Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKLVPRFRKQWFAYLTVLCLALAAAVSFGVPAKAAENPQTSVSNTGKEADATKNQTSKADQVSAPYEGTGKTSKSLYGGQTELEKNIQTLQPSSIIGTDERTRISSTTSFPYRATVQLSIKYPNTSSTYGCTGFLVNPNTVVTAGHCVYSQDHGWASTITAAPGRNGS-SYPYGTYSGTMFYSVKGWTESKDTNYDYGAIKLNGSP-----GNTVGWYGYRTTNSSSPVGLSSSVTGFPCDKTFGTMWSDTKPIRSAETYKLTYTTDTYGCQSGSPVYRNYSDTGQTAIAIHTNGGSSYNLGTRVTNDVFNNIQYWANQ 1WCZ Chain:A ((1-187)) ---------------------------------------------------------------------------------------------VILPNNDRHQITDTTNGHYAPVTYIQVEA---TGTFIASGVVVGKDTLLTNKHVVDATHGDP-HALKAFPSAINQDNYPNGGFTAEQITKY-------SGEGDLAIVKFSPNEQNKHIGEVVKPATMSNNAE-TQVNQNITVTGYPGDKPVATMWESKGKITYLKGEAMQYDLSTTGGNSGSPVFNEK----NEVIGIHWGG------------------------

General information: TITO was launched using: RESULT: Template: 1WCZ.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 : 1059 -52819 -49.88 -293.44 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain A : 0.67 3D Compatibility (PKB) : -49.88 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.364

(partial model without unconserved sides chains): PDB file : Tito_1WCZ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1WCZ-query.scw PDB file : Tito_Scwrl_1WCZ.pdb: