Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTTPSDRPLMAKLSAIAAYFALGEIRSYKRAPGTNHNYLVATEEGEYLFKIIVNTTLEDVLNGLPFLQRLQEQNFAATAYYLRSSSGQVFYHSPDCDAVVLQRLPGRNP-SLSPAVCHEIGVVLARLHLVPCDNLPE-KRHWLDARYLPET----IEKAVNMYG-------TE--------RLRETL-AVIDSLKHF---------QPATFPQCIIHGDLDTSNCLFEGERLVAFVDWQEVGVSAAMMDFVQTVIGFCFVEQDAGSDYWALFNSELYHALYAGYTSIRPLTPYEQAHLDAALKYVGLTQPAWSMLMWEHYHPGEQMIETNLLFWKYGLDKLTLPVL 2Q83 Chain:A ((23-301)) ------------AENVLQGWDVQAEKIDVIQ---ALVWKVHTDSGAVCLKRIHRP-EKKALFSIFAQDYLAKKGMNVP-GILPNKKGSLYSKHGSFLFVVYDWIEGRPFELTVKQDLEFIMKGLADFHTASVGYQPPNGVPIFTKLGRWPNHYTKRCKQMETWKLMAEAEKEDPFSQLYLQEIDGFIEDGLRIKDRLLQSTYVPWTEQLKKSPNLCHQDYGTGNTLLGENEQIWVIDLDTVSFDLPIRDLRKMIIPLLDTT--------GVWDDETFNVMLNAYESRAPLTEEQKQVMFI----------------------------------------------

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 : 948 -71847 -75.79 -294.45 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain A : 0.60 3D Compatibility (PKB) : -75.79 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.254

(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: