Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTTNRKDEHILYA----LEQKSSYNSFDEVELIHSSLPLYNLDEIDLSTEFAGRKWDFPFYINAMTGGSNKGREINQKLAQVAETCGILFVTGSYSAAL-KNPTDDSFS-VKSSHPNLLLGTNIGLDKPVE-LGLQTVEEMNPVL----LQVHVNVMQELLMPEGERKFRSWQ-SHLADYSKQIPVPIVLKEVGFGMDAKTIERAYEFGVRTVDLSGRGGTSFAYIENRRSGQR---------DYLNQWGQSTMQALLNAQEWKDKVELLVSGGVRNPLDMIKCLVFGAKAVGLSRTVLELVETYTVEEVIGIVQGWKA---DLRLIMCSLNCATIADLQKVDYLLYGKLKEANDQMKKA 2ZRU Chain:A ((9-349)) ------VEHVEIAAFENVDGLSSSTFLNDVILVHQGFPGISFSEINTKTKFFRKEISVPVMVTGMT---NELGRINKIIAEVAEKFGIPMGVGSQRVAIEKAEARESFAIVRKVAPTIPIIANLGMPQLVKGYGLKEFQDAIQMIEADAIAVHLNPAQEVFQPEGEPEYQIYALEKLRDISKELSVPIIVKESGNGISMETAKLLYSYGIKNFDTSGQGGTNWIAIEMIRDIRRGNWKAESAKNFLD-WGVPTAASIMEVRYSVPDSFLVGSGGIRSGLDAAKAIALGADIAGMALPVLK----SAIEGKESLEQFFRKIIFELKAAMMLTGSKDVDALKKTSIVILGKLKE--------

General information: TITO was launched using: RESULT: Template: 2ZRU.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 : 1856 17221 9.28 54.84 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.77 3D Compatibility (PKB) : 9.28 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.77 QMean score : 0.462

(partial model without unconserved sides chains): PDB file : Tito_2ZRU.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2ZRU-query.scw PDB file : Tito_Scwrl_2ZRU.pdb: