Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MQSWSRVYCSLAKRGHFNRISHGLQGLSAVPLRTYADQPIDADVTVIGSGPGGYVAAIKAAQLGFKTVCIEKNET------LGGTCLNVGCIPSKALLNNSHYYHMAHGKDFASR---GIEMSEVRLNLDKMMEQKSTAVKALTGGIAHLFKQNKVVHVNGYGKITGKN---QVTATKADGGTQVIDTKNILIATGSEVTPFPGITIDED----TIVSSTGALSLKKV--PEKMVVIGAGVIGVELGSVWQR-LGADVTAVEFLGHVGGVGIDMEISKNFQRILQKQGFKFKLNTKVTGATKKSDGKIDVSIEAASGGK---AEVITCDVLLVCIGRRPFTKNLGLEELGIELDPRGRIPVNTRFQTKIPNIYAIGDVVAGP-MLAHKAEDEGIICVEGMAGGA--VHIDYNCVPSVIYTHPEVAWVGKSEEQLKEEGIEYKVGKFPFAANSRAKTNADTDG----MVKILGQKSTDRVLGAHILGPGAGEMVNEAALALEYGASCEDIARVCHAHP---TLSEAFREANLAASFGKSINF- 3LAD Chain:A ((1-472)) --------------------------------------SQKFDVIVIGAGPGGYVAAIKSAQLGLKTALIEKYKGKEGKTALGGTCLNVGCIPSKALLDSSYKFHEAHESFK--LHGISTG--EVAIDVPTMIARKDQIVRNLTGGVASLIKANG-VTLFE-GHGKLL-AGKKVEVTAADGSSQVLDTENVILASGSKPVEIPPAPVDQ-DVIVD---STGALDFQ--NVPGKLGVIGAGVIGLELGSVWARL-GAEVTVLEAMDKFLPA-VDEQVAKEAQKILTKQGLKILLGARVTGTEVKN-KQVTVKFVDA----EGEKSQA-FDKLIVAVGRRPVTTDLLAADSGVTLDERGFIYVDDYCATSVPGVYAIGDVVRG-AMLAHKASEEGVVVAERIAG--HKAQMNYDLIPAVIYTHPEIAGVGKTEQALKAEG----VAINVGVFPFAASGRAMAANDTAGFVKVIADAKTDRVLGVHVIGPSAAELVQQGAIAMEFGTSAEDLGMM--VFAHPA-LSEALHEAALAVSG-HAIHVA

General information: TITO was launched using: RESULT: Template: 3LAD.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 : 2518 4159 1.65 9.47 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain A : 0.78 3D Compatibility (PKB) : 1.65 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.78 QMean score : 0.426

(partial model without unconserved sides chains): PDB file : Tito_3LAD.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3lad-query.scw PDB file : Tito_Scwrl_3LAD.pdb: