Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLLMIDNYDSFTYNIVQYFGELNQEVKVVRNDQVTLEDIERWQPKYLVIGPGPCSPSEVGISIPAINHFAGKIPLFGVCLGHQSIGQAFGGKIVRAKTVMHGRLSDMYHSNKGIFSNLPSPFSATRYHSLVIDQETLPDCLEVTCWTNEADGSMEEIMGVKHKTLPVEGVQFHPESILSQHGHQIFKNFLDIYA 2YWB Chain:A ((1-212)) MVLVLDFGSQYTRLIARRLRELRAFSLILPGD-APLEEVLKHRPQALILSGGPRSVFDPDAPRPDPRLFSSGLPLLGICYGMQLLAQELGGRVERA---EYGKALLTRHEGP-LFRGLEGEVQVWMSHQ---DAVTAPP----PGWRVVAETEENPVAAIASPDGRAYGVQFHPEVAHTPKGMQILENFLEL--

General information: TITO was launched using: RESULT: Template: 2YWB.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 : 1081 -98678 -91.28 -548.21 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : -91.28 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.247

(partial model without unconserved sides chains): PDB file : Tito_2YWB.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2YWB-query.scw PDB file : Tito_Scwrl_2YWB.pdb: