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



Input alignment information:
Query sequenceMSIEKFSVEKVLSVHRWTPTLFSFTMTRPSHFKFTAGQFARIGLKVGDELIVRAYSVVSSPFDETLEFFSIVVPDGAFTSNLQHLKVGDELYLEKIPYGYLTLARYQQPLPHDLWLLATGTGLAPFLSMLQDFETWSNYQKINLVYSVRTAAELAYVDRIQE---IAETFGEG-HLGFKFIPIITRDPSAPLHERLPVLIENGELEKVAGL-ELSPASSHVMLCGNPQMVDDTKEALKRCGLTMN-RRGE-GNIAVENYW
1A8P Chain:A ((2-255))---SNLNVERVLSVHHWNDTLFSFKTTRNPSLRFENGQFVMIGLEVDGRPLMRAYSIASPNYEEHLEFFSIKVQNGPLTSRLQHLKEGDELMVSRKPTGTLVTSDL-LPGKH-LYMLSTGTGLAPFMSLIQDPEVYERFEKVVLIHGVRQVNELAYQQFITEHLPQSEYFGEAVKEKLIYYPTVTRE-SFHNQGRLTDLMRSGKLFEDIGLPPINPQDDRAMICGSPSMLDESCEVLDGFGLKISPRMGEPGDYLIERAF


General information:
TITO was launched using:
RESULT:

Template: 1A8P.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 : 1297 -106154 -81.85 -429.77
target 2D structure prediction score : 0.49
Monomeric hydrophicity matching model chain A : 0.80

3D Compatibility (PKB) : -81.85
2D Compatibility (Sec. Struct. Predict.) : 0.49
1D Compatibility (Hydrophobicity) : 0.80
QMean score : 0.549

(partial model without unconserved sides chains):
PDB file : Tito_1A8P.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-1A8P-query.scw
PDB file : Tito_Scwrl_1A8P.pdb: