Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ----------------MKFL-PVILSLALITNASYANPFDPKPASGQV--EIPNIGSGIGLLDQQKEKFIGEKVFRE-------VHKQMPVIQDVWLEDQFFQVF-SNILSETQLG-----------------------------QPIALVVIKDPQINAFAVPGGLFALNTG----LISSARNIDEIAGVMAHEIAHVSQRHFSRSEEAFK----GQTLLSLAG--LLAGVALAAQAGGDAGAAVMLGTQAALLDKQL-----TYSRNQEREADRIGM--------------------QYMYAAGYNPQSMADYFETMHRATSRVSFLPDFWLTHPLT----------------SERMSEARLRANQMPKVKSRIYDVDFEILKWYTMVVAGEATENQLQSLASQKNLAGLLALSAFYLKQGDYTQAQAT---------LEQAKSSGKPLVALIQTD-----IYLGQNKINQAYNSIAPLQMTMPENKAFSYKLAEV---------LLRQGKYAQVQTLVQRFI----------NKNARDIQGWQ-LLQQAANLDKNSPL---------RAVNVLRYRAEAQYWSGSEEDAIKSMLHAQRLAKGN------QAMSARIDSRLKQMQDERRMKI-- 5I4A Chain:A ((4-642)) AYLNLYKIDIPKKIKRLYFYNPDMEPKLFARNLSRVNNFKFQDSNDLVWIEIPDIDFQITPKNVFQYKVEKEEIIKEEEDKKLFVKTLYKYIKKLFLDNDFYFKKGNNFISNSEVFSLDSNENVNAHLTYKIKIHNISNEYYLSILPKFTFLSKEPALESAIKSGYLYNIKSGKSFPYISGLDGILKIDINQIVEVAYPENYLFNFTTRDAEKYGFSKEVHEIYKNKVFEGFKKIPKTLGFLNKITNLNENYQDGYKIFINVIYKFKNGESRYAKDVFKYSFYKNEQPLKAIFFFSSKKQFFEVQKSLKELFHNKHSVFYRAAAELGFSKVEFLRDSKTKSSAFLYNPEEFTVKNTEFINQIEDNVMAIVLLDKYIGNIDPLVRNFPDNLILQPILKEKLEDIKPFIIKSYVYKMGNFIPECKPFILKKMEDKEKNLYIGIDLSHDARKTNLCIAAVDNTGDILYIGKHK-NLELNEKMNLDILEKEYIKAFEKYIEKFNVSPENVFILRDGRFIEDIEIIKNFISDTKYTLVEVNKNT-NINSYDDLKEWIIKLDENTYIYYPKTFLNQKGVEVKILENNTDY---TIEEIIEQIYLLTRVAHSTPYTNYKLPYPLHIANKVALTDYEWKLYIPY

General information: TITO was launched using: RESULT: Template: 5I4A.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 : 2070 73533 35.52 155.46 target 2D structure prediction score : 0.43 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : 35.52 2D Compatibility (Sec. Struct. Predict.) : 0.43 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.102

(partial model without unconserved sides chains): PDB file : Tito_5I4A.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5I4A-query.scw PDB file : Tito_Scwrl_5I4A.pdb: