Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAVRALKLLTTLLAVVAAASQAEVESEAGWGMVTPDLLFAEGTAAYARGDWPGVVLSMERALRSRAALRALRLRCRTQCAADFPWELDPDWSPSPAQASGAAALRDLSFFGGLLRRAACLRRCLGPPAAHSLSEEMELEFRKRSPYNYLQVAYFKINKLEKAVAAAHTFFVGNPEHMEMQQNLDYYQTMSGVKEADFKDLETQPHMQEFRLGVRLYSEEQPQEAVPHLEAALQEYFVAYEECRALCEGPYDYDGYNYLEYNADLFQAITDHYIQVLNCKQNCVTELASHPSREKPFEDFLPSHYNYLQFAYYNIGNYTQAVECAKTYLLFFPNDEVMNQNLAYYAAMLGEEHTRSIGPRESAKEYRQRSLLEKELLFFAYDVFGIPFVDPDSWTPEEVIPKRLQEKQKSERETAVRISQEIGNLMKEIETLVEEKTKESLDVSRLTREGGPLLYEGISLTMNSKLLNGSQ-RVVMDGVISDHECQEL-QRLTNVAATSGDGYRGQ-TSPHTPNEKFYGVTVFKALKLGQEGKVPLQSAHLYYNVTEKVRRIMESY-FRLDTPLYFSYSHLVCRTAIEEVQAERKDDSHPVHVDNCILNAETL-VCVKEPPAYTFRDYSAILYLN--GDFDGGNFYFTELDAKTVTAEVQPQCGRAVGFSSGTENPHGVKAVTRGQRCAIA-LWFT-LDPRHSERDRVQADDLVKMLFSPEEMDLSQEQPLDAQQGPPEPAQESLSGSESKPKDEL 3DKQ Chain:A ((14-243)) --------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------NLYFQGMLIEIPNVFSKQEVSHLREQLDARRWIDGNQTSGAMATTRKRNQQLD-------------------------KDDPVAVALGQQIMDRLLAHPQFVSAALPLQFYPPLFNRYQGGETFGYHIDNAIRSTPDGMIRT---------DLSATLFLSEPENYQGGELVIQDTYG---QQSIKLSAGSLVLYPSSS--LHQVTPVLSGERTAAFMWLQSMVRDEGQRRLLFQLDQSIQSLTAQTAAEQELFNLSGVYHNLLRRWSEL------------

General information: TITO was launched using: RESULT: Template: 3DKQ.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 : 1061 32200 30.35 145.70 target 2D structure prediction score : 0.43 Monomeric hydrophicity matching model chain A : 0.56 3D Compatibility (PKB) : 30.35 2D Compatibility (Sec. Struct. Predict.) : 0.43 1D Compatibility (Hydrophobicity) : 0.56 QMean score : 0.230

(partial model without unconserved sides chains): PDB file : Tito_3DKQ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3DKQ-query.scw PDB file : Tito_Scwrl_3DKQ.pdb: