Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFKALFGVLQKIGRALMLPVAILPAAGILLAIGNAMQNKDMIQVLHFLSNDNVQLVAGVMESAGQIVFDNLPLLFAV-GVAIGLANGDGVAGIAAIIGYLVM--NVSMSAVLL--ANGTIPSDSVERAKFFTENHPAYVNMLGIPTLATGVFGGIIV------GVLAALLFNRFYTIELPQYLGFFAGKRFVPIVTSISALILGLIMLVI---WP-----PIQHGLNAFSTGLVEANPTLAAFIFGVIERSLIPFGLHHIFYSPFWYEFFSYKSAAGEIIRGDQRIFMAQIKD-GVQLTAGTFMTGKYPFMMFGLPAAALAIYHEAKPQNKKLVAGIMGSAALTSFLTGITEPLEFSFLFVAPVLFAIHCLFAGLSFMVMQLLNVKIGMTFSGGLIDYFLFGILPNRTAWWLVIPVGLGLAVIYYFGFRFAIRKFNLKTPGREDAAEETAAPGKTGEAGDLPYEILQAMGDQENIKHLDACITRLRVTVNDQKKVDKDRLKQLGASGVL--EVGNNIQ-AIFGPRSDGLKTQMQDIIAGRKPRP---EPKTSAQEEVGQQVEEVIAEPLQNEIGEEVFVSPITGEIHPITDVPDQVFSGKMMGDGFAILPSEGIVVSPVRGKILNVFPT--KHAIGLQSDGGREILIHFGIDTVSLKGEGFTSFVSEGDRVEPGQKLLEVDLDAVKPNVPSLMTPIVFTNLAEGETVSIKASGSVNREQEDIVKIEK 4QFH Chain:A ((6-615)) HHHMKDQYLKDLTVHLNESNA--APANTSMAVASFNMPHEITRRMRPLGVDADTSLTSC------PSWRRLQELYEIHGSESILKNFDECKDRFQRYSLEVDLRSSDKNFVFLDYSKTHINDEIKDVLFKLVEER-------GIRAFMRALFAGEKVNTAENRSVLHIALRNR------SNRPIFVNGHDVMPLVNKVLEQMKKLSEKVRRGEWKGQSGKPIRHVVNI-GIGGSDLGPMMACEA-------LRPFSDRRISMHFVSNIDGTHLSEVLNLVDLESTLFIIASKTFTTQETITNALSARNEFLKF-LSSRGIS---EAGAVAKHFVALSTNAEKVKEF--GIDEENMFQFWDWVGGRYSL-WSAIGLSVMISIGYDNFVELLTGAHIMDEHFINAPTENN-----LPIILALVGIWYNNFF------------------------GSETQAILPYD--------QYLWRLPAYLQQLDMESNGKGATKNGRMVSTHTGPIIFGEAGTNGQHAFYQLIHQGTKLIPCDFIGAIQTQNYIGEHHRILMSNFFAQTEALMIGKTPEEVKRELESAGGKSEDEIQLLIPQKTFTGGR--------PSNSLLVKALTPRALGAIIAMYEHKVLVQGAIW-----------------GINSY------------------DQWGVELGKLLAKSILLQLQPGQKVT-NHDSSTNGLIELFNERSH

General information: TITO was launched using: RESULT: Template: 4QFH.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 : 2897 -267375 -92.29 -459.41 target 2D structure prediction score : 0.46 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -92.29 2D Compatibility (Sec. Struct. Predict.) : 0.46 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.155

(partial model without unconserved sides chains): PDB file : Tito_4QFH.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4QFH-query.scw PDB file : Tito_Scwrl_4QFH.pdb: