Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNTRHFSQLPKAALAYPKVVQGLIFKKPKGPKILPQVEYVVDTLEIDQNHLKAYNEVCGFQNNGFVPAIYLAVLSQSLQMHMMTAEAFPFPIL-GLVHIRNQIK-QTRPIGVTEKLTLSCKLGELKPHDKGVQFDFITTAKV---GNEVVMEGLTTYLSRQKVEKRVGEKAKEEQAPAYVP------KAEWNILENTGRRYAKVSGDFNLIHIHAITAKAFGFKQAIAHG-MWSKAKALANLELPN-AYEADVWFKLPMFLPSKVEFLTANADKKTDFLIRNAKSQKPHVA--GTVKAL- 1PN2 Chain:A ((4-275)) --DPVWRFDDRDVILYNIA------------------------LGATTKQLKYVYE--NDSDFQVIPTFGHLITFNSGKSQNSFAKLLRNFNPMLLLHGEHYLKVHSWPPPTEGEIKTTFEPIATTPKGTNVVIVHGSKSVDNKSGELIYSNEATYFIRNCQADNKVYADRPAFATNQFLAPKRAPDYQVDVPVSEDLAALYRLSGDRNPLHIDPNFAKGAKFPKPILHGMCTYGLSAKALIDKFGMFNEIKARFTGIVFPGETLRVLAWKESDDTIVFQTHVVDRGTIAINNAAIKLVG

General information: TITO was launched using: RESULT: Template: 1PN2.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 : 1356 -16868 -12.44 -65.89 target 2D structure prediction score : 0.51 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : -12.44 2D Compatibility (Sec. Struct. Predict.) : 0.51 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.244

(partial model without unconserved sides chains): PDB file : Tito_1PN2.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1PN2-query.scw PDB file : Tito_Scwrl_1PN2.pdb: