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



Input alignment information:
Query sequenceMSDFLNKRFWKYRGKRIRPYMRNNVKLAGAIIFVPVFLLSMFLFWREQLIHFDLSQVIKNFEWNVPLIIKSVLCSVLIAVGSIVASYFLLFDSYKKILHRQKIAKMIFSNKFYEKENVKVRKIFSNETDSKEKITYFPRMYYQVKNNHIYIRIAMDMSRFQNRFLDLGKDLENGLFCDLVDKQMEEGFVCFKLLYDVKKNRISIDDAVAENGVLPLMKHISWQFDKLPHMLIAGGTGGGKTYFMLTIIKACVGL----GADVRILDPKNADLADLEEVLP-KKVYSQKNGILMCLRKSVDGMMERMDEMKQMSNYKTGENYAYLGLKPVFIFFDEYVAFMDLLDMKERNEALSYMKQLVMLGRQAGYFLVLGAQRPDAK-----YLADGIRDQFSFRVSLGLMSDTGYGMMFGDVEKAYVNKKETGRGYANVGTGSVLEFYSPIVPKGYDFMSSIKNALVGVEGAQATAVASGSVSDQTASGEGVSEANG
4NH0 Chain:A ((932-1147))-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------SPVYLDFNTDPHFLVFGDTECGKSNLLRLITAGIIERYTPQQARLIFIDYSRS-LLDVATTEHQIGYAASSTAASSLVRDIKGAMEARLPPPDLT--PEQLRSRSWWTGAELFLVVDDYEMVATS------DNPLRPLAELLPQARDIGLHLIIARSMGGAGRALYEPIIQRIKEMASPGLVMS--GNKDEGILLGNVK---PHKLPQGRGYFVERRSGTRLIQTAYRES-------------------------------------------


General information:
TITO was launched using:
RESULT:

Template: 4NH0.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 : 1025 -135266 -131.97 -656.63
target 2D structure prediction score : 0.47
Monomeric hydrophicity matching model chain A : 0.57

3D Compatibility (PKB) : -131.97
2D Compatibility (Sec. Struct. Predict.) : 0.47
1D Compatibility (Hydrophobicity) : 0.57
QMean score : 0.379

(partial model without unconserved sides chains):
PDB file : Tito_4NH0.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-4NH0-query.scw
PDB file : Tito_Scwrl_4NH0.pdb: