Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)



Input alignment information:
Query sequence-----------FLLNRSSDLITTA-----SENYFIKIYG------------FDKLPSIKFQLDFLSKCFK-YGLPVAKVIQTNSKTSYFKIDKTYGILQEFLGGEQLRNIKINRSVVTDIGFILGSIHKLSHRSNFIGKKWKRYQWDLAQFNIVVKDYHKIKNIIP-------SWISDLIDEVITEWKSNKIKLAKLRKGSI-----HNDFQGRNILVAKD--GKISIVDFGDAINSWYIADIAISLAHICFT----------VKQPSIFIKSFLRGYQKQFK--LLKLEKDFLPLLMKMRAVTAIVEI--QLLKGKKGIFHP-PDNQLVNL---LKYFKDTKAKNIF------------
4OCV Chain:A ((24-378))TNEALFDVASHFALEGTVDSIEPYGDGHINTTYLVTTDGPRYILQRMNTGIFPDTVNLMRNVELVTSTLKAQGKETLDIVRTTSGDTWAEIDGGAWRVYKFIEHTMSYNLVPNPDVFREAGRAFGDFQNFL--SGFDANQLTET---IAHFHDTPHRFEDFKKALAADELGRAAGCGPEIEFYLSHADQYAVVMDGLRDGSIPLRVTHNDTKLNNILMDATTGKARAIIDLDTIMPGSMLFDFGDSIRFGASTALEDERDLDKVHFSTELFRAYTEGFVGELRDSITAREAELLPFSGNLLTMECGMRFLADYLEGDVYFATKYPEHNLVRSRTQIKLVREMEQRADETRAIVADVMETT


General information:
TITO was launched using:
RESULT:

Template: 4OCV.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 : 1231 -17504 -14.22 -62.07
target 2D structure prediction score : 0.59
Monomeric hydrophicity matching model chain A : 0.71

3D Compatibility (PKB) : -14.22
2D Compatibility (Sec. Struct. Predict.) : 0.59
1D Compatibility (Hydrophobicity) : 0.71
QMean score : 0.463

(partial model without unconserved sides chains):
PDB file : Tito_4OCV.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-4ocv-query.scw
PDB file : Tito_Scwrl_4OCV.pdb: