Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MMFNNIFQILESFGFLSQHRSVYLQFSDASLNSQVFLQRIDGQHYLNQGMTAELICLSTNAHIPLKTFIGVQVAVDQVTDRGSFFCTTGIITGASQGQSDGALTLYKLAISDPTYLWHKRRNSRVFMNKSVKEISEILFQEWQGKSPLFASSLTLDLSGLKQTYDVRPFVMQLNESDYEFLTRLWRSEGISWLIDEAELTVASNMDNIQPQKLRLIDDNNQYQALT--RRAIRYHRSSATEQFDSMTSLMADRSLQPTSIFVQRWQPDVLQQTDGAGSVQSKHQHSTNYDNQSLSLEEAWHFSPAWMQDLNGEDGATSASNQQLEKFNQNLSAYYDAQSKQFIAKTTVRDTQVGYWFELNEHPEIDQHESTDKEFLIIGKNYYNQNNLPKDLNQQIQTLLQQSDWQASNTDERQANQLILQRRHIPTTPAYNPQTHSPVAHPQRAKVVGPEGEEIYVDEWGRIKVRFLFTRSDDHSHDGGAGTNNNDTDSAWIDVLTPWAGEGYGARFLPRIGEIVVINFFNGDIDRPFVMGRVHEAQRHPTKFDNKGKLPDTKKLSGIRSKEVSG---SGFGQLRFDDTPGQISTQLQSSHGASQL--NLGKLSHPKDKAESEDRGEGFELRTDQWGALRAGQGLLVSTHKQDNAKGDHLDAEVAKKQLEGSQTNSKALSDIAKNQKTDEIESLEQLKDFASQIQQQIAKFEKALLLLSSPDGIALSSSEDIHISADAQINQIAGDSINISTQKNVIAHAQNRLSLFAAQSGLKAVAAQGKVEIQAQADALDVLSKLGITISSTDDKVIISSPKEVKITGGSSQITLNGSGIFPKTGGKFQVNAGQHLFMGGASANASAPELPKAKPMQGALELLRSYGGDNFFKQNSYKVIDSLGKQITGKLDGNGFAQITGIAPGPAKVVFEKDNTSAWLQSSDFKRNYTWAEPVKSVQGLMKNALEAVGQNTMSQLQNNLLSTDKNSFKNLGKNTLDNLAGQTVAQIKNQVTNTALNTVSKQLNLNLSADQMKSLGQMATNPSQSLEMLKEQGGDFLSDQMTAKLFKTTNQESPIQQGDLDTFVRTKK 4MTK Chain:A ((5-640)) ---------------------RLVQVDCPLGPDVLLLQRMEGREELGRLFAYELHLVSENPNLPLEQLLGKPMSLSLELPGGSRRFFHGIVARCSQVAGHGQFAGYQATLRPWPWLLTRTSDCRIFQNQSVPEIIKQVFRN-LGFSDFEDA--------LTRPYREWEYCVQYRETSFDFISRLMEQEGIYYWFRHEQ----------KRHILVLSDAYGAHRSPGGYASVPYYPPTLGHRERDHFFDWQMAREVQPGSLTLNDYD---FQRPGARLEVRSNIARPHAA-------------ADYPLYDYPGE----YVQSQDGEQYARNRIEAIQAQHERVRLRGVVRGIGAGHLFRLSGYPRDDQ----NREYLVVGAEYRVVQELS-----QFESELDCIDASQSF-------------RLLPQTPV------PVVRGPQTAVVVGPKGEEIWTDQYGRVKVHFHWDRHD----------QSNENSSCWIRVSQAWAGKNWGSMQIPRIGQEVIVSFLEGDPDRPIITGRVYNAEQTVPY-----ELPANATQSGMKSRSSKGGTPANFNEIRMEDKKGAEQLYIHAERNQDNLVENDASLSVGHDRNKSIGHDELARIGNNRTRAVKLNDTLLVGGAKSDSVTGTYLIEAGAQIRLVCGKSVVEFNADGTINISGSAFNLYASGNGNIDT--------GGRLDLNSGGASEVDAKGKGVQGTIDGQVQAMFPPP----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4MTK.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 : 2673 -71143 -26.62 -114.75 target 2D structure prediction score : 0.46 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -26.62 2D Compatibility (Sec. Struct. Predict.) : 0.46 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.297

(partial model without unconserved sides chains): PDB file : Tito_4MTK.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4MTK-query.scw PDB file : Tito_Scwrl_4MTK.pdb: