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



Input alignment information:
Query sequenceMDILRKGNKDLIKDINRYTVLNLIREKGEITRTEIAKKCDFGMSTLTYILDDLQQEGIILEGAETSSTGGRRAKLVRFNKDYGFVVSVKVEEEQLLFALTDLNAEIIENTSIPFSSEKKPEEAIELIAKNVKKMCGNRDMNHLLGVGIAISGLVNRKKGTVIRS-TML-GWENVALEAMLHAHFPDIPVYVDKNINCYTLAELWLGEGKQSNNFATVSVGAGLGLSVVINRQIYYGAQGGAGEFGHTTIQPGGYKCHCGQKGCLEMYASEFYFRNRGEELKEAYPTSELNDFHFDKVAKSARAGDEMATELMGKMGEYLGYGIRNIINTFNPEKVIIVGEGLHHRDLFLTKIDEIASQNFFSGAGFETEITTTSLEDPAWLQGAALLVIHQLFQVPIYEEEQTLLR
2AA4 Chain:A ((1-288))----------------------------------------------------------------------------------MTTLAIDIGGTKLAAALIGADGQIRDRRELPTPASQTPEALRDALSALVSPL-----QAHAQRVAIASTGIIRDGS-LLALNPHNLGGLLHFPLVKTLEQLT-NLPTIAINDAQAAAWAEFQALD-GDITDMVFITVSTGVGGGVVSGCKLLTGPGGLAGHIGHTLADPHGPVCGCGRTGCVEAIASGRGIAAAAQGELA--------GADAKTIFTRAGQGDEQAQQLIHRSARTLARLIADIKATTDCQCVVVGGSVGLA-EGYLALVETYLAQEPA--A-FHVDLLAAHYRHDAGLLGAALLAQG----------------


General information:
TITO was launched using:
RESULT:

Template: 2AA4.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -212126 for 2529 contacts (-83.9/contact) +
2D Compatibility (PS) -30865 + (NN) -11527 + (LL) 6772
1D Compatibility (HY) -3600 + (ID) 3250
Total energy: -254596.0 ( -100.67 by residue)
QMean score : 0.490

(partial model without unconserved sides chains):
PDB file : Tito_2AA4.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-2AA4-query.scw
PDB file : Tito_Scwrl_2AA4.pdb: