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



Input alignment information:
Query sequenceMSRIPFLLILIIVIASLPVINNWLSYHNQTLNDDYIGERLDNYISRNFDKIIKILREESIKSNYAARDNATKGKILQYENKIFDLAYPYLGNENSNIIAVGFFDYSCGYCKAIKDD-----IKQLINDGKIKYIFRDTPILGNNSLKAAKSALAVYFIDKGKYFDFHYAILDHKGEF------SDENILDIVKSIGINEDNFNNSMKNNAGKIEQMINDSKFLVRELGAGGTPFLIIG-----------DSLFIGATDLDVLRKKVDELSHKQN----
3F4S Chain:A ((20-218))----------------------------------------------------------------------TSNELLLPLPN-----DKLLGDPKAPILMIEYASLTCYHCSLFHRNVFPKIKEKYIDTGKMLYIFRHFP-LDYRGLKAAMLSHCYE--KQEDYFNFNKAVFNSIDSWNYYNLSDLTLLQRIAALSNLKQDAFNQCI-NDKKIMDKIVNDKSLAINKLGITAVPIFFIKLNDDKSYIEHNKVKHGGYKELKYFTNVIDKLYGKAIVKLE


General information:
TITO was launched using:
RESULT:

Template: 3F4S.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -63780 for 1277 contacts (-49.9/contact) +
2D Compatibility (PS) -18933 + (NN) -10105 + (LL) 6576
1D Compatibility (HY) -12800 + (ID) 2000
Total energy: -101042.0 ( -79.12 by residue)
QMean score : 0.541

(partial model without unconserved sides chains):
PDB file : Tito_3F4S.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3F4S-query.scw
PDB file : Tito_Scwrl_3F4S.pdb: