Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MWKEKVSVTPPYHFDRVLDRLSLDPLNAVDREAREVRVPIRNQAGDVCIVKVQALGHAGEPEFLVSGETDQGEMMKEIKRIFQWENHLQHVLDHFSKTSLSAIFEEHAGTPLVLDYSVYNCMMKCIIHQQLNLSFAYTLTERFVHAFGEQKDGV---WCYPKPETIAELDYQDLRDLQFSMRKAEYTIDTSRMIAEGTLSLSELPHMADEDIMKKLIKIRGIGPWTVQNVLMFGLGRPNLFPLADIGLQNAIKRHFQLDDKPAKDVMLAMSKEWEPYLSYASLYLWRSIE 3OH9 Chain:A ((75-279)) -------------------------------------------------------------------EPVAAECLAKMSRLFDLQCNPQIV-----NGALGRLGAARPGLRLPGCVDAFEQGVRAILGQLVSVAMAAKLTARVAQLYGERLDDFPEYICFPTPQRLAAADPQALKALGMPLKRAEALIHLANAALEGTLPMT-IPGDV-EQAMKTLQTFPGIGRWTANYFALRGWQAKDVF-LPDDCL---IKQRFP-GMTPAQ--IRRYAERWKPWRSYALLHIW----

General information: TITO was launched using: RESULT: Template: 3OH9.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 : 840 -117833 -140.28 -583.33 target 2D structure prediction score : 0.68 Monomeric hydrophicity matching model chain A : 0.71 3D Compatibility (PKB) : -140.28 2D Compatibility (Sec. Struct. Predict.) : 0.68 1D Compatibility (Hydrophobicity) : 0.71 QMean score : 0.467

(partial model without unconserved sides chains): PDB file : Tito_3OH9.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3OH9-query.scw PDB file : Tito_Scwrl_3OH9.pdb: