AS object created. control filepath is: /data/PSVS/PSVS-v1.4-dev/results/PFR193A_NMR_em_bcr3/rpf_calc/input/ctrl_file bmrb: chem_shift.bmrb sequence: PFR193A_NMR_em_bcr3_seq.bmrb parsing bmrb: /data/PSVS/PSVS-v1.4-dev/results/PFR193A_NMR_em_bcr3/rpf_calc/input/chem_shift.bmrb new residue 1 adding: *1* *1* *Met* *HA* *H* *3.999* *.* *1* old residue 1 adding: *2* *1* *Met* *HB2* *H* *2.011* *.* *2* old residue 1 adding: *3* *1* *Met* *HB3* *H* *1.946* *.* *2* old residue 1 adding: *4* *1* *Met* *HG2* *H* *2.368* *.* *2* old residue 1 adding: *5* *1* *Met* *HG3* *H* *2.274* *.* *2* old residue 1 adding: *6* *1* *Met* *CA* *C* *55.110* *.* *1* old residue 1 adding: *7* *1* *Met* *CB* *C* *33.147* *.* *1* old residue 1 adding: *8* *1* *Met* *CG* *C* *30.951* *.* *1* new residue 2 adding: *9* *2* *Glu* *HA* *H* *4.548* *.* *1* old residue 2 adding: *10* *2* *Glu* *HB2* *H* *1.863* *.* *2* old residue 2 adding: *11* *2* *Glu* *HB3* *H* *1.694* *.* *2* old residue 2 adding: *12* *2* *Glu* *HG2* *H* *2.198* *.* *2* old residue 2 adding: *13* *2* *Glu* *HG3* *H* *2.198* *.* *2* old residue 2 adding: *14* *2* *Glu* *C* *C* *174.089* *.* *1* old residue 2 adding: *15* *2* *Glu* *CA* *C* *55.411* *.* *1* old residue 2 adding: *16* *2* *Glu* *CB* *C* *31.573* *.* *1* old residue 2 adding: *17* *2* *Glu* *CG* *C* *36.021* *.* *1* new residue 3 adding: *18* *3* *Phe* *H* *H* *8.282* *.* *1* old residue 3 adding: *19* *3* *Phe* *HA* *H* *4.909* *.* *1* old residue 3 adding: *20* *3* *Phe* *HB2* *H* *3.331* *.* *2* old residue 3 adding: *21* *3* *Phe* *HB3* *H* *2.587* *.* *2* old residue 3 adding: *22* *3* *Phe* *HD1* *H* *7.195* *.* *3* old residue 3 adding: *23* *3* *Phe* *HD2* *H* *7.195* *.* *3* old residue 3 adding: *24* *3* *Phe* *HE1* *H* *7.277* *.* *3* old residue 3 adding: *25* *3* *Phe* *HE2* *H* *7.277* *.* *3* old residue 3 adding: *26* *3* *Phe* *HZ* *H* *7.273* *.* *1* old residue 3 adding: *27* *3* *Phe* *C* *C* *173.967* *.* *1* old residue 3 adding: *28* *3* *Phe* *CA* *C* *55.763* *.* *1* old residue 3 adding: *29* *3* *Phe* *CB* *C* *42.184* *.* *1* old residue 3 adding: *30* *3* *Phe* *CD1* *C* *131.613* *.* *3* old residue 3 adding: *31* *3* *Phe* *CD2* *C* *131.613* *.* *3* old residue 3 adding: *32* *3* *Phe* *CE1* *C* *131.681* *.* *3* old residue 3 adding: *33* *3* *Phe* *CE2* *C* *131.681* *.* *3* old residue 3 adding: *34* *3* *Phe* *CZ* *C* *129.94* *.* *1* old residue 3 adding: *35* *3* *Phe* *N* *N* *117.356* *.* *1* new residue 4 adding: *36* *4* *Pro* *HA* *H* *4.771* *.* *1* old residue 4 adding: *37* *4* *Pro* *HB2* *H* *2.362* *.* *2* old residue 4 adding: *38* *4* *Pro* *HB3* *H* *1.531* *.* *2* old residue 4 adding: *39* *4* *Pro* *HG2* *H* *2.014* *.* *2* old residue 4 adding: *40* *4* *Pro* *HG3* *H* *1.858* *.* *2* old residue 4 adding: *41* *4* *Pro* *HD2* *H* *4.330* *.* *2* old residue 4 adding: *42* *4* *Pro* *HD3* *H* *3.715* *.* *2* old residue 4 adding: *43* *4* *Pro* *C* *C* *176.562* *.* *1* old residue 4 adding: *44* *4* *Pro* *CA* *C* *62.812* *.* *1* old residue 4 adding: *45* *4* *Pro* *CB* *C* *33.831* *.* *1* old residue 4 adding: *46* *4* *Pro* *CG* *C* *27.063* *.* *1* old residue 4 adding: *47* *4* *Pro* *CD* *C* *50.139* *.* *1* new residue 5 adding: *48* *5* *Asp* *H* *H* *7.928* *.* *1* old residue 5 adding: *49* *5* *Asp* *HA* *H* *4.913* *.* *1* old residue 5 adding: *50* *5* *Asp* *HB2* *H* *2.753* *.* *2* old residue 5 adding: *51* *5* *Asp* *HB3* *H* *2.662* *.* *2* old residue 5 adding: *52* *5* *Asp* *C* *C* *174.604* *.* *1* old residue 5 adding: *53* *5* *Asp* *CA* *C* *56.666* *.* *1* old residue 5 adding: *54* *5* *Asp* *CB* *C* *42.145* *.* *1* old residue 5 adding: *55* *5* *Asp* *N* *N* *113.214* *.* *1* new residue 6 adding: *56* *6* *Leu* *H* *H* *8.835* *.* *1* old residue 6 adding: *57* *6* *Leu* *HA* *H* *5.443* *.* *1* old residue 6 adding: *58* *6* *Leu* *HB2* *H* *1.906* *.* *2* old residue 6 adding: *59* *6* *Leu* *HB3* *H* *1.308* *.* *2* old residue 6 adding: *60* *6* *Leu* *HG* *H* *1.588* *.* *1* old residue 6 adding: *61* *6* *Leu* *HD1* *H* *1.028* *.* *1* old residue 6 adding: *62* *6* *Leu* *HD2* *H* *0.863* *.* *1* old residue 6 adding: *63* *6* *Leu* *C* *C* *177.981* *.* *1* old residue 6 adding: *64* *6* *Leu* *CA* *C* *53.803* *.* *1* old residue 6 adding: *65* *6* *Leu* *CB* *C* *43.299* *.* *1* old residue 6 adding: *66* *6* *Leu* *CG* *C* *27.407* *.* *1* old residue 6 adding: *67* *6* *Leu* *CD1* *C* *26.184* *.* *1* old residue 6 adding: *68* *6* *Leu* *CD2* *C* *23.893* *.* *1* old residue 6 adding: *69* *6* *Leu* *N* *N* *125.960* *.* *1* new residue 7 adding: *70* *7* *Thr* *H* *H* *9.148* *.* *1* old residue 7 adding: *71* *7* *Thr* *HA* *H* *4.806* *.* *1* old residue 7 adding: *72* *7* *Thr* *HB* *H* *4.149* *.* *1* old residue 7 adding: *73* *7* *Thr* *HG1* *H* *6.187* *.* *1* old residue 7 adding: *74* *7* *Thr* *HG2* *H* *1.057* *.* *1* old residue 7 adding: *75* *7* *Thr* *C* *C* *170.943* *.* *1* old residue 7 adding: *76* *7* *Thr* *CA* *C* *60.678* *.* *1* old residue 7 adding: *77* *7* *Thr* *CB* *C* *69.914* *.* *1* old residue 7 adding: *78* *7* *Thr* *CG2* *C* *18.757* *.* *1* old residue 7 adding: *79* *7* *Thr* *N* *N* *118.730* *.* *1* new residue 8 adding: *80* *8* *Val* *H* *H* *7.567* *.* *1* old residue 8 adding: *81* *8* *Val* *HA* *H* *5.638* *.* *1* old residue 8 adding: *82* *8* *Val* *HB* *H* *1.758* *.* *1* old residue 8 adding: *83* *8* *Val* *HG1* *H* *0.713* *.* *1* old residue 8 adding: *84* *8* *Val* *HG2* *H* *0.698* *.* *1* old residue 8 adding: *85* *8* *Val* *C* *C* *172.395* *.* *1* old residue 8 adding: *86* *8* *Val* *CA* *C* *58.581* *.* *1* old residue 8 adding: *87* *8* *Val* *CB* *C* *36.200* *.* *1* old residue 8 adding: *88* *8* *Val* *CG1* *C* *21.139* *.* *1* old residue 8 adding: *89* *8* *Val* *CG2* *C* *21.360* *.* *1* old residue 8 adding: *90* *8* *Val* *N* *N* *117.776* *.* *1* new residue 9 adding: *91* *9* *Glu* *H* *H* *8.377* *.* *1* old residue 9 adding: *92* *9* *Glu* *HA* *H* *4.573* *.* *1* old residue 9 adding: *93* *9* *Glu* *HB2* *H* *1.970* *.* *2* old residue 9 adding: *94* *9* *Glu* *HB3* *H* *1.934* *.* *2* old residue 9 adding: *95* *9* *Glu* *HG2* *H* *2.191* *.* *2* old residue 9 adding: *96* *9* *Glu* *HG3* *H* *2.191* *.* *2* old residue 9 adding: *97* *9* *Glu* *C* *C* *174.215* *.* *1* old residue 9 adding: *98* *9* *Glu* *CA* *C* *55.269* *.* *1* old residue 9 adding: *99* *9* *Glu* *CB* *C* *34.854* *.* *1* old residue 9 adding: *100* *9* *Glu* *CG* *C* *36.18* *.* *1* old residue 9 adding: *101* *9* *Glu* *N* *N* *122.065* *.* *1* new residue 10 adding: *102* *10* *Ile* *H* *H* *8.841* *.* *1* old residue 10 adding: *103* *10* *Ile* *HA* *H* *4.936* *.* *1* old residue 10 adding: *104* *10* *Ile* *HB* *H* *1.488* *.* *1* old residue 10 adding: *105* *10* *Ile* *HG12* *H* *1.479* *.* *2* old residue 10 adding: *106* *10* *Ile* *HG13* *H* *0.754* *.* *2* old residue 10 adding: *107* *10* *Ile* *HG2* *H* *0.430* *.* *1* old residue 10 adding: *108* *10* *Ile* *HD1* *H* *0.756* *.* *1* old residue 10 adding: *109* *10* *Ile* *C* *C* *173.958* *.* *1* old residue 10 adding: *110* *10* *Ile* *CA* *C* *60.256* *.* *1* old residue 10 adding: *111* *10* *Ile* *CB* *C* *41.035* *.* *1* old residue 10 adding: *112* *10* *Ile* *CG1* *C* *28.089* *.* *1* old residue 10 adding: *113* *10* *Ile* *CG2* *C* *17.415* *.* *1* old residue 10 adding: *114* *10* *Ile* *CD1* *C* *15.119* *.* *1* old residue 10 adding: *115* *10* *Ile* *N* *N* *124.576* *.* *1* new residue 11 adding: *116* *11* *Lys* *H* *H* *8.971* *.* *1* old residue 11 adding: *117* *11* *Lys* *HA* *H* *4.684* *.* *1* old residue 11 adding: *118* *11* *Lys* *HB2* *H* *1.792* *.* *2* old residue 11 adding: *119* *11* *Lys* *HB3* *H* *1.601* *.* *2* old residue 11 adding: *120* *11* *Lys* *HG2* *H* *1.174* *.* *2* old residue 11 adding: *121* *11* *Lys* *HG3* *H* *1.127* *.* *2* old residue 11 adding: *122* *11* *Lys* *HD2* *H* *1.546* *.* *2* old residue 11 adding: *123* *11* *Lys* *HD3* *H* *1.363* *.* *2* old residue 11 adding: *124* *11* *Lys* *HE2* *H* *2.626* *.* *2* old residue 11 adding: *125* *11* *Lys* *HE3* *H* *2.613* *.* *2* old residue 11 adding: *126* *11* *Lys* *C* *C* *174.329* *.* *1* old residue 11 adding: *127* *11* *Lys* *CA* *C* *54.444* *.* *1* old residue 11 adding: *128* *11* *Lys* *CB* *C* *36.417* *.* *1* old residue 11 adding: *129* *11* *Lys* *CG* *C* *24.937* *.* *1* old residue 11 adding: *130* *11* *Lys* *CD* *C* *28.906* *.* *1* old residue 11 adding: *131* *11* *Lys* *CE* *C* *41.939* *.* *1* old residue 11 adding: *132* *11* *Lys* *N* *N* *124.301* *.* *1* new residue 12 adding: *133* *12* *Gly* *H* *H* *7.905* *.* *1* old residue 12 adding: *134* *12* *Gly* *HA2* *H* *4.159* *.* *2* old residue 12 adding: *135* *12* *Gly* *HA3* *H* *3.636* *.* *2* old residue 12 adding: *136* *12* *Gly* *C* *C* *169.442* *.* *1* old residue 12 adding: *137* *12* *Gly* *CA* *C* *45.067* *.* *1* old residue 12 adding: *138* *12* *Gly* *N* *N* *109.528* *.* *1* new residue 13 adding: *139* *13* *Pro* *HA* *H* *4.634* *.* *1* old residue 13 adding: *140* *13* *Pro* *HB2* *H* *2.266* *.* *2* old residue 13 adding: *141* *13* *Pro* *HB3* *H* *1.984* *.* *2* old residue 13 adding: *142* *13* *Pro* *HG2* *H* *2.036* *.* *2* old residue 13 adding: *143* *13* *Pro* *HG3* *H* *1.911* *.* *2* old residue 13 adding: *144* *13* *Pro* *HD2* *H* *3.079* *.* *2* old residue 13 adding: *145* *13* *Pro* *HD3* *H* *2.425* *.* *2* old residue 13 adding: *146* *13* *Pro* *C* *C* *176.817* *.* *1* old residue 13 adding: *147* *13* *Pro* *CA* *C* *63.062* *.* *1* old residue 13 adding: *148* *13* *Pro* *CB* *C* *32.444* *.* *1* old residue 13 adding: *149* *13* *Pro* *CG* *C* *27.136* *.* *1* old residue 13 adding: *150* *13* *Pro* *CD* *C* *49.245* *.* *1* new residue 14 adding: *151* *14* *Asp* *H* *H* *8.783* *.* *1* old residue 14 adding: *152* *14* *Asp* *HA* *H* *4.948* *.* *1* old residue 14 adding: *153* *14* *Asp* *HB2* *H* *3.067* *.* *2* old residue 14 adding: *154* *14* *Asp* *HB3* *H* *2.797* *.* *2* old residue 14 adding: *155* *14* *Asp* *C* *C* *175.824* *.* *1* old residue 14 adding: *156* *14* *Asp* *CA* *C* *54.450* *.* *1* old residue 14 adding: *157* *14* *Asp* *CB* *C* *40.499* *.* *1* old residue 14 adding: *158* *14* *Asp* *N* *N* *120.167* *.* *1* new residue 15 adding: *159* *15* *Val* *H* *H* *7.569* *.* *1* old residue 15 adding: *160* *15* *Val* *HA* *H* *5.375* *.* *1* old residue 15 adding: *161* *15* *Val* *HB* *H* *1.817* *.* *1* old residue 15 adding: *162* *15* *Val* *HG1* *H* *0.785* *.* *1* old residue 15 adding: *163* *15* *Val* *HG2* *H* *0.966* *.* *1* old residue 15 adding: *164* *15* *Val* *C* *C* *175.389* *.* *1* old residue 15 adding: *165* *15* *Val* *CA* *C* *61.542* *.* *1* old residue 15 adding: *166* *15* *Val* *CB* *C* *34.836* *.* *1* old residue 15 adding: *167* *15* *Val* *CG1* *C* *21.463* *.* *1* old residue 15 adding: *168* *15* *Val* *CG2* *C* *21.510* *.* *1* old residue 15 adding: *169* *15* *Val* *N* *N* *122.443* *.* *1* new residue 16 adding: *170* *16* *Val* *H* *H* *8.889* *.* *1* old residue 16 adding: *171* *16* *Val* *HA* *H* *4.307* *.* *1* old residue 16 adding: *172* *16* *Val* *HB* *H* *1.811* *.* *1* old residue 16 adding: *173* *16* *Val* *HG1* *H* *0.819* *.* *1* old residue 16 adding: *174* *16* *Val* *HG2* *H* *0.920* *.* *1* old residue 16 adding: *175* *16* *Val* *C* *C* *174.601* *.* *1* old residue 16 adding: *176* *16* *Val* *CA* *C* *60.045* *.* *1* old residue 16 adding: *177* *16* *Val* *CB* *C* *36.973* *.* *1* old residue 16 adding: *178* *16* *Val* *CG1* *C* *22.554* *.* *1* old residue 16 adding: *179* *16* *Val* *CG2* *C* *22.221* *.* *1* old residue 16 adding: *180* *16* *Val* *N* *N* *125.587* *.* *1* new residue 17 adding: *181* *17* *Gly* *H* *H* *8.563* *.* *1* old residue 17 adding: *182* *17* *Gly* *HA2* *H* *4.625* *.* *2* old residue 17 adding: *183* *17* *Gly* *HA3* *H* *3.353* *.* *2* old residue 17 adding: *184* *17* *Gly* *C* *C* *173.511* *.* *1* old residue 17 adding: *185* *17* *Gly* *CA* *C* *44.297* *.* *1* old residue 17 adding: *186* *17* *Gly* *N* *N* *111.233* *.* *1* new residue 18 adding: *187* *18* *Val* *H* *H* *8.006* *.* *1* old residue 18 adding: *188* *18* *Val* *HA* *H* *3.129* *.* *1* old residue 18 adding: *189* *18* *Val* *HB* *H* *1.624* *.* *1* old residue 18 adding: *190* *18* *Val* *HG1* *H* *0.798* *.* *1* old residue 18 adding: *191* *18* *Val* *HG2* *H* *0.684* *.* *1* old residue 18 adding: *192* *18* *Val* *C* *C* *175.404* *.* *1* old residue 18 adding: *193* *18* *Val* *CA* *C* *63.972* *.* *1* old residue 18 adding: *194* *18* *Val* *CB* *C* *31.932* *.* *1* old residue 18 adding: *195* *18* *Val* *CG1* *C* *20.719* *.* *1* old residue 18 adding: *196* *18* *Val* *CG2* *C* *22.450* *.* *1* old residue 18 adding: *197* *18* *Val* *N* *N* *120.888* *.* *1* new residue 19 adding: *198* *19* *Asn* *H* *H* *8.564* *.* *1* old residue 19 adding: *199* *19* *Asn* *HA* *H* *3.970* *.* *1* old residue 19 adding: *200* *19* *Asn* *HB2* *H* *3.009* *.* *2* old residue 19 adding: *201* *19* *Asn* *HB3* *H* *2.932* *.* *2* old residue 19 adding: *202* *19* *Asn* *HD21* *H* *7.525* *.* *1* old residue 19 adding: *203* *19* *Asn* *HD22* *H* *6.861* *.* *1* old residue 19 adding: *204* *19* *Asn* *C* *C* *173.605* *.* *1* old residue 19 adding: *205* *19* *Asn* *CA* *C* *55.315* *.* *1* old residue 19 adding: *206* *19* *Asn* *CB* *C* *37.090* *.* *1* old residue 19 adding: *207* *19* *Asn* *CG* *C* *178.106* *.* *1* old residue 19 adding: *208* *19* *Asn* *N* *N* *117.109* *.* *1* old residue 19 adding: *209* *19* *Asn* *ND2* *N* *113.631* *.* *1* new residue 20 adding: *210* *20* *Lys* *H* *H* *7.490* *.* *1* old residue 20 adding: *211* *20* *Lys* *HA* *H* *4.488* *.* *1* old residue 20 adding: *212* *20* *Lys* *HB2* *H* *1.928* *.* *2* old residue 20 adding: *213* *20* *Lys* *HB3* *H* *1.627* *.* *2* old residue 20 adding: *214* *20* *Lys* *HG2* *H* *1.347* *.* *2* old residue 20 adding: *215* *20* *Lys* *HG3* *H* *1.149* *.* *2* old residue 20 adding: *216* *20* *Lys* *HD2* *H* *1.617* *.* *2* old residue 20 adding: *217* *20* *Lys* *HD3* *H* *1.581* *.* *2* old residue 20 adding: *218* *20* *Lys* *HE2* *H* *2.985* *.* *2* old residue 20 adding: *219* *20* *Lys* *HE3* *H* *2.985* *.* *2* old residue 20 adding: *220* *20* *Lys* *C* *C* *173.648* *.* *1* old residue 20 adding: *221* *20* *Lys* *CA* *C* *53.974* *.* *1* old residue 20 adding: *222* *20* *Lys* *CB* *C* *33.308* *.* *1* old residue 20 adding: *223* *20* *Lys* *CG* *C* *24.202* *.* *1* old residue 20 adding: *224* *20* *Lys* *CD* *C* *28.433* *.* *1* old residue 20 adding: *225* *20* *Lys* *CE* *C* *42.322* *.* *1* old residue 20 adding: *226* *20* *Lys* *N* *N* *119.052* *.* *1* new residue 21 adding: *227* *21* *Leu* *H* *H* *7.761* *.* *1* old residue 21 adding: *228* *21* *Leu* *HA* *H* *4.355* *.* *1* old residue 21 adding: *229* *21* *Leu* *HB2* *H* *1.581* *.* *2* old residue 21 adding: *230* *21* *Leu* *HB3* *H* *1.429* *.* *2* old residue 21 adding: *231* *21* *Leu* *HG* *H* *1.354* *.* *1* old residue 21 adding: *232* *21* *Leu* *HD1* *H* *0.867* *.* *1* old residue 21 adding: *233* *21* *Leu* *HD2* *H* *0.806* *.* *1* old residue 21 adding: *234* *21* *Leu* *C* *C* *176.563* *.* *1* old residue 21 adding: *235* *21* *Leu* *CA* *C* *55.863* *.* *1* old residue 21 adding: *236* *21* *Leu* *CB* *C* *43.114* *.* *1* old residue 21 adding: *237* *21* *Leu* *CG* *C* *27.425* *.* *1* old residue 21 adding: *238* *21* *Leu* *CD1* *C* *25.213* *.* *1* old residue 21 adding: *239* *21* *Leu* *CD2* *C* *25.663* *.* *1* old residue 21 adding: *240* *21* *Leu* *N* *N* *122.175* *.* *1* new residue 22 adding: *241* *22* *Ala* *H* *H* *9.241* *.* *1* old residue 22 adding: *242* *22* *Ala* *HA* *H* *4.734* *.* *1* old residue 22 adding: *243* *22* *Ala* *HB* *H* *1.583* *.* *1* old residue 22 adding: *244* *22* *Ala* *C* *C* *175.095* *.* *1* old residue 22 adding: *245* *22* *Ala* *CA* *C* *50.881* *.* *1* old residue 22 adding: *246* *22* *Ala* *CB* *C* *23.297* *.* *1* old residue 22 adding: *247* *22* *Ala* *N* *N* *132.877* *.* *1* new residue 23 adding: *248* *23* *Glu* *H* *H* *7.988* *.* *1* old residue 23 adding: *249* *23* *Glu* *HA* *H* *4.899* *.* *1* old residue 23 adding: *250* *23* *Glu* *HB2* *H* *1.854* *.* *2* old residue 23 adding: *251* *23* *Glu* *HB3* *H* *1.679* *.* *2* old residue 23 adding: *252* *23* *Glu* *HG2* *H* *2.058* *.* *2* old residue 23 adding: *253* *23* *Glu* *HG3* *H* *1.941* *.* *2* old residue 23 adding: *254* *23* *Glu* *C* *C* *174.569* *.* *1* old residue 23 adding: *255* *23* *Glu* *CA* *C* *55.333* *.* *1* old residue 23 adding: *256* *23* *Glu* *CB* *C* *32.35* *.* *1* old residue 23 adding: *257* *23* *Glu* *CG* *C* *37.288* *.* *1* old residue 23 adding: *258* *23* *Glu* *N* *N* *120.423* *.* *1* new residue 24 adding: *259* *24* *Tyr* *H* *H* *8.467* *.* *1* old residue 24 adding: *260* *24* *Tyr* *HA* *H* *4.508* *.* *1* old residue 24 adding: *261* *24* *Tyr* *HB2* *H* *2.102* *.* *2* old residue 24 adding: *262* *24* *Tyr* *HB3* *H* *0.966* *.* *2* old residue 24 adding: *263* *24* *Tyr* *HD1* *H* *6.296* *.* *3* old residue 24 adding: *264* *24* *Tyr* *HD2* *H* *6.296* *.* *3* old residue 24 adding: *265* *24* *Tyr* *HE1* *H* *6.583* *.* *3* old residue 24 adding: *266* *24* *Tyr* *HE2* *H* *6.583* *.* *3* old residue 24 adding: *267* *24* *Tyr* *HH* *H* *7.935* *.* *1* old residue 24 adding: *268* *24* *Tyr* *C* *C* *174.906* *.* *1* old residue 24 adding: *269* *24* *Tyr* *CA* *C* *57.306* *.* *1* old residue 24 adding: *270* *24* *Tyr* *CB* *C* *43.837* *.* *1* old residue 24 adding: *271* *24* *Tyr* *CD1* *C* *131.860* *.* *3* old residue 24 adding: *272* *24* *Tyr* *CD2* *C* *131.860* *.* *3* old residue 24 adding: *273* *24* *Tyr* *CE1* *C* *118.104* *.* *3* old residue 24 adding: *274* *24* *Tyr* *CE2* *C* *118.104* *.* *3* old residue 24 adding: *275* *24* *Tyr* *N* *N* *121.153* *.* *1* new residue 25 adding: *276* *25* *Glu* *H* *H* *8.948* *.* *1* old residue 25 adding: *277* *25* *Glu* *HA* *H* *4.881* *.* *1* old residue 25 adding: *278* *25* *Glu* *HB2* *H* *2.021* *.* *2* old residue 25 adding: *279* *25* *Glu* *HB3* *H* *1.629* *.* *2* old residue 25 adding: *280* *25* *Glu* *HG2* *H* *2.294* *.* *2* old residue 25 adding: *281* *25* *Glu* *HG3* *H* *1.964* *.* *2* old residue 25 adding: *282* *25* *Glu* *C* *C* *175.815* *.* *1* old residue 25 adding: *283* *25* *Glu* *CA* *C* *53.871* *.* *1* old residue 25 adding: *284* *25* *Glu* *CB* *C* *33.588* *.* *1* old residue 25 adding: *285* *25* *Glu* *CG* *C* *35.101* *.* *1* old residue 25 adding: *286* *25* *Glu* *N* *N* *116.307* *.* *1* new residue 26 adding: *287* *26* *Val* *H* *H* *9.524* *.* *1* old residue 26 adding: *288* *26* *Val* *HA* *H* *4.607* *.* *1* old residue 26 adding: *289* *26* *Val* *HB* *H* *1.905* *.* *1* old residue 26 adding: *290* *26* *Val* *HG1* *H* *0.581* *.* *1* old residue 26 adding: *291* *26* *Val* *HG2* *H* *0.983* *.* *1* old residue 26 adding: *292* *26* *Val* *C* *C* *175.575* *.* *1* old residue 26 adding: *293* *26* *Val* *CA* *C* *61.478* *.* *1* old residue 26 adding: *294* *26* *Val* *CB* *C* *32.291* *.* *1* old residue 26 adding: *295* *26* *Val* *CG1* *C* *21.565* *.* *1* old residue 26 adding: *296* *26* *Val* *CG2* *C* *21.670* *.* *1* old residue 26 adding: *297* *26* *Val* *N* *N* *123.659* *.* *1* new residue 27 adding: *298* *27* *His* *H* *H* *9.519* *.* *1* old residue 27 adding: *299* *27* *His* *HA* *H* *4.881* *.* *1* old residue 27 adding: *300* *27* *His* *HB2* *H* *3.168* *.* *2* old residue 27 adding: *301* *27* *His* *HB3* *H* *3.010* *.* *2* old residue 27 adding: *302* *27* *His* *HD2* *H* *6.791* *.* *1* old residue 27 adding: *303* *27* *His* *HE1* *H* *8.469* *.* *1* old residue 27 adding: *304* *27* *His* *C* *C* *173.800* *.* *1* old residue 27 adding: *305* *27* *His* *CA* *C* *54.754* *.* *1* old residue 27 adding: *306* *27* *His* *CB* *C* *29.169* *.* *1* old residue 27 adding: *307* *27* *His* *CD2* *C* *116.839* *.* *1* old residue 27 adding: *308* *27* *His* *CE1* *C* *137.074* *.* *1* old residue 27 adding: *309* *27* *His* *N* *N* *126.962* *.* *1* new residue 28 adding: *310* *28* *Val* *H* *H* *9.226* *.* *1* old residue 28 adding: *311* *28* *Val* *HA* *H* *4.986* *.* *1* old residue 28 adding: *312* *28* *Val* *HB* *H* *1.817* *.* *1* old residue 28 adding: *313* *28* *Val* *HG1* *H* *0.867* *.* *2* old residue 28 adding: *314* *28* *Val* *HG2* *H* *0.867* *.* *2* old residue 28 adding: *315* *28* *Val* *C* *C* *173.076* *.* *1* old residue 28 adding: *316* *28* *Val* *CA* *C* *59.533* *.* *1* old residue 28 adding: *317* *28* *Val* *CB* *C* *33.601* *.* *1* old residue 28 adding: *318* *28* *Val* *CG1* *C* *21.441* *.* *2* old residue 28 adding: *319* *28* *Val* *CG2* *C* *21.441* *.* *2* old residue 28 adding: *320* *28* *Val* *N* *N* *125.754* *.* *1* new residue 29 adding: *321* *29* *Lys* *H* *H* *8.318* *.* *1* old residue 29 adding: *322* *29* *Lys* *HA* *H* *5.360* *.* *1* old residue 29 adding: *323* *29* *Lys* *HB2* *H* *1.678* *.* *2* old residue 29 adding: *324* *29* *Lys* *HB3* *H* *1.497* *.* *2* old residue 29 adding: *325* *29* *Lys* *HG2* *H* *1.144* *.* *2* old residue 29 adding: *326* *29* *Lys* *HG3* *H* *1.127* *.* *2* old residue 29 adding: *327* *29* *Lys* *HD2* *H* *1.529* *.* *2* old residue 29 adding: *328* *29* *Lys* *HD3* *H* *1.446* *.* *2* old residue 29 adding: *329* *29* *Lys* *HE2* *H* *2.769* *.* *2* old residue 29 adding: *330* *29* *Lys* *HE3* *H* *2.662* *.* *2* old residue 29 adding: *331* *29* *Lys* *C* *C* *174.823* *.* *1* old residue 29 adding: *332* *29* *Lys* *CA* *C* *54.258* *.* *1* old residue 29 adding: *333* *29* *Lys* *CB* *C* *36.822* *.* *1* old residue 29 adding: *334* *29* *Lys* *CG* *C* *25.387* *.* *1* old residue 29 adding: *335* *29* *Lys* *CD* *C* *29.727* *.* *1* old residue 29 adding: *336* *29* *Lys* *CE* *C* *42.150* *.* *1* old residue 29 adding: *337* *29* *Lys* *N* *N* *124.169* *.* *1* new residue 30 adding: *338* *30* *Asn* *H* *H* *8.420* *.* *1* old residue 30 adding: *339* *30* *Asn* *HA* *H* *5.363* *.* *1* old residue 30 adding: *340* *30* *Asn* *HB2* *H* *3.451* *.* *2* old residue 30 adding: *341* *30* *Asn* *HB3* *H* *2.373* *.* *2* old residue 30 adding: *342* *30* *Asn* *HD21* *H* *7.710* *.* *1* old residue 30 adding: *343* *30* *Asn* *HD22* *H* *6.500* *.* *1* old residue 30 adding: *344* *30* *Asn* *C* *C* *175.354* *.* *1* old residue 30 adding: *345* *30* *Asn* *CA* *C* *50.158* *.* *1* old residue 30 adding: *346* *30* *Asn* *CB* *C* *39.370* *.* *1* old residue 30 adding: *347* *30* *Asn* *N* *N* *117.630* *.* *1* old residue 30 adding: *348* *30* *Asn* *ND2* *N* *112.030* *.* *1* new residue 31 adding: *349* *31* *Leu* *H* *H* *9.400* *.* *1* old residue 31 adding: *350* *31* *Leu* *HA* *H* *4.272* *.* *1* old residue 31 adding: *351* *31* *Leu* *HB2* *H* *1.810* *.* *2* old residue 31 adding: *352* *31* *Leu* *HB3* *H* *1.810* *.* *2* old residue 31 adding: *353* *31* *Leu* *HG* *H* *1.603* *.* *1* old residue 31 adding: *354* *31* *Leu* *HD1* *H* *0.901* *.* *1* old residue 31 adding: *355* *31* *Leu* *HD2* *H* *0.819* *.* *1* old residue 31 adding: *356* *31* *Leu* *C* *C* *178.661* *.* *1* old residue 31 adding: *357* *31* *Leu* *CA* *C* *54.830* *.* *1* old residue 31 adding: *358* *31* *Leu* *CB* *C* *42.492* *.* *1* old residue 31 adding: *359* *31* *Leu* *CG* *C* *26.984* *.* *1* old residue 31 adding: *360* *31* *Leu* *CD1* *C* *25.284* *.* *1* old residue 31 adding: *361* *31* *Leu* *CD2* *C* *22.371* *.* *1* old residue 31 adding: *362* *31* *Leu* *N* *N* *122.003* *.* *1* new residue 32 adding: *363* *32* *Gly* *H* *H* *7.836* *.* *1* old residue 32 adding: *364* *32* *Gly* *HA2* *H* *4.640* *.* *2* old residue 32 adding: *365* *32* *Gly* *HA3* *H* *4.159* *.* *2* old residue 32 adding: *366* *32* *Gly* *C* *C* *173.108* *.* *1* old residue 32 adding: *367* *32* *Gly* *CA* *C* *43.827* *.* *1* old residue 32 adding: *368* *32* *Gly* *N* *N* *104.966* *.* *1* new residue 33 adding: *369* *33* *Gly* *H* *H* *8.300* *.* *1* old residue 33 adding: *370* *33* *Gly* *HA2* *H* *4.192* *.* *2* old residue 33 adding: *371* *33* *Gly* *HA3* *H* *3.739* *.* *2* old residue 33 adding: *372* *33* *Gly* *C* *C* *172.947* *.* *1* old residue 33 adding: *373* *33* *Gly* *CA* *C* *45.486* *.* *1* old residue 33 adding: *374* *33* *Gly* *N* *N* *103.116* *.* *1* new residue 34 adding: *375* *34* *Ile* *H* *H* *6.758* *.* *1* old residue 34 adding: *376* *34* *Ile* *HA* *H* *4.412* *.* *1* old residue 34 adding: *377* *34* *Ile* *HB* *H* *1.471* *.* *1* old residue 34 adding: *378* *34* *Ile* *HG12* *H* *1.340* *.* *2* old residue 34 adding: *379* *34* *Ile* *HG13* *H* *1.084* *.* *2* old residue 34 adding: *380* *34* *Ile* *HG2* *H* *0.903* *.* *1* old residue 34 adding: *381* *34* *Ile* *HD1* *H* *0.798* *.* *1* old residue 34 adding: *382* *34* *Ile* *C* *C* *174.771* *.* *1* old residue 34 adding: *383* *34* *Ile* *CA* *C* *57.881* *.* *1* old residue 34 adding: *384* *34* *Ile* *CB* *C* *40.871* *.* *1* old residue 34 adding: *385* *34* *Ile* *CG1* *C* *26.915* *.* *1* old residue 34 adding: *386* *34* *Ile* *CG2* *C* *16.283* *.* *1* old residue 34 adding: *387* *34* *Ile* *CD1* *C* *12.115* *.* *1* old residue 34 adding: *388* *34* *Ile* *N* *N* *117.237* *.* *1* new residue 35 adding: *389* *35* *Gly* *H* *H* *8.860* *.* *1* old residue 35 adding: *390* *35* *Gly* *HA2* *H* *3.938* *.* *2* old residue 35 adding: *391* *35* *Gly* *HA3* *H* *3.691* *.* *2* old residue 35 adding: *392* *35* *Gly* *C* *C* *171.709* *.* *1* old residue 35 adding: *393* *35* *Gly* *CA* *C* *44.718* *.* *1* old residue 35 adding: *394* *35* *Gly* *N* *N* *112.288* *.* *1* new residue 36 adding: *395* *36* *Val* *H* *H* *8.873* *.* *1* old residue 36 adding: *396* *36* *Val* *HA* *H* *4.431* *.* *1* old residue 36 adding: *397* *36* *Val* *HB* *H* *2.027* *.* *1* old residue 36 adding: *398* *36* *Val* *HG1* *H* *0.880* *.* *1* old residue 36 adding: *399* *36* *Val* *HG2* *H* *0.959* *.* *1* old residue 36 adding: *400* *36* *Val* *C* *C* *173.918* *.* *1* old residue 36 adding: *401* *36* *Val* *CA* *C* *59.176* *.* *1* old residue 36 adding: *402* *36* *Val* *CB* *C* *34.549* *.* *1* old residue 36 adding: *403* *36* *Val* *CG1* *C* *21.896* *.* *1* old residue 36 adding: *404* *36* *Val* *CG2* *C* *21.855* *.* *1* old residue 36 adding: *405* *36* *Val* *N* *N* *119.649* *.* *1* new residue 37 adding: *406* *37* *Pro* *HA* *H* *4.251* *.* *1* old residue 37 adding: *407* *37* *Pro* *HB2* *H* *2.360* *.* *2* old residue 37 adding: *408* *37* *Pro* *HB3* *H* *1.944* *.* *2* old residue 37 adding: *409* *37* *Pro* *HG2* *H* *2.116* *.* *2* old residue 37 adding: *410* *37* *Pro* *HG3* *H* *1.988* *.* *2* old residue 37 adding: *411* *37* *Pro* *HD2* *H* *3.923* *.* *2* old residue 37 adding: *412* *37* *Pro* *HD3* *H* *3.691* *.* *2* old residue 37 adding: *413* *37* *Pro* *C* *C* *177.224* *.* *1* old residue 37 adding: *414* *37* *Pro* *CA* *C* *64.819* *.* *1* old residue 37 adding: *415* *37* *Pro* *CB* *C* *32.454* *.* *1* old residue 37 adding: *416* *37* *Pro* *CG* *C* *27.117* *.* *1* old residue 37 adding: *417* *37* *Pro* *CD* *C* *51.321* *.* *1* new residue 38 adding: *418* *38* *Ser* *H* *H* *7.376* *.* *1* old residue 38 adding: *419* *38* *Ser* *HA* *H* *4.590* *.* *1* old residue 38 adding: *420* *38* *Ser* *HB2* *H* *3.585* *.* *2* old residue 38 adding: *421* *38* *Ser* *HB3* *H* *3.549* *.* *2* old residue 38 adding: *422* *38* *Ser* *C* *C* *173.336* *.* *1* old residue 38 adding: *423* *38* *Ser* *CA* *C* *58.222* *.* *1* old residue 38 adding: *424* *38* *Ser* *CB* *C* *63.932* *.* *1* old residue 38 adding: *425* *38* *Ser* *N* *N* *108.183* *.* *1* new residue 39 adding: *426* *39* *Thr* *H* *H* *9.004* *.* *1* old residue 39 adding: *427* *39* *Thr* *HA* *H* *4.596* *.* *1* old residue 39 adding: *428* *39* *Thr* *HB* *H* *4.000* *.* *1* old residue 39 adding: *429* *39* *Thr* *HG2* *H* *0.825* *.* *1* old residue 39 adding: *430* *39* *Thr* *C* *C* *170.923* *.* *1* old residue 39 adding: *431* *39* *Thr* *CA* *C* *61.044* *.* *1* old residue 39 adding: *432* *39* *Thr* *CB* *C* *69.000* *.* *1* old residue 39 adding: *433* *39* *Thr* *CG2* *C* *18.032* *.* *1* old residue 39 adding: *434* *39* *Thr* *N* *N* *122.850* *.* *1* new residue 40 adding: *435* *40* *Lys* *H* *H* *7.982* *.* *1* old residue 40 adding: *436* *40* *Lys* *HA* *H* *5.556* *.* *1* old residue 40 adding: *437* *40* *Lys* *HB2* *H* *2.002* *.* *2* old residue 40 adding: *438* *40* *Lys* *HB3* *H* *1.696* *.* *2* old residue 40 adding: *439* *40* *Lys* *HG2* *H* *1.555* *.* *2* old residue 40 adding: *440* *40* *Lys* *HG3* *H* *1.471* *.* *2* old residue 40 adding: *441* *40* *Lys* *HD2* *H* *1.647* *.* *2* old residue 40 adding: *442* *40* *Lys* *HD3* *H* *1.635* *.* *2* old residue 40 adding: *443* *40* *Lys* *HE2* *H* *2.885* *.* *2* old residue 40 adding: *444* *40* *Lys* *HE3* *H* *2.885* *.* *2* old residue 40 adding: *445* *40* *Lys* *C* *C* *177.528* *.* *1* old residue 40 adding: *446* *40* *Lys* *CA* *C* *55.250* *.* *1* old residue 40 adding: *447* *40* *Lys* *CB* *C* *35.077* *.* *1* old residue 40 adding: *448* *40* *Lys* *CG* *C* *25.471* *.* *1* old residue 40 adding: *449* *40* *Lys* *CD* *C* *29.188* *.* *1* old residue 40 adding: *450* *40* *Lys* *CE* *C* *42.391* *.* *1* old residue 40 adding: *451* *40* *Lys* *N* *N* *123.251* *.* *1* new residue 41 adding: *452* *41* *Val* *H* *H* *9.571* *.* *1* old residue 41 adding: *453* *41* *Val* *HA* *H* *5.212* *.* *1* old residue 41 adding: *454* *41* *Val* *HB* *H* *2.144* *.* *1* old residue 41 adding: *455* *41* *Val* *HG1* *H* *0.931* *.* *1* old residue 41 adding: *456* *41* *Val* *HG2* *H* *0.919* *.* *1* old residue 41 adding: *457* *41* *Val* *C* *C* *174.643* *.* *1* old residue 41 adding: *458* *41* *Val* *CA* *C* *60.515* *.* *1* old residue 41 adding: *459* *41* *Val* *CB* *C* *34.218* *.* *1* old residue 41 adding: *460* *41* *Val* *CG1* *C* *20.778* *.* *1* old residue 41 adding: *461* *41* *Val* *CG2* *C* *22.343* *.* *1* old residue 41 adding: *462* *41* *Val* *N* *N* *127.550* *.* *1* new residue 42 adding: *463* *42* *Arg* *H* *H* *8.854* *.* *1* old residue 42 adding: *464* *42* *Arg* *HA* *H* *5.061* *.* *1* old residue 42 adding: *465* *42* *Arg* *HB2* *H* *1.847* *.* *2* old residue 42 adding: *466* *42* *Arg* *HB3* *H* *1.188* *.* *2* old residue 42 adding: *467* *42* *Arg* *HG2* *H* *1.536* *.* *2* old residue 42 adding: *468* *42* *Arg* *HG3* *H* *1.360* *.* *2* old residue 42 adding: *469* *42* *Arg* *HD2* *H* *3.080* *.* *2* old residue 42 adding: *470* *42* *Arg* *HD3* *H* *2.999* *.* *2* old residue 42 adding: *471* *42* *Arg* *HE* *H* *7.455* *.* *1* old residue 42 adding: *472* *42* *Arg* *C* *C* *174.625* *.* *1* old residue 42 adding: *473* *42* *Arg* *CA* *C* *54.837* *.* *1* old residue 42 adding: *474* *42* *Arg* *CB* *C* *34.596* *.* *1* old residue 42 adding: *475* *42* *Arg* *CG* *C* *29.69* *.* *1* old residue 42 adding: *476* *42* *Arg* *CD* *C* *43.856* *.* *1* old residue 42 adding: *477* *42* *Arg* *N* *N* *125.941* *.* *1* old residue 42 adding: *478* *42* *Arg* *NE* *N* *84.879* *.* *1* new residue 43 adding: *479* *43* *Val* *H* *H* *8.451* *.* *1* old residue 43 adding: *480* *43* *Val* *HA* *H* *5.118* *.* *1* old residue 43 adding: *481* *43* *Val* *HB* *H* *1.419* *.* *1* old residue 43 adding: *482* *43* *Val* *HG1* *H* *0.313* *.* *1* old residue 43 adding: *483* *43* *Val* *HG2* *H* *0.870* *.* *1* old residue 43 adding: *484* *43* *Val* *C* *C* *173.495* *.* *1* old residue 43 adding: *485* *43* *Val* *CA* *C* *60.383* *.* *1* old residue 43 adding: *486* *43* *Val* *CB* *C* *35.320* *.* *1* old residue 43 adding: *487* *43* *Val* *CG1* *C* *20.962* *.* *1* old residue 43 adding: *488* *43* *Val* *CG2* *C* *23.290* *.* *1* old residue 43 adding: *489* *43* *Val* *N* *N* *119.116* *.* *1* new residue 44 adding: *490* *44* *Tyr* *H* *H* *9.581* *.* *1* old residue 44 adding: *491* *44* *Tyr* *HA* *H* *5.057* *.* *1* old residue 44 adding: *492* *44* *Tyr* *HB2* *H* *2.883* *.* *2* old residue 44 adding: *493* *44* *Tyr* *HB3* *H* *2.335* *.* *2* old residue 44 adding: *494* *44* *Tyr* *HD1* *H* *6.703* *.* *3* old residue 44 adding: *495* *44* *Tyr* *HD2* *H* *6.703* *.* *3* old residue 44 adding: *496* *44* *Tyr* *HE1* *H* *6.732* *.* *3* old residue 44 adding: *497* *44* *Tyr* *HE2* *H* *6.732* *.* *3* old residue 44 adding: *498* *44* *Tyr* *C* *C* *174.783* *.* *1* old residue 44 adding: *499* *44* *Tyr* *CA* *C* *55.778* *.* *1* old residue 44 adding: *500* *44* *Tyr* *CB* *C* *42.364* *.* *1* old residue 44 adding: *501* *44* *Tyr* *CD1* *C* *132.814* *.* *3* old residue 44 adding: *502* *44* *Tyr* *CD2* *C* *132.814* *.* *3* old residue 44 adding: *503* *44* *Tyr* *CE1* *C* *118.702* *.* *3* old residue 44 adding: *504* *44* *Tyr* *CE2* *C* *118.702* *.* *3* old residue 44 adding: *505* *44* *Tyr* *N* *N* *127.172* *.* *1* new residue 45 adding: *506* *45* *Ile* *H* *H* *8.410* *.* *1* old residue 45 adding: *507* *45* *Ile* *HA* *H* *4.418* *.* *1* old residue 45 adding: *508* *45* *Ile* *HB* *H* *1.422* *.* *1* old residue 45 adding: *509* *45* *Ile* *HG12* *H* *0.677* *.* *2* old residue 45 adding: *510* *45* *Ile* *HG13* *H* *0.168* *.* *2* old residue 45 adding: *511* *45* *Ile* *HG2* *H* *0.370* *.* *1* old residue 45 adding: *512* *45* *Ile* *HD1* *H* *-1.066* *.* *1* old residue 45 adding: *513* *45* *Ile* *C* *C* *176.667* *.* *1* old residue 45 adding: *514* *45* *Ile* *CA* *C* *61.220* *.* *1* old residue 45 adding: *515* *45* *Ile* *CB* *C* *38.830* *.* *1* old residue 45 adding: *516* *45* *Ile* *CG1* *C* *26.910* *.* *1* old residue 45 adding: *517* *45* *Ile* *CG2* *C* *16.769* *.* *1* old residue 45 adding: *518* *45* *Ile* *CD1* *C* *10.014* *.* *1* old residue 45 adding: *519* *45* *Ile* *N* *N* *118.408* *.* *1* new residue 46 adding: *520* *46* *Asn* *H* *H* *9.745* *.* *1* old residue 46 adding: *521* *46* *Asn* *HA* *H* *4.542* *.* *1* old residue 46 adding: *522* *46* *Asn* *HB2* *H* *3.355* *.* *2* old residue 46 adding: *523* *46* *Asn* *HB3* *H* *2.957* *.* *2* old residue 46 adding: *524* *46* *Asn* *HD21* *H* *7.800* *.* *1* old residue 46 adding: *525* *46* *Asn* *HD22* *H* *6.160* *.* *1* old residue 46 adding: *526* *46* *Asn* *C* *C* *175.978* *.* *1* old residue 46 adding: *527* *46* *Asn* *CA* *C* *53.814* *.* *1* old residue 46 adding: *528* *46* *Asn* *CB* *C* *36.563* *.* *1* old residue 46 adding: *529* *46* *Asn* *CG* *C* *176.947* *.* *1* old residue 46 adding: *530* *46* *Asn* *N* *N* *129.504* *.* *1* old residue 46 adding: *531* *46* *Asn* *ND2* *N* *111.852* *.* *1* new residue 47 adding: *532* *47* *Gly* *H* *H* *9.255* *.* *1* old residue 47 adding: *533* *47* *Gly* *HA2* *H* *4.192* *.* *2* old residue 47 adding: *534* *47* *Gly* *HA3* *H* *3.548* *.* *2* old residue 47 adding: *535* *47* *Gly* *C* *C* *173.986* *.* *1* old residue 47 adding: *536* *47* *Gly* *CA* *C* *45.471* *.* *1* old residue 47 adding: *537* *47* *Gly* *N* *N* *103.190* *.* *1* new residue 48 adding: *538* *48* *Thr* *H* *H* *7.939* *.* *1* old residue 48 adding: *539* *48* *Thr* *HA* *H* *4.614* *.* *1* old residue 48 adding: *540* *48* *Thr* *HB* *H* *4.191* *.* *1* old residue 48 adding: *541* *48* *Thr* *HG2* *H* *1.335* *.* *1* old residue 48 adding: *542* *48* *Thr* *C* *C* *174.591* *.* *1* old residue 48 adding: *543* *48* *Thr* *CA* *C* *61.965* *.* *1* old residue 48 adding: *544* *48* *Thr* *CB* *C* *70.086* *.* *1* old residue 48 adding: *545* *48* *Thr* *CG2* *C* *22.041* *.* *1* old residue 48 adding: *546* *48* *Thr* *N* *N* *118.684* *.* *1* new residue 49 adding: *547* *49* *Leu* *H* *H* *9.246* *.* *1* old residue 49 adding: *548* *49* *Leu* *HA* *H* *3.579* *.* *1* old residue 49 adding: *549* *49* *Leu* *HB2* *H* *1.705* *.* *2* old residue 49 adding: *550* *49* *Leu* *HB3* *H* *1.339* *.* *2* old residue 49 adding: *551* *49* *Leu* *HG* *H* *1.115* *.* *1* old residue 49 adding: *552* *49* *Leu* *HD1* *H* *0.299* *.* *1* old residue 49 adding: *553* *49* *Leu* *HD2* *H* *0.717* *.* *1* old residue 49 adding: *554* *49* *Leu* *C* *C* *174.902* *.* *1* old residue 49 adding: *555* *49* *Leu* *CA* *C* *57.480* *.* *1* old residue 49 adding: *556* *49* *Leu* *CB* *C* *41.012* *.* *1* old residue 49 adding: *557* *49* *Leu* *CG* *C* *26.560* *.* *1* old residue 49 adding: *558* *49* *Leu* *CD1* *C* *22.710* *.* *1* old residue 49 adding: *559* *49* *Leu* *CD2* *C* *26.096* *.* *1* old residue 49 adding: *560* *49* *Leu* *N* *N* *131.569* *.* *1* new residue 50 adding: *561* *50* *Tyr* *H* *H* *9.655* *.* *1* old residue 50 adding: *562* *50* *Tyr* *HA* *H* *4.607* *.* *1* old residue 50 adding: *563* *50* *Tyr* *HB2* *H* *2.851* *.* *2* old residue 50 adding: *564* *50* *Tyr* *HB3* *H* *2.227* *.* *2* old residue 50 adding: *565* *50* *Tyr* *HD1* *H* *6.703* *.* *3* old residue 50 adding: *566* *50* *Tyr* *HD2* *H* *6.703* *.* *3* old residue 50 adding: *567* *50* *Tyr* *HE1* *H* *7.050* *.* *3* old residue 50 adding: *568* *50* *Tyr* *HE2* *H* *7.050* *.* *3* old residue 50 adding: *569* *50* *Tyr* *C* *C* *174.719* *.* *1* old residue 50 adding: *570* *50* *Tyr* *CA* *C* *58.967* *.* *1* old residue 50 adding: *571* *50* *Tyr* *CB* *C* *42.483* *.* *1* old residue 50 adding: *572* *50* *Tyr* *CD1* *C* *132.814* *.* *3* old residue 50 adding: *573* *50* *Tyr* *CD2* *C* *132.814* *.* *3* old residue 50 adding: *574* *50* *Tyr* *CE1* *C* *117.851* *.* *3* old residue 50 adding: *575* *50* *Tyr* *CE2* *C* *117.851* *.* *3* old residue 50 adding: *576* *50* *Tyr* *N* *N* *130.369* *.* *1* new residue 51 adding: *577* *51* *Lys* *H* *H* *7.369* *.* *1* old residue 51 adding: *578* *51* *Lys* *HA* *H* *4.078* *.* *1* old residue 51 adding: *579* *51* *Lys* *HB2* *H* *0.822* *.* *2* old residue 51 adding: *580* *51* *Lys* *HB3* *H* *0.387* *.* *2* old residue 51 adding: *581* *51* *Lys* *HG2* *H* *0.596* *.* *2* old residue 51 adding: *582* *51* *Lys* *HG3* *H* *0.325* *.* *2* old residue 51 adding: *583* *51* *Lys* *HD2* *H* *1.365* *.* *2* old residue 51 adding: *584* *51* *Lys* *HD3* *H* *1.365* *.* *2* old residue 51 adding: *585* *51* *Lys* *HE2* *H* *2.693* *.* *2* old residue 51 adding: *586* *51* *Lys* *HE3* *H* *2.561* *.* *2* old residue 51 adding: *587* *51* *Lys* *C* *C* *173.058* *.* *1* old residue 51 adding: *588* *51* *Lys* *CA* *C* *54.126* *.* *1* old residue 51 adding: *589* *51* *Lys* *CB* *C* *37.004* *.* *1* old residue 51 adding: *590* *51* *Lys* *CG* *C* *24.122* *.* *1* old residue 51 adding: *591* *51* *Lys* *CD* *C* *28.611* *.* *1* old residue 51 adding: *592* *51* *Lys* *CE* *C* *42.143* *.* *1* old residue 51 adding: *593* *51* *Lys* *N* *N* *116.050* *.* *1* new residue 52 adding: *594* *52* *Asn* *H* *H* *7.487* *.* *1* old residue 52 adding: *595* *52* *Asn* *HA* *H* *5.339* *.* *1* old residue 52 adding: *596* *52* *Asn* *HB2* *H* *2.510* *.* *2* old residue 52 adding: *597* *52* *Asn* *HB3* *H* *2.510* *.* *2* old residue 52 adding: *598* *52* *Asn* *HD21* *H* *6.979* *.* *1* old residue 52 adding: *599* *52* *Asn* *HD22* *H* *6.532* *.* *1* old residue 52 adding: *600* *52* *Asn* *C* *C* *172.841* *.* *1* old residue 52 adding: *601* *52* *Asn* *CA* *C* *52.384* *.* *1* old residue 52 adding: *602* *52* *Asn* *CB* *C* *42.844* *.* *1* old residue 52 adding: *603* *52* *Asn* *CG* *C* *175.721* *.* *1* old residue 52 adding: *604* *52* *Asn* *N* *N* *116.740* *.* *1* old residue 52 adding: *605* *52* *Asn* *ND2* *N* *112.168* *.* *1* new residue 53 adding: *606* *53* *Trp* *H* *H* *9.430* *.* *1* old residue 53 adding: *607* *53* *Trp* *HA* *H* *5.014* *.* *1* old residue 53 adding: *608* *53* *Trp* *HB2* *H* *3.247* *.* *2* old residue 53 adding: *609* *53* *Trp* *HB3* *H* *2.802* *.* *2* old residue 53 adding: *610* *53* *Trp* *HD1* *H* *7.422* *.* *1* old residue 53 adding: *611* *53* *Trp* *HE1* *H* *10.477* *.* *1* old residue 53 adding: *612* *53* *Trp* *HE3* *H* *7.359* *.* *1* old residue 53 adding: *613* *53* *Trp* *HZ2* *H* *7.553* *.* *1* old residue 53 adding: *614* *53* *Trp* *HZ3* *H* *6.569* *.* *1* old residue 53 adding: *615* *53* *Trp* *HH2* *H* *6.693* *.* *1* old residue 53 adding: *616* *53* *Trp* *C* *C* *175.677* *.* *1* old residue 53 adding: *617* *53* *Trp* *CA* *C* *58.102* *.* *1* old residue 53 adding: *618* *53* *Trp* *CB* *C* *34.864* *.* *1* old residue 53 adding: *619* *53* *Trp* *CD1* *C* *128.051* *.* *1* old residue 53 adding: *620* *53* *Trp* *CE3* *C* *120.743* *.* *1* old residue 53 adding: *621* *53* *Trp* *CZ2* *C* *114.558* *.* *1* old residue 53 adding: *622* *53* *Trp* *CZ3* *C* *120.846* *.* *1* old residue 53 adding: *623* *53* *Trp* *CH2* *C* *122.582* *.* *1* old residue 53 adding: *624* *53* *Trp* *N* *N* *120.779* *.* *1* old residue 53 adding: *625* *53* *Trp* *NE1* *N* *129.726* *.* *1* new residue 54 adding: *626* *54* *Thr* *H* *H* *8.902* *.* *1* old residue 54 adding: *627* *54* *Thr* *HA* *H* *5.130* *.* *1* old residue 54 adding: *628* *54* *Thr* *HB* *H* *4.024* *.* *1* old residue 54 adding: *629* *54* *Thr* *HG2* *H* *1.150* *.* *1* old residue 54 adding: *630* *54* *Thr* *C* *C* *174.481* *.* *1* old residue 54 adding: *631* *54* *Thr* *CA* *C* *62.656* *.* *1* old residue 54 adding: *632* *54* *Thr* *CB* *C* *69.780* *.* *1* old residue 54 adding: *633* *54* *Thr* *CG2* *C* *21.759* *.* *1* old residue 54 adding: *634* *54* *Thr* *N* *N* *120.049* *.* *1* new residue 55 adding: *635* *55* *Val* *H* *H* *9.045* *.* *1* old residue 55 adding: *636* *55* *Val* *HA* *H* *4.901* *.* *1* old residue 55 adding: *637* *55* *Val* *HB* *H* *1.970* *.* *1* old residue 55 adding: *638* *55* *Val* *HG1* *H* *0.814* *.* *1* old residue 55 adding: *639* *55* *Val* *HG2* *H* *0.620* *.* *1* old residue 55 adding: *640* *55* *Val* *C* *C* *173.044* *.* *1* old residue 55 adding: *641* *55* *Val* *CA* *C* *59.043* *.* *1* old residue 55 adding: *642* *55* *Val* *CB* *C* *36.213* *.* *1* old residue 55 adding: *643* *55* *Val* *CG1* *C* *22.168* *.* *1* old residue 55 adding: *644* *55* *Val* *CG2* *C* *19.586* *.* *1* old residue 55 adding: *645* *55* *Val* *N* *N* *119.888* *.* *1* new residue 56 adding: *646* *56* *Ser* *H* *H* *8.089* *.* *1* old residue 56 adding: *647* *56* *Ser* *HA* *H* *4.664* *.* *1* old residue 56 adding: *648* *56* *Ser* *HB2* *H* *3.779* *.* *2* old residue 56 adding: *649* *56* *Ser* *HB3* *H* *3.779* *.* *2* old residue 56 adding: *650* *56* *Ser* *C* *C* *174.435* *.* *1* old residue 56 adding: *651* *56* *Ser* *CA* *C* *56.069* *.* *1* old residue 56 adding: *652* *56* *Ser* *CB* *C* *65.818* *.* *1* old residue 56 adding: *653* *56* *Ser* *N* *N* *115.648* *.* *1* new residue 57 adding: *654* *57* *Leu* *H* *H* *8.433* *.* *1* old residue 57 adding: *655* *57* *Leu* *HA* *H* *4.860* *.* *1* old residue 57 adding: *656* *57* *Leu* *HB2* *H* *1.644* *.* *2* old residue 57 adding: *657* *57* *Leu* *HB3* *H* *1.400* *.* *2* old residue 57 adding: *658* *57* *Leu* *HG* *H* *1.406* *.* *1* old residue 57 adding: *659* *57* *Leu* *HD1* *H* *0.670* *.* *1* old residue 57 adding: *660* *57* *Leu* *HD2* *H* *0.716* *.* *1* old residue 57 adding: *661* *57* *Leu* *C* *C* *176.215* *.* *1* old residue 57 adding: *662* *57* *Leu* *CA* *C* *53.578* *.* *1* old residue 57 adding: *663* *57* *Leu* *CB* *C* *47.794* *.* *1* old residue 57 adding: *664* *57* *Leu* *CG* *C* *27.264* *.* *1* old residue 57 adding: *665* *57* *Leu* *CD1* *C* *26.678* *.* *1* old residue 57 adding: *666* *57* *Leu* *CD2* *C* *24.676* *.* *1* old residue 57 adding: *667* *57* *Leu* *N* *N* *122.922* *.* *1* new residue 58 adding: *668* *58* *Gly* *H* *H* *9.873* *.* *1* old residue 58 adding: *669* *58* *Gly* *HA2* *H* *4.290* *.* *2* old residue 58 adding: *670* *58* *Gly* *HA3* *H* *3.796* *.* *2* old residue 58 adding: *671* *58* *Gly* *CA* *C* *44.508* *.* *1* old residue 58 adding: *672* *58* *Gly* *N* *N* *114.634* *.* *1* new residue 59 adding: *673* *59* *Pro* *HA* *H* *3.919* *.* *1* old residue 59 adding: *674* *59* *Pro* *HB2* *H* *1.897* *.* *2* old residue 59 adding: *675* *59* *Pro* *HB3* *H* *1.777* *.* *2* old residue 59 adding: *676* *59* *Pro* *HG2* *H* *2.120* *.* *2* old residue 59 adding: *677* *59* *Pro* *HG3* *H* *1.654* *.* *2* old residue 59 adding: *678* *59* *Pro* *HD2* *H* *3.567* *.* *2* old residue 59 adding: *679* *59* *Pro* *HD3* *H* *3.360* *.* *2* old residue 59 adding: *680* *59* *Pro* *C* *C* *177.333* *.* *1* old residue 59 adding: *681* *59* *Pro* *CA* *C* *63.833* *.* *1* old residue 59 adding: *682* *59* *Pro* *CB* *C* *31.693* *.* *1* old residue 59 adding: *683* *59* *Pro* *CG* *C* *27.840* *.* *1* old residue 59 adding: *684* *59* *Pro* *CD* *C* *49.366* *.* *1* new residue 60 adding: *685* *60* *Lys* *H* *H* *7.945* *.* *1* old residue 60 adding: *686* *60* *Lys* *HA* *H* *4.337* *.* *1* old residue 60 adding: *687* *60* *Lys* *HB2* *H* *2.003* *.* *2* old residue 60 adding: *688* *60* *Lys* *HB3* *H* *1.951* *.* *2* old residue 60 adding: *689* *60* *Lys* *HG2* *H* *1.363* *.* *2* old residue 60 adding: *690* *60* *Lys* *HG3* *H* *1.130* *.* *2* old residue 60 adding: *691* *60* *Lys* *HD2* *H* *1.545* *.* *2* old residue 60 adding: *692* *60* *Lys* *HD3* *H* *1.545* *.* *2* old residue 60 adding: *693* *60* *Lys* *HE2* *H* *2.869* *.* *2* old residue 60 adding: *694* *60* *Lys* *HE3* *H* *2.869* *.* *2* old residue 60 adding: *695* *60* *Lys* *C* *C* *175.413* *.* *1* old residue 60 adding: *696* *60* *Lys* *CA* *C* *57.274* *.* *1* old residue 60 adding: *697* *60* *Lys* *CB* *C* *29.346* *.* *1* old residue 60 adding: *698* *60* *Lys* *CG* *C* *25.085* *.* *1* old residue 60 adding: *699* *60* *Lys* *CD* *C* *28.554* *.* *1* old residue 60 adding: *700* *60* *Lys* *CE* *C* *42.455* *.* *1* old residue 60 adding: *701* *60* *Lys* *N* *N* *119.243* *.* *1* new residue 61 adding: *702* *61* *Glu* *H* *H* *7.600* *.* *1* old residue 61 adding: *703* *61* *Glu* *HA* *H* *4.344* *.* *1* old residue 61 adding: *704* *61* *Glu* *HB2* *H* *1.950* *.* *2* old residue 61 adding: *705* *61* *Glu* *HB3* *H* *1.664* *.* *2* old residue 61 adding: *706* *61* *Glu* *HG2* *H* *2.361* *.* *2* old residue 61 adding: *707* *61* *Glu* *HG3* *H* *2.115* *.* *2* old residue 61 adding: *708* *61* *Glu* *C* *C* *174.063* *.* *1* old residue 61 adding: *709* *61* *Glu* *CA* *C* *56.685* *.* *1* old residue 61 adding: *710* *61* *Glu* *CB* *C* *31.845* *.* *1* old residue 61 adding: *711* *61* *Glu* *CG* *C* *37.270* *.* *1* old residue 61 adding: *712* *61* *Glu* *N* *N* *121.045* *.* *1* new residue 62 adding: *713* *62* *Glu* *H* *H* *8.353* *.* *1* old residue 62 adding: *714* *62* *Glu* *HA* *H* *5.242* *.* *1* old residue 62 adding: *715* *62* *Glu* *HB2* *H* *1.921* *.* *2* old residue 62 adding: *716* *62* *Glu* *HB3* *H* *1.818* *.* *2* old residue 62 adding: *717* *62* *Glu* *HG2* *H* *2.014* *.* *2* old residue 62 adding: *718* *62* *Glu* *HG3* *H* *1.917* *.* *2* old residue 62 adding: *719* *62* *Glu* *C* *C* *175.353* *.* *1* old residue 62 adding: *720* *62* *Glu* *CA* *C* *53.900* *.* *1* old residue 62 adding: *721* *62* *Glu* *CB* *C* *33.032* *.* *1* old residue 62 adding: *722* *62* *Glu* *CG* *C* *36.355* *.* *1* old residue 62 adding: *723* *62* *Glu* *N* *N* *124.052* *.* *1* new residue 63 adding: *724* *63* *Lys* *H* *H* *9.226* *.* *1* old residue 63 adding: *725* *63* *Lys* *HA* *H* *4.597* *.* *1* old residue 63 adding: *726* *63* *Lys* *HB2* *H* *1.601* *.* *2* old residue 63 adding: *727* *63* *Lys* *HB3* *H* *1.330* *.* *2* old residue 63 adding: *728* *63* *Lys* *HG2* *H* *1.316* *.* *2* old residue 63 adding: *729* *63* *Lys* *HG3* *H* *1.316* *.* *2* old residue 63 adding: *730* *63* *Lys* *HD2* *H* *1.600* *.* *2* old residue 63 adding: *731* *63* *Lys* *HD3* *H* *1.560* *.* *2* old residue 63 adding: *732* *63* *Lys* *HE2* *H* *3.070* *.* *2* old residue 63 adding: *733* *63* *Lys* *HE3* *H* *3.033* *.* *2* old residue 63 adding: *734* *63* *Lys* *C* *C* *174.074* *.* *1* old residue 63 adding: *735* *63* *Lys* *CA* *C* *55.214* *.* *1* old residue 63 adding: *736* *63* *Lys* *CB* *C* *37.305* *.* *1* old residue 63 adding: *737* *63* *Lys* *CG* *C* *26.648* *.* *1* old residue 63 adding: *738* *63* *Lys* *CD* *C* *29.113* *.* *1* old residue 63 adding: *739* *63* *Lys* *CE* *C* *42.592* *.* *1* old residue 63 adding: *740* *63* *Lys* *N* *N* *125.754* *.* *1* new residue 64 adding: *741* *64* *Val* *H* *H* *8.476* *.* *1* old residue 64 adding: *742* *64* *Val* *HA* *H* *4.175* *.* *1* old residue 64 adding: *743* *64* *Val* *HB* *H* *1.692* *.* *1* old residue 64 adding: *744* *64* *Val* *HG1* *H* *0.291* *.* *1* old residue 64 adding: *745* *64* *Val* *HG2* *H* *0.233* *.* *1* old residue 64 adding: *746* *64* *Val* *C* *C* *174.797* *.* *1* old residue 64 adding: *747* *64* *Val* *CA* *C* *61.759* *.* *1* old residue 64 adding: *748* *64* *Val* *CB* *C* *32.024* *.* *1* old residue 64 adding: *749* *64* *Val* *CG1* *C* *20.906* *.* *1* old residue 64 adding: *750* *64* *Val* *CG2* *C* *20.703* *.* *1* old residue 64 adding: *751* *64* *Val* *N* *N* *122.489* *.* *1* new residue 65 adding: *752* *65* *Leu* *H* *H* *8.815* *.* *1* old residue 65 adding: *753* *65* *Leu* *HA* *H* *4.466* *.* *1* old residue 65 adding: *754* *65* *Leu* *HB2* *H* *0.774* *.* *2* old residue 65 adding: *755* *65* *Leu* *HB3* *H* *-0.111* *.* *2* old residue 65 adding: *756* *65* *Leu* *HG* *H* *0.960* *.* *1* old residue 65 adding: *757* *65* *Leu* *HD1* *H* *-0.075* *.* *1* old residue 65 adding: *758* *65* *Leu* *HD2* *H* *0.170* *.* *1* old residue 65 adding: *759* *65* *Leu* *C* *C* *176.014* *.* *1* old residue 65 adding: *760* *65* *Leu* *CA* *C* *52.528* *.* *1* old residue 65 adding: *761* *65* *Leu* *CB* *C* *41.644* *.* *1* old residue 65 adding: *762* *65* *Leu* *CG* *C* *25.898* *.* *1* old residue 65 adding: *763* *65* *Leu* *CD1* *C* *24.476* *.* *1* old residue 65 adding: *764* *65* *Leu* *CD2* *C* *21.991* *.* *1* old residue 65 adding: *765* *65* *Leu* *N* *N* *131.096* *.* *1* new residue 66 adding: *766* *66* *Thr* *H* *H* *8.373* *.* *1* old residue 66 adding: *767* *66* *Thr* *HA* *H* *5.446* *.* *1* old residue 66 adding: *768* *66* *Thr* *HB* *H* *4.252* *.* *1* old residue 66 adding: *769* *66* *Thr* *HG2* *H* *1.102* *.* *1* old residue 66 adding: *770* *66* *Thr* *C* *C* *174.567* *.* *1* old residue 66 adding: *771* *66* *Thr* *CA* *C* *60.271* *.* *1* old residue 66 adding: *772* *66* *Thr* *CB* *C* *71.340* *.* *1* old residue 66 adding: *773* *66* *Thr* *CG2* *C* *21.805* *.* *1* old residue 66 adding: *774* *66* *Thr* *N* *N* *113.604* *.* *1* new residue 67 adding: *775* *67* *Phe* *H* *H* *8.680* *.* *1* old residue 67 adding: *776* *67* *Phe* *HA* *H* *5.341* *.* *1* old residue 67 adding: *777* *67* *Phe* *HB2* *H* *3.479* *.* *2* old residue 67 adding: *778* *67* *Phe* *HB3* *H* *3.385* *.* *2* old residue 67 adding: *779* *67* *Phe* *HD1* *H* *7.274* *.* *3* old residue 67 adding: *780* *67* *Phe* *HD2* *H* *7.274* *.* *3* old residue 67 adding: *781* *67* *Phe* *HE1* *H* *6.767* *.* *3* old residue 67 adding: *782* *67* *Phe* *HE2* *H* *6.767* *.* *3* old residue 67 adding: *783* *67* *Phe* *HZ* *H* *6.549* *.* *1* old residue 67 adding: *784* *67* *Phe* *C* *C* *171.534* *.* *1* old residue 67 adding: *785* *67* *Phe* *CA* *C* *56.742* *.* *1* old residue 67 adding: *786* *67* *Phe* *CB* *C* *42.486* *.* *1* old residue 67 adding: *787* *67* *Phe* *CD1* *C* *132.238* *.* *3* old residue 67 adding: *788* *67* *Phe* *CD2* *C* *132.238* *.* *3* old residue 67 adding: *789* *67* *Phe* *CE1* *C* *130.820* *.* *3* old residue 67 adding: *790* *67* *Phe* *CE2* *C* *130.820* *.* *3* old residue 67 adding: *791* *67* *Phe* *CZ* *C* *129.788* *.* *1* old residue 67 adding: *792* *67* *Phe* *N* *N* *116.946* *.* *1* new residue 68 adding: *793* *68* *Ser* *H* *H* *9.063* *.* *1* old residue 68 adding: *794* *68* *Ser* *HA* *H* *5.884* *.* *1* old residue 68 adding: *795* *68* *Ser* *HB2* *H* *3.922* *.* *2* old residue 68 adding: *796* *68* *Ser* *HB3* *H* *3.941* *.* *2* old residue 68 adding: *797* *68* *Ser* *C* *C* *174.260* *.* *1* old residue 68 adding: *798* *68* *Ser* *CA* *C* *56.269* *.* *1* old residue 68 adding: *799* *68* *Ser* *CB* *C* *66.454* *.* *1* old residue 68 adding: *800* *68* *Ser* *N* *N* *115.447* *.* *1* new residue 69 adding: *801* *69* *Trp* *H* *H* *9.641* *.* *1* old residue 69 adding: *802* *69* *Trp* *HA* *H* *5.004* *.* *1* old residue 69 adding: *803* *69* *Trp* *HB2* *H* *3.217* *.* *2* old residue 69 adding: *804* *69* *Trp* *HB3* *H* *3.095* *.* *2* old residue 69 adding: *805* *69* *Trp* *HD1* *H* *6.971* *.* *1* old residue 69 adding: *806* *69* *Trp* *HE1* *H* *9.855* *.* *1* old residue 69 adding: *807* *69* *Trp* *HE3* *H* *7.406* *.* *1* old residue 69 adding: *808* *69* *Trp* *HZ2* *H* *6.328* *.* *1* old residue 69 adding: *809* *69* *Trp* *HZ3* *H* *6.751* *.* *1* old residue 69 adding: *810* *69* *Trp* *HH2* *H* *5.946* *.* *1* old residue 69 adding: *811* *69* *Trp* *C* *C* *172.755* *.* *1* old residue 69 adding: *812* *69* *Trp* *CA* *C* *57.366* *.* *1* old residue 69 adding: *813* *69* *Trp* *CB* *C* *31.998* *.* *1* old residue 69 adding: *814* *69* *Trp* *CD1* *C* *125.724* *.* *1* old residue 69 adding: *815* *69* *Trp* *CE3* *C* *119.664* *.* *1* old residue 69 adding: *816* *69* *Trp* *CZ2* *C* *113.280* *.* *1* old residue 69 adding: *817* *69* *Trp* *CZ3* *C* *120.677* *.* *1* old residue 69 adding: *818* *69* *Trp* *CH2* *C* *123.627* *.* *1* old residue 69 adding: *819* *69* *Trp* *N* *N* *127.663* *.* *1* new residue 70 adding: *820* *70* *Thr* *H* *H* *7.923* *.* *1* old residue 70 adding: *821* *70* *Thr* *HA* *H* *4.934* *.* *1* old residue 70 adding: *822* *70* *Thr* *HB* *H* *3.813* *.* *1* old residue 70 adding: *823* *70* *Thr* *HG2* *H* *0.673* *.* *1* old residue 70 adding: *824* *70* *Thr* *CA* *C* *57.926* *.* *1* old residue 70 adding: *825* *70* *Thr* *CB* *C* *69.883* *.* *1* old residue 70 adding: *826* *70* *Thr* *CG2* *C* *19.865* *.* *1* old residue 70 adding: *827* *70* *Thr* *N* *N* *124.513* *.* *1* new residue 71 adding: *828* *71* *Pro* *HA* *H* *3.910* *.* *1* old residue 71 adding: *829* *71* *Pro* *HB2* *H* *1.258* *.* *2* old residue 71 adding: *830* *71* *Pro* *HB3* *H* *1.130* *.* *2* old residue 71 adding: *831* *71* *Pro* *HG2* *H* *1.520* *.* *2* old residue 71 adding: *832* *71* *Pro* *HG3* *H* *0.593* *.* *2* old residue 71 adding: *833* *71* *Pro* *HD2* *H* *4.004* *.* *2* old residue 71 adding: *834* *71* *Pro* *HD3* *H* *1.965* *.* *2* old residue 71 adding: *835* *71* *Pro* *C* *C* *177.885* *.* *1* old residue 71 adding: *836* *71* *Pro* *CA* *C* *61.314* *.* *1* old residue 71 adding: *837* *71* *Pro* *CB* *C* *32.974* *.* *1* old residue 71 adding: *838* *71* *Pro* *CG* *C* *26.753* *.* *1* old residue 71 adding: *839* *71* *Pro* *CD* *C* *49.606* *.* *1* new residue 72 adding: *840* *72* *Thr* *H* *H* *8.426* *.* *1* old residue 72 adding: *841* *72* *Thr* *HA* *H* *4.452* *.* *1* old residue 72 adding: *842* *72* *Thr* *HB* *H* *4.497* *.* *1* old residue 72 adding: *843* *72* *Thr* *HG2* *H* *1.146* *.* *1* old residue 72 adding: *844* *72* *Thr* *C* *C* *174.271* *.* *1* old residue 72 adding: *845* *72* *Thr* *CA* *C* *61.201* *.* *1* old residue 72 adding: *846* *72* *Thr* *CB* *C* *69.843* *.* *1* old residue 72 adding: *847* *72* *Thr* *CG2* *C* *21.552* *.* *1* old residue 72 adding: *848* *72* *Thr* *N* *N* *108.519* *.* *1* new residue 73 adding: *849* *73* *Gln* *H* *H* *7.108* *.* *1* old residue 73 adding: *850* *73* *Gln* *HA* *H* *4.627* *.* *1* old residue 73 adding: *851* *73* *Gln* *HB2* *H* *2.066* *.* *2* old residue 73 adding: *852* *73* *Gln* *HB3* *H* *1.998* *.* *2* old residue 73 adding: *853* *73* *Gln* *HG2* *H* *2.500* *.* *2* old residue 73 adding: *854* *73* *Gln* *HG3* *H* *2.445* *.* *2* old residue 73 adding: *855* *73* *Gln* *HE21* *H* *7.614* *.* *1* old residue 73 adding: *856* *73* *Gln* *HE22* *H* *6.898* *.* *1* old residue 73 adding: *857* *73* *Gln* *C* *C* *175.445* *.* *1* old residue 73 adding: *858* *73* *Gln* *CA* *C* *54.625* *.* *1* old residue 73 adding: *859* *73* *Gln* *CB* *C* *32.427* *.* *1* old residue 73 adding: *860* *73* *Gln* *CG* *C* *33.509* *.* *1* old residue 73 adding: *861* *73* *Gln* *CD* *C* *180.686* *.* *1* old residue 73 adding: *862* *73* *Gln* *N* *N* *118.466* *.* *1* old residue 73 adding: *863* *73* *Gln* *NE2* *N* *112.464* *.* *1* new residue 74 adding: *864* *74* *Glu* *H* *H* *9.707* *.* *1* old residue 74 adding: *865* *74* *Glu* *HA* *H* *3.983* *.* *1* old residue 74 adding: *866* *74* *Glu* *HB2* *H* *2.083* *.* *2* old residue 74 adding: *867* *74* *Glu* *HB3* *H* *2.039* *.* *2* old residue 74 adding: *868* *74* *Glu* *HG2* *H* *2.277* *.* *2* old residue 74 adding: *869* *74* *Glu* *HG3* *H* *2.189* *.* *2* old residue 74 adding: *870* *74* *Glu* *C* *C* *175.084* *.* *1* old residue 74 adding: *871* *74* *Glu* *CA* *C* *57.217* *.* *1* old residue 74 adding: *872* *74* *Glu* *CB* *C* *30.502* *.* *1* old residue 74 adding: *873* *74* *Glu* *CG* *C* *36.368* *.* *1* old residue 74 adding: *874* *74* *Glu* *N* *N* *127.003* *.* *1* new residue 75 adding: *875* *75* *Gly* *H* *H* *8.735* *.* *1* old residue 75 adding: *876* *75* *Gly* *HA2* *H* *4.460* *.* *2* old residue 75 adding: *877* *75* *Gly* *HA3* *H* *3.906* *.* *2* old residue 75 adding: *878* *75* *Gly* *C* *C* *171.365* *.* *1* old residue 75 adding: *879* *75* *Gly* *CA* *C* *44.543* *.* *1* old residue 75 adding: *880* *75* *Gly* *N* *N* *109.437* *.* *1* new residue 76 adding: *881* *76* *Met* *H* *H* *8.263* *.* *1* old residue 76 adding: *882* *76* *Met* *HA* *H* *5.540* *.* *1* old residue 76 adding: *883* *76* *Met* *HB2* *H* *2.005* *.* *2* old residue 76 adding: *884* *76* *Met* *HB3* *H* *1.932* *.* *2* old residue 76 adding: *885* *76* *Met* *HG2* *H* *2.609* *.* *2* old residue 76 adding: *886* *76* *Met* *HG3* *H* *2.531* *.* *2* old residue 76 adding: *887* *76* *Met* *HE* *H* *1.988* *.* *1* old residue 76 adding: *888* *76* *Met* *C* *C* *177.035* *.* *1* old residue 76 adding: *889* *76* *Met* *CA* *C* *53.774* *.* *1* old residue 76 adding: *890* *76* *Met* *CB* *C* *32.227* *.* *1* old residue 76 adding: *891* *76* *Met* *CG* *C* *31.748* *.* *1* old residue 76 adding: *892* *76* *Met* *CE* *C* *15.950* *.* *1* old residue 76 adding: *893* *76* *Met* *N* *N* *118.471* *.* *1* new residue 77 adding: *894* *77* *Tyr* *H* *H* *9.685* *.* *1* old residue 77 adding: *895* *77* *Tyr* *HA* *H* *4.973* *.* *1* old residue 77 adding: *896* *77* *Tyr* *HB2* *H* *2.933* *.* *2* old residue 77 adding: *897* *77* *Tyr* *HB3* *H* *2.455* *.* *2* old residue 77 adding: *898* *77* *Tyr* *HD1* *H* *7.174* *.* *3* old residue 77 adding: *899* *77* *Tyr* *HD2* *H* *7.174* *.* *3* old residue 77 adding: *900* *77* *Tyr* *HE1* *H* *6.915* *.* *3* old residue 77 adding: *901* *77* *Tyr* *HE2* *H* *6.915* *.* *3* old residue 77 adding: *902* *77* *Tyr* *C* *C* *173.692* *.* *1* old residue 77 adding: *903* *77* *Tyr* *CA* *C* *56.639* *.* *1* old residue 77 adding: *904* *77* *Tyr* *CB* *C* *41.785* *.* *1* old residue 77 adding: *905* *77* *Tyr* *CD1* *C* *134.743* *.* *3* old residue 77 adding: *906* *77* *Tyr* *CD2* *C* *134.743* *.* *3* old residue 77 adding: *907* *77* *Tyr* *CE1* *C* *117.366* *.* *3* old residue 77 adding: *908* *77* *Tyr* *CE2* *C* *117.366* *.* *3* old residue 77 adding: *909* *77* *Tyr* *N* *N* *124.810* *.* *1* new residue 78 adding: *910* *78* *Arg* *H* *H* *8.571* *.* *1* old residue 78 adding: *911* *78* *Arg* *HA* *H* *5.060* *.* *1* old residue 78 adding: *912* *78* *Arg* *HB2* *H* *1.862* *.* *2* old residue 78 adding: *913* *78* *Arg* *HB3* *H* *1.718* *.* *2* old residue 78 adding: *914* *78* *Arg* *HG2* *H* *1.463* *.* *2* old residue 78 adding: *915* *78* *Arg* *HG3* *H* *1.302* *.* *2* old residue 78 adding: *916* *78* *Arg* *HD2* *H* *3.139* *.* *2* old residue 78 adding: *917* *78* *Arg* *HD3* *H* *3.041* *.* *2* old residue 78 adding: *918* *78* *Arg* *HE* *H* *8.884* *.* *1* old residue 78 adding: *919* *78* *Arg* *C* *C* *175.519* *.* *1* old residue 78 adding: *920* *78* *Arg* *CA* *C* *55.062* *.* *1* old residue 78 adding: *921* *78* *Arg* *CB* *C* *31.592* *.* *1* old residue 78 adding: *922* *78* *Arg* *CG* *C* *26.514* *.* *1* old residue 78 adding: *923* *78* *Arg* *CD* *C* *43.151* *.* *1* old residue 78 adding: *924* *78* *Arg* *N* *N* *122.907* *.* *1* old residue 78 adding: *925* *78* *Arg* *NE* *N* *85.715* *.* *1* new residue 79 adding: *926* *79* *Ile* *H* *H* *9.609* *.* *1* old residue 79 adding: *927* *79* *Ile* *HA* *H* *4.901* *.* *1* old residue 79 adding: *928* *79* *Ile* *HB* *H* *1.953* *.* *1* old residue 79 adding: *929* *79* *Ile* *HG12* *H* *1.382* *.* *2* old residue 79 adding: *930* *79* *Ile* *HG13* *H* *0.344* *.* *2* old residue 79 adding: *931* *79* *Ile* *HG2* *H* *0.626* *.* *1* old residue 79 adding: *932* *79* *Ile* *HD1* *H* *-0.109* *.* *1* old residue 79 adding: *933* *79* *Ile* *C* *C* *175.428* *.* *1* old residue 79 adding: *934* *79* *Ile* *CA* *C* *60.204* *.* *1* old residue 79 adding: *935* *79* *Ile* *CB* *C* *38.506* *.* *1* old residue 79 adding: *936* *79* *Ile* *CG1* *C* *27.056* *.* *1* old residue 79 adding: *937* *79* *Ile* *CG2* *C* *17.555* *.* *1* old residue 79 adding: *938* *79* *Ile* *CD1* *C* *12.205* *.* *1* old residue 79 adding: *939* *79* *Ile* *N* *N* *132.189* *.* *1* new residue 80 adding: *940* *80* *Asn* *H* *H* *8.981* *.* *1* old residue 80 adding: *941* *80* *Asn* *HA* *H* *5.971* *.* *1* old residue 80 adding: *942* *80* *Asn* *HB2* *H* *2.579* *.* *2* old residue 80 adding: *943* *80* *Asn* *HB3* *H* *2.442* *.* *2* old residue 80 adding: *944* *80* *Asn* *HD21* *H* *6.820* *.* *1* old residue 80 adding: *945* *80* *Asn* *HD22* *H* *6.446* *.* *1* old residue 80 adding: *946* *80* *Asn* *C* *C* *173.976* *.* *1* old residue 80 adding: *947* *80* *Asn* *CA* *C* *51.715* *.* *1* old residue 80 adding: *948* *80* *Asn* *CB* *C* *43.626* *.* *1* old residue 80 adding: *949* *80* *Asn* *CG* *C* *175.717* *.* *1* old residue 80 adding: *950* *80* *Asn* *N* *N* *123.729* *.* *1* old residue 80 adding: *951* *80* *Asn* *ND2* *N* *110.594* *.* *1* new residue 81 adding: *952* *81* *Ala* *H* *H* *9.034* *.* *1* old residue 81 adding: *953* *81* *Ala* *HA* *H* *6.185* *.* *1* old residue 81 adding: *954* *81* *Ala* *HB* *H* *1.237* *.* *1* old residue 81 adding: *955* *81* *Ala* *C* *C* *175.692* *.* *1* old residue 81 adding: *956* *81* *Ala* *CA* *C* *49.681* *.* *1* old residue 81 adding: *957* *81* *Ala* *CB* *C* *22.689* *.* *1* old residue 81 adding: *958* *81* *Ala* *N* *N* *123.195* *.* *1* new residue 82 adding: *959* *82* *Thr* *H* *H* *9.642* *.* *1* old residue 82 adding: *960* *82* *Thr* *HA* *H* *5.582* *.* *1* old residue 82 adding: *961* *82* *Thr* *HB* *H* *4.447* *.* *1* old residue 82 adding: *962* *82* *Thr* *HG1* *H* *6.630* *.* *1* old residue 82 adding: *963* *82* *Thr* *HG2* *H* *1.266* *.* *1* old residue 82 adding: *964* *82* *Thr* *C* *C* *173.360* *.* *1* old residue 82 adding: *965* *82* *Thr* *CA* *C* *58.430* *.* *1* old residue 82 adding: *966* *82* *Thr* *CB* *C* *72.061* *.* *1* old residue 82 adding: *967* *82* *Thr* *CG2* *C* *22.261* *.* *1* old residue 82 adding: *968* *82* *Thr* *N* *N* *110.774* *.* *1* new residue 83 adding: *969* *83* *Val* *H* *H* *8.337* *.* *1* old residue 83 adding: *970* *83* *Val* *HA* *H* *5.352* *.* *1* old residue 83 adding: *971* *83* *Val* *HB* *H* *1.819* *.* *1* old residue 83 adding: *972* *83* *Val* *HG1* *H* *0.885* *.* *1* old residue 83 adding: *973* *83* *Val* *HG2* *H* *0.953* *.* *1* old residue 83 adding: *974* *83* *Val* *C* *C* *174.034* *.* *1* old residue 83 adding: *975* *83* *Val* *CA* *C* *58.588* *.* *1* old residue 83 adding: *976* *83* *Val* *CB* *C* *35.069* *.* *1* old residue 83 adding: *977* *83* *Val* *CG1* *C* *18.854* *.* *1* old residue 83 adding: *978* *83* *Val* *CG2* *C* *23.582* *.* *1* old residue 83 adding: *979* *83* *Val* *N* *N* *117.465* *.* *1* new residue 84 adding: *980* *84* *Asp* *H* *H* *8.669* *.* *1* old residue 84 adding: *981* *84* *Asp* *HA* *H* *4.800* *.* *1* old residue 84 adding: *982* *84* *Asp* *HB2* *H* *2.975* *.* *2* old residue 84 adding: *983* *84* *Asp* *HB3* *H* *2.482* *.* *2* old residue 84 adding: *984* *84* *Asp* *C* *C* *178.637* *.* *1* old residue 84 adding: *985* *84* *Asp* *CA* *C* *55.858* *.* *1* old residue 84 adding: *986* *84* *Asp* *CB* *C* *40.684* *.* *1* old residue 84 adding: *987* *84* *Asp* *N* *N* *124.583* *.* *1* new residue 85 adding: *988* *85* *Glu* *H* *H* *8.413* *.* *1* old residue 85 adding: *989* *85* *Glu* *HA* *H* *4.098* *.* *1* old residue 85 adding: *990* *85* *Glu* *HB2* *H* *2.129* *.* *2* old residue 85 adding: *991* *85* *Glu* *HB3* *H* *1.925* *.* *2* old residue 85 adding: *992* *85* *Glu* *HG2* *H* *2.324* *.* *2* old residue 85 adding: *993* *85* *Glu* *HG3* *H* *2.324* *.* *2* old residue 85 adding: *994* *85* *Glu* *C* *C* *178.303* *.* *1* old residue 85 adding: *995* *85* *Glu* *CA* *C* *60.547* *.* *1* old residue 85 adding: *996* *85* *Glu* *CB* *C* *30.229* *.* *1* old residue 85 adding: *997* *85* *Glu* *CG* *C* *36.320* *.* *1* old residue 85 adding: *998* *85* *Glu* *N* *N* *123.135* *.* *1* new residue 86 adding: *999* *86* *Glu* *H* *H* *10.006* *.* *1* old residue 86 adding: *1000* *86* *Glu* *HA* *H* *4.154* *.* *1* old residue 86 adding: *1001* *86* *Glu* *HB2* *H* *2.129* *.* *2* old residue 86 adding: *1002* *86* *Glu* *HB3* *H* *2.039* *.* *2* old residue 86 adding: *1003* *86* *Glu* *HG2* *H* *2.355* *.* *2* old residue 86 adding: *1004* *86* *Glu* *HG3* *H* *2.340* *.* *2* old residue 86 adding: *1005* *86* *Glu* *C* *C* *175.706* *.* *1* old residue 86 adding: *1006* *86* *Glu* *CA* *C* *57.669* *.* *1* old residue 86 adding: *1007* *86* *Glu* *CB* *C* *29.041* *.* *1* old residue 86 adding: *1008* *86* *Glu* *CG* *C* *37.207* *.* *1* old residue 86 adding: *1009* *86* *Glu* *N* *N* *116.390* *.* *1* new residue 87 adding: *1010* *87* *Asn* *H* *H* *8.188* *.* *1* old residue 87 adding: *1011* *87* *Asn* *HA* *H* *5.036* *.* *1* old residue 87 adding: *1012* *87* *Asn* *HB2* *H* *3.332* *.* *2* old residue 87 adding: *1013* *87* *Asn* *HB3* *H* *2.366* *.* *2* old residue 87 adding: *1014* *87* *Asn* *HD21* *H* *7.759* *.* *1* old residue 87 adding: *1015* *87* *Asn* *HD22* *H* *6.831* *.* *1* old residue 87 adding: *1016* *87* *Asn* *C* *C* *175.428* *.* *1* old residue 87 adding: *1017* *87* *Asn* *CA* *C* *52.648* *.* *1* old residue 87 adding: *1018* *87* *Asn* *CB* *C* *36.025* *.* *1* old residue 87 adding: *1019* *87* *Asn* *CG* *C* *178.565* *.* *1* old residue 87 adding: *1020* *87* *Asn* *N* *N* *119.187* *.* *1* old residue 87 adding: *1021* *87* *Asn* *ND2* *N* *112.560* *.* *1* new residue 88 adding: *1022* *88* *Thr* *H* *H* *10.569* *.* *1* old residue 88 adding: *1023* *88* *Thr* *HA* *H* *4.433* *.* *1* old residue 88 adding: *1024* *88* *Thr* *HB* *H* *4.429* *.* *1* old residue 88 adding: *1025* *88* *Thr* *HG2* *H* *1.103* *.* *1* old residue 88 adding: *1026* *88* *Thr* *C* *C* *175.419* *.* *1* old residue 88 adding: *1027* *88* *Thr* *CA* *C* *61.920* *.* *1* old residue 88 adding: *1028* *88* *Thr* *CB* *C* *68.977* *.* *1* old residue 88 adding: *1029* *88* *Thr* *CG2* *C* *22.173* *.* *1* old residue 88 adding: *1030* *88* *Thr* *N* *N* *114.484* *.* *1* new residue 89 adding: *1031* *89* *Val* *H* *H* *9.097* *.* *1* old residue 89 adding: *1032* *89* *Val* *HA* *H* *4.378* *.* *1* old residue 89 adding: *1033* *89* *Val* *HB* *H* *2.191* *.* *1* old residue 89 adding: *1034* *89* *Val* *HG1* *H* *0.847* *.* *2* old residue 89 adding: *1035* *89* *Val* *HG2* *H* *0.923* *.* *2* old residue 89 adding: *1036* *89* *Val* *C* *C* *176.250* *.* *1* old residue 89 adding: *1037* *89* *Val* *CA* *C* *61.284* *.* *1* old residue 89 adding: *1038* *89* *Val* *CB* *C* *33.365* *.* *1* old residue 89 adding: *1039* *89* *Val* *CG1* *C* *21.392* *.* *2* old residue 89 adding: *1040* *89* *Val* *CG2* *C* *20.542* *.* *2* old residue 89 adding: *1041* *89* *Val* *N* *N* *125.014* *.* *1* new residue 90 adding: *1042* *90* *Val* *H* *H* *9.136* *.* *1* old residue 90 adding: *1043* *90* *Val* *HA* *H* *4.048* *.* *1* old residue 90 adding: *1044* *90* *Val* *HB* *H* *2.068* *.* *1* old residue 90 adding: *1045* *90* *Val* *HG1* *H* *0.813* *.* *1* old residue 90 adding: *1046* *90* *Val* *HG2* *H* *1.013* *.* *1* old residue 90 adding: *1047* *90* *Val* *C* *C* *175.821* *.* *1* old residue 90 adding: *1048* *90* *Val* *CA* *C* *64.097* *.* *1* old residue 90 adding: *1049* *90* *Val* *CB* *C* *30.911* *.* *1* old residue 90 adding: *1050* *90* *Val* *CG1* *C* *21.180* *.* *1* old residue 90 adding: *1051* *90* *Val* *CG2* *C* *21.200* *.* *1* old residue 90 adding: *1052* *90* *Val* *N* *N* *134.703* *.* *1* new residue 91 adding: *1053* *91* *Glu* *H* *H* *8.424* *.* *1* old residue 91 adding: *1054* *91* *Glu* *HA* *H* *5.031* *.* *1* old residue 91 adding: *1055* *91* *Glu* *HB2* *H* *2.421* *.* *2* old residue 91 adding: *1056* *91* *Glu* *HB3* *H* *1.678* *.* *2* old residue 91 adding: *1057* *91* *Glu* *HG2* *H* *2.316* *.* *2* old residue 91 adding: *1058* *91* *Glu* *HG3* *H* *1.885* *.* *2* old residue 91 adding: *1059* *91* *Glu* *C* *C* *176.558* *.* *1* old residue 91 adding: *1060* *91* *Glu* *CA* *C* *53.975* *.* *1* old residue 91 adding: *1061* *91* *Glu* *CB* *C* *37.145* *.* *1* old residue 91 adding: *1062* *91* *Glu* *CG* *C* *38.374* *.* *1* old residue 91 adding: *1063* *91* *Glu* *N* *N* *125.202* *.* *1* new residue 92 adding: *1064* *92* *Leu* *H* *H* *8.125* *.* *1* old residue 92 adding: *1065* *92* *Leu* *HA* *H* *3.955* *.* *1* old residue 92 adding: *1066* *92* *Leu* *HB2* *H* *1.549* *.* *2* old residue 92 adding: *1067* *92* *Leu* *HB3* *H* *1.549* *.* *2* old residue 92 adding: *1068* *92* *Leu* *HG* *H* *1.573* *.* *1* old residue 92 adding: *1069* *92* *Leu* *HD1* *H* *0.989* *.* *2* old residue 92 adding: *1070* *92* *Leu* *HD2* *H* *0.982* *.* *2* old residue 92 adding: *1071* *92* *Leu* *C* *C* *176.373* *.* *1* old residue 92 adding: *1072* *92* *Leu* *CA* *C* *56.511* *.* *1* old residue 92 adding: *1073* *92* *Leu* *CB* *C* *43.249* *.* *1* old residue 92 adding: *1074* *92* *Leu* *CG* *C* *26.818* *.* *1* old residue 92 adding: *1075* *92* *Leu* *CD1* *C* *24.498* *.* *2* old residue 92 adding: *1076* *92* *Leu* *CD2* *C* *24.498* *.* *2* old residue 92 adding: *1077* *92* *Leu* *N* *N* *116.288* *.* *1* new residue 93 adding: *1078* *93* *Asn* *H* *H* *6.284* *.* *1* old residue 93 adding: *1079* *93* *Asn* *HA* *H* *4.912* *.* *1* old residue 93 adding: *1080* *93* *Asn* *HB2* *H* *3.320* *.* *2* old residue 93 adding: *1081* *93* *Asn* *HB3* *H* *2.526* *.* *2* old residue 93 adding: *1082* *93* *Asn* *HD21* *H* *7.604* *.* *1* old residue 93 adding: *1083* *93* *Asn* *HD22* *H* *7.105* *.* *1* old residue 93 adding: *1084* *93* *Asn* *C* *C* *175.733* *.* *1* old residue 93 adding: *1085* *93* *Asn* *CA* *C* *51.727* *.* *1* old residue 93 adding: *1086* *93* *Asn* *CB* *C* *39.580* *.* *1* old residue 93 adding: *1087* *93* *Asn* *CG* *C* *176.786* *.* *1* old residue 93 adding: *1088* *93* *Asn* *N* *N* *109.138* *.* *1* old residue 93 adding: *1089* *93* *Asn* *ND2* *N* *110.577* *.* *1* new residue 94 adding: *1090* *94* *Glu* *HA* *H* *4.848* *.* *1* old residue 94 adding: *1091* *94* *Glu* *HB2* *H* *2.434* *.* *2* old residue 94 adding: *1092* *94* *Glu* *HB3* *H* *1.524* *.* *2* old residue 94 adding: *1093* *94* *Glu* *HG2* *H* *2.474* *.* *2* old residue 94 adding: *1094* *94* *Glu* *HG3* *H* *2.082* *.* *2* old residue 94 adding: *1095* *94* *Glu* *C* *C* *176.942* *.* *1* old residue 94 adding: *1096* *94* *Glu* *CA* *C* *55.393* *.* *1* old residue 94 adding: *1097* *94* *Glu* *CB* *C* *28.428* *.* *1* old residue 94 adding: *1098* *94* *Glu* *CG* *C* *33.523* *.* *1* new residue 95 adding: *1099* *95* *Asn* *H* *H* *8.880* *.* *1* old residue 95 adding: *1100* *95* *Asn* *HA* *H* *5.097* *.* *1* old residue 95 adding: *1101* *95* *Asn* *HB2* *H* *3.109* *.* *2* old residue 95 adding: *1102* *95* *Asn* *HB3* *H* *2.894* *.* *2* old residue 95 adding: *1103* *95* *Asn* *HD21* *H* *7.631* *.* *1* old residue 95 adding: *1104* *95* *Asn* *HD22* *H* *6.971* *.* *1* old residue 95 adding: *1105* *95* *Asn* *C* *C* *174.350* *.* *1* old residue 95 adding: *1106* *95* *Asn* *CA* *C* *53.798* *.* *1* old residue 95 adding: *1107* *95* *Asn* *CB* *C* *39.529* *.* *1* old residue 95 adding: *1108* *95* *Asn* *CG* *C* *177.567* *.* *1* old residue 95 adding: *1109* *95* *Asn* *N* *N* *117.760* *.* *1* old residue 95 adding: *1110* *95* *Asn* *ND2* *N* *113.588* *.* *1* new residue 96 adding: *1111* *96* *Asn* *H* *H* *7.678* *.* *1* old residue 96 adding: *1112* *96* *Asn* *HA* *H* *5.327* *.* *1* old residue 96 adding: *1113* *96* *Asn* *HB2* *H* *3.325* *.* *2* old residue 96 adding: *1114* *96* *Asn* *HB3* *H* *2.654* *.* *2* old residue 96 adding: *1115* *96* *Asn* *HD21* *H* *8.404* *.* *1* old residue 96 adding: *1116* *96* *Asn* *HD22* *H* *8.197* *.* *1* old residue 96 adding: *1117* *96* *Asn* *C* *C* *175.694* *.* *1* old residue 96 adding: *1118* *96* *Asn* *CA* *C* *51.506* *.* *1* old residue 96 adding: *1119* *96* *Asn* *CB* *C* *36.973* *.* *1* old residue 96 adding: *1120* *96* *Asn* *CG* *C* *179.240* *.* *1* old residue 96 adding: *1121* *96* *Asn* *N* *N* *119.200* *.* *1* old residue 96 adding: *1122* *96* *Asn* *ND2* *N* *115.727* *.* *1* new residue 97 adding: *1123* *97* *Asn* *H* *H* *8.423* *.* *1* old residue 97 adding: *1124* *97* *Asn* *HA* *H* *4.500* *.* *1* old residue 97 adding: *1125* *97* *Asn* *HB2* *H* *3.688* *.* *2* old residue 97 adding: *1126* *97* *Asn* *HB3* *H* *2.891* *.* *2* old residue 97 adding: *1127* *97* *Asn* *HD21* *H* *7.146* *.* *1* old residue 97 adding: *1128* *97* *Asn* *HD22* *H* *9.365* *.* *1* old residue 97 adding: *1129* *97* *Asn* *C* *C* *172.867* *.* *1* old residue 97 adding: *1130* *97* *Asn* *CA* *C* *54.174* *.* *1* old residue 97 adding: *1131* *97* *Asn* *CB* *C* *37.381* *.* *1* old residue 97 adding: *1132* *97* *Asn* *N* *N* *119.174* *.* *1* old residue 97 adding: *1133* *97* *Asn* *ND2* *N* *121.957* *.* *1* new residue 98 adding: *1134* *98* *Val* *H* *H* *7.545* *.* *1* old residue 98 adding: *1135* *98* *Val* *HA* *H* *5.149* *.* *1* old residue 98 adding: *1136* *98* *Val* *HB* *H* *1.953* *.* *1* old residue 98 adding: *1137* *98* *Val* *HG1* *H* *0.862* *.* *1* old residue 98 adding: *1138* *98* *Val* *HG2* *H* *0.900* *.* *1* old residue 98 adding: *1139* *98* *Val* *C* *C* *174.661* *.* *1* old residue 98 adding: *1140* *98* *Val* *CA* *C* *60.472* *.* *1* old residue 98 adding: *1141* *98* *Val* *CB* *C* *35.396* *.* *1* old residue 98 adding: *1142* *98* *Val* *CG1* *C* *20.555* *.* *1* old residue 98 adding: *1143* *98* *Val* *CG2* *C* *21.028* *.* *1* old residue 98 adding: *1144* *98* *Val* *N* *N* *116.287* *.* *1* new residue 99 adding: *1145* *99* *Ala* *H* *H* *9.309* *.* *1* old residue 99 adding: *1146* *99* *Ala* *HA* *H* *5.036* *.* *1* old residue 99 adding: *1147* *99* *Ala* *HB* *H* *1.506* *.* *1* old residue 99 adding: *1148* *99* *Ala* *C* *C* *176.452* *.* *1* old residue 99 adding: *1149* *99* *Ala* *CA* *C* *50.579* *.* *1* old residue 99 adding: *1150* *99* *Ala* *CB* *C* *22.839* *.* *1* old residue 99 adding: *1151* *99* *Ala* *N* *N* *129.392* *.* *1* new residue 100 adding: *1152* *100* *Thr* *H* *H* *8.809* *.* *1* old residue 100 adding: *1153* *100* *Thr* *HA* *H* *5.112* *.* *1* old residue 100 adding: *1154* *100* *Thr* *HB* *H* *3.872* *.* *1* old residue 100 adding: *1155* *100* *Thr* *HG2* *H* *1.087* *.* *1* old residue 100 adding: *1156* *100* *Thr* *C* *C* *173.096* *.* *1* old residue 100 adding: *1157* *100* *Thr* *CA* *C* *61.740* *.* *1* old residue 100 adding: *1158* *100* *Thr* *CB* *C* *71.459* *.* *1* old residue 100 adding: *1159* *100* *Thr* *CG2* *C* *21.455* *.* *1* old residue 100 adding: *1160* *100* *Thr* *N* *N* *116.886* *.* *1* new residue 101 adding: *1161* *101* *Phe* *H* *H* *9.431* *.* *1* old residue 101 adding: *1162* *101* *Phe* *HA* *H* *4.662* *.* *1* old residue 101 adding: *1163* *101* *Phe* *HB2* *H* *3.007* *.* *2* old residue 101 adding: *1164* *101* *Phe* *HB3* *H* *2.721* *.* *2* old residue 101 adding: *1165* *101* *Phe* *HD1* *H* *7.076* *.* *3* old residue 101 adding: *1166* *101* *Phe* *HD2* *H* *7.076* *.* *3* old residue 101 adding: *1167* *101* *Phe* *HE1* *H* *7.444* *.* *3* old residue 101 adding: *1168* *101* *Phe* *HE2* *H* *7.444* *.* *3* old residue 101 adding: *1169* *101* *Phe* *HZ* *H* *7.452* *.* *1* old residue 101 adding: *1170* *101* *Phe* *C* *C* *173.153* *.* *1* old residue 101 adding: *1171* *101* *Phe* *CA* *C* *58.104* *.* *1* old residue 101 adding: *1172* *101* *Phe* *CB* *C* *44.323* *.* *1* old residue 101 adding: *1173* *101* *Phe* *CD1* *C* *131.373* *.* *3* old residue 101 adding: *1174* *101* *Phe* *CD2* *C* *131.373* *.* *3* old residue 101 adding: *1175* *101* *Phe* *CE1* *C* *131.373* *.* *3* old residue 101 adding: *1176* *101* *Phe* *CE2* *C* *131.373* *.* *3* old residue 101 adding: *1177* *101* *Phe* *CZ* *C* *130.84* *.* *1* old residue 101 adding: *1178* *101* *Phe* *N* *N* *129.977* *.* *1* new residue 102 adding: *1179* *102* *Asp* *H* *H* *8.054* *.* *1* old residue 102 adding: *1180* *102* *Asp* *HA* *H* *5.585* *.* *1* old residue 102 adding: *1181* *102* *Asp* *HB2* *H* *2.484* *.* *2* old residue 102 adding: *1182* *102* *Asp* *HB3* *H* *2.365* *.* *2* old residue 102 adding: *1183* *102* *Asp* *C* *C* *174.817* *.* *1* old residue 102 adding: *1184* *102* *Asp* *CA* *C* *54.411* *.* *1* old residue 102 adding: *1185* *102* *Asp* *CB* *C* *42.405* *.* *1* old residue 102 adding: *1186* *102* *Asp* *N* *N* *129.424* *.* *1* new residue 103 adding: *1187* *103* *Val* *H* *H* *9.295* *.* *1* old residue 103 adding: *1188* *103* *Val* *HA* *H* *4.606* *.* *1* old residue 103 adding: *1189* *103* *Val* *HB* *H* *2.135* *.* *1* old residue 103 adding: *1190* *103* *Val* *HG1* *H* *1.128* *.* *1* old residue 103 adding: *1191* *103* *Val* *HG2* *H* *1.200* *.* *1* old residue 103 adding: *1192* *103* *Val* *C* *C* *174.858* *.* *1* old residue 103 adding: *1193* *103* *Val* *CA* *C* *60.898* *.* *1* old residue 103 adding: *1194* *103* *Val* *CB* *C* *36.279* *.* *1* old residue 103 adding: *1195* *103* *Val* *CG1* *C* *21.662* *.* *1* old residue 103 adding: *1196* *103* *Val* *CG2* *C* *21.966* *.* *1* old residue 103 adding: *1197* *103* *Val* *N* *N* *122.749* *.* *1* new residue 104 adding: *1198* *104* *Ser* *H* *H* *8.488* *.* *1* old residue 104 adding: *1199* *104* *Ser* *HA* *H* *5.198* *.* *1* old residue 104 adding: *1200* *104* *Ser* *HB2* *H* *3.919* *.* *2* old residue 104 adding: *1201* *104* *Ser* *HB3* *H* *3.868* *.* *2* old residue 104 adding: *1202* *104* *Ser* *C* *C* *173.020* *.* *1* old residue 104 adding: *1203* *104* *Ser* *CA* *C* *57.073* *.* *1* old residue 104 adding: *1204* *104* *Ser* *CB* *C* *64.532* *.* *1* old residue 104 adding: *1205* *104* *Ser* *N* *N* *122.474* *.* *1* new residue 105 adding: *1206* *105* *Val* *H* *H* *9.253* *.* *1* old residue 105 adding: *1207* *105* *Val* *HA* *H* *5.469* *.* *1* old residue 105 adding: *1208* *105* *Val* *HB* *H* *2.530* *.* *1* old residue 105 adding: *1209* *105* *Val* *HG1* *H* *0.627* *.* *1* old residue 105 adding: *1210* *105* *Val* *HG2* *H* *0.820* *.* *1* old residue 105 adding: *1211* *105* *Val* *C* *C* *177.786* *.* *1* old residue 105 adding: *1212* *105* *Val* *CA* *C* *60.647* *.* *1* old residue 105 adding: *1213* *105* *Val* *CB* *C* *31.601* *.* *1* old residue 105 adding: *1214* *105* *Val* *CG1* *C* *21.543* *.* *1* old residue 105 adding: *1215* *105* *Val* *CG2* *C* *22.798* *.* *1* old residue 105 adding: *1216* *105* *Val* *N* *N* *127.805* *.* *1* new residue 106 adding: *1217* *106* *Val* *H* *H* *8.563* *.* *1* old residue 106 adding: *1218* *106* *Val* *HA* *H* *4.896* *.* *1* old residue 106 adding: *1219* *106* *Val* *HB* *H* *2.182* *.* *1* old residue 106 adding: *1220* *106* *Val* *HG1* *H* *0.851* *.* *1* old residue 106 adding: *1221* *106* *Val* *HG2* *H* *0.613* *.* *1* old residue 106 adding: *1222* *106* *Val* *C* *C* *175.452* *.* *1* old residue 106 adding: *1223* *106* *Val* *CA* *C* *58.810* *.* *1* old residue 106 adding: *1224* *106* *Val* *CB* *C* *35.409* *.* *1* old residue 106 adding: *1225* *106* *Val* *CG1* *C* *21.495* *.* *1* old residue 106 adding: *1226* *106* *Val* *CG2* *C* *18.146* *.* *1* old residue 106 adding: *1227* *106* *Val* *N* *N* *121.562* *.* *1* new residue 107 adding: *1228* *107* *Leu* *H* *H* *8.578* *.* *1* old residue 107 adding: *1229* *107* *Leu* *HA* *H* *4.265* *.* *1* old residue 107 adding: *1230* *107* *Leu* *HB2* *H* *1.544* *.* *2* old residue 107 adding: *1231* *107* *Leu* *HB3* *H* *1.544* *.* *2* old residue 107 adding: *1232* *107* *Leu* *HG* *H* *1.483* *.* *1* old residue 107 adding: *1233* *107* *Leu* *HD1* *H* *0.896* *.* *1* old residue 107 adding: *1234* *107* *Leu* *HD2* *H* *0.865* *.* *1* old residue 107 adding: *1235* *107* *Leu* *C* *C* *177.313* *.* *1* old residue 107 adding: *1236* *107* *Leu* *CA* *C* *55.847* *.* *1* old residue 107 adding: *1237* *107* *Leu* *CB* *C* *42.387* *.* *1* old residue 107 adding: *1238* *107* *Leu* *CG* *C* *27.172* *.* *1* old residue 107 adding: *1239* *107* *Leu* *CD1* *C* *24.466* *.* *1* old residue 107 adding: *1240* *107* *Leu* *CD2* *C* *24.351* *.* *1* old residue 107 adding: *1241* *107* *Leu* *N* *N* *123.215* *.* *1* new residue 108 adding: *1242* *108* *Glu* *H* *H* *8.330* *.* *1* old residue 108 adding: *1243* *108* *Glu* *HA* *H* *4.268* *.* *1* old residue 108 adding: *1244* *108* *Glu* *HB2* *H* *1.851* *.* *2* old residue 108 adding: *1245* *108* *Glu* *HB3* *H* *1.851* *.* *2* old residue 108 adding: *1246* *108* *Glu* *HG2* *H* *2.177* *.* *2* old residue 108 adding: *1247* *108* *Glu* *HG3* *H* *2.037* *.* *2* old residue 108 adding: *1248* *108* *Glu* *C* *C* *175.465* *.* *1* old residue 108 adding: *1249* *108* *Glu* *CA* *C* *56.131* *.* *1* old residue 108 adding: *1250* *108* *Glu* *CB* *C* *31.127* *.* *1* old residue 108 adding: *1251* *108* *Glu* *CG* *C* *36.495* *.* *1* old residue 108 adding: *1252* *108* *Glu* *N* *N* *121.238* *.* *1* seqcode size is : 108 seqcode: 33 shift counts are : 6 seqcode: 32 shift counts are : 6 seqcode: 90 shift counts are : 11 seqcode: 63 shift counts are : 17 seqcode: 21 shift counts are : 14 seqcode: 71 shift counts are : 12 seqcode: 102 shift counts are : 8 seqcode: 7 shift counts are : 10 seqcode: 80 shift counts are : 12 seqcode: 26 shift counts are : 11 seqcode: 99 shift counts are : 7 seqcode: 18 shift counts are : 11 seqcode: 72 shift counts are : 9 seqcode: 16 shift counts are : 11 seqcode: 44 shift counts are : 16 seqcode: 55 shift counts are : 11 seqcode: 74 shift counts are : 11 seqcode: 27 shift counts are : 12 seqcode: 84 shift counts are : 8 seqcode: 95 shift counts are : 12 seqcode: 57 shift counts are : 14 seqcode: 61 shift counts are : 11 seqcode: 108 shift counts are : 11 seqcode: 20 shift counts are : 17 seqcode: 92 shift counts are : 14 seqcode: 103 shift counts are : 11 seqcode: 89 shift counts are : 11 seqcode: 10 shift counts are : 14 seqcode: 31 shift counts are : 14 seqcode: 35 shift counts are : 6 seqcode: 11 shift counts are : 17 seqcode: 91 shift counts are : 11 seqcode: 78 shift counts are : 16 seqcode: 107 shift counts are : 14 seqcode: 48 shift counts are : 9 seqcode: 87 shift counts are : 12 seqcode: 93 shift counts are : 12 seqcode: 77 shift counts are : 16 seqcode: 106 shift counts are : 11 seqcode: 65 shift counts are : 14 seqcode: 29 shift counts are : 17 seqcode: 50 shift counts are : 16 seqcode: 39 shift counts are : 9 seqcode: 64 shift counts are : 11 seqcode: 97 shift counts are : 11 seqcode: 58 shift counts are : 5 seqcode: 41 shift counts are : 11 seqcode: 12 shift counts are : 6 seqcode: 15 shift counts are : 11 seqcode: 81 shift counts are : 7 seqcode: 52 shift counts are : 12 seqcode: 60 shift counts are : 17 seqcode: 56 shift counts are : 8 seqcode: 101 shift counts are : 18 seqcode: 73 shift counts are : 15 seqcode: 66 shift counts are : 9 seqcode: 45 shift counts are : 14 seqcode: 86 shift counts are : 11 seqcode: 76 shift counts are : 13 seqcode: 19 shift counts are : 12 seqcode: 62 shift counts are : 11 seqcode: 54 shift counts are : 9 seqcode: 67 shift counts are : 18 seqcode: 70 shift counts are : 8 seqcode: 68 shift counts are : 8 seqcode: 2 shift counts are : 9 seqcode: 17 shift counts are : 6 seqcode: 1 shift counts are : 8 seqcode: 88 shift counts are : 9 seqcode: 30 shift counts are : 11 seqcode: 100 shift counts are : 9 seqcode: 82 shift counts are : 10 seqcode: 25 shift counts are : 11 seqcode: 28 shift counts are : 11 seqcode: 83 shift counts are : 11 seqcode: 75 shift counts are : 6 seqcode: 40 shift counts are : 17 seqcode: 14 shift counts are : 8 seqcode: 69 shift counts are : 19 seqcode: 59 shift counts are : 12 seqcode: 49 shift counts are : 14 seqcode: 24 shift counts are : 17 seqcode: 104 shift counts are : 8 seqcode: 53 shift counts are : 20 seqcode: 79 shift counts are : 14 seqcode: 22 shift counts are : 7 seqcode: 42 shift counts are : 16 seqcode: 46 shift counts are : 12 seqcode: 23 shift counts are : 11 seqcode: 13 shift counts are : 12 seqcode: 105 shift counts are : 11 seqcode: 96 shift counts are : 12 seqcode: 6 shift counts are : 14 seqcode: 85 shift counts are : 11 seqcode: 3 shift counts are : 18 seqcode: 36 shift counts are : 11 seqcode: 94 shift counts are : 9 seqcode: 9 shift counts are : 11 seqcode: 51 shift counts are : 17 seqcode: 47 shift counts are : 6 seqcode: 8 shift counts are : 11 seqcode: 38 shift counts are : 8 seqcode: 98 shift counts are : 11 seqcode: 4 shift counts are : 12 seqcode: 34 shift counts are : 14 seqcode: 37 shift counts are : 12 seqcode: 43 shift counts are : 11 seqcode: 5 shift counts are : 8 setting ambig code at 1051 for HG2 to 2 setting ambig code at 1050 for HG1 to 2 setting ambig code at 239 for HD2 to 2 setting ambig code at 238 for HD1 to 2 setting ambig code at 296 for HG2 to 2 setting ambig code at 295 for HG1 to 2 setting ambig code at 196 for HG2 to 2 setting ambig code at 195 for HG1 to 2 setting ambig code at 179 for HG2 to 2 setting ambig code at 178 for HG1 to 2 setting ambig code at 644 for HG2 to 2 setting ambig code at 643 for HG1 to 2 setting ambig code at 666 for HD2 to 2 setting ambig code at 665 for HD1 to 2 setting ambig code at 1076 for HD2 to 2 setting ambig code at 1075 for HD1 to 2 setting ambig code at 1196 for HG2 to 2 setting ambig code at 1195 for HG1 to 2 setting ambig code at 1040 for HG2 to 2 setting ambig code at 1039 for HG1 to 2 setting ambig code at 361 for HD2 to 2 setting ambig code at 360 for HD1 to 2 setting ambig code at 1240 for HD2 to 2 setting ambig code at 1239 for HD1 to 2 setting ambig code at 1226 for HG2 to 2 setting ambig code at 1225 for HG1 to 2 setting ambig code at 764 for HD2 to 2 setting ambig code at 763 for HD1 to 2 setting ambig code at 750 for HG2 to 2 setting ambig code at 749 for HG1 to 2 setting ambig code at 461 for HG2 to 2 setting ambig code at 460 for HG1 to 2 setting ambig code at 168 for HG2 to 2 setting ambig code at 167 for HG1 to 2 setting ambig code at 319 for HG2 to 2 setting ambig code at 318 for HG1 to 2 setting ambig code at 978 for HG2 to 2 setting ambig code at 977 for HG1 to 2 setting ambig code at 559 for HD2 to 2 setting ambig code at 558 for HD1 to 2 setting ambig code at 1215 for HG2 to 2 setting ambig code at 1214 for HG1 to 2 setting ambig code at 68 for HD2 to 2 setting ambig code at 67 for HD1 to 2 setting ambig code at 404 for HG2 to 2 setting ambig code at 403 for HG1 to 2 setting ambig code at 89 for HG2 to 2 setting ambig code at 88 for HG1 to 2 setting ambig code at 1143 for HG2 to 2 setting ambig code at 1142 for HG1 to 2 setting ambig code at 488 for HG2 to 2 setting ambig code at 487 for HG1 to 2 1 1 MET HA H 3.999 . 1 2 1 MET HB2 H 2.011 . 2 3 1 MET HB3 H 1.946 . 2 4 1 MET HG2 H 2.368 . 2 5 1 MET HG3 H 2.274 . 2 6 1 MET CA C 55.110 . 1 7 1 MET CB C 33.147 . 1 8 1 MET CG C 30.951 . 1 9 2 GLU HA H 4.548 . 1 10 2 GLU HB2 H 1.863 . 2 11 2 GLU HB3 H 1.694 . 2 12 2 GLU HG2 H 2.198 . 2 13 2 GLU HG3 H 2.198 . 2 14 2 GLU C C 174.089 . 1 15 2 GLU CA C 55.411 . 1 16 2 GLU CB C 31.573 . 1 17 2 GLU CG C 36.021 . 1 18 3 PHE H H 8.282 . 1 19 3 PHE HA H 4.909 . 1 20 3 PHE HB2 H 3.331 . 2 21 3 PHE HB3 H 2.587 . 2 22 3 PHE HD1 H 7.195 . 3 23 3 PHE HD2 H 7.195 . 3 24 3 PHE HE1 H 7.277 . 3 25 3 PHE HE2 H 7.277 . 3 26 3 PHE HZ H 7.273 . 1 27 3 PHE C C 173.967 . 1 28 3 PHE CA C 55.763 . 1 29 3 PHE CB C 42.184 . 1 30 3 PHE CD1 C 131.613 . 3 31 3 PHE CD2 C 131.613 . 3 32 3 PHE CE1 C 131.681 . 3 33 3 PHE CE2 C 131.681 . 3 34 3 PHE CZ C 129.94 . 1 35 3 PHE N N 117.356 . 1 36 4 PRO HA H 4.771 . 1 37 4 PRO HB2 H 2.362 . 2 38 4 PRO HB3 H 1.531 . 2 39 4 PRO HG2 H 2.014 . 2 40 4 PRO HG3 H 1.858 . 2 41 4 PRO HD2 H 4.330 . 2 42 4 PRO HD3 H 3.715 . 2 43 4 PRO C C 176.562 . 1 44 4 PRO CA C 62.812 . 1 45 4 PRO CB C 33.831 . 1 46 4 PRO CG C 27.063 . 1 47 4 PRO CD C 50.139 . 1 48 5 ASP H H 7.928 . 1 49 5 ASP HA H 4.913 . 1 50 5 ASP HB2 H 2.753 . 2 51 5 ASP HB3 H 2.662 . 2 52 5 ASP C C 174.604 . 1 53 5 ASP CA C 56.666 . 1 54 5 ASP CB C 42.145 . 1 55 5 ASP N N 113.214 . 1 56 6 LEU H H 8.835 . 1 57 6 LEU HA H 5.443 . 1 58 6 LEU HB2 H 1.906 . 2 59 6 LEU HB3 H 1.308 . 2 60 6 LEU HG H 1.588 . 1 61 6 LEU HD1 H 1.028 . 2 62 6 LEU HD2 H 0.863 . 2 63 6 LEU C C 177.981 . 1 64 6 LEU CA C 53.803 . 1 65 6 LEU CB C 43.299 . 1 66 6 LEU CG C 27.407 . 1 67 6 LEU CD1 C 26.184 . 2 68 6 LEU CD2 C 23.893 . 2 69 6 LEU N N 125.960 . 1 70 7 THR H H 9.148 . 1 71 7 THR HA H 4.806 . 1 72 7 THR HB H 4.149 . 1 73 7 THR HG1 H 6.187 . 1 74 7 THR HG2 H 1.057 . 1 75 7 THR C C 170.943 . 1 76 7 THR CA C 60.678 . 1 77 7 THR CB C 69.914 . 1 78 7 THR CG2 C 18.757 . 1 79 7 THR N N 118.730 . 1 80 8 VAL H H 7.567 . 1 81 8 VAL HA H 5.638 . 1 82 8 VAL HB H 1.758 . 1 83 8 VAL HG1 H 0.713 . 2 84 8 VAL HG2 H 0.698 . 2 85 8 VAL C C 172.395 . 1 86 8 VAL CA C 58.581 . 1 87 8 VAL CB C 36.200 . 1 88 8 VAL CG1 C 21.139 . 2 89 8 VAL CG2 C 21.360 . 2 90 8 VAL N N 117.776 . 1 91 9 GLU H H 8.377 . 1 92 9 GLU HA H 4.573 . 1 93 9 GLU HB2 H 1.970 . 2 94 9 GLU HB3 H 1.934 . 2 95 9 GLU HG2 H 2.191 . 2 96 9 GLU HG3 H 2.191 . 2 97 9 GLU C C 174.215 . 1 98 9 GLU CA C 55.269 . 1 99 9 GLU CB C 34.854 . 1 100 9 GLU CG C 36.18 . 1 101 9 GLU N N 122.065 . 1 102 10 ILE H H 8.841 . 1 103 10 ILE HA H 4.936 . 1 104 10 ILE HB H 1.488 . 1 105 10 ILE HG12 H 1.479 . 2 106 10 ILE HG13 H 0.754 . 2 107 10 ILE HG2 H 0.430 . 1 108 10 ILE HD1 H 0.756 . 1 109 10 ILE C C 173.958 . 1 110 10 ILE CA C 60.256 . 1 111 10 ILE CB C 41.035 . 1 112 10 ILE CG1 C 28.089 . 1 113 10 ILE CG2 C 17.415 . 1 114 10 ILE CD1 C 15.119 . 1 115 10 ILE N N 124.576 . 1 116 11 LYS H H 8.971 . 1 117 11 LYS HA H 4.684 . 1 118 11 LYS HB2 H 1.792 . 2 119 11 LYS HB3 H 1.601 . 2 120 11 LYS HG2 H 1.174 . 2 121 11 LYS HG3 H 1.127 . 2 122 11 LYS HD2 H 1.546 . 2 123 11 LYS HD3 H 1.363 . 2 124 11 LYS HE2 H 2.626 . 2 125 11 LYS HE3 H 2.613 . 2 126 11 LYS C C 174.329 . 1 127 11 LYS CA C 54.444 . 1 128 11 LYS CB C 36.417 . 1 129 11 LYS CG C 24.937 . 1 130 11 LYS CD C 28.906 . 1 131 11 LYS CE C 41.939 . 1 132 11 LYS N N 124.301 . 1 133 12 GLY H H 7.905 . 1 134 12 GLY HA2 H 4.159 . 2 135 12 GLY HA3 H 3.636 . 2 136 12 GLY C C 169.442 . 1 137 12 GLY CA C 45.067 . 1 138 12 GLY N N 109.528 . 1 139 13 PRO HA H 4.634 . 1 140 13 PRO HB2 H 2.266 . 2 141 13 PRO HB3 H 1.984 . 2 142 13 PRO HG2 H 2.036 . 2 143 13 PRO HG3 H 1.911 . 2 144 13 PRO HD2 H 3.079 . 2 145 13 PRO HD3 H 2.425 . 2 146 13 PRO C C 176.817 . 1 147 13 PRO CA C 63.062 . 1 148 13 PRO CB C 32.444 . 1 149 13 PRO CG C 27.136 . 1 150 13 PRO CD C 49.245 . 1 151 14 ASP H H 8.783 . 1 152 14 ASP HA H 4.948 . 1 153 14 ASP HB2 H 3.067 . 2 154 14 ASP HB3 H 2.797 . 2 155 14 ASP C C 175.824 . 1 156 14 ASP CA C 54.450 . 1 157 14 ASP CB C 40.499 . 1 158 14 ASP N N 120.167 . 1 159 15 VAL H H 7.569 . 1 160 15 VAL HA H 5.375 . 1 161 15 VAL HB H 1.817 . 1 162 15 VAL HG1 H 0.785 . 2 163 15 VAL HG2 H 0.966 . 2 164 15 VAL C C 175.389 . 1 165 15 VAL CA C 61.542 . 1 166 15 VAL CB C 34.836 . 1 167 15 VAL CG1 C 21.463 . 2 168 15 VAL CG2 C 21.510 . 2 169 15 VAL N N 122.443 . 1 170 16 VAL H H 8.889 . 1 171 16 VAL HA H 4.307 . 1 172 16 VAL HB H 1.811 . 1 173 16 VAL HG1 H 0.819 . 2 174 16 VAL HG2 H 0.920 . 2 175 16 VAL C C 174.601 . 1 176 16 VAL CA C 60.045 . 1 177 16 VAL CB C 36.973 . 1 178 16 VAL CG1 C 22.554 . 2 179 16 VAL CG2 C 22.221 . 2 180 16 VAL N N 125.587 . 1 181 17 GLY H H 8.563 . 1 182 17 GLY HA2 H 4.625 . 2 183 17 GLY HA3 H 3.353 . 2 184 17 GLY C C 173.511 . 1 185 17 GLY CA C 44.297 . 1 186 17 GLY N N 111.233 . 1 187 18 VAL H H 8.006 . 1 188 18 VAL HA H 3.129 . 1 189 18 VAL HB H 1.624 . 1 190 18 VAL HG1 H 0.798 . 2 191 18 VAL HG2 H 0.684 . 2 192 18 VAL C C 175.404 . 1 193 18 VAL CA C 63.972 . 1 194 18 VAL CB C 31.932 . 1 195 18 VAL CG1 C 20.719 . 2 196 18 VAL CG2 C 22.450 . 2 197 18 VAL N N 120.888 . 1 198 19 ASN H H 8.564 . 1 199 19 ASN HA H 3.970 . 1 200 19 ASN HB2 H 3.009 . 2 201 19 ASN HB3 H 2.932 . 2 202 19 ASN HD21 H 7.525 . 1 203 19 ASN HD22 H 6.861 . 1 204 19 ASN C C 173.605 . 1 205 19 ASN CA C 55.315 . 1 206 19 ASN CB C 37.090 . 1 207 19 ASN CG C 178.106 . 1 208 19 ASN N N 117.109 . 1 209 19 ASN ND2 N 113.631 . 1 210 20 LYS H H 7.490 . 1 211 20 LYS HA H 4.488 . 1 212 20 LYS HB2 H 1.928 . 2 213 20 LYS HB3 H 1.627 . 2 214 20 LYS HG2 H 1.347 . 2 215 20 LYS HG3 H 1.149 . 2 216 20 LYS HD2 H 1.617 . 2 217 20 LYS HD3 H 1.581 . 2 218 20 LYS HE2 H 2.985 . 2 219 20 LYS HE3 H 2.985 . 2 220 20 LYS C C 173.648 . 1 221 20 LYS CA C 53.974 . 1 222 20 LYS CB C 33.308 . 1 223 20 LYS CG C 24.202 . 1 224 20 LYS CD C 28.433 . 1 225 20 LYS CE C 42.322 . 1 226 20 LYS N N 119.052 . 1 227 21 LEU H H 7.761 . 1 228 21 LEU HA H 4.355 . 1 229 21 LEU HB2 H 1.581 . 2 230 21 LEU HB3 H 1.429 . 2 231 21 LEU HG H 1.354 . 1 232 21 LEU HD1 H 0.867 . 2 233 21 LEU HD2 H 0.806 . 2 234 21 LEU C C 176.563 . 1 235 21 LEU CA C 55.863 . 1 236 21 LEU CB C 43.114 . 1 237 21 LEU CG C 27.425 . 1 238 21 LEU CD1 C 25.213 . 2 239 21 LEU CD2 C 25.663 . 2 240 21 LEU N N 122.175 . 1 241 22 ALA H H 9.241 . 1 242 22 ALA HA H 4.734 . 1 243 22 ALA HB H 1.583 . 1 244 22 ALA C C 175.095 . 1 245 22 ALA CA C 50.881 . 1 246 22 ALA CB C 23.297 . 1 247 22 ALA N N 132.877 . 1 248 23 GLU H H 7.988 . 1 249 23 GLU HA H 4.899 . 1 250 23 GLU HB2 H 1.854 . 2 251 23 GLU HB3 H 1.679 . 2 252 23 GLU HG2 H 2.058 . 2 253 23 GLU HG3 H 1.941 . 2 254 23 GLU C C 174.569 . 1 255 23 GLU CA C 55.333 . 1 256 23 GLU CB C 32.35 . 1 257 23 GLU CG C 37.288 . 1 258 23 GLU N N 120.423 . 1 259 24 TYR H H 8.467 . 1 260 24 TYR HA H 4.508 . 1 261 24 TYR HB2 H 2.102 . 2 262 24 TYR HB3 H 0.966 . 2 263 24 TYR HD1 H 6.296 . 3 264 24 TYR HD2 H 6.296 . 3 265 24 TYR HE1 H 6.583 . 3 266 24 TYR HE2 H 6.583 . 3 267 24 TYR HH H 7.935 . 1 268 24 TYR C C 174.906 . 1 269 24 TYR CA C 57.306 . 1 270 24 TYR CB C 43.837 . 1 271 24 TYR CD1 C 131.860 . 3 272 24 TYR CD2 C 131.860 . 3 273 24 TYR CE1 C 118.104 . 3 274 24 TYR CE2 C 118.104 . 3 275 24 TYR N N 121.153 . 1 276 25 GLU H H 8.948 . 1 277 25 GLU HA H 4.881 . 1 278 25 GLU HB2 H 2.021 . 2 279 25 GLU HB3 H 1.629 . 2 280 25 GLU HG2 H 2.294 . 2 281 25 GLU HG3 H 1.964 . 2 282 25 GLU C C 175.815 . 1 283 25 GLU CA C 53.871 . 1 284 25 GLU CB C 33.588 . 1 285 25 GLU CG C 35.101 . 1 286 25 GLU N N 116.307 . 1 287 26 VAL H H 9.524 . 1 288 26 VAL HA H 4.607 . 1 289 26 VAL HB H 1.905 . 1 290 26 VAL HG1 H 0.581 . 2 291 26 VAL HG2 H 0.983 . 2 292 26 VAL C C 175.575 . 1 293 26 VAL CA C 61.478 . 1 294 26 VAL CB C 32.291 . 1 295 26 VAL CG1 C 21.565 . 2 296 26 VAL CG2 C 21.670 . 2 297 26 VAL N N 123.659 . 1 298 27 HIS H H 9.519 . 1 299 27 HIS HA H 4.881 . 1 300 27 HIS HB2 H 3.168 . 2 301 27 HIS HB3 H 3.010 . 2 302 27 HIS HD2 H 6.791 . 1 303 27 HIS HE1 H 8.469 . 1 304 27 HIS C C 173.800 . 1 305 27 HIS CA C 54.754 . 1 306 27 HIS CB C 29.169 . 1 307 27 HIS CD2 C 116.839 . 1 308 27 HIS CE1 C 137.074 . 1 309 27 HIS N N 126.962 . 1 310 28 VAL H H 9.226 . 1 311 28 VAL HA H 4.986 . 1 312 28 VAL HB H 1.817 . 1 313 28 VAL HG1 H 0.867 . 2 314 28 VAL HG2 H 0.867 . 2 315 28 VAL C C 173.076 . 1 316 28 VAL CA C 59.533 . 1 317 28 VAL CB C 33.601 . 1 318 28 VAL CG1 C 21.441 . 2 319 28 VAL CG2 C 21.441 . 2 320 28 VAL N N 125.754 . 1 321 29 LYS H H 8.318 . 1 322 29 LYS HA H 5.360 . 1 323 29 LYS HB2 H 1.678 . 2 324 29 LYS HB3 H 1.497 . 2 325 29 LYS HG2 H 1.144 . 2 326 29 LYS HG3 H 1.127 . 2 327 29 LYS HD2 H 1.529 . 2 328 29 LYS HD3 H 1.446 . 2 329 29 LYS HE2 H 2.769 . 2 330 29 LYS HE3 H 2.662 . 2 331 29 LYS C C 174.823 . 1 332 29 LYS CA C 54.258 . 1 333 29 LYS CB C 36.822 . 1 334 29 LYS CG C 25.387 . 1 335 29 LYS CD C 29.727 . 1 336 29 LYS CE C 42.150 . 1 337 29 LYS N N 124.169 . 1 338 30 ASN H H 8.420 . 1 339 30 ASN HA H 5.363 . 1 340 30 ASN HB2 H 3.451 . 2 341 30 ASN HB3 H 2.373 . 2 342 30 ASN HD21 H 7.710 . 1 343 30 ASN HD22 H 6.500 . 1 344 30 ASN C C 175.354 . 1 345 30 ASN CA C 50.158 . 1 346 30 ASN CB C 39.370 . 1 347 30 ASN N N 117.630 . 1 348 30 ASN ND2 N 112.030 . 1 349 31 LEU H H 9.400 . 1 350 31 LEU HA H 4.272 . 1 351 31 LEU HB2 H 1.810 . 2 352 31 LEU HB3 H 1.810 . 2 353 31 LEU HG H 1.603 . 1 354 31 LEU HD1 H 0.901 . 2 355 31 LEU HD2 H 0.819 . 2 356 31 LEU C C 178.661 . 1 357 31 LEU CA C 54.830 . 1 358 31 LEU CB C 42.492 . 1 359 31 LEU CG C 26.984 . 1 360 31 LEU CD1 C 25.284 . 2 361 31 LEU CD2 C 22.371 . 2 362 31 LEU N N 122.003 . 1 363 32 GLY H H 7.836 . 1 364 32 GLY HA2 H 4.640 . 2 365 32 GLY HA3 H 4.159 . 2 366 32 GLY C C 173.108 . 1 367 32 GLY CA C 43.827 . 1 368 32 GLY N N 104.966 . 1 369 33 GLY H H 8.300 . 1 370 33 GLY HA2 H 4.192 . 2 371 33 GLY HA3 H 3.739 . 2 372 33 GLY C C 172.947 . 1 373 33 GLY CA C 45.486 . 1 374 33 GLY N N 103.116 . 1 375 34 ILE H H 6.758 . 1 376 34 ILE HA H 4.412 . 1 377 34 ILE HB H 1.471 . 1 378 34 ILE HG12 H 1.340 . 2 379 34 ILE HG13 H 1.084 . 2 380 34 ILE HG2 H 0.903 . 1 381 34 ILE HD1 H 0.798 . 1 382 34 ILE C C 174.771 . 1 383 34 ILE CA C 57.881 . 1 384 34 ILE CB C 40.871 . 1 385 34 ILE CG1 C 26.915 . 1 386 34 ILE CG2 C 16.283 . 1 387 34 ILE CD1 C 12.115 . 1 388 34 ILE N N 117.237 . 1 389 35 GLY H H 8.860 . 1 390 35 GLY HA2 H 3.938 . 2 391 35 GLY HA3 H 3.691 . 2 392 35 GLY C C 171.709 . 1 393 35 GLY CA C 44.718 . 1 394 35 GLY N N 112.288 . 1 395 36 VAL H H 8.873 . 1 396 36 VAL HA H 4.431 . 1 397 36 VAL HB H 2.027 . 1 398 36 VAL HG1 H 0.880 . 2 399 36 VAL HG2 H 0.959 . 2 400 36 VAL C C 173.918 . 1 401 36 VAL CA C 59.176 . 1 402 36 VAL CB C 34.549 . 1 403 36 VAL CG1 C 21.896 . 2 404 36 VAL CG2 C 21.855 . 2 405 36 VAL N N 119.649 . 1 406 37 PRO HA H 4.251 . 1 407 37 PRO HB2 H 2.360 . 2 408 37 PRO HB3 H 1.944 . 2 409 37 PRO HG2 H 2.116 . 2 410 37 PRO HG3 H 1.988 . 2 411 37 PRO HD2 H 3.923 . 2 412 37 PRO HD3 H 3.691 . 2 413 37 PRO C C 177.224 . 1 414 37 PRO CA C 64.819 . 1 415 37 PRO CB C 32.454 . 1 416 37 PRO CG C 27.117 . 1 417 37 PRO CD C 51.321 . 1 418 38 SER H H 7.376 . 1 419 38 SER HA H 4.590 . 1 420 38 SER HB2 H 3.585 . 2 421 38 SER HB3 H 3.549 . 2 422 38 SER C C 173.336 . 1 423 38 SER CA C 58.222 . 1 424 38 SER CB C 63.932 . 1 425 38 SER N N 108.183 . 1 426 39 THR H H 9.004 . 1 427 39 THR HA H 4.596 . 1 428 39 THR HB H 4.000 . 1 429 39 THR HG2 H 0.825 . 1 430 39 THR C C 170.923 . 1 431 39 THR CA C 61.044 . 1 432 39 THR CB C 69.000 . 1 433 39 THR CG2 C 18.032 . 1 434 39 THR N N 122.850 . 1 435 40 LYS H H 7.982 . 1 436 40 LYS HA H 5.556 . 1 437 40 LYS HB2 H 2.002 . 2 438 40 LYS HB3 H 1.696 . 2 439 40 LYS HG2 H 1.555 . 2 440 40 LYS HG3 H 1.471 . 2 441 40 LYS HD2 H 1.647 . 2 442 40 LYS HD3 H 1.635 . 2 443 40 LYS HE2 H 2.885 . 2 444 40 LYS HE3 H 2.885 . 2 445 40 LYS C C 177.528 . 1 446 40 LYS CA C 55.250 . 1 447 40 LYS CB C 35.077 . 1 448 40 LYS CG C 25.471 . 1 449 40 LYS CD C 29.188 . 1 450 40 LYS CE C 42.391 . 1 451 40 LYS N N 123.251 . 1 452 41 VAL H H 9.571 . 1 453 41 VAL HA H 5.212 . 1 454 41 VAL HB H 2.144 . 1 455 41 VAL HG1 H 0.931 . 2 456 41 VAL HG2 H 0.919 . 2 457 41 VAL C C 174.643 . 1 458 41 VAL CA C 60.515 . 1 459 41 VAL CB C 34.218 . 1 460 41 VAL CG1 C 20.778 . 2 461 41 VAL CG2 C 22.343 . 2 462 41 VAL N N 127.550 . 1 463 42 ARG H H 8.854 . 1 464 42 ARG HA H 5.061 . 1 465 42 ARG HB2 H 1.847 . 2 466 42 ARG HB3 H 1.188 . 2 467 42 ARG HG2 H 1.536 . 2 468 42 ARG HG3 H 1.360 . 2 469 42 ARG HD2 H 3.080 . 2 470 42 ARG HD3 H 2.999 . 2 471 42 ARG HE H 7.455 . 1 472 42 ARG C C 174.625 . 1 473 42 ARG CA C 54.837 . 1 474 42 ARG CB C 34.596 . 1 475 42 ARG CG C 29.69 . 1 476 42 ARG CD C 43.856 . 1 477 42 ARG N N 125.941 . 1 478 42 ARG NE N 84.879 . 1 479 43 VAL H H 8.451 . 1 480 43 VAL HA H 5.118 . 1 481 43 VAL HB H 1.419 . 1 482 43 VAL HG1 H 0.313 . 2 483 43 VAL HG2 H 0.870 . 2 484 43 VAL C C 173.495 . 1 485 43 VAL CA C 60.383 . 1 486 43 VAL CB C 35.320 . 1 487 43 VAL CG1 C 20.962 . 2 488 43 VAL CG2 C 23.290 . 2 489 43 VAL N N 119.116 . 1 490 44 TYR H H 9.581 . 1 491 44 TYR HA H 5.057 . 1 492 44 TYR HB2 H 2.883 . 2 493 44 TYR HB3 H 2.335 . 2 494 44 TYR HD1 H 6.703 . 3 495 44 TYR HD2 H 6.703 . 3 496 44 TYR HE1 H 6.732 . 3 497 44 TYR HE2 H 6.732 . 3 498 44 TYR C C 174.783 . 1 499 44 TYR CA C 55.778 . 1 500 44 TYR CB C 42.364 . 1 501 44 TYR CD1 C 132.814 . 3 502 44 TYR CD2 C 132.814 . 3 503 44 TYR CE1 C 118.702 . 3 504 44 TYR CE2 C 118.702 . 3 505 44 TYR N N 127.172 . 1 506 45 ILE H H 8.410 . 1 507 45 ILE HA H 4.418 . 1 508 45 ILE HB H 1.422 . 1 509 45 ILE HG12 H 0.677 . 2 510 45 ILE HG13 H 0.168 . 2 511 45 ILE HG2 H 0.370 . 1 512 45 ILE HD1 H -1.066 . 1 513 45 ILE C C 176.667 . 1 514 45 ILE CA C 61.220 . 1 515 45 ILE CB C 38.830 . 1 516 45 ILE CG1 C 26.910 . 1 517 45 ILE CG2 C 16.769 . 1 518 45 ILE CD1 C 10.014 . 1 519 45 ILE N N 118.408 . 1 520 46 ASN H H 9.745 . 1 521 46 ASN HA H 4.542 . 1 522 46 ASN HB2 H 3.355 . 2 523 46 ASN HB3 H 2.957 . 2 524 46 ASN HD21 H 7.800 . 1 525 46 ASN HD22 H 6.160 . 1 526 46 ASN C C 175.978 . 1 527 46 ASN CA C 53.814 . 1 528 46 ASN CB C 36.563 . 1 529 46 ASN CG C 176.947 . 1 530 46 ASN N N 129.504 . 1 531 46 ASN ND2 N 111.852 . 1 532 47 GLY H H 9.255 . 1 533 47 GLY HA2 H 4.192 . 2 534 47 GLY HA3 H 3.548 . 2 535 47 GLY C C 173.986 . 1 536 47 GLY CA C 45.471 . 1 537 47 GLY N N 103.190 . 1 538 48 THR H H 7.939 . 1 539 48 THR HA H 4.614 . 1 540 48 THR HB H 4.191 . 1 541 48 THR HG2 H 1.335 . 1 542 48 THR C C 174.591 . 1 543 48 THR CA C 61.965 . 1 544 48 THR CB C 70.086 . 1 545 48 THR CG2 C 22.041 . 1 546 48 THR N N 118.684 . 1 547 49 LEU H H 9.246 . 1 548 49 LEU HA H 3.579 . 1 549 49 LEU HB2 H 1.705 . 2 550 49 LEU HB3 H 1.339 . 2 551 49 LEU HG H 1.115 . 1 552 49 LEU HD1 H 0.299 . 2 553 49 LEU HD2 H 0.717 . 2 554 49 LEU C C 174.902 . 1 555 49 LEU CA C 57.480 . 1 556 49 LEU CB C 41.012 . 1 557 49 LEU CG C 26.560 . 1 558 49 LEU CD1 C 22.710 . 2 559 49 LEU CD2 C 26.096 . 2 560 49 LEU N N 131.569 . 1 561 50 TYR H H 9.655 . 1 562 50 TYR HA H 4.607 . 1 563 50 TYR HB2 H 2.851 . 2 564 50 TYR HB3 H 2.227 . 2 565 50 TYR HD1 H 6.703 . 3 566 50 TYR HD2 H 6.703 . 3 567 50 TYR HE1 H 7.050 . 3 568 50 TYR HE2 H 7.050 . 3 569 50 TYR C C 174.719 . 1 570 50 TYR CA C 58.967 . 1 571 50 TYR CB C 42.483 . 1 572 50 TYR CD1 C 132.814 . 3 573 50 TYR CD2 C 132.814 . 3 574 50 TYR CE1 C 117.851 . 3 575 50 TYR CE2 C 117.851 . 3 576 50 TYR N N 130.369 . 1 577 51 LYS H H 7.369 . 1 578 51 LYS HA H 4.078 . 1 579 51 LYS HB2 H 0.822 . 2 580 51 LYS HB3 H 0.387 . 2 581 51 LYS HG2 H 0.596 . 2 582 51 LYS HG3 H 0.325 . 2 583 51 LYS HD2 H 1.365 . 2 584 51 LYS HD3 H 1.365 . 2 585 51 LYS HE2 H 2.693 . 2 586 51 LYS HE3 H 2.561 . 2 587 51 LYS C C 173.058 . 1 588 51 LYS CA C 54.126 . 1 589 51 LYS CB C 37.004 . 1 590 51 LYS CG C 24.122 . 1 591 51 LYS CD C 28.611 . 1 592 51 LYS CE C 42.143 . 1 593 51 LYS N N 116.050 . 1 594 52 ASN H H 7.487 . 1 595 52 ASN HA H 5.339 . 1 596 52 ASN HB2 H 2.510 . 2 597 52 ASN HB3 H 2.510 . 2 598 52 ASN HD21 H 6.979 . 1 599 52 ASN HD22 H 6.532 . 1 600 52 ASN C C 172.841 . 1 601 52 ASN CA C 52.384 . 1 602 52 ASN CB C 42.844 . 1 603 52 ASN CG C 175.721 . 1 604 52 ASN N N 116.740 . 1 605 52 ASN ND2 N 112.168 . 1 606 53 TRP H H 9.430 . 1 607 53 TRP HA H 5.014 . 1 608 53 TRP HB2 H 3.247 . 2 609 53 TRP HB3 H 2.802 . 2 610 53 TRP HD1 H 7.422 . 1 611 53 TRP HE1 H 10.477 . 1 612 53 TRP HE3 H 7.359 . 1 613 53 TRP HZ2 H 7.553 . 1 614 53 TRP HZ3 H 6.569 . 1 615 53 TRP HH2 H 6.693 . 1 616 53 TRP C C 175.677 . 1 617 53 TRP CA C 58.102 . 1 618 53 TRP CB C 34.864 . 1 619 53 TRP CD1 C 128.051 . 1 620 53 TRP CE3 C 120.743 . 1 621 53 TRP CZ2 C 114.558 . 1 622 53 TRP CZ3 C 120.846 . 1 623 53 TRP CH2 C 122.582 . 1 624 53 TRP N N 120.779 . 1 625 53 TRP NE1 N 129.726 . 1 626 54 THR H H 8.902 . 1 627 54 THR HA H 5.130 . 1 628 54 THR HB H 4.024 . 1 629 54 THR HG2 H 1.150 . 1 630 54 THR C C 174.481 . 1 631 54 THR CA C 62.656 . 1 632 54 THR CB C 69.780 . 1 633 54 THR CG2 C 21.759 . 1 634 54 THR N N 120.049 . 1 635 55 VAL H H 9.045 . 1 636 55 VAL HA H 4.901 . 1 637 55 VAL HB H 1.970 . 1 638 55 VAL HG1 H 0.814 . 2 639 55 VAL HG2 H 0.620 . 2 640 55 VAL C C 173.044 . 1 641 55 VAL CA C 59.043 . 1 642 55 VAL CB C 36.213 . 1 643 55 VAL CG1 C 22.168 . 2 644 55 VAL CG2 C 19.586 . 2 645 55 VAL N N 119.888 . 1 646 56 SER H H 8.089 . 1 647 56 SER HA H 4.664 . 1 648 56 SER HB2 H 3.779 . 2 649 56 SER HB3 H 3.779 . 2 650 56 SER C C 174.435 . 1 651 56 SER CA C 56.069 . 1 652 56 SER CB C 65.818 . 1 653 56 SER N N 115.648 . 1 654 57 LEU H H 8.433 . 1 655 57 LEU HA H 4.860 . 1 656 57 LEU HB2 H 1.644 . 2 657 57 LEU HB3 H 1.400 . 2 658 57 LEU HG H 1.406 . 1 659 57 LEU HD1 H 0.670 . 2 660 57 LEU HD2 H 0.716 . 2 661 57 LEU C C 176.215 . 1 662 57 LEU CA C 53.578 . 1 663 57 LEU CB C 47.794 . 1 664 57 LEU CG C 27.264 . 1 665 57 LEU CD1 C 26.678 . 2 666 57 LEU CD2 C 24.676 . 2 667 57 LEU N N 122.922 . 1 668 58 GLY H H 9.873 . 1 669 58 GLY HA2 H 4.290 . 2 670 58 GLY HA3 H 3.796 . 2 671 58 GLY CA C 44.508 . 1 672 58 GLY N N 114.634 . 1 673 59 PRO HA H 3.919 . 1 674 59 PRO HB2 H 1.897 . 2 675 59 PRO HB3 H 1.777 . 2 676 59 PRO HG2 H 2.120 . 2 677 59 PRO HG3 H 1.654 . 2 678 59 PRO HD2 H 3.567 . 2 679 59 PRO HD3 H 3.360 . 2 680 59 PRO C C 177.333 . 1 681 59 PRO CA C 63.833 . 1 682 59 PRO CB C 31.693 . 1 683 59 PRO CG C 27.840 . 1 684 59 PRO CD C 49.366 . 1 685 60 LYS H H 7.945 . 1 686 60 LYS HA H 4.337 . 1 687 60 LYS HB2 H 2.003 . 2 688 60 LYS HB3 H 1.951 . 2 689 60 LYS HG2 H 1.363 . 2 690 60 LYS HG3 H 1.130 . 2 691 60 LYS HD2 H 1.545 . 2 692 60 LYS HD3 H 1.545 . 2 693 60 LYS HE2 H 2.869 . 2 694 60 LYS HE3 H 2.869 . 2 695 60 LYS C C 175.413 . 1 696 60 LYS CA C 57.274 . 1 697 60 LYS CB C 29.346 . 1 698 60 LYS CG C 25.085 . 1 699 60 LYS CD C 28.554 . 1 700 60 LYS CE C 42.455 . 1 701 60 LYS N N 119.243 . 1 702 61 GLU H H 7.600 . 1 703 61 GLU HA H 4.344 . 1 704 61 GLU HB2 H 1.950 . 2 705 61 GLU HB3 H 1.664 . 2 706 61 GLU HG2 H 2.361 . 2 707 61 GLU HG3 H 2.115 . 2 708 61 GLU C C 174.063 . 1 709 61 GLU CA C 56.685 . 1 710 61 GLU CB C 31.845 . 1 711 61 GLU CG C 37.270 . 1 712 61 GLU N N 121.045 . 1 713 62 GLU H H 8.353 . 1 714 62 GLU HA H 5.242 . 1 715 62 GLU HB2 H 1.921 . 2 716 62 GLU HB3 H 1.818 . 2 717 62 GLU HG2 H 2.014 . 2 718 62 GLU HG3 H 1.917 . 2 719 62 GLU C C 175.353 . 1 720 62 GLU CA C 53.900 . 1 721 62 GLU CB C 33.032 . 1 722 62 GLU CG C 36.355 . 1 723 62 GLU N N 124.052 . 1 724 63 LYS H H 9.226 . 1 725 63 LYS HA H 4.597 . 1 726 63 LYS HB2 H 1.601 . 2 727 63 LYS HB3 H 1.330 . 2 728 63 LYS HG2 H 1.316 . 2 729 63 LYS HG3 H 1.316 . 2 730 63 LYS HD2 H 1.600 . 2 731 63 LYS HD3 H 1.560 . 2 732 63 LYS HE2 H 3.070 . 2 733 63 LYS HE3 H 3.033 . 2 734 63 LYS C C 174.074 . 1 735 63 LYS CA C 55.214 . 1 736 63 LYS CB C 37.305 . 1 737 63 LYS CG C 26.648 . 1 738 63 LYS CD C 29.113 . 1 739 63 LYS CE C 42.592 . 1 740 63 LYS N N 125.754 . 1 741 64 VAL H H 8.476 . 1 742 64 VAL HA H 4.175 . 1 743 64 VAL HB H 1.692 . 1 744 64 VAL HG1 H 0.291 . 2 745 64 VAL HG2 H 0.233 . 2 746 64 VAL C C 174.797 . 1 747 64 VAL CA C 61.759 . 1 748 64 VAL CB C 32.024 . 1 749 64 VAL CG1 C 20.906 . 2 750 64 VAL CG2 C 20.703 . 2 751 64 VAL N N 122.489 . 1 752 65 LEU H H 8.815 . 1 753 65 LEU HA H 4.466 . 1 754 65 LEU HB2 H 0.774 . 2 755 65 LEU HB3 H -0.111 . 2 756 65 LEU HG H 0.960 . 1 757 65 LEU HD1 H -0.075 . 2 758 65 LEU HD2 H 0.170 . 2 759 65 LEU C C 176.014 . 1 760 65 LEU CA C 52.528 . 1 761 65 LEU CB C 41.644 . 1 762 65 LEU CG C 25.898 . 1 763 65 LEU CD1 C 24.476 . 2 764 65 LEU CD2 C 21.991 . 2 765 65 LEU N N 131.096 . 1 766 66 THR H H 8.373 . 1 767 66 THR HA H 5.446 . 1 768 66 THR HB H 4.252 . 1 769 66 THR HG2 H 1.102 . 1 770 66 THR C C 174.567 . 1 771 66 THR CA C 60.271 . 1 772 66 THR CB C 71.340 . 1 773 66 THR CG2 C 21.805 . 1 774 66 THR N N 113.604 . 1 775 67 PHE H H 8.680 . 1 776 67 PHE HA H 5.341 . 1 777 67 PHE HB2 H 3.479 . 2 778 67 PHE HB3 H 3.385 . 2 779 67 PHE HD1 H 7.274 . 3 780 67 PHE HD2 H 7.274 . 3 781 67 PHE HE1 H 6.767 . 3 782 67 PHE HE2 H 6.767 . 3 783 67 PHE HZ H 6.549 . 1 784 67 PHE C C 171.534 . 1 785 67 PHE CA C 56.742 . 1 786 67 PHE CB C 42.486 . 1 787 67 PHE CD1 C 132.238 . 3 788 67 PHE CD2 C 132.238 . 3 789 67 PHE CE1 C 130.820 . 3 790 67 PHE CE2 C 130.820 . 3 791 67 PHE CZ C 129.788 . 1 792 67 PHE N N 116.946 . 1 793 68 SER H H 9.063 . 1 794 68 SER HA H 5.884 . 1 795 68 SER HB2 H 3.922 . 2 796 68 SER HB3 H 3.941 . 2 797 68 SER C C 174.260 . 1 798 68 SER CA C 56.269 . 1 799 68 SER CB C 66.454 . 1 800 68 SER N N 115.447 . 1 801 69 TRP H H 9.641 . 1 802 69 TRP HA H 5.004 . 1 803 69 TRP HB2 H 3.217 . 2 804 69 TRP HB3 H 3.095 . 2 805 69 TRP HD1 H 6.971 . 1 806 69 TRP HE1 H 9.855 . 1 807 69 TRP HE3 H 7.406 . 1 808 69 TRP HZ2 H 6.328 . 1 809 69 TRP HZ3 H 6.751 . 1 810 69 TRP HH2 H 5.946 . 1 811 69 TRP C C 172.755 . 1 812 69 TRP CA C 57.366 . 1 813 69 TRP CB C 31.998 . 1 814 69 TRP CD1 C 125.724 . 1 815 69 TRP CE3 C 119.664 . 1 816 69 TRP CZ2 C 113.280 . 1 817 69 TRP CZ3 C 120.677 . 1 818 69 TRP CH2 C 123.627 . 1 819 69 TRP N N 127.663 . 1 820 70 THR H H 7.923 . 1 821 70 THR HA H 4.934 . 1 822 70 THR HB H 3.813 . 1 823 70 THR HG2 H 0.673 . 1 824 70 THR CA C 57.926 . 1 825 70 THR CB C 69.883 . 1 826 70 THR CG2 C 19.865 . 1 827 70 THR N N 124.513 . 1 828 71 PRO HA H 3.910 . 1 829 71 PRO HB2 H 1.258 . 2 830 71 PRO HB3 H 1.130 . 2 831 71 PRO HG2 H 1.520 . 2 832 71 PRO HG3 H 0.593 . 2 833 71 PRO HD2 H 4.004 . 2 834 71 PRO HD3 H 1.965 . 2 835 71 PRO C C 177.885 . 1 836 71 PRO CA C 61.314 . 1 837 71 PRO CB C 32.974 . 1 838 71 PRO CG C 26.753 . 1 839 71 PRO CD C 49.606 . 1 840 72 THR H H 8.426 . 1 841 72 THR HA H 4.452 . 1 842 72 THR HB H 4.497 . 1 843 72 THR HG2 H 1.146 . 1 844 72 THR C C 174.271 . 1 845 72 THR CA C 61.201 . 1 846 72 THR CB C 69.843 . 1 847 72 THR CG2 C 21.552 . 1 848 72 THR N N 108.519 . 1 849 73 GLN H H 7.108 . 1 850 73 GLN HA H 4.627 . 1 851 73 GLN HB2 H 2.066 . 2 852 73 GLN HB3 H 1.998 . 2 853 73 GLN HG2 H 2.500 . 2 854 73 GLN HG3 H 2.445 . 2 855 73 GLN HE21 H 7.614 . 1 856 73 GLN HE22 H 6.898 . 1 857 73 GLN C C 175.445 . 1 858 73 GLN CA C 54.625 . 1 859 73 GLN CB C 32.427 . 1 860 73 GLN CG C 33.509 . 1 861 73 GLN CD C 180.686 . 1 862 73 GLN N N 118.466 . 1 863 73 GLN NE2 N 112.464 . 1 864 74 GLU H H 9.707 . 1 865 74 GLU HA H 3.983 . 1 866 74 GLU HB2 H 2.083 . 2 867 74 GLU HB3 H 2.039 . 2 868 74 GLU HG2 H 2.277 . 2 869 74 GLU HG3 H 2.189 . 2 870 74 GLU C C 175.084 . 1 871 74 GLU CA C 57.217 . 1 872 74 GLU CB C 30.502 . 1 873 74 GLU CG C 36.368 . 1 874 74 GLU N N 127.003 . 1 875 75 GLY H H 8.735 . 1 876 75 GLY HA2 H 4.460 . 2 877 75 GLY HA3 H 3.906 . 2 878 75 GLY C C 171.365 . 1 879 75 GLY CA C 44.543 . 1 880 75 GLY N N 109.437 . 1 881 76 MET H H 8.263 . 1 882 76 MET HA H 5.540 . 1 883 76 MET HB2 H 2.005 . 2 884 76 MET HB3 H 1.932 . 2 885 76 MET HG2 H 2.609 . 2 886 76 MET HG3 H 2.531 . 2 887 76 MET HE H 1.988 . 1 888 76 MET C C 177.035 . 1 889 76 MET CA C 53.774 . 1 890 76 MET CB C 32.227 . 1 891 76 MET CG C 31.748 . 1 892 76 MET CE C 15.950 . 1 893 76 MET N N 118.471 . 1 894 77 TYR H H 9.685 . 1 895 77 TYR HA H 4.973 . 1 896 77 TYR HB2 H 2.933 . 2 897 77 TYR HB3 H 2.455 . 2 898 77 TYR HD1 H 7.174 . 3 899 77 TYR HD2 H 7.174 . 3 900 77 TYR HE1 H 6.915 . 3 901 77 TYR HE2 H 6.915 . 3 902 77 TYR C C 173.692 . 1 903 77 TYR CA C 56.639 . 1 904 77 TYR CB C 41.785 . 1 905 77 TYR CD1 C 134.743 . 3 906 77 TYR CD2 C 134.743 . 3 907 77 TYR CE1 C 117.366 . 3 908 77 TYR CE2 C 117.366 . 3 909 77 TYR N N 124.810 . 1 910 78 ARG H H 8.571 . 1 911 78 ARG HA H 5.060 . 1 912 78 ARG HB2 H 1.862 . 2 913 78 ARG HB3 H 1.718 . 2 914 78 ARG HG2 H 1.463 . 2 915 78 ARG HG3 H 1.302 . 2 916 78 ARG HD2 H 3.139 . 2 917 78 ARG HD3 H 3.041 . 2 918 78 ARG HE H 8.884 . 1 919 78 ARG C C 175.519 . 1 920 78 ARG CA C 55.062 . 1 921 78 ARG CB C 31.592 . 1 922 78 ARG CG C 26.514 . 1 923 78 ARG CD C 43.151 . 1 924 78 ARG N N 122.907 . 1 925 78 ARG NE N 85.715 . 1 926 79 ILE H H 9.609 . 1 927 79 ILE HA H 4.901 . 1 928 79 ILE HB H 1.953 . 1 929 79 ILE HG12 H 1.382 . 2 930 79 ILE HG13 H 0.344 . 2 931 79 ILE HG2 H 0.626 . 1 932 79 ILE HD1 H -0.109 . 1 933 79 ILE C C 175.428 . 1 934 79 ILE CA C 60.204 . 1 935 79 ILE CB C 38.506 . 1 936 79 ILE CG1 C 27.056 . 1 937 79 ILE CG2 C 17.555 . 1 938 79 ILE CD1 C 12.205 . 1 939 79 ILE N N 132.189 . 1 940 80 ASN H H 8.981 . 1 941 80 ASN HA H 5.971 . 1 942 80 ASN HB2 H 2.579 . 2 943 80 ASN HB3 H 2.442 . 2 944 80 ASN HD21 H 6.820 . 1 945 80 ASN HD22 H 6.446 . 1 946 80 ASN C C 173.976 . 1 947 80 ASN CA C 51.715 . 1 948 80 ASN CB C 43.626 . 1 949 80 ASN CG C 175.717 . 1 950 80 ASN N N 123.729 . 1 951 80 ASN ND2 N 110.594 . 1 952 81 ALA H H 9.034 . 1 953 81 ALA HA H 6.185 . 1 954 81 ALA HB H 1.237 . 1 955 81 ALA C C 175.692 . 1 956 81 ALA CA C 49.681 . 1 957 81 ALA CB C 22.689 . 1 958 81 ALA N N 123.195 . 1 959 82 THR H H 9.642 . 1 960 82 THR HA H 5.582 . 1 961 82 THR HB H 4.447 . 1 962 82 THR HG1 H 6.630 . 1 963 82 THR HG2 H 1.266 . 1 964 82 THR C C 173.360 . 1 965 82 THR CA C 58.430 . 1 966 82 THR CB C 72.061 . 1 967 82 THR CG2 C 22.261 . 1 968 82 THR N N 110.774 . 1 969 83 VAL H H 8.337 . 1 970 83 VAL HA H 5.352 . 1 971 83 VAL HB H 1.819 . 1 972 83 VAL HG1 H 0.885 . 2 973 83 VAL HG2 H 0.953 . 2 974 83 VAL C C 174.034 . 1 975 83 VAL CA C 58.588 . 1 976 83 VAL CB C 35.069 . 1 977 83 VAL CG1 C 18.854 . 2 978 83 VAL CG2 C 23.582 . 2 979 83 VAL N N 117.465 . 1 980 84 ASP H H 8.669 . 1 981 84 ASP HA H 4.800 . 1 982 84 ASP HB2 H 2.975 . 2 983 84 ASP HB3 H 2.482 . 2 984 84 ASP C C 178.637 . 1 985 84 ASP CA C 55.858 . 1 986 84 ASP CB C 40.684 . 1 987 84 ASP N N 124.583 . 1 988 85 GLU H H 8.413 . 1 989 85 GLU HA H 4.098 . 1 990 85 GLU HB2 H 2.129 . 2 991 85 GLU HB3 H 1.925 . 2 992 85 GLU HG2 H 2.324 . 2 993 85 GLU HG3 H 2.324 . 2 994 85 GLU C C 178.303 . 1 995 85 GLU CA C 60.547 . 1 996 85 GLU CB C 30.229 . 1 997 85 GLU CG C 36.320 . 1 998 85 GLU N N 123.135 . 1 999 86 GLU H H 10.006 . 1 1000 86 GLU HA H 4.154 . 1 1001 86 GLU HB2 H 2.129 . 2 1002 86 GLU HB3 H 2.039 . 2 1003 86 GLU HG2 H 2.355 . 2 1004 86 GLU HG3 H 2.340 . 2 1005 86 GLU C C 175.706 . 1 1006 86 GLU CA C 57.669 . 1 1007 86 GLU CB C 29.041 . 1 1008 86 GLU CG C 37.207 . 1 1009 86 GLU N N 116.390 . 1 1010 87 ASN H H 8.188 . 1 1011 87 ASN HA H 5.036 . 1 1012 87 ASN HB2 H 3.332 . 2 1013 87 ASN HB3 H 2.366 . 2 1014 87 ASN HD21 H 7.759 . 1 1015 87 ASN HD22 H 6.831 . 1 1016 87 ASN C C 175.428 . 1 1017 87 ASN CA C 52.648 . 1 1018 87 ASN CB C 36.025 . 1 1019 87 ASN CG C 178.565 . 1 1020 87 ASN N N 119.187 . 1 1021 87 ASN ND2 N 112.560 . 1 1022 88 THR H H 10.569 . 1 1023 88 THR HA H 4.433 . 1 1024 88 THR HB H 4.429 . 1 1025 88 THR HG2 H 1.103 . 1 1026 88 THR C C 175.419 . 1 1027 88 THR CA C 61.920 . 1 1028 88 THR CB C 68.977 . 1 1029 88 THR CG2 C 22.173 . 1 1030 88 THR N N 114.484 . 1 1031 89 VAL H H 9.097 . 1 1032 89 VAL HA H 4.378 . 1 1033 89 VAL HB H 2.191 . 1 1034 89 VAL HG1 H 0.847 . 2 1035 89 VAL HG2 H 0.923 . 2 1036 89 VAL C C 176.250 . 1 1037 89 VAL CA C 61.284 . 1 1038 89 VAL CB C 33.365 . 1 1039 89 VAL CG1 C 21.392 . 2 1040 89 VAL CG2 C 20.542 . 2 1041 89 VAL N N 125.014 . 1 1042 90 VAL H H 9.136 . 1 1043 90 VAL HA H 4.048 . 1 1044 90 VAL HB H 2.068 . 1 1045 90 VAL HG1 H 0.813 . 2 1046 90 VAL HG2 H 1.013 . 2 1047 90 VAL C C 175.821 . 1 1048 90 VAL CA C 64.097 . 1 1049 90 VAL CB C 30.911 . 1 1050 90 VAL CG1 C 21.180 . 2 1051 90 VAL CG2 C 21.200 . 2 1052 90 VAL N N 134.703 . 1 1053 91 GLU H H 8.424 . 1 1054 91 GLU HA H 5.031 . 1 1055 91 GLU HB2 H 2.421 . 2 1056 91 GLU HB3 H 1.678 . 2 1057 91 GLU HG2 H 2.316 . 2 1058 91 GLU HG3 H 1.885 . 2 1059 91 GLU C C 176.558 . 1 1060 91 GLU CA C 53.975 . 1 1061 91 GLU CB C 37.145 . 1 1062 91 GLU CG C 38.374 . 1 1063 91 GLU N N 125.202 . 1 1064 92 LEU H H 8.125 . 1 1065 92 LEU HA H 3.955 . 1 1066 92 LEU HB2 H 1.549 . 2 1067 92 LEU HB3 H 1.549 . 2 1068 92 LEU HG H 1.573 . 1 1069 92 LEU HD1 H 0.989 . 2 1070 92 LEU HD2 H 0.982 . 2 1071 92 LEU C C 176.373 . 1 1072 92 LEU CA C 56.511 . 1 1073 92 LEU CB C 43.249 . 1 1074 92 LEU CG C 26.818 . 1 1075 92 LEU CD1 C 24.498 . 2 1076 92 LEU CD2 C 24.498 . 2 1077 92 LEU N N 116.288 . 1 1078 93 ASN H H 6.284 . 1 1079 93 ASN HA H 4.912 . 1 1080 93 ASN HB2 H 3.320 . 2 1081 93 ASN HB3 H 2.526 . 2 1082 93 ASN HD21 H 7.604 . 1 1083 93 ASN HD22 H 7.105 . 1 1084 93 ASN C C 175.733 . 1 1085 93 ASN CA C 51.727 . 1 1086 93 ASN CB C 39.580 . 1 1087 93 ASN CG C 176.786 . 1 1088 93 ASN N N 109.138 . 1 1089 93 ASN ND2 N 110.577 . 1 1090 94 GLU HA H 4.848 . 1 1091 94 GLU HB2 H 2.434 . 2 1092 94 GLU HB3 H 1.524 . 2 1093 94 GLU HG2 H 2.474 . 2 1094 94 GLU HG3 H 2.082 . 2 1095 94 GLU C C 176.942 . 1 1096 94 GLU CA C 55.393 . 1 1097 94 GLU CB C 28.428 . 1 1098 94 GLU CG C 33.523 . 1 1099 95 ASN H H 8.880 . 1 1100 95 ASN HA H 5.097 . 1 1101 95 ASN HB2 H 3.109 . 2 1102 95 ASN HB3 H 2.894 . 2 1103 95 ASN HD21 H 7.631 . 1 1104 95 ASN HD22 H 6.971 . 1 1105 95 ASN C C 174.350 . 1 1106 95 ASN CA C 53.798 . 1 1107 95 ASN CB C 39.529 . 1 1108 95 ASN CG C 177.567 . 1 1109 95 ASN N N 117.760 . 1 1110 95 ASN ND2 N 113.588 . 1 1111 96 ASN H H 7.678 . 1 1112 96 ASN HA H 5.327 . 1 1113 96 ASN HB2 H 3.325 . 2 1114 96 ASN HB3 H 2.654 . 2 1115 96 ASN HD21 H 8.404 . 1 1116 96 ASN HD22 H 8.197 . 1 1117 96 ASN C C 175.694 . 1 1118 96 ASN CA C 51.506 . 1 1119 96 ASN CB C 36.973 . 1 1120 96 ASN CG C 179.240 . 1 1121 96 ASN N N 119.200 . 1 1122 96 ASN ND2 N 115.727 . 1 1123 97 ASN H H 8.423 . 1 1124 97 ASN HA H 4.500 . 1 1125 97 ASN HB2 H 3.688 . 2 1126 97 ASN HB3 H 2.891 . 2 1127 97 ASN HD21 H 7.146 . 1 1128 97 ASN HD22 H 9.365 . 1 1129 97 ASN C C 172.867 . 1 1130 97 ASN CA C 54.174 . 1 1131 97 ASN CB C 37.381 . 1 1132 97 ASN N N 119.174 . 1 1133 97 ASN ND2 N 121.957 . 1 1134 98 VAL H H 7.545 . 1 1135 98 VAL HA H 5.149 . 1 1136 98 VAL HB H 1.953 . 1 1137 98 VAL HG1 H 0.862 . 2 1138 98 VAL HG2 H 0.900 . 2 1139 98 VAL C C 174.661 . 1 1140 98 VAL CA C 60.472 . 1 1141 98 VAL CB C 35.396 . 1 1142 98 VAL CG1 C 20.555 . 2 1143 98 VAL CG2 C 21.028 . 2 1144 98 VAL N N 116.287 . 1 1145 99 ALA H H 9.309 . 1 1146 99 ALA HA H 5.036 . 1 1147 99 ALA HB H 1.506 . 1 1148 99 ALA C C 176.452 . 1 1149 99 ALA CA C 50.579 . 1 1150 99 ALA CB C 22.839 . 1 1151 99 ALA N N 129.392 . 1 1152 100 THR H H 8.809 . 1 1153 100 THR HA H 5.112 . 1 1154 100 THR HB H 3.872 . 1 1155 100 THR HG2 H 1.087 . 1 1156 100 THR C C 173.096 . 1 1157 100 THR CA C 61.740 . 1 1158 100 THR CB C 71.459 . 1 1159 100 THR CG2 C 21.455 . 1 1160 100 THR N N 116.886 . 1 1161 101 PHE H H 9.431 . 1 1162 101 PHE HA H 4.662 . 1 1163 101 PHE HB2 H 3.007 . 2 1164 101 PHE HB3 H 2.721 . 2 1165 101 PHE HD1 H 7.076 . 3 1166 101 PHE HD2 H 7.076 . 3 1167 101 PHE HE1 H 7.444 . 3 1168 101 PHE HE2 H 7.444 . 3 1169 101 PHE HZ H 7.452 . 1 1170 101 PHE C C 173.153 . 1 1171 101 PHE CA C 58.104 . 1 1172 101 PHE CB C 44.323 . 1 1173 101 PHE CD1 C 131.373 . 3 1174 101 PHE CD2 C 131.373 . 3 1175 101 PHE CE1 C 131.373 . 3 1176 101 PHE CE2 C 131.373 . 3 1177 101 PHE CZ C 130.84 . 1 1178 101 PHE N N 129.977 . 1 1179 102 ASP H H 8.054 . 1 1180 102 ASP HA H 5.585 . 1 1181 102 ASP HB2 H 2.484 . 2 1182 102 ASP HB3 H 2.365 . 2 1183 102 ASP C C 174.817 . 1 1184 102 ASP CA C 54.411 . 1 1185 102 ASP CB C 42.405 . 1 1186 102 ASP N N 129.424 . 1 1187 103 VAL H H 9.295 . 1 1188 103 VAL HA H 4.606 . 1 1189 103 VAL HB H 2.135 . 1 1190 103 VAL HG1 H 1.128 . 2 1191 103 VAL HG2 H 1.200 . 2 1192 103 VAL C C 174.858 . 1 1193 103 VAL CA C 60.898 . 1 1194 103 VAL CB C 36.279 . 1 1195 103 VAL CG1 C 21.662 . 2 1196 103 VAL CG2 C 21.966 . 2 1197 103 VAL N N 122.749 . 1 1198 104 SER H H 8.488 . 1 1199 104 SER HA H 5.198 . 1 1200 104 SER HB2 H 3.919 . 2 1201 104 SER HB3 H 3.868 . 2 1202 104 SER C C 173.020 . 1 1203 104 SER CA C 57.073 . 1 1204 104 SER CB C 64.532 . 1 1205 104 SER N N 122.474 . 1 1206 105 VAL H H 9.253 . 1 1207 105 VAL HA H 5.469 . 1 1208 105 VAL HB H 2.530 . 1 1209 105 VAL HG1 H 0.627 . 2 1210 105 VAL HG2 H 0.820 . 2 1211 105 VAL C C 177.786 . 1 1212 105 VAL CA C 60.647 . 1 1213 105 VAL CB C 31.601 . 1 1214 105 VAL CG1 C 21.543 . 2 1215 105 VAL CG2 C 22.798 . 2 1216 105 VAL N N 127.805 . 1 1217 106 VAL H H 8.563 . 1 1218 106 VAL HA H 4.896 . 1 1219 106 VAL HB H 2.182 . 1 1220 106 VAL HG1 H 0.851 . 2 1221 106 VAL HG2 H 0.613 . 2 1222 106 VAL C C 175.452 . 1 1223 106 VAL CA C 58.810 . 1 1224 106 VAL CB C 35.409 . 1 1225 106 VAL CG1 C 21.495 . 2 1226 106 VAL CG2 C 18.146 . 2 1227 106 VAL N N 121.562 . 1 1228 107 LEU H H 8.578 . 1 1229 107 LEU HA H 4.265 . 1 1230 107 LEU HB2 H 1.544 . 2 1231 107 LEU HB3 H 1.544 . 2 1232 107 LEU HG H 1.483 . 1 1233 107 LEU HD1 H 0.896 . 2 1234 107 LEU HD2 H 0.865 . 2 1235 107 LEU C C 177.313 . 1 1236 107 LEU CA C 55.847 . 1 1237 107 LEU CB C 42.387 . 1 1238 107 LEU CG C 27.172 . 1 1239 107 LEU CD1 C 24.466 . 2 1240 107 LEU CD2 C 24.351 . 2 1241 107 LEU N N 123.215 . 1 1242 108 GLU H H 8.330 . 1 1243 108 GLU HA H 4.268 . 1 1244 108 GLU HB2 H 1.851 . 2 1245 108 GLU HB3 H 1.851 . 2 1246 108 GLU HG2 H 2.177 . 2 1247 108 GLU HG3 H 2.037 . 2 1248 108 GLU C C 175.465 . 1 1249 108 GLU CA C 56.131 . 1 1250 108 GLU CB C 31.127 . 1 1251 108 GLU CG C 36.495 . 1 1252 108 GLU N N 121.238 . 1 cwd: /data/PSVS/PSVS-v1.4-dev/results/PFR193A_NMR_em_bcr3 command to execute is: /farm/software/asdp/asdp-1.0-release/bin//../bin/noesyassign -c /data/PSVS/PSVS-v1.4-dev/results/PFR193A_NMR_em_bcr3/rpf_calc/input/ctrl_file -o rpf_calc -q PFR193A_NMR_em_bcr3.pdb.iupac 2>&1| ASDP Version 1.0 Copyright(C) 2010 Center for Advanced Biotechnology and Medicine (CABM) Rutgers University Reading Control_File ...  Doing SimpleMatch for n.peaks ...   Doing SimpleMatch for c_aro.peaks ...   Doing SimpleMatch for c_ali.peaks ...   Reading ComparePdbFile: PFR193A_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: PFR193A_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: PFR193A_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: PFR193A_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: PFR193A_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: PFR193A_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: PFR193A_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: PFR193A_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: PFR193A_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: PFR193A_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: PFR193A_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: PFR193A_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: PFR193A_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: PFR193A_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: PFR193A_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: PFR193A_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: PFR193A_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: PFR193A_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: PFR193A_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: PFR193A_NMR_em_bcr3.pdb.iupac  quality-estimation for n.peaks ...   Doing Recall analysis for n.peaks ...  Doing Precision analysis for n.peaks ...  Doing Recall analysis for n.peaks ...  Doing Precision analysis for n.peaks ... prtSimleMatchPeakAtom for n.peaks ...   quality-estimation for c_aro.peaks ...   Doing Recall analysis for c_aro.peaks ...  Doing Precision analysis for c_aro.peaks ...  Doing Recall analysis for c_aro.peaks ...  Doing Precision analysis for c_aro.peaks ... prtSimleMatchPeakAtom for c_aro.peaks ...   quality-estimation for c_ali.peaks ...   Doing Recall analysis for c_ali.peaks ...  Doing Precision analysis for c_ali.peaks ...  Doing Recall analysis for c_ali.peaks ...  Doing Precision analysis for c_ali.peaks ... prtSimleMatchPeakAtom for c_ali.peaks ...