQTA---PQFGFRKDNYLG---TLVQKNSFE-EDWWT-FFFKDRLESQISLAEETNRWNVQRQEKYLRFKE-RVLKSVEPKKITPRLLHGDLWSGNVFFDQQGHPVFVD-PAVSYGNREQDIAM--------SQLFGGFRPEF-LDAYQTIFPLEKGWKDR-LPI-YQLYYLLAHLNMFGESYGSQVDQLLENF--------------- 2Q83 Chain:A ((11-346)) LSAEDAKKLTELAENVLQGWDVQAEKIDVIQ---ALVWKVHTDSGAVCLKRIHR-PEKKALFSIFAQDYLAKKGMNVPGILPNKKGSLYSKHGSFLFVVYDWIEGRPFELTVKQDLEFIMKGLADFHTASVGYQPPNGVPIFTKLGRWPNHYTKRCKQMETWKLMAEAEKEDPFSQLYLQEIDGFIEDGLRIKDRLLQSTYVPWTEQLKKSPNLCHQDYGTGNTLLGENEQIWVIDLDTVSFDLPIRDLRKMIIPLLDTTGVWDDETFNVMLNAYESRAPLTEEQKQVMFIDMLFPYELYDVIREKYVRKSALPKEELESAFEYERIKANALRQLI

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 : 1052 40202 38.21 147.26 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : 38.21 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.337

(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: