Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSKRIIQSVLSVSVLASMMSMAFAAQNEQEQAEQTLEKPAEPVKLETIFVTAE--EQVKQSL--GVSVITKEDLAKLPVRNDISDYVRRMPGVNLTGNSATGQRGNNRQIDIRGMGPENTLILVDGKPINSRNSVRYGWKGERDTRGDSNWVPAEAIESIEVLRGPAAARYGSGAAGGVVNIITKKVTNETHGSVEFYTSQPEDSKEGSSNRVGFNVSG-PLIKDVLSYRLYGNYNKTEADDVDINKSIGSTAAGREGVKNKDISGRLAWQATDQQTVLLDVSSSKQGNIYSGDSQLNANAEADAILSQLIGKETNTMYRDSY--ALTHEGDWSWGKSKLVAQYDKTHNKRLPEGLAGSVEGKINSLDDKATSRLETLRFNGEANIPFEYYLPQVLTVGTEWVEDRFKDNVSTTQGKDSSGSGYGDQLAKGDRSKMESRIASAYIEDNLKVTDSTDVVLGL------------RFDDHSKSGSNWSPSLNITQKLNDNFTLKGGVAKAYKAPNMYQNAEGYLLSTNGNGCPANIESRCLLQGNGDLKPETSVNKELGIQFQRDIVNASLTWFRNDYKDKIVAGTHVVGTADGSSTNANTGAVTNTKWNILRWENTPKALIQGFEGSLGLDFGDIRWTNNFTYMMDSKDKQTGNPLSLVPIYTINSIFDYDITDQLDVNFVFTQYGRQKSRQFAENRLESGIGSGGANSALKPSTVKSYSTAGINVGYKFSDQISTRVGVSNLFDKQILRDSNSISQTYNEPGRAYYASLKYSF 3RGN Chain:A ((6-594)) ---------------------------------------------DTLVVTANRFEQPRSTVLAPTTVVTRQDIDRWQ-STSVNDVLRRLPGVDITQNGGSGQLSS---IFIRGTNASHVLVLIDGVRLNLA-----GVSGSADL----SQFPIALVQRVEYIRGPRSAVYGSDAIGGVVNIITTRDEPGTEISAGW----------GSNSYQNYDVSTQQQLGDKTRVTLLGDYAHTHG-----------------GFLSKTLYGALEHNFTDAWSGFV--------RGYGYDNRTN----------------TRKLYSQSWDAGLRYNGELI--KSQLITSY--SHSKDY------NY---------SAT-------------------LDEMKQYTVQWA-----NNVIVGHGSIGAGV---------DWQKQTTTPGTGYVEDGYDQRNTGIYLTGLQQVGDFTFEGAARSDDNSQFGRHGTCQTSAGWEFIEGYRFIASYGTSYKAPNLGQLYGFY--------------------GNPNLDPEKSKQWEGAFEGLTAGVNWRISGYRNDVSDLIDYDDHT-----------------------LKYYNEGKARIKGVEATANFDTGPLTHTVSYDY-VDARNAITDTPLLRRAKQQVKYQLDWQLYD-FDWGITYQYLGTRYDKDYSSYPYQT-VKMGGV------------SLWDLAVAYPVTSHLTVRGKIANLFDK----DYETV-YGYQTAGREYTLSGSYTF

General information: TITO was launched using: RESULT: Template: 3RGN.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 : 3211 151019 47.03 284.94 target 2D structure prediction score : 0.40 Monomeric hydrophicity matching model chain A : 0.71 3D Compatibility (PKB) : 47.03 2D Compatibility (Sec. Struct. Predict.) : 0.40 1D Compatibility (Hydrophobicity) : 0.71 QMean score : 0.239

(partial model without unconserved sides chains): PDB file : Tito_3RGN.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3RGN-query.scw PDB file : Tito_Scwrl_3RGN.pdb: