Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRFGMPKLISEKNQLQQLSLNSNGGVVYQPARGFFKVVYQGLILPNLPAPLRYFNYISLIGQPRIPLCYNTNGILTSAVDTATVLVSNSLHSVGHLKTYSIRRQCQLNPSRYQFDKTDLIEWQ-IPRVQLRRIDSEMSCDLIVQTPSDISNSSA---LQWG------ISDYWSILCHCEGEILYKGQKYEVNGLGRFKHARALHLPFLSLCFYTCQIINLNETTQVTLSQIRNQWNIILF-SRLDIQELGKQPLTFT-EDVNFHIHRVYPKVETPHGREMYLPREFSWQCKKNGKVIFELYGESRGDYK-FG---LAAGYIGSFRYQLSWNDQCLQGEGGYCEYIDCRPLRWQEKNQNEKMLDKLLLLQPCLYKKT 2ICH Chain:A ((106-329)) --------------------------------------------------------------------------------------------------------------DVKLDDW-IFVRETDGRYRTRIEAEDFTLTFILTPSQPLMLQGENGFSRKGPGAPQASYYYSEPHLQVSGIINRQGEDIPVTGTAWLDREWSSEYLDPNAAGWDWISANLDDGSALMAFQIRGKDDSKIWAYAALR-DASGHTRLFTPDQVSFHPIRT---WRSART-QAVYPV--ATRVLTGE-TEWQITPLMDDQELDSRASAGAVYWEGAVTFT--RDG-Q-PAGRGYMELTGY-----------------------------

General information: TITO was launched using: RESULT: Template: 2ICH.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 : 926 809 0.87 3.89 target 2D structure prediction score : 0.48 Monomeric hydrophicity matching model chain A : 0.59 3D Compatibility (PKB) : 0.87 2D Compatibility (Sec. Struct. Predict.) : 0.48 1D Compatibility (Hydrophobicity) : 0.59 QMean score : 0.292

(partial model without unconserved sides chains): PDB file : Tito_2ICH.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2ICH-query.scw PDB file : Tito_Scwrl_2ICH.pdb: