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



Input alignment information:
Query sequenceMLHCCFTTMPLNDNFVYAPPQDPLSILFEDDDLIVVDKPAGLLSVMGRLPEHHDSAYLRVLEKFPLAKVTHRLDMATSGLLMFAKHRDAEVAVSKMFQARTVKKHYIALVQGQVK-QEGSVEVPLITDWENRPRQIVHFELGKHAKTLFQPLVYDATTDQSRVLLEPVTGRSHQLRVHMMHIGHPIMGDKLYHPEPKRFHLNRMALHAAYLAFQHPLKGTDVVIESQVPF
2I82 Chain:D ((7-217))------------------PQEPWLVILYQDDHIMVVNKPSGLLSVPGRLEEHKDSVMTRIQRDYPQAESVHRLDMATSGVIVVALTKAAERELKRQFREREPKKQYVARVWGHPSPAEGLVDLPLICDWPNRPKQKVCYETGKPAQTEYEVVEYAA-DNTARVVLKPITGRSHQLRVHMLALGHPILGDRFYASPEARAMAPRLLLHAEMLTITHPAYGNSMTFKAPADF


General information:
TITO was launched using:
RESULT:

Template: 2I82.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
Monomeric PKB - chain D - contact count / total energy / energy per contact / energy per residue : 1096 -62971 -57.45 -299.86
target 2D structure prediction score : 0.51
Monomeric hydrophicity matching model chain D : 0.79

3D Compatibility (PKB) : -57.45
2D Compatibility (Sec. Struct. Predict.) : 0.51
1D Compatibility (Hydrophobicity) : 0.79
QMean score : 0.493

(partial model without unconserved sides chains):
PDB file : Tito_2I82.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-2I82-query.scw
PDB file : Tito_Scwrl_2I82.pdb: