Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKHTFVLFLSLILLVLPGCSAEKSSADTAKKTLTIYSTMSTDSERDTFRKLAAAFEKEHSDIHVSLHFPGNDYENMMRVRMAANDLPDLFDTHGWGKIRYGEYTADLRDMKWT-----QDLDPNLNSILKNKSG---------KVYAYPINQAKDGLAYNRNILDRYGIAPPETMDDFIKALRTIKEKSKGSIVPFWFAGYDKSSFAQYYDQFATPLLITDPAHNEKKQLINGTFQWSKFTYLSEILKQ--MQKEKLINIDAVTAKK------SQLIELMAQNKIAFTMQGGTLGQDVAQINPNVKVGIIPTPAIHPGDD-PIWIGGERYTLAAWKDSPQLKEAKDFIAFMARPANAKQMAEATSLPSGLTNVKADIFYANDYEYYQDVKVEPYFDRLYLPNGMWDVLGTVGQELAADILAPQDISQKLGREYKRLREQSETQGAENNE 2HFB Chain:A ((23-343)) -------------------------------TVTIEYFNQKKEMTKTLEEITRDFEKENPKIKVKVVNVPNAGE-VLKTRVLAGDVPDVVNI----------YPQSIELQEWAKAGVFEDLS-NKDYLKRVKNGYAEKYAVNEKVYNVPFTANAYGIYYNKDKFEELGLKVPETWDEFEQLVKDIVAKGQ---TPFGIAGADAWTL-NGYNQLA--FATATGGGKEANQYLR--YSQPNAIKLSDPIMKDDIKVMDILRINGSKQKNWEGAGYTDVIGAFARGDVLMTPNGSWAITAINEQKPNFKIGTFMIPGKEKGQSLTVGAGDLAWSISATTKHP--KEANAFVEYMTRPEVMQKYYDVDGSPTAIEGVK---------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 2HFB.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 : 1407 28142 20.00 94.44 target 2D structure prediction score : 0.68 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : 20.00 2D Compatibility (Sec. Struct. Predict.) : 0.68 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.483

(partial model without unconserved sides chains): PDB file : Tito_2HFB.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2HFB-query.scw PDB file : Tito_Scwrl_2HFB.pdb: