Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRILSVASTERSSRMIKLWRRYKPFINAGVQELITYRVNFILYRIGDVMGAFVAFYLWKAVFDSSQESLIQGFSMADITLYIIMSFV--TNLL----TRSDSSFMIGEEV---------KDGSIIMRLLRPVHFAASYLFTEL--GSKWLIFISVGLPFLSVIVLMKIISGQGIVEVLGLTVLYLFSLTLAYLINFFFNICFGFSAFVFKNLWGSNLLKTSIVAFMSGSLIPLAFFPKVVSDILSFLPFSSLIYTPVMIIVGKYDASQILQALLLQFFWLLVMVGLSQLIWKRVQSFITIQGG 2SCU Chain:A ((1-119)) ---------------------------------------------------------SIL-IDKNTKVICQGFTGSQGTFHSEQAIAYGTKMVGGVTPGKGGTTHLGLPVFNTVREAVAATGATASVIYVPAPFCKDSILEAIDAGIKLIITITEGIPTLDMLTVKVKLDEAG-VRMIGP---------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 2SCU.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 : 476 -19282 -40.51 -189.04 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain A : 0.46 3D Compatibility (PKB) : -40.51 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.46 QMean score : 0.451

(partial model without unconserved sides chains): PDB file : Tito_2SCU.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2SCU-query.scw PDB file : Tito_Scwrl_2SCU.pdb: