Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence --METTDTLLQLLQEAHKTNQAQQQTIQNLTTEIQLLNEKVNYLTNKLFGRSKETLFEETNGQLNLFSDEEISVSVPEAAATIIPVKGHQRVVGTKADKIKHLPITEKEHLLPLEEQFCEHCGSQMKDIGRTKVREEIRFHQAMLDCLTHYQHTYCCKSCEKEGLSSFKKAIVPKPLISNSLGSNSLVAETIRMKFGQKVPAYRQENYWKQTHGLDISRDNITNWHIKAVQNALDPLGERLRVNNNQEEILHGDETSYRVIESAKTDTYYWQFCTGKDSQHPIVYYHHDESRAGDVPKTFLKEFTGYLHCDGYSGYNAVESVRLVYCFAHVRRKFFEAIPKEKKNTDIPAAQAVKQLDKWFVLEKKWKDFSPEKRLSCRQQELRPLFIAFYEWMATIDPVAKS--------KLDAAVQYACKLRSGFEPIFEDGRLELTNNRAERNIKELVIGRKNWLHSTSLEGARTSGIILSVYKTAELNGLNPVKYLEFLFDKIPNLPVLSAETLDQLLPWNKDVQQHFSRN 5C3M Chain:B ((5-438)) LKMATIGGGSSYTPELVEGLIKRYHELP--VGELWLVDIPEGKEKLEIVGALAKRMVEKAGVPI------EIHLTLDRRRAL----EGADFVTTQF--RVGGLEARAKDERIPLKYGVI---GQETN--GPGGLFKGLRTIPVILDIIRDMEE------------------LCPDAWLINFTNPAGMVTEAVLRYTKQE----------------------------KVVGLCNVPIGMRMGVAKLL-----GVDADRVHIDFAGLNHMVFGLHVYLDGVEVTEKVIDLVAHPLGWEPDFLKGL-KVLPCPYHRYYY--------------QTDKMLAEELEAAKTKGTRAEVVQQLEKELFE--LYKDPRGGAYYS---DAACSLISSIYNDKRDIQPVNTRNNGAIASIPPESAVEVNCVIT-------KDGPKPIAVGDLPVAVRGLVQQIKSF-ERVAAEAAVT-GDYQTALVAMTINPL------------VPS-DTIAKQMLDEMLEAHKEHLPQFF--

General information: TITO was launched using: RESULT: Template: 5C3M.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 2243 103683 46.22 258.56 target 2D structure prediction score : 0.51 Monomeric hydrophicity matching model chain B : 0.65 3D Compatibility (PKB) : 46.22 2D Compatibility (Sec. Struct. Predict.) : 0.51 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.196

(partial model without unconserved sides chains): PDB file : Tito_5C3M.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5C3M-query.scw PDB file : Tito_Scwrl_5C3M.pdb: