Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTNKLTSFLADRKKTIENQLSVYTEKLDMPDSLKKSMLYSLQAGGKRLRPLIVL--AVLNAYGKSEKDGIPVGCAVEMIHTYSLIHDDLPCMDDDDLRRGKPTNHKVFGEATAVLAGDGLLTESFKLITSHVSDEVSAEKRLRLVNELISAAGTEGMVG--GQVADMEAENRQVTLEELESIHERKTAKLLGFCVIAGAILADAPEEDIETLRTFSSHIGIGFQIRDDILDLEGSEEKIGKRVGSDTTNDKSTYPSLLSLEGAKHKLDVHIKEAKRLIGGLSLQKDLLYELCDLIAARDH 3AQC Chain:B ((30-252)) ------------------------------ETINKAAHHILSSGGKRVRPMFVLLSGFLNDTQKD--DLIRTAVSLELVHMASLVHDDY--IDNSDMRRGNTSVHIAFDKDTAIRTGHFLLARALQNIAT-----INNSK----FHQIFSKTILEVCFGEFDQMAD--RFNYPVSFTAYLRRINRKTAILIEASCHLGALSSQLDEQSTYHIKQFGHCIGMSYQIIDDILDYTSDEATLGKPVGSDIRNGHITYPLMAAIANLKEQDD--------------------------------

General information: TITO was launched using: RESULT: Template: 3AQC.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 : 895 -252 -0.28 -1.15 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain B : 0.72 3D Compatibility (PKB) : -0.28 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.72 QMean score : 0.304

(partial model without unconserved sides chains): PDB file : Tito_3AQC.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3AQC-query.scw PDB file : Tito_Scwrl_3AQC.pdb: