Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ------------------MNQCVKKLIASILFVFPLLMVTSVFADVEKTNESTQSENQSFDKT----TFSEESITSETTESQSEASTNKRQEENKTSETSEVAEQTSDSSEAALARAVSADGYSEAATTEELAQLLADESVTKIRLIQPLTLD-RELE----IKRD------IVIDFGGFAHNFG--TH--------------------------HIYINEIPQSIEFQNFKGTAAHPGG----------------------LTPNIDGNAIIIAYMTDFWGSR--------YHFTGEIKFTGTLDLYDGSKLGLIYAPR-------ATVTLDGVSG---------VLDVQPVKEGLNAAPGKAYFCRSYQLNVINGSQLYGPYLGKFYGFLDSGDETGSGKTAPGIHILSGSKVSLDYDRAD--GVSDEGEAVDTLPGNVMFE-----VSGSGSEFSVNTKI---NITNDNNRGIIQMRGSGSK--VTVSNGGK----------ITINTATTGGFRLQGDSSQI------HVSSGGQISVKMAGDDDQP----GNNGMRFV----GKGLSLIVE-GAGSVIDIDKQS-GR------------------SSAVRFEN----GTQKLTVTNGGSLRVRNTGDGKSYVNRLNQ---------GNQAIQFYD------ASGFLESPG------SADFTVT------------GEKSNIDIRADSGATVDTTGDIDLNFTAGE-----KTYLVMVGKTGEDKTGIISGDVLNVDLESP-TYFDFQNKRIGSETNGIGGWVFQ-----GNGDSSLKIAHSEIALWRKTG-ATFDNFEKDPDYFSDMTDLSINGTDLGNFVSSPSAGLTNEFAQTGAGMKNYNRISANNQLPMIESLRVPTNADKKIYGHVVVPEGVEAKP------RDAWTGEVEVTLRITYAD-----TTKSSVEITALTQGQTDENEGAGY--------NPWGEGEQGGLFEVQV-PNDERLKTEDQVQVVAAKK-----VRGGQEVTELDSAKTTVDVIPP-----EPANLSTTLINAA--------SRTI--TGTGEAGALVSLKKN--QAVLSETTIDDTGEFVLSIPENQLFAGDVLEI------------VLNDQAGEATAKGVQNKPSTNDEIGNHNPSDTPVVY--HDAPPFAP--ATKIVVEGGLS--FLAPSKLDFGQIKATGLTQEAFGQMDIQEKLWIYDQRET------KNPWILTIKLSQPFTNDAGFSMQDVLYFKKGEEYQLVNEEELEIVRGQNSTNVQADYSEYL--NNGRAFKLVLTKENQIAGNYSAEITWTLADAPTE--------------------------------------------------------------------------------------------------------------------------------------------------------- 4IGL Chain:A ((7-1485)) EMAITTLSLPKGGGAINGMGESVGQAGPDGMVTFSIPLPFSAGRGVAPALSLSYSSGAGNGPFGMGWQCSAMSIS--------------RRTQKGVPQYNEDDEFLSPSGEV-MAIALNDSGFEDVRTANRLQGIPLPFSYKVTRYQPRLIQDFIKIEYWQPVKQTDGTPFWIIYSPDGQTHILGKNSHSRVANAENPSQIASWLLEETVTPTGEHIYYQYSGENQVNCTDAEIALHPQDSAQRYLARIDYGNISPQASLFVLDEELPNLTQWLFHLVFDYGERDISINKIPTFEGGTTGWLARPDMFSRYDFGIEIRNRRLCHQVLGFHRLEALNDRDVTDEIPVLVNRLTLDYDLNNSVSTLVAVRQVAYET-DGSPITQPPLEFDYQRFDTGSIPG-WQEMPQLEAFNGYQ---PYQMIDLYGEGTPGILYQETPGAWWYKSPQRQIGGDSNAVTYGAMKALPKIPRLEGATLMDINGDGRLDWVITSAGVRGFHSIEWTHFTPLNTLPTEYFHPKAQLADLVGAGLSDLVLIGPKSVRLYANQNVSLPVIGSRQLVAFADMLGSGQQHLVEITADSVKCWPNMGHGRFGQPLTLEGFSQPQTSFNPDRVFLADIDGSGTNDIIYAHSECLEIYLNESGNRFSKPISLLLPDGVNFDNTCQLQAADIQGLGIASLVMTVPHMSPTHWRCDLALNKPWLLNVMNNNRGAETCLFYRSSAQFWLDEKQLVEAAGQQPECHLPFPMHLHWRSEIFDE----ITGNRLTQEQEYAHGSWDGQER----EFRGFGRLIQRDTDGFAQGTVDIPTHPSRTVSWFATGIPEIDTTLSAEFWRGDDQAFSPFSPRFTRWEDSE-AGSDVAFIPSEHDAFWLNRAMKGQLLRSELYGDDGTPEAEIPYSVTEMRHQVRALPTTDATVPSAWCSTIE-TRSYQYQRVAADPQCSQQVVIKADRYGSPLLSVAINYPRRKKPEKSPYPDDLPETLFDSSYDTQQQQLHLTKQQQNYFHLTNDDNWLLGLPKEQRNDGYQYDQERAPANGFTLETLIASNSLIGSNQPFTYLGQSRVAYQGGVDEQPSLQALVAYGETAILDEKTLQAFVGVLDSKTRDELLFSAGYQLAPRLFRVESEPDVWVARQGYSEFGDYSQFWRPLSQRSTLLTGKTTLKWDKHYCVVIETQDAAQLVTQARYDYRFLTPYSLTDANDNQHYVVLNPFGEVIASRFWGTEAGKDAGYSTPQAKPFVVPATIEAALALSPGIPVAHCAIFEPESWMQKLTQHDVSERMADNGTLWNALLQARFVTEDGYVCALGRRRWMARHG-LSVLMLTLLAEIPRTPPHSLTITTDRYDSDDQQQLRQRILFSDGFGRLLQSAQRVEAGESWQRSEDSSLVVNVSGTPALVVTDNRWAVSGRTEYDGKGQGIRVYQPYFLDDWRYLSDDSARTDLFADTHIYDPLGREYQVITAKGYRRERQYTPWFVVNQDENDTAAN

General information: TITO was launched using: RESULT: Template: 4IGL.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 : 5780 291059 50.36 284.24 target 2D structure prediction score : 0.49 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : 50.36 2D Compatibility (Sec. Struct. Predict.) : 0.49 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.094

(partial model without unconserved sides chains): PDB file : Tito_4IGL.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4IGL-query.scw PDB file : Tito_Scwrl_4IGL.pdb: