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



Input alignment information:
Query sequenceMSTRRDLPQSPYLAAVTGRKPSRVPVWFMRQAGRSLPEYR--ALRERYSMLAACFEPDVACEITLQPIRRYD-VDAAILFSDIVVPLRAAGVDLDIVADVGPVIADPVRTAADVAAMKPLDPQ-AIQPVLVAASLLVAELG-DVPLIGFAGAPFTLASYLVEGGPSRHHAHVKAMMLAEPASWHALMAKLTDLTIAFLVGQIDAGVDAIQVFDSWAGALSPIDYRQYVLPHSARVFAALGEH----GVPMTHFGVGTAELLGAMSEAVTAGERPGRGAVVGVDWRTPLTDAAARVVPGTALQGNLDPAVVLAGWPAVERAARAVVDDGRRAVDAGAAGHIFNLGHGVLPESDPAVLADLVSLVHSL
4WSH Chain:A ((10-357))----TALKNDRFLRALLKQPVDVTPVWMMRQAGRYLPEYRATRAKAG-DFMSLCMNPELACEVTLQPLDRYPQLDAAILFSDILTIPDAMGQGLYFETGEGPRFRKVVSSLADIEALPVPDPEQDLGYVMDAVRTIRRELNGRVPLIGFSGSPWTLATYMVEGGSSKDFRKSKAMLYDNPKAMHALLDKLAQSVTSYLNGQIHAGAQAVQIFDSWGGSLSAAAYQEFSLAYMRKIVDGLIREHDGRRVPVILFTKGGGLWLESMAEVG--------AEALGLDWTCDIGSARARVGERVALQGNMDPSVLYANPAAIRAEVARILAAY-----GKGTGHVFNLGHGITPEVDPAHAGAFFEAVHEL


General information:
TITO was launched using:
RESULT:

Template: 4WSH.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -268177 for 3027 contacts (-88.6/contact) +
2D Compatibility (PS) -36536 + (NN) -14818 + (LL) 900
1D Compatibility (HY) -26400 + (ID) 6800
Total energy: -351831.0 ( -116.23 by residue)
QMean score : 0.547

(partial model without unconserved sides chains):
PDB file : Tito_4WSH.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-4WSH-query.scw
PDB file : Tito_Scwrl_4WSH.pdb: