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



Input alignment information:
Query sequenceMRVIDTHCDALYKLQAGKGKYTFQDAEELDVNFERLIEAKMLLQGFAIFLDEDIPVEHKWKKAVEQVNIFKQHVLHKGGIIHHVKKWCDLENL-PEDKIGAMLTLEGIEPIGRDLDKLTQLLDGGVLSVGLTWNNANLAADGIMEERG-AGLTRFGKDIIHLLNERKVFTDVSHLSVKAFWETLEQAEF-VIASHSSAKAICAHPRNLDDEQIKAMIEHDAMIHVIFHPLFTTNDG---------------------------------------VADIEDVIRHIDHICELGGMKNIGFGSDFDGIPDHVKGLEHAGKYQNFL-ETLGKHYTKEEVEGFASRNFLNHLPK
3S2J Chain:A ((48-366))----------------------------LHTDLARLRSGGVGAQYWSVYVRSDLP--GAVTATLEQIDCVRRLIDRHPGELRAALTAADMEAARAEGRIASLMGAEGGHSIDNSLATLRALYALGVRYMTLTHNDNNAWADSATDEPGVGGLSAFGREVVREMNREGMLVDLSHVAATTMRDALDTSTAPVIFSHSSSRAVCDHPRNIPDDVLERLSANGGMAMVTFVPKFVLQAAVDWTAEADDNMRAHGFHHLDSSPEAMKVHAAFEERVPRPVATVSTVADHLDHMREVAGVDHLGIGGDYDGTPFTPDGLGDVSGYPNLIAELLDRGWSQSDLAKLTWKNAVRVL--


General information:
TITO was launched using:
RESULT:

Template: 3S2J.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -169399 for 2467 contacts (-68.7/contact) +
2D Compatibility (PS) -28977 + (NN) -7124 + (LL) 2296
1D Compatibility (HY) -16000 + (ID) 3900
Total energy: -223104.0 ( -90.44 by residue)
QMean score : 0.459

(partial model without unconserved sides chains):
PDB file : Tito_3S2J.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3S2J-query.scw
PDB file : Tito_Scwrl_3S2J.pdb: