Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKGAAFVKKEGLKQKALEIGRVPTH--LKLEIEDYGGDDKRAHFCWADPQDENTGIIVELGP-DGELESLSRDIEPESGERLSEEKLEDIMRQFVETHHPGALSAFVREENDRAYGDKVRFSYVQM-EAGLPLPMSGFMADVSL-SGEIVYFRYYGE---AGSIIKPKRVADVEEALAFIKKDVEFD---LLFEVLHRSVYKNGDDQPHLVYEPEGR------AITVPADLVQEEQAVDDDDDYREPESFPLPLFEGIREKADPDSMIGIENGFVKEREADLGDGRIGIVWRNPDDPVYQPADKSMDSWFKGRTHQVLKTIYNKETGKLEGVMSFMEKKGPLTVTLAECEKIALRFLFALFPNADQYFRIRYDEKDEEENAVAGFTFEAHCHGVPLRFGQIRICVSRQTGYITVYMGPDIDPNKLATIDPVPAISVEQAKSIFWQHFKVELGWEREYGDDEEHSYRLVYKPVYPHFIDAHTGEPVFSIW 5BOI Chain:A ((10-229)) ------VSEDVAKQVARSFLNLKGNEQIHIVKSGKDADYEVYSLTITDPK-TNQETYMDITQKGGYPLWVLEDRDI-KKQNISLNDAMNKATKFLKDHRFES---LVMAESA-QYDNMGVFTFVEQTESGVRIYPDSVKMKMSLEDGSVIGFSAKDFLLKHRTRDIPKPKISKEQAKTKLNSNVKVMEERLAIITND-------LNEEVLCYEFLGTIKNDTYRIFINADTGFEEKVEK----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5BOI.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 : 910 -84391 -92.74 -415.72 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain A : 0.59 3D Compatibility (PKB) : -92.74 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.59 QMean score : 0.467

(partial model without unconserved sides chains): PDB file : Tito_5BOI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5BOI-query.scw PDB file : Tito_Scwrl_5BOI.pdb: