Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNGFMDKLSEKIMPLANLLGQNRYLTVLRDAFMLSFPLTMFGSIVVVINNLPF--FSDAT----KGTLSNLFGNGQNATMSIMSVFVTFGIGYYLSKSYDVEGIFGGAVSFASFLILTPFAMKTAGG--E---DVTGVLSLDRLGAKGMFIGMIAAFLAGEIYCRITKRGWQIKMPDGVPPAVTKPFAALIPAVVTLTIFLVINAVMTGIFNANLHDVVYEVIQKPLTGLGSSLPATLIALFFVQFLWFFGLHGQIIVNSVMDPIWNTLMLDNLEAYQHGKELPHIITKPFMETFTVGIGGSGMTLAVVLLMAFVLKKKQYRDVGRLALAPGIFNVNEPAIFGLPIVLNATILIPWVVAPLIVTTFNYLVMAAGLVPAPT-GVSVPWTVPIIASGVLATN-SWLGGMLQVIDFVIVAFIWYPFLKVLDKQPDLDIA 3QNQ Chain:D ((3-431)) -----RFLEKYVMPVAGKVAEQRHLLAIRDGLVLTMPFLIIGSIFLIISTLPIPGYSEFMASLFGKNWNVALGYPVSATFNIMALIAVFGIAYRLGEYYKVDALASGALSLVTFLLATPFQVAYIMPGTKESILVDGVIPAALMGSQGLFVAMIIAIISTEIYRFLVQKKMIIKMPETVPPAVTRSFAALIPGFIVVTVVWIIRLIFEHTTFGSIHNVVGKLLQEPLSILGASLWGAVIAVILVHVLWACGIHGATIVGGVMSPIWLSLMDQNRIAFQAGQDVPNTITAQFFDLWI-YMGGSGATLALVVGMLLFARSQQLKSLGRLSIAPGIFNINEMVTFGMPIVMNPLLLIPFIVVPVVLTIVSYFAMEWGLVA-RPSGAAVTWTTPILFSGYLGSGGKISGVILQLVNFALAFVIYLPFLKIWDKQKIAEEK

General information: TITO was launched using: RESULT: Template: 3QNQ.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain D - contact count / total energy / energy per contact / energy per residue : 2041 -237310 -116.27 -570.46 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain D : 0.83 3D Compatibility (PKB) : -116.27 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.83 QMean score : 0.361

(partial model without unconserved sides chains): PDB file : Tito_3QNQ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3QNQ-query.scw PDB file : Tito_Scwrl_3QNQ.pdb: