AS object created. control filepath is: /data/PSVS/PSVS-v1.4-dev/results/SGR145_R3_em_bcr3/rpf_calc/input/ctrl_file bmrb: chem_shift.bmrb sequence: SGR145_R3_em_bcr3_seq.bmrb parsing bmrb: /data/PSVS/PSVS-v1.4-dev/results/SGR145_R3_em_bcr3/rpf_calc/input/chem_shift.bmrb new residue 2 adding: *1* *2* *Trp* *HE1* *H* *10.182* *.* *1* old residue 2 adding: *2* *2* *Trp* *NE1* *N* *129.364* *.* *1* new residue 8 adding: *3* *8* *Gln* *H* *H* *8.446* *.* *1* old residue 8 adding: *4* *8* *Gln* *N* *N* *121.976* *.* *1* new residue 12 adding: *5* *12* *Val* *HG1* *H* *0.716* *.* *2* old residue 12 adding: *6* *12* *Val* *HG2* *H* *0.752* *.* *2* old residue 12 adding: *7* *12* *Val* *CG1* *C* *20.903* *.* *2* old residue 12 adding: *8* *12* *Val* *CG2* *C* *20.749* *.* *2* new residue 21 adding: *9* *21* *Leu* *H* *H* *8.503* *.* *1* old residue 21 adding: *10* *21* *Leu* *HD1* *H* *0.774* *.* *2* old residue 21 adding: *11* *21* *Leu* *HD2* *H* *0.936* *.* *2* old residue 21 adding: *12* *21* *Leu* *C* *C* *178.031* *.* *1* old residue 21 adding: *13* *21* *Leu* *CA* *C* *57.976* *.* *1* old residue 21 adding: *14* *21* *Leu* *CB* *C* *41.831* *.* *1* old residue 21 adding: *15* *21* *Leu* *CD1* *C* *23.623* *.* *2* old residue 21 adding: *16* *21* *Leu* *CD2* *C* *26.298* *.* *2* old residue 21 adding: *17* *21* *Leu* *N* *N* *124.586* *.* *1* new residue 22 adding: *18* *22* *Val* *H* *H* *7.889* *.* *1* old residue 22 adding: *19* *22* *Val* *HG1* *H* *0.757* *.* *2* old residue 22 adding: *20* *22* *Val* *HG2* *H* *0.212* *.* *2* old residue 22 adding: *21* *22* *Val* *C* *C* *179.007* *.* *1* old residue 22 adding: *22* *22* *Val* *CA* *C* *66.543* *.* *1* old residue 22 adding: *23* *22* *Val* *CB* *C* *31.744* *.* *1* old residue 22 adding: *24* *22* *Val* *CG1* *C* *20.731* *.* *2* old residue 22 adding: *25* *22* *Val* *CG2* *C* *21.487* *.* *2* old residue 22 adding: *26* *22* *Val* *N* *N* *115.794* *.* *1* new residue 23 adding: *27* *23* *Ser* *H* *H* *7.620* *.* *1* old residue 23 adding: *28* *23* *Ser* *C* *C* *176.013* *.* *1* old residue 23 adding: *29* *23* *Ser* *CA* *C* *61.344* *.* *1* old residue 23 adding: *30* *23* *Ser* *CB* *C* *63.576* *.* *1* old residue 23 adding: *31* *23* *Ser* *N* *N* *114.438* *.* *1* new residue 24 adding: *32* *24* *Val* *H* *H* *7.153* *.* *1* old residue 24 adding: *33* *24* *Val* *HG1* *H* *0.346* *.* *2* old residue 24 adding: *34* *24* *Val* *HG2* *H* *0.222* *.* *2* old residue 24 adding: *35* *24* *Val* *C* *C* *177.092* *.* *1* old residue 24 adding: *36* *24* *Val* *CA* *C* *61.176* *.* *1* old residue 24 adding: *37* *24* *Val* *CB* *C* *32.230* *.* *1* old residue 24 adding: *38* *24* *Val* *CG1* *C* *21.520* *.* *2* old residue 24 adding: *39* *24* *Val* *CG2* *C* *17.612* *.* *2* old residue 24 adding: *40* *24* *Val* *N* *N* *111.911* *.* *1* new residue 25 adding: *41* *25* *Ala* *H* *H* *7.619* *.* *1* old residue 25 adding: *42* *25* *Ala* *C* *C* *178.065* *.* *1* old residue 25 adding: *43* *25* *Ala* *CA* *C* *55.707* *.* *1* old residue 25 adding: *44* *25* *Ala* *CB* *C* *17.553* *.* *1* old residue 25 adding: *45* *25* *Ala* *N* *N* *125.280* *.* *1* new residue 26 adding: *46* *26* *Asn* *H* *H* *8.204* *.* *1* old residue 26 adding: *47* *26* *Asn* *C* *C* *176.888* *.* *1* old residue 26 adding: *48* *26* *Asn* *CA* *C* *54.771* *.* *1* old residue 26 adding: *49* *26* *Asn* *CB* *C* *37.341* *.* *1* old residue 26 adding: *50* *26* *Asn* *N* *N* *109.515* *.* *1* new residue 27 adding: *51* *27* *Gln* *H* *H* *8.305* *.* *1* old residue 27 adding: *52* *27* *Gln* *C* *C* *175.842* *.* *1* old residue 27 adding: *53* *27* *Gln* *CA* *C* *56.083* *.* *1* old residue 27 adding: *54* *27* *Gln* *CB* *C* *28.964* *.* *1* old residue 27 adding: *55* *27* *Gln* *N* *N* *117.788* *.* *1* new residue 28 adding: *56* *28* *Ile* *H* *H* *7.674* *.* *1* old residue 28 adding: *57* *28* *Ile* *HD1* *H* *0.307* *.* *1* old residue 28 adding: *58* *28* *Ile* *C* *C* *175.651* *.* *1* old residue 28 adding: *59* *28* *Ile* *CA* *C* *59.983* *.* *1* old residue 28 adding: *60* *28* *Ile* *CB* *C* *37.627* *.* *1* old residue 28 adding: *61* *28* *Ile* *CD1* *C* *13.820* *.* *1* old residue 28 adding: *62* *28* *Ile* *N* *N* *120.944* *.* *1* new residue 29 adding: *63* *29* *Pro* *C* *C* *175.430* *.* *1* old residue 29 adding: *64* *29* *Pro* *CA* *C* *63.730* *.* *1* old residue 29 adding: *65* *29* *Pro* *CB* *C* *31.596* *.* *1* new residue 30 adding: *66* *30* *Gln* *H* *H* *7.994* *.* *1* old residue 30 adding: *67* *30* *Gln* *C* *C* *176.838* *.* *1* old residue 30 adding: *68* *30* *Gln* *CA* *C* *57.600* *.* *1* old residue 30 adding: *69* *30* *Gln* *CB* *C* *28.377* *.* *1* old residue 30 adding: *70* *30* *Gln* *N* *N* *117.512* *.* *1* new residue 31 adding: *71* *31* *Gly* *H* *H* *7.388* *.* *1* old residue 31 adding: *72* *31* *Gly* *C* *C* *172.651* *.* *1* old residue 31 adding: *73* *31* *Gly* *CA* *C* *45.604* *.* *1* old residue 31 adding: *74* *31* *Gly* *N* *N* *109.764* *.* *1* new residue 32 adding: *75* *32* *Lys* *H* *H* *9.707* *.* *1* old residue 32 adding: *76* *32* *Lys* *C* *C* *176.964* *.* *1* old residue 32 adding: *77* *32* *Lys* *CA* *C* *56.201* *.* *1* old residue 32 adding: *78* *32* *Lys* *CB* *C* *35.004* *.* *1* old residue 32 adding: *79* *32* *Lys* *N* *N* *126.107* *.* *1* new residue 33 adding: *80* *33* *Ile* *H* *H* *8.778* *.* *1* old residue 33 adding: *81* *33* *Ile* *HD1* *H* *0.223* *.* *1* old residue 33 adding: *82* *33* *Ile* *C* *C* *173.323* *.* *1* old residue 33 adding: *83* *33* *Ile* *CA* *C* *58.669* *.* *1* old residue 33 adding: *84* *33* *Ile* *CB* *C* *41.740* *.* *1* old residue 33 adding: *85* *33* *Ile* *CD1* *C* *14.396* *.* *1* old residue 33 adding: *86* *33* *Ile* *N* *N* *120.931* *.* *1* new residue 34 adding: *87* *34* *Leu* *H* *H* *8.210* *.* *1* old residue 34 adding: *88* *34* *Leu* *HD1* *H* *0.339* *.* *2* old residue 34 adding: *89* *34* *Leu* *HD2* *H* *0.280* *.* *2* old residue 34 adding: *90* *34* *Leu* *C* *C* *175.238* *.* *1* old residue 34 adding: *91* *34* *Leu* *CA* *C* *52.911* *.* *1* old residue 34 adding: *92* *34* *Leu* *CB* *C* *42.608* *.* *1* old residue 34 adding: *93* *34* *Leu* *CD1* *C* *22.662* *.* *2* old residue 34 adding: *94* *34* *Leu* *CD2* *C* *25.404* *.* *2* old residue 34 adding: *95* *34* *Leu* *N* *N* *130.293* *.* *1* new residue 35 adding: *96* *35* *Cys* *H* *H* *9.130* *.* *1* old residue 35 adding: *97* *35* *Cys* *C* *C* *175.640* *.* *1* old residue 35 adding: *98* *35* *Cys* *CA* *C* *58.020* *.* *1* old residue 35 adding: *99* *35* *Cys* *CB* *C* *29.302* *.* *1* old residue 35 adding: *100* *35* *Cys* *N* *N* *124.073* *.* *1* new residue 36 adding: *101* *36* *Leu* *H* *H* *8.100* *.* *1* old residue 36 adding: *102* *36* *Leu* *HD1* *H* *0.862* *.* *2* old residue 36 adding: *103* *36* *Leu* *HD2* *H* *0.618* *.* *2* old residue 36 adding: *104* *36* *Leu* *C* *C* *176.248* *.* *1* old residue 36 adding: *105* *36* *Leu* *CA* *C* *54.618* *.* *1* old residue 36 adding: *106* *36* *Leu* *CB* *C* *42.107* *.* *1* old residue 36 adding: *107* *36* *Leu* *CD1* *C* *25.135* *.* *2* old residue 36 adding: *108* *36* *Leu* *CD2* *C* *21.810* *.* *2* old residue 36 adding: *109* *36* *Leu* *N* *N* *122.749* *.* *1* new residue 37 adding: *110* *37* *Ala* *H* *H* *7.785* *.* *1* old residue 37 adding: *111* *37* *Ala* *C* *C* *177.527* *.* *1* old residue 37 adding: *112* *37* *Ala* *CA* *C* *53.330* *.* *1* old residue 37 adding: *113* *37* *Ala* *CB* *C* *17.160* *.* *1* old residue 37 adding: *114* *37* *Ala* *N* *N* *124.510* *.* *1* new residue 41 adding: *115* *41* *Gly* *C* *C* *176.068* *.* *1* old residue 41 adding: *116* *41* *Gly* *CA* *C* *47.326* *.* *1* new residue 42 adding: *117* *42* *Arg* *H* *H* *7.866* *.* *1* old residue 42 adding: *118* *42* *Arg* *C* *C* *178.614* *.* *1* old residue 42 adding: *119* *42* *Arg* *CA* *C* *58.713* *.* *1* old residue 42 adding: *120* *42* *Arg* *CB* *C* *28.288* *.* *1* old residue 42 adding: *121* *42* *Arg* *N* *N* *118.964* *.* *1* new residue 43 adding: *122* *43* *Asn* *H* *H* *8.883* *.* *1* old residue 43 adding: *123* *43* *Asn* *C* *C* *177.653* *.* *1* old residue 43 adding: *124* *43* *Asn* *CA* *C* *57.009* *.* *1* old residue 43 adding: *125* *43* *Asn* *CB* *C* *38.026* *.* *1* old residue 43 adding: *126* *43* *Asn* *N* *N* *119.555* *.* *1* new residue 44 adding: *127* *44* *Ala* *H* *H* *9.656* *.* *1* old residue 44 adding: *128* *44* *Ala* *C* *C* *179.832* *.* *1* old residue 44 adding: *129* *44* *Ala* *CA* *C* *55.579* *.* *1* old residue 44 adding: *130* *44* *Ala* *CB* *C* *18.435* *.* *1* old residue 44 adding: *131* *44* *Ala* *N* *N* *124.769* *.* *1* new residue 45 adding: *132* *45* *Cys* *H* *H* *8.694* *.* *1* old residue 45 adding: *133* *45* *Cys* *C* *C* *177.623* *.* *1* old residue 45 adding: *134* *45* *Cys* *CA* *C* *64.542* *.* *1* old residue 45 adding: *135* *45* *Cys* *CB* *C* *26.692* *.* *1* old residue 45 adding: *136* *45* *Cys* *N* *N* *112.322* *.* *1* new residue 46 adding: *137* *46* *Phe* *H* *H* *6.979* *.* *1* old residue 46 adding: *138* *46* *Phe* *C* *C* *178.201* *.* *1* old residue 46 adding: *139* *46* *Phe* *CA* *C* *60.655* *.* *1* old residue 46 adding: *140* *46* *Phe* *CB* *C* *38.954* *.* *1* old residue 46 adding: *141* *46* *Phe* *N* *N* *120.419* *.* *1* new residue 47 adding: *142* *47* *Leu* *H* *H* *8.091* *.* *1* old residue 47 adding: *143* *47* *Leu* *HD1* *H* *0.642* *.* *2* old residue 47 adding: *144* *47* *Leu* *HD2* *H* *0.453* *.* *2* old residue 47 adding: *145* *47* *Leu* *C* *C* *179.663* *.* *1* old residue 47 adding: *146* *47* *Leu* *CA* *C* *57.946* *.* *1* old residue 47 adding: *147* *47* *Leu* *CB* *C* *41.577* *.* *1* old residue 47 adding: *148* *47* *Leu* *CD1* *C* *25.925* *.* *2* old residue 47 adding: *149* *47* *Leu* *CD2* *C* *21.324* *.* *2* old residue 47 adding: *150* *47* *Leu* *N* *N* *120.097* *.* *1* new residue 48 adding: *151* *48* *Ala* *H* *H* *8.543* *.* *1* old residue 48 adding: *152* *48* *Ala* *C* *C* *182.532* *.* *1* old residue 48 adding: *153* *48* *Ala* *CA* *C* *54.842* *.* *1* old residue 48 adding: *154* *48* *Ala* *CB* *C* *18.194* *.* *1* old residue 48 adding: *155* *48* *Ala* *N* *N* *122.491* *.* *1* new residue 49 adding: *156* *49* *Ser* *H* *H* *8.021* *.* *1* old residue 49 adding: *157* *49* *Ser* *C* *C* *174.987* *.* *1* old residue 49 adding: *158* *49* *Ser* *CA* *C* *61.560* *.* *1* old residue 49 adding: *159* *49* *Ser* *CB* *C* *62.883* *.* *1* old residue 49 adding: *160* *49* *Ser* *N* *N* *117.016* *.* *1* new residue 50 adding: *161* *50* *Leu* *H* *H* *7.146* *.* *1* old residue 50 adding: *162* *50* *Leu* *HD1* *H* *0.624* *.* *2* old residue 50 adding: *163* *50* *Leu* *HD2* *H* *0.700* *.* *2* old residue 50 adding: *164* *50* *Leu* *C* *C* *177.841* *.* *1* old residue 50 adding: *165* *50* *Leu* *CA* *C* *54.944* *.* *1* old residue 50 adding: *166* *50* *Leu* *CB* *C* *42.081* *.* *1* old residue 50 adding: *167* *50* *Leu* *CD1* *C* *26.054* *.* *2* old residue 50 adding: *168* *50* *Leu* *CD2* *C* *21.727* *.* *2* old residue 50 adding: *169* *50* *Leu* *N* *N* *120.750* *.* *1* new residue 51 adding: *170* *51* *Gly* *H* *H* *7.776* *.* *1* old residue 51 adding: *171* *51* *Gly* *C* *C* *174.999* *.* *1* old residue 51 adding: *172* *51* *Gly* *CA* *C* *44.925* *.* *1* old residue 51 adding: *173* *51* *Gly* *N* *N* *105.208* *.* *1* new residue 52 adding: *174* *52* *Tyr* *H* *H* *7.088* *.* *1* old residue 52 adding: *175* *52* *Tyr* *C* *C* *175.330* *.* *1* old residue 52 adding: *176* *52* *Tyr* *CA* *C* *59.333* *.* *1* old residue 52 adding: *177* *52* *Tyr* *CB* *C* *38.877* *.* *1* old residue 52 adding: *178* *52* *Tyr* *N* *N* *118.637* *.* *1* new residue 53 adding: *179* *53* *Glu* *H* *H* *8.439* *.* *1* old residue 53 adding: *180* *53* *Glu* *C* *C* *177.573* *.* *1* old residue 53 adding: *181* *53* *Glu* *CA* *C* *55.784* *.* *1* old residue 53 adding: *182* *53* *Glu* *CB* *C* *29.971* *.* *1* old residue 53 adding: *183* *53* *Glu* *N* *N* *122.887* *.* *1* new residue 54 adding: *184* *54* *Val* *H* *H* *9.620* *.* *1* old residue 54 adding: *185* *54* *Val* *HG1* *H* *0.955* *.* *2* old residue 54 adding: *186* *54* *Val* *HG2* *H* *0.931* *.* *2* old residue 54 adding: *187* *54* *Val* *C* *C* *176.109* *.* *1* old residue 54 adding: *188* *54* *Val* *CA* *C* *63.265* *.* *1* old residue 54 adding: *189* *54* *Val* *CB* *C* *34.959* *.* *1* old residue 54 adding: *190* *54* *Val* *CG1* *C* *22.509* *.* *2* old residue 54 adding: *191* *54* *Val* *CG2* *C* *22.205* *.* *2* old residue 54 adding: *192* *54* *Val* *N* *N* *129.989* *.* *1* new residue 55 adding: *193* *55* *Thr* *H* *H* *9.477* *.* *1* old residue 55 adding: *194* *55* *Thr* *C* *C* *172.125* *.* *1* old residue 55 adding: *195* *55* *Thr* *CA* *C* *62.059* *.* *1* old residue 55 adding: *196* *55* *Thr* *CB* *C* *71.193* *.* *1* old residue 55 adding: *197* *55* *Thr* *N* *N* *125.500* *.* *1* new residue 56 adding: *198* *56* *Ala* *H* *H* *9.368* *.* *1* old residue 56 adding: *199* *56* *Ala* *C* *C* *174.034* *.* *1* old residue 56 adding: *200* *56* *Ala* *CA* *C* *50.296* *.* *1* old residue 56 adding: *201* *56* *Ala* *CB* *C* *20.643* *.* *1* old residue 56 adding: *202* *56* *Ala* *N* *N* *130.486* *.* *1* new residue 57 adding: *203* *57* *Val* *H* *H* *8.001* *.* *1* old residue 57 adding: *204* *57* *Val* *HG1* *H* *0.453* *.* *2* old residue 57 adding: *205* *57* *Val* *HG2* *H* *0.153* *.* *2* old residue 57 adding: *206* *57* *Val* *C* *C* *175.055* *.* *1* old residue 57 adding: *207* *57* *Val* *CA* *C* *58.830* *.* *1* old residue 57 adding: *208* *57* *Val* *CB* *C* *34.538* *.* *1* old residue 57 adding: *209* *57* *Val* *CG1* *C* *20.501* *.* *2* old residue 57 adding: *210* *57* *Val* *CG2* *C* *21.480* *.* *2* old residue 57 adding: *211* *57* *Val* *N* *N* *121.126* *.* *1* new residue 58 adding: *212* *58* *Asp* *H* *H* *8.412* *.* *1* old residue 58 adding: *213* *58* *Asp* *C* *C* *174.923* *.* *1* old residue 58 adding: *214* *58* *Asp* *CA* *C* *54.675* *.* *1* old residue 58 adding: *215* *58* *Asp* *CB* *C* *46.800* *.* *1* old residue 58 adding: *216* *58* *Asp* *N* *N* *125.094* *.* *1* new residue 59 adding: *217* *59* *Gln* *H* *H* *8.476* *.* *1* old residue 59 adding: *218* *59* *Gln* *C* *C* *177.044* *.* *1* old residue 59 adding: *219* *59* *Gln* *CA* *C* *57.419* *.* *1* old residue 59 adding: *220* *59* *Gln* *CB* *C* *29.094* *.* *1* old residue 59 adding: *221* *59* *Gln* *N* *N* *120.047* *.* *1* new residue 60 adding: *222* *60* *Ser* *H* *H* *9.158* *.* *1* old residue 60 adding: *223* *60* *Ser* *C* *C* *175.734* *.* *1* old residue 60 adding: *224* *60* *Ser* *CA* *C* *56.940* *.* *1* old residue 60 adding: *225* *60* *Ser* *CB* *C* *64.352* *.* *1* old residue 60 adding: *226* *60* *Ser* *N* *N* *115.261* *.* *1* new residue 61 adding: *227* *61* *Ser* *H* *H* *8.974* *.* *1* old residue 61 adding: *228* *61* *Ser* *C* *C* *177.834* *.* *1* old residue 61 adding: *229* *61* *Ser* *CA* *C* *61.303* *.* *1* old residue 61 adding: *230* *61* *Ser* *CB* *C* *62.517* *.* *1* old residue 61 adding: *231* *61* *Ser* *N* *N* *124.466* *.* *1* new residue 62 adding: *232* *62* *Val* *H* *H* *7.845* *.* *1* old residue 62 adding: *233* *62* *Val* *HG1* *H* *0.929* *.* *2* old residue 62 adding: *234* *62* *Val* *HG2* *H* *1.024* *.* *2* old residue 62 adding: *235* *62* *Val* *C* *C* *178.961* *.* *1* old residue 62 adding: *236* *62* *Val* *CA* *C* *65.966* *.* *1* old residue 62 adding: *237* *62* *Val* *CB* *C* *32.141* *.* *1* old residue 62 adding: *238* *62* *Val* *CG1* *C* *20.705* *.* *2* old residue 62 adding: *239* *62* *Val* *CG2* *C* *21.883* *.* *2* old residue 62 adding: *240* *62* *Val* *N* *N* *123.568* *.* *1* new residue 63 adding: *241* *63* *Gly* *H* *H* *8.223* *.* *1* old residue 63 adding: *242* *63* *Gly* *C* *C* *176.479* *.* *1* old residue 63 adding: *243* *63* *Gly* *CA* *C* *47.825* *.* *1* old residue 63 adding: *244* *63* *Gly* *N* *N* *109.354* *.* *1* new residue 64 adding: *245* *64* *Leu* *H* *H* *7.783* *.* *1* old residue 64 adding: *246* *64* *Leu* *HD1* *H* *0.797* *.* *2* old residue 64 adding: *247* *64* *Leu* *HD2* *H* *0.656* *.* *2* old residue 64 adding: *248* *64* *Leu* *C* *C* *179.478* *.* *1* old residue 64 adding: *249* *64* *Leu* *CA* *C* *57.520* *.* *1* old residue 64 adding: *250* *64* *Leu* *CB* *C* *41.233* *.* *1* old residue 64 adding: *251* *64* *Leu* *CD1* *C* *25.462* *.* *2* old residue 64 adding: *252* *64* *Leu* *CD2* *C* *21.173* *.* *2* old residue 64 adding: *253* *64* *Leu* *N* *N* *119.433* *.* *1* new residue 65 adding: *254* *65* *Ala* *H* *H* *7.928* *.* *1* old residue 65 adding: *255* *65* *Ala* *C* *C* *182.018* *.* *1* old residue 65 adding: *256* *65* *Ala* *CA* *C* *55.598* *.* *1* old residue 65 adding: *257* *65* *Ala* *CB* *C* *17.619* *.* *1* old residue 65 adding: *258* *65* *Ala* *N* *N* *121.987* *.* *1* new residue 66 adding: *259* *66* *Lys* *H* *H* *7.951* *.* *1* old residue 66 adding: *260* *66* *Lys* *C* *C* *179.872* *.* *1* old residue 66 adding: *261* *66* *Lys* *CA* *C* *59.767* *.* *1* old residue 66 adding: *262* *66* *Lys* *CB* *C* *31.338* *.* *1* old residue 66 adding: *263* *66* *Lys* *N* *N* *120.547* *.* *1* new residue 67 adding: *264* *67* *Ala* *H* *H* *8.187* *.* *1* old residue 67 adding: *265* *67* *Ala* *C* *C* *179.542* *.* *1* old residue 67 adding: *266* *67* *Ala* *CA* *C* *55.544* *.* *1* old residue 67 adding: *267* *67* *Ala* *CB* *C* *16.688* *.* *1* old residue 67 adding: *268* *67* *Ala* *N* *N* *124.216* *.* *1* new residue 68 adding: *269* *68* *Lys* *H* *H* *8.083* *.* *1* old residue 68 adding: *270* *68* *Lys* *C* *C* *180.064* *.* *1* old residue 68 adding: *271* *68* *Lys* *CA* *C* *59.688* *.* *1* old residue 68 adding: *272* *68* *Lys* *CB* *C* *31.968* *.* *1* old residue 68 adding: *273* *68* *Lys* *N* *N* *116.475* *.* *1* new residue 69 adding: *274* *69* *Gln* *H* *H* *7.935* *.* *1* old residue 69 adding: *275* *69* *Gln* *C* *C* *178.504* *.* *1* old residue 69 adding: *276* *69* *Gln* *CA* *C* *59.146* *.* *1* old residue 69 adding: *277* *69* *Gln* *CB* *C* *28.119* *.* *1* old residue 69 adding: *278* *69* *Gln* *N* *N* *120.633* *.* *1* new residue 70 adding: *279* *70* *Leu* *H* *H* *8.290* *.* *1* old residue 70 adding: *280* *70* *Leu* *HD1* *H* *0.526* *.* *2* old residue 70 adding: *281* *70* *Leu* *C* *C* *178.826* *.* *1* old residue 70 adding: *282* *70* *Leu* *CA* *C* *57.839* *.* *1* old residue 70 adding: *283* *70* *Leu* *CB* *C* *40.693* *.* *1* old residue 70 adding: *284* *70* *Leu* *CD1* *C* *25.250* *.* *2* old residue 70 adding: *285* *70* *Leu* *N* *N* *122.888* *.* *1* new residue 71 adding: *286* *71* *Ala* *H* *H* *8.270* *.* *1* old residue 71 adding: *287* *71* *Ala* *C* *C* *180.004* *.* *1* old residue 71 adding: *288* *71* *Ala* *CA* *C* *55.602* *.* *1* old residue 71 adding: *289* *71* *Ala* *CB* *C* *17.436* *.* *1* old residue 71 adding: *290* *71* *Ala* *N* *N* *120.809* *.* *1* new residue 72 adding: *291* *72* *Gln* *H* *H* *7.797* *.* *1* old residue 72 adding: *292* *72* *Gln* *C* *C* *180.345* *.* *1* old residue 72 adding: *293* *72* *Gln* *CA* *C* *59.039* *.* *1* old residue 72 adding: *294* *72* *Gln* *CB* *C* *28.100* *.* *1* old residue 72 adding: *295* *72* *Gln* *N* *N* *117.093* *.* *1* new residue 73 adding: *296* *73* *Glu* *H* *H* *8.227* *.* *1* old residue 73 adding: *297* *73* *Glu* *C* *C* *179.404* *.* *1* old residue 73 adding: *298* *73* *Glu* *CA* *C* *59.463* *.* *1* old residue 73 adding: *299* *73* *Glu* *CB* *C* *29.272* *.* *1* old residue 73 adding: *300* *73* *Glu* *N* *N* *121.109* *.* *1* new residue 74 adding: *301* *74* *Lys* *H* *H* *8.338* *.* *1* old residue 74 adding: *302* *74* *Lys* *C* *C* *177.156* *.* *1* old residue 74 adding: *303* *74* *Lys* *CA* *C* *55.996* *.* *1* old residue 74 adding: *304* *74* *Lys* *CB* *C* *32.618* *.* *1* old residue 74 adding: *305* *74* *Lys* *N* *N* *116.178* *.* *1* new residue 75 adding: *306* *75* *Gly* *H* *H* *7.990* *.* *1* old residue 75 adding: *307* *75* *Gly* *C* *C* *175.545* *.* *1* old residue 75 adding: *308* *75* *Gly* *CA* *C* *46.839* *.* *1* old residue 75 adding: *309* *75* *Gly* *N* *N* *109.425* *.* *1* new residue 76 adding: *310* *76* *Val* *H* *H* *8.186* *.* *1* old residue 76 adding: *311* *76* *Val* *HG1* *H* *0.744* *.* *2* old residue 76 adding: *312* *76* *Val* *HG2* *H* *0.800* *.* *2* old residue 76 adding: *313* *76* *Val* *C* *C* *174.054* *.* *1* old residue 76 adding: *314* *76* *Val* *CA* *C* *58.617* *.* *1* old residue 76 adding: *315* *76* *Val* *CB* *C* *35.204* *.* *1* old residue 76 adding: *316* *76* *Val* *CG1* *C* *20.786* *.* *2* old residue 76 adding: *317* *76* *Val* *CG2* *C* *18.036* *.* *2* old residue 76 adding: *318* *76* *Val* *N* *N* *111.321* *.* *1* new residue 77 adding: *319* *77* *Lys* *H* *H* *8.503* *.* *1* old residue 77 adding: *320* *77* *Lys* *C* *C* *176.177* *.* *1* old residue 77 adding: *321* *77* *Lys* *CA* *C* *55.360* *.* *1* old residue 77 adding: *322* *77* *Lys* *CB* *C* *34.063* *.* *1* old residue 77 adding: *323* *77* *Lys* *N* *N* *120.320* *.* *1* new residue 78 adding: *324* *78* *Ile* *H* *H* *8.242* *.* *1* old residue 78 adding: *325* *78* *Ile* *HD1* *H* *0.517* *.* *1* old residue 78 adding: *326* *78* *Ile* *C* *C* *174.940* *.* *1* old residue 78 adding: *327* *78* *Ile* *CA* *C* *60.016* *.* *1* old residue 78 adding: *328* *78* *Ile* *CB* *C* *42.383* *.* *1* old residue 78 adding: *329* *78* *Ile* *CD1* *C* *13.755* *.* *1* old residue 78 adding: *330* *78* *Ile* *N* *N* *114.883* *.* *1* new residue 79 adding: *331* *79* *Thr* *H* *H* *8.604* *.* *1* old residue 79 adding: *332* *79* *Thr* *C* *C* *174.209* *.* *1* old residue 79 adding: *333* *79* *Thr* *CA* *C* *62.846* *.* *1* old residue 79 adding: *334* *79* *Thr* *CB* *C* *69.940* *.* *1* old residue 79 adding: *335* *79* *Thr* *N* *N* *119.982* *.* *1* new residue 80 adding: *336* *80* *Thr* *H* *H* *8.762* *.* *1* old residue 80 adding: *337* *80* *Thr* *C* *C* *174.173* *.* *1* old residue 80 adding: *338* *80* *Thr* *CA* *C* *59.280* *.* *1* old residue 80 adding: *339* *80* *Thr* *CB* *C* *70.898* *.* *1* old residue 80 adding: *340* *80* *Thr* *N* *N* *116.688* *.* *1* new residue 81 adding: *341* *81* *Val* *H* *H* *8.722* *.* *1* old residue 81 adding: *342* *81* *Val* *HG1* *H* *0.977* *.* *2* old residue 81 adding: *343* *81* *Val* *HG2* *H* *0.931* *.* *2* old residue 81 adding: *344* *81* *Val* *C* *C* *173.093* *.* *1* old residue 81 adding: *345* *81* *Val* *CA* *C* *61.765* *.* *1* old residue 81 adding: *346* *81* *Val* *CB* *C* *35.818* *.* *1* old residue 81 adding: *347* *81* *Val* *CG1* *C* *20.691* *.* *2* old residue 81 adding: *348* *81* *Val* *CG2* *C* *20.674* *.* *2* old residue 81 adding: *349* *81* *Val* *N* *N* *123.228* *.* *1* new residue 82 adding: *350* *82* *Gln* *H* *H* *8.602* *.* *1* old residue 82 adding: *351* *82* *Gln* *C* *C* *176.096* *.* *1* old residue 82 adding: *352* *82* *Gln* *CA* *C* *54.020* *.* *1* old residue 82 adding: *353* *82* *Gln* *CB* *C* *27.746* *.* *1* old residue 82 adding: *354* *82* *Gln* *N* *N* *127.669* *.* *1* new residue 83 adding: *355* *83* *Ser* *H* *H* *7.810* *.* *1* old residue 83 adding: *356* *83* *Ser* *C* *C* *173.817* *.* *1* old residue 83 adding: *357* *83* *Ser* *CA* *C* *58.332* *.* *1* old residue 83 adding: *358* *83* *Ser* *CB* *C* *65.729* *.* *1* old residue 83 adding: *359* *83* *Ser* *N* *N* *120.905* *.* *1* new residue 84 adding: *360* *84* *Asn* *H* *H* *8.855* *.* *1* old residue 84 adding: *361* *84* *Asn* *CA* *C* *54.060* *.* *1* old residue 84 adding: *362* *84* *Asn* *CB* *C* *38.330* *.* *1* old residue 84 adding: *363* *84* *Asn* *N* *N* *122.834* *.* *1* new residue 85 adding: *364* *85* *Leu* *H* *H* *9.341* *.* *1* old residue 85 adding: *365* *85* *Leu* *HD1* *H* *0.919* *.* *2* old residue 85 adding: *366* *85* *Leu* *HD2* *H* *0.692* *.* *2* old residue 85 adding: *367* *85* *Leu* *C* *C* *178.161* *.* *1* old residue 85 adding: *368* *85* *Leu* *CA* *C* *58.428* *.* *1* old residue 85 adding: *369* *85* *Leu* *CB* *C* *40.591* *.* *1* old residue 85 adding: *370* *85* *Leu* *CD1* *C* *26.426* *.* *2* old residue 85 adding: *371* *85* *Leu* *CD2* *C* *23.330* *.* *2* old residue 85 adding: *372* *85* *Leu* *N* *N* *126.559* *.* *1* new residue 86 adding: *373* *86* *Ala* *H* *H* *8.561* *.* *1* old residue 86 adding: *374* *86* *Ala* *C* *C* *178.234* *.* *1* old residue 86 adding: *375* *86* *Ala* *CA* *C* *54.448* *.* *1* old residue 86 adding: *376* *86* *Ala* *CB* *C* *18.490* *.* *1* old residue 86 adding: *377* *86* *Ala* *N* *N* *118.989* *.* *1* new residue 87 adding: *378* *87* *Asp* *H* *H* *7.451* *.* *1* old residue 87 adding: *379* *87* *Asp* *C* *C* *175.668* *.* *1* old residue 87 adding: *380* *87* *Asp* *CA* *C* *54.041* *.* *1* old residue 87 adding: *381* *87* *Asp* *CB* *C* *42.171* *.* *1* old residue 87 adding: *382* *87* *Asp* *N* *N* *113.796* *.* *1* new residue 88 adding: *383* *88* *Phe* *H* *H* *7.067* *.* *1* old residue 88 adding: *384* *88* *Phe* *C* *C* *174.041* *.* *1* old residue 88 adding: *385* *88* *Phe* *CA* *C* *58.590* *.* *1* old residue 88 adding: *386* *88* *Phe* *CB* *C* *40.067* *.* *1* old residue 88 adding: *387* *88* *Phe* *N* *N* *121.115* *.* *1* new residue 89 adding: *388* *89* *Asp* *H* *H* *7.862* *.* *1* old residue 89 adding: *389* *89* *Asp* *C* *C* *174.394* *.* *1* old residue 89 adding: *390* *89* *Asp* *CA* *C* *53.834* *.* *1* old residue 89 adding: *391* *89* *Asp* *CB* *C* *41.518* *.* *1* old residue 89 adding: *392* *89* *Asp* *N* *N* *128.128* *.* *1* new residue 90 adding: *393* *90* *Ile* *H* *H* *7.617* *.* *1* old residue 90 adding: *394* *90* *Ile* *HD1* *H* *0.722* *.* *1* old residue 90 adding: *395* *90* *Ile* *C* *C* *175.534* *.* *1* old residue 90 adding: *396* *90* *Ile* *CA* *C* *61.248* *.* *1* old residue 90 adding: *397* *90* *Ile* *CB* *C* *38.388* *.* *1* old residue 90 adding: *398* *90* *Ile* *CD1* *C* *13.070* *.* *1* old residue 90 adding: *399* *90* *Ile* *N* *N* *123.620* *.* *1* new residue 91 adding: *400* *91* *Val* *H* *H* *9.216* *.* *1* old residue 91 adding: *401* *91* *Val* *HG1* *H* *0.962* *.* *2* old residue 91 adding: *402* *91* *Val* *HG2* *H* *0.910* *.* *2* old residue 91 adding: *403* *91* *Val* *C* *C* *174.586* *.* *1* old residue 91 adding: *404* *91* *Val* *CA* *C* *63.858* *.* *1* old residue 91 adding: *405* *91* *Val* *CB* *C* *31.781* *.* *1* old residue 91 adding: *406* *91* *Val* *CG1* *C* *21.139* *.* *2* old residue 91 adding: *407* *91* *Val* *CG2* *C* *22.098* *.* *2* old residue 91 adding: *408* *91* *Val* *N* *N* *133.913* *.* *1* new residue 92 adding: *409* *92* *Ala* *H* *H* *7.932* *.* *1* old residue 92 adding: *410* *92* *Ala* *C* *C* *178.809* *.* *1* old residue 92 adding: *411* *92* *Ala* *CA* *C* *52.681* *.* *1* old residue 92 adding: *412* *92* *Ala* *CB* *C* *18.488* *.* *1* old residue 92 adding: *413* *92* *Ala* *N* *N* *124.969* *.* *1* new residue 93 adding: *414* *93* *Asp* *H* *H* *9.041* *.* *1* old residue 93 adding: *415* *93* *Asp* *C* *C* *174.964* *.* *1* old residue 93 adding: *416* *93* *Asp* *CA* *C* *55.834* *.* *1* old residue 93 adding: *417* *93* *Asp* *CB* *C* *40.020* *.* *1* old residue 93 adding: *418* *93* *Asp* *N* *N* *117.292* *.* *1* new residue 94 adding: *419* *94* *Ala* *H* *H* *7.781* *.* *1* old residue 94 adding: *420* *94* *Ala* *C* *C* *178.685* *.* *1* old residue 94 adding: *421* *94* *Ala* *CA* *C* *53.071* *.* *1* old residue 94 adding: *422* *94* *Ala* *CB* *C* *21.593* *.* *1* old residue 94 adding: *423* *94* *Ala* *N* *N* *117.418* *.* *1* new residue 95 adding: *424* *95* *Trp* *H* *H* *8.370* *.* *1* old residue 95 adding: *425* *95* *Trp* *HE1* *H* *9.854* *.* *1* old residue 95 adding: *426* *95* *Trp* *CA* *C* *56.537* *.* *1* old residue 95 adding: *427* *95* *Trp* *CB* *C* *30.878* *.* *1* old residue 95 adding: *428* *95* *Trp* *N* *N* *119.602* *.* *1* old residue 95 adding: *429* *95* *Trp* *NE1* *N* *126.742* *.* *1* new residue 97 adding: *430* *97* *Gly* *H* *H* *7.851* *.* *1* old residue 97 adding: *431* *97* *Gly* *N* *N* *101.270* *.* *1* new residue 98 adding: *432* *98* *Ile* *HD1* *H* *0.816* *.* *1* old residue 98 adding: *433* *98* *Ile* *C* *C* *173.726* *.* *1* old residue 98 adding: *434* *98* *Ile* *CA* *C* *61.922* *.* *1* old residue 98 adding: *435* *98* *Ile* *CB* *C* *41.173* *.* *1* old residue 98 adding: *436* *98* *Ile* *CD1* *C* *14.538* *.* *1* new residue 99 adding: *437* *99* *Val* *H* *H* *8.941* *.* *1* old residue 99 adding: *438* *99* *Val* *HG1* *H* *0.762* *.* *2* old residue 99 adding: *439* *99* *Val* *HG2* *H* *0.562* *.* *2* old residue 99 adding: *440* *99* *Val* *C* *C* *174.309* *.* *1* old residue 99 adding: *441* *99* *Val* *CA* *C* *61.416* *.* *1* old residue 99 adding: *442* *99* *Val* *CB* *C* *35.148* *.* *1* old residue 99 adding: *443* *99* *Val* *CG1* *C* *22.178* *.* *2* old residue 99 adding: *444* *99* *Val* *CG2* *C* *21.156* *.* *2* old residue 99 adding: *445* *99* *Val* *N* *N* *126.024* *.* *1* new residue 100 adding: *446* *100* *Ser* *H* *H* *9.130* *.* *1* old residue 100 adding: *447* *100* *Ser* *C* *C* *172.346* *.* *1* old residue 100 adding: *448* *100* *Ser* *CA* *C* *55.965* *.* *1* old residue 100 adding: *449* *100* *Ser* *CB* *C* *64.349* *.* *1* old residue 100 adding: *450* *100* *Ser* *N* *N* *121.601* *.* *1* new residue 101 adding: *451* *101* *Ile* *H* *H* *9.412* *.* *1* old residue 101 adding: *452* *101* *Ile* *HD1* *H* *0.535* *.* *1* old residue 101 adding: *453* *101* *Ile* *C* *C* *174.472* *.* *1* old residue 101 adding: *454* *101* *Ile* *CA* *C* *58.487* *.* *1* old residue 101 adding: *455* *101* *Ile* *CB* *C* *35.386* *.* *1* old residue 101 adding: *456* *101* *Ile* *CD1* *C* *29.463* *.* *1* old residue 101 adding: *457* *101* *Ile* *N* *N* *128.506* *.* *1* new residue 102 adding: *458* *102* *Phe* *H* *H* *8.780* *.* *1* old residue 102 adding: *459* *102* *Phe* *C* *C* *173.427* *.* *1* old residue 102 adding: *460* *102* *Phe* *CA* *C* *61.139* *.* *1* old residue 102 adding: *461* *102* *Phe* *CB* *C* *36.702* *.* *1* old residue 102 adding: *462* *102* *Phe* *N* *N* *122.152* *.* *1* new residue 103 adding: *463* *103* *Cys* *H* *H* *8.715* *.* *1* old residue 103 adding: *464* *103* *Cys* *C* *C* *174.356* *.* *1* old residue 103 adding: *465* *103* *Cys* *CA* *C* *57.748* *.* *1* old residue 103 adding: *466* *103* *Cys* *CB* *C* *25.239* *.* *1* old residue 103 adding: *467* *103* *Cys* *N* *N* *122.042* *.* *1* new residue 104 adding: *468* *104* *His* *H* *H* *8.621* *.* *1* old residue 104 adding: *469* *104* *His* *C* *C* *174.813* *.* *1* old residue 104 adding: *470* *104* *His* *CA* *C* *56.219* *.* *1* old residue 104 adding: *471* *104* *His* *CB* *C* *30.090* *.* *1* old residue 104 adding: *472* *104* *His* *N* *N* *127.009* *.* *1* new residue 105 adding: *473* *105* *Leu* *H* *H* *8.969* *.* *1* old residue 105 adding: *474* *105* *Leu* *HD1* *H* *0.677* *.* *2* old residue 105 adding: *475* *105* *Leu* *HD2* *H* *0.884* *.* *2* old residue 105 adding: *476* *105* *Leu* *C* *C* *173.533* *.* *1* old residue 105 adding: *477* *105* *Leu* *CA* *C* *51.807* *.* *1* old residue 105 adding: *478* *105* *Leu* *CB* *C* *45.385* *.* *1* old residue 105 adding: *479* *105* *Leu* *CD1* *C* *26.479* *.* *2* old residue 105 adding: *480* *105* *Leu* *CD2* *C* *22.832* *.* *2* old residue 105 adding: *481* *105* *Leu* *N* *N* *124.562* *.* *1* new residue 106 adding: *482* *106* *Pro* *C* *C* *178.657* *.* *1* old residue 106 adding: *483* *106* *Pro* *CA* *C* *62.605* *.* *1* old residue 106 adding: *484* *106* *Pro* *CB* *C* *32.214* *.* *1* new residue 107 adding: *485* *107* *Ser* *H* *H* *9.051* *.* *1* old residue 107 adding: *486* *107* *Ser* *C* *C* *177.297* *.* *1* old residue 107 adding: *487* *107* *Ser* *CA* *C* *63.284* *.* *1* old residue 107 adding: *488* *107* *Ser* *CB* *C* *61.734* *.* *1* old residue 107 adding: *489* *107* *Ser* *N* *N* *122.544* *.* *1* new residue 108 adding: *490* *108* *Ser* *H* *H* *8.814* *.* *1* old residue 108 adding: *491* *108* *Ser* *C* *C* *176.639* *.* *1* old residue 108 adding: *492* *108* *Ser* *CA* *C* *61.375* *.* *1* old residue 108 adding: *493* *108* *Ser* *CB* *C* *62.026* *.* *1* old residue 108 adding: *494* *108* *Ser* *N* *N* *116.205* *.* *1* new residue 109 adding: *495* *109* *Leu* *H* *H* *6.973* *.* *1* old residue 109 adding: *496* *109* *Leu* *HD1* *H* *0.980* *.* *2* old residue 109 adding: *497* *109* *Leu* *HD2* *H* *0.956* *.* *2* old residue 109 adding: *498* *109* *Leu* *C* *C* *179.902* *.* *1* old residue 109 adding: *499* *109* *Leu* *CA* *C* *56.900* *.* *1* old residue 109 adding: *500* *109* *Leu* *CB* *C* *41.919* *.* *1* old residue 109 adding: *501* *109* *Leu* *CD1* *C* *23.601* *.* *2* old residue 109 adding: *502* *109* *Leu* *CD2* *C* *25.877* *.* *2* old residue 109 adding: *503* *109* *Leu* *N* *N* *122.072* *.* *1* new residue 110 adding: *504* *110* *Arg* *H* *H* *8.340* *.* *1* old residue 110 adding: *505* *110* *Arg* *C* *C* *178.355* *.* *1* old residue 110 adding: *506* *110* *Arg* *CA* *C* *61.873* *.* *1* old residue 110 adding: *507* *110* *Arg* *CB* *C* *28.890* *.* *1* old residue 110 adding: *508* *110* *Arg* *N* *N* *121.024* *.* *1* new residue 111 adding: *509* *111* *Gln* *H* *H* *7.906* *.* *1* old residue 111 adding: *510* *111* *Gln* *C* *C* *177.374* *.* *1* old residue 111 adding: *511* *111* *Gln* *CA* *C* *58.338* *.* *1* old residue 111 adding: *512* *111* *Gln* *CB* *C* *28.048* *.* *1* old residue 111 adding: *513* *111* *Gln* *N* *N* *113.105* *.* *1* new residue 112 adding: *514* *112* *Gln* *H* *H* *7.007* *.* *1* old residue 112 adding: *515* *112* *Gln* *C* *C* *177.927* *.* *1* old residue 112 adding: *516* *112* *Gln* *CA* *C* *57.029* *.* *1* old residue 112 adding: *517* *112* *Gln* *CB* *C* *29.999* *.* *1* old residue 112 adding: *518* *112* *Gln* *N* *N* *114.483* *.* *1* new residue 113 adding: *519* *113* *Leu* *H* *H* *8.603* *.* *1* old residue 113 adding: *520* *113* *Leu* *HD1* *H* *1.036* *.* *2* old residue 113 adding: *521* *113* *Leu* *HD2* *H* *0.854* *.* *2* old residue 113 adding: *522* *113* *Leu* *C* *C* *179.051* *.* *1* old residue 113 adding: *523* *113* *Leu* *CA* *C* *57.474* *.* *1* old residue 113 adding: *524* *113* *Leu* *CB* *C* *43.682* *.* *1* old residue 113 adding: *525* *113* *Leu* *CD1* *C* *23.235* *.* *2* old residue 113 adding: *526* *113* *Leu* *CD2* *C* *26.699* *.* *2* old residue 113 adding: *527* *113* *Leu* *N* *N* *119.883* *.* *1* new residue 114 adding: *528* *114* *Tyr* *H* *H* *9.185* *.* *1* old residue 114 adding: *529* *114* *Tyr* *C* *C* *177.053* *.* *1* old residue 114 adding: *530* *114* *Tyr* *CA* *C* *60.103* *.* *1* old residue 114 adding: *531* *114* *Tyr* *CB* *C* *31.986* *.* *1* old residue 114 adding: *532* *114* *Tyr* *N* *N* *119.712* *.* *1* new residue 115 adding: *533* *115* *Pro* *C* *C* *180.126* *.* *1* old residue 115 adding: *534* *115* *Pro* *CA* *C* *66.986* *.* *1* old residue 115 adding: *535* *115* *Pro* *CB* *C* *31.137* *.* *1* new residue 116 adding: *536* *116* *Lys* *H* *H* *6.982* *.* *1* old residue 116 adding: *537* *116* *Lys* *C* *C* *180.255* *.* *1* old residue 116 adding: *538* *116* *Lys* *CA* *C* *58.999* *.* *1* old residue 116 adding: *539* *116* *Lys* *CB* *C* *32.649* *.* *1* old residue 116 adding: *540* *116* *Lys* *N* *N* *115.015* *.* *1* new residue 117 adding: *541* *117* *Val* *H* *H* *8.226* *.* *1* old residue 117 adding: *542* *117* *Val* *HG1* *H* *0.464* *.* *2* old residue 117 adding: *543* *117* *Val* *HG2* *H* *0.948* *.* *2* old residue 117 adding: *544* *117* *Val* *C* *C* *176.567* *.* *1* old residue 117 adding: *545* *117* *Val* *CA* *C* *66.490* *.* *1* old residue 117 adding: *546* *117* *Val* *CB* *C* *31.289* *.* *1* old residue 117 adding: *547* *117* *Val* *CG1* *C* *20.166* *.* *2* old residue 117 adding: *548* *117* *Val* *CG2* *C* *22.632* *.* *2* old residue 117 adding: *549* *117* *Val* *N* *N* *122.120* *.* *1* new residue 118 adding: *550* *118* *Tyr* *H* *H* *8.056* *.* *1* old residue 118 adding: *551* *118* *Tyr* *C* *C* *178.921* *.* *1* old residue 118 adding: *552* *118* *Tyr* *CA* *C* *62.805* *.* *1* old residue 118 adding: *553* *118* *Tyr* *CB* *C* *37.923* *.* *1* old residue 118 adding: *554* *118* *Tyr* *N* *N* *116.005* *.* *1* new residue 119 adding: *555* *119* *Gln* *H* *H* *8.049* *.* *1* old residue 119 adding: *556* *119* *Gln* *C* *C* *177.438* *.* *1* old residue 119 adding: *557* *119* *Gln* *CA* *C* *58.225* *.* *1* old residue 119 adding: *558* *119* *Gln* *CB* *C* *28.727* *.* *1* old residue 119 adding: *559* *119* *Gln* *N* *N* *116.047* *.* *1* new residue 120 adding: *560* *120* *Gly* *H* *H* *8.063* *.* *1* old residue 120 adding: *561* *120* *Gly* *C* *C* *173.849* *.* *1* old residue 120 adding: *562* *120* *Gly* *CA* *C* *46.411* *.* *1* old residue 120 adding: *563* *120* *Gly* *N* *N* *108.779* *.* *1* new residue 121 adding: *564* *121* *Leu* *H* *H* *6.955* *.* *1* old residue 121 adding: *565* *121* *Leu* *HD1* *H* *0.632* *.* *2* old residue 121 adding: *566* *121* *Leu* *HD2* *H* *0.704* *.* *2* old residue 121 adding: *567* *121* *Leu* *C* *C* *177.555* *.* *1* old residue 121 adding: *568* *121* *Leu* *CA* *C* *54.419* *.* *1* old residue 121 adding: *569* *121* *Leu* *CB* *C* *43.076* *.* *1* old residue 121 adding: *570* *121* *Leu* *CD1* *C* *26.223* *.* *2* old residue 121 adding: *571* *121* *Leu* *CD2* *C* *23.346* *.* *2* old residue 121 adding: *572* *121* *Leu* *N* *N* *120.365* *.* *1* new residue 123 adding: *573* *123* *Pro* *C* *C* *178.291* *.* *1* old residue 123 adding: *574* *123* *Pro* *CA* *C* *64.964* *.* *1* old residue 123 adding: *575* *123* *Pro* *CB* *C* *30.875* *.* *1* new residue 124 adding: *576* *124* *Gly* *H* *H* *8.957* *.* *1* old residue 124 adding: *577* *124* *Gly* *C* *C* *173.666* *.* *1* old residue 124 adding: *578* *124* *Gly* *CA* *C* *45.605* *.* *1* old residue 124 adding: *579* *124* *Gly* *N* *N* *116.207* *.* *1* new residue 125 adding: *580* *125* *Gly* *H* *H* *9.014* *.* *1* old residue 125 adding: *581* *125* *Gly* *C* *C* *172.926* *.* *1* old residue 125 adding: *582* *125* *Gly* *CA* *C* *45.423* *.* *1* old residue 125 adding: *583* *125* *Gly* *N* *N* *108.848* *.* *1* new residue 126 adding: *584* *126* *Val* *HG1* *H* *0.911* *.* *2* old residue 126 adding: *585* *126* *Val* *HG2* *H* *0.928* *.* *2* old residue 126 adding: *586* *126* *Val* *C* *C* *173.462* *.* *1* old residue 126 adding: *587* *126* *Val* *CA* *C* *58.819* *.* *1* old residue 126 adding: *588* *126* *Val* *CB* *C* *35.958* *.* *1* old residue 126 adding: *589* *126* *Val* *CG1* *C* *21.153* *.* *2* old residue 126 adding: *590* *126* *Val* *CG2* *C* *19.892* *.* *2* new residue 127 adding: *591* *127* *Phe* *H* *H* *9.126* *.* *1* old residue 127 adding: *592* *127* *Phe* *C* *C* *174.237* *.* *1* old residue 127 adding: *593* *127* *Phe* *CA* *C* *54.697* *.* *1* old residue 127 adding: *594* *127* *Phe* *CB* *C* *43.117* *.* *1* old residue 127 adding: *595* *127* *Phe* *N* *N* *122.396* *.* *1* new residue 128 adding: *596* *128* *Ile* *H* *H* *7.986* *.* *1* old residue 128 adding: *597* *128* *Ile* *HD1* *H* *0.481* *.* *1* old residue 128 adding: *598* *128* *Ile* *C* *C* *172.508* *.* *1* old residue 128 adding: *599* *128* *Ile* *CA* *C* *60.088* *.* *1* old residue 128 adding: *600* *128* *Ile* *CB* *C* *41.278* *.* *1* old residue 128 adding: *601* *128* *Ile* *CD1* *C* *14.893* *.* *1* old residue 128 adding: *602* *128* *Ile* *N* *N* *127.144* *.* *1* new residue 129 adding: *603* *129* *Leu* *H* *H* *9.084* *.* *1* old residue 129 adding: *604* *129* *Leu* *HD1* *H* *0.931* *.* *2* old residue 129 adding: *605* *129* *Leu* *HD2* *H* *0.330* *.* *2* old residue 129 adding: *606* *129* *Leu* *C* *C* *175.481* *.* *1* old residue 129 adding: *607* *129* *Leu* *CA* *C* *53.579* *.* *1* old residue 129 adding: *608* *129* *Leu* *CB* *C* *45.899* *.* *1* old residue 129 adding: *609* *129* *Leu* *CD1* *C* *27.425* *.* *2* old residue 129 adding: *610* *129* *Leu* *CD2* *C* *23.667* *.* *2* old residue 129 adding: *611* *129* *Leu* *N* *N* *128.415* *.* *1* new residue 130 adding: *612* *130* *Glu* *H* *H* *7.951* *.* *1* old residue 130 adding: *613* *130* *Glu* *C* *C* *175.929* *.* *1* old residue 130 adding: *614* *130* *Glu* *CA* *C* *56.477* *.* *1* old residue 130 adding: *615* *130* *Glu* *CB* *C* *32.779* *.* *1* old residue 130 adding: *616* *130* *Glu* *N* *N* *123.630* *.* *1* new residue 131 adding: *617* *131* *Gly* *H* *H* *8.349* *.* *1* old residue 131 adding: *618* *131* *Gly* *C* *C* *171.038* *.* *1* old residue 131 adding: *619* *131* *Gly* *CA* *C* *44.404* *.* *1* old residue 131 adding: *620* *131* *Gly* *N* *N* *114.394* *.* *1* new residue 132 adding: *621* *132* *Phe* *H* *H* *10.500* *.* *1* old residue 132 adding: *622* *132* *Phe* *C* *C* *174.938* *.* *1* old residue 132 adding: *623* *132* *Phe* *CA* *C* *60.371* *.* *1* old residue 132 adding: *624* *132* *Phe* *CB* *C* *39.080* *.* *1* old residue 132 adding: *625* *132* *Phe* *N* *N* *119.370* *.* *1* new residue 133 adding: *626* *133* *Ala* *H* *H* *8.744* *.* *1* old residue 133 adding: *627* *133* *Ala* *C* *C* *176.412* *.* *1* old residue 133 adding: *628* *133* *Ala* *CA* *C* *49.444* *.* *1* old residue 133 adding: *629* *133* *Ala* *CB* *C* *19.527* *.* *1* old residue 133 adding: *630* *133* *Ala* *N* *N* *124.079* *.* *1* new residue 134 adding: *631* *134* *Pro* *C* *C* *179.488* *.* *1* old residue 134 adding: *632* *134* *Pro* *CA* *C* *65.935* *.* *1* old residue 134 adding: *633* *134* *Pro* *CB* *C* *30.246* *.* *1* new residue 135 adding: *634* *135* *Glu* *H* *H* *8.765* *.* *1* old residue 135 adding: *635* *135* *Glu* *C* *C* *177.167* *.* *1* old residue 135 adding: *636* *135* *Glu* *CA* *C* *60.249* *.* *1* old residue 135 adding: *637* *135* *Glu* *CB* *C* *28.435* *.* *1* old residue 135 adding: *638* *135* *Glu* *N* *N* *117.678* *.* *1* new residue 136 adding: *639* *136* *Gln* *H* *H* *8.510* *.* *1* old residue 136 adding: *640* *136* *Gln* *C* *C* *178.283* *.* *1* old residue 136 adding: *641* *136* *Gln* *CA* *C* *57.115* *.* *1* old residue 136 adding: *642* *136* *Gln* *CB* *C* *27.010* *.* *1* old residue 136 adding: *643* *136* *Gln* *N* *N* *121.058* *.* *1* new residue 137 adding: *644* *137* *Leu* *H* *H* *7.384* *.* *1* old residue 137 adding: *645* *137* *Leu* *HD1* *H* *0.863* *.* *2* old residue 137 adding: *646* *137* *Leu* *HD2* *H* *0.783* *.* *2* old residue 137 adding: *647* *137* *Leu* *C* *C* *178.917* *.* *1* old residue 137 adding: *648* *137* *Leu* *CA* *C* *57.259* *.* *1* old residue 137 adding: *649* *137* *Leu* *CB* *C* *41.025* *.* *1* old residue 137 adding: *650* *137* *Leu* *CD1* *C* *25.495* *.* *2* old residue 137 adding: *651* *137* *Leu* *CD2* *C* *23.264* *.* *2* old residue 137 adding: *652* *137* *Leu* *N* *N* *117.057* *.* *1* new residue 138 adding: *653* *138* *Gln* *H* *H* *7.608* *.* *1* old residue 138 adding: *654* *138* *Gln* *C* *C* *176.554* *.* *1* old residue 138 adding: *655* *138* *Gln* *CA* *C* *56.696* *.* *1* old residue 138 adding: *656* *138* *Gln* *CB* *C* *28.802* *.* *1* old residue 138 adding: *657* *138* *Gln* *N* *N* *114.792* *.* *1* new residue 139 adding: *658* *139* *Tyr* *H* *H* *7.985* *.* *1* old residue 139 adding: *659* *139* *Tyr* *C* *C* *176.478* *.* *1* old residue 139 adding: *660* *139* *Tyr* *CA* *C* *57.373* *.* *1* old residue 139 adding: *661* *139* *Tyr* *CB* *C* *39.474* *.* *1* old residue 139 adding: *662* *139* *Tyr* *N* *N* *120.301* *.* *1* new residue 140 adding: *663* *140* *Asn* *H* *H* *8.514* *.* *1* old residue 140 adding: *664* *140* *Asn* *C* *C* *176.647* *.* *1* old residue 140 adding: *665* *140* *Asn* *CA* *C* *53.381* *.* *1* old residue 140 adding: *666* *140* *Asn* *CB* *C* *38.435* *.* *1* old residue 140 adding: *667* *140* *Asn* *N* *N* *115.095* *.* *1* new residue 141 adding: *668* *141* *Thr* *H* *H* *7.257* *.* *1* old residue 141 adding: *669* *141* *Thr* *C* *C* *174.127* *.* *1* old residue 141 adding: *670* *141* *Thr* *CA* *C* *60.564* *.* *1* old residue 141 adding: *671* *141* *Thr* *CB* *C* *68.629* *.* *1* old residue 141 adding: *672* *141* *Thr* *N* *N* *105.367* *.* *1* new residue 142 adding: *673* *142* *Gly* *H* *H* *8.070* *.* *1* old residue 142 adding: *674* *142* *Gly* *C* *C* *174.533* *.* *1* old residue 142 adding: *675* *142* *Gly* *CA* *C* *44.450* *.* *1* old residue 142 adding: *676* *142* *Gly* *N* *N* *107.918* *.* *1* new residue 143 adding: *677* *143* *Gly* *H* *H* *8.132* *.* *1* old residue 143 adding: *678* *143* *Gly* *C* *C* *171.717* *.* *1* old residue 143 adding: *679* *143* *Gly* *CA* *C* *44.594* *.* *1* old residue 143 adding: *680* *143* *Gly* *N* *N* *104.894* *.* *1* new residue 144 adding: *681* *144* *Pro* *C* *C* *175.978* *.* *1* old residue 144 adding: *682* *144* *Pro* *CA* *C* *62.910* *.* *1* old residue 144 adding: *683* *144* *Pro* *CB* *C* *32.464* *.* *1* new residue 145 adding: *684* *145* *Lys* *H* *H* *8.295* *.* *1* old residue 145 adding: *685* *145* *Lys* *C* *C* *175.478* *.* *1* old residue 145 adding: *686* *145* *Lys* *CA* *C* *54.553* *.* *1* old residue 145 adding: *687* *145* *Lys* *CB* *C* *32.425* *.* *1* old residue 145 adding: *688* *145* *Lys* *N* *N* *116.163* *.* *1* new residue 146 adding: *689* *146* *Asp* *H* *H* *6.653* *.* *1* old residue 146 adding: *690* *146* *Asp* *C* *C* *177.145* *.* *1* old residue 146 adding: *691* *146* *Asp* *CA* *C* *52.968* *.* *1* old residue 146 adding: *692* *146* *Asp* *CB* *C* *43.090* *.* *1* old residue 146 adding: *693* *146* *Asp* *N* *N* *117.896* *.* *1* new residue 147 adding: *694* *147* *Leu* *H* *H* *8.854* *.* *1* old residue 147 adding: *695* *147* *Leu* *HD1* *H* *0.973* *.* *2* old residue 147 adding: *696* *147* *Leu* *HD2* *H* *0.945* *.* *2* old residue 147 adding: *697* *147* *Leu* *C* *C* *179.889* *.* *1* old residue 147 adding: *698* *147* *Leu* *CA* *C* *58.125* *.* *1* old residue 147 adding: *699* *147* *Leu* *CB* *C* *41.873* *.* *1* old residue 147 adding: *700* *147* *Leu* *CD1* *C* *24.519* *.* *2* old residue 147 adding: *701* *147* *Leu* *CD2* *C* *24.191* *.* *2* old residue 147 adding: *702* *147* *Leu* *N* *N* *126.919* *.* *1* new residue 148 adding: *703* *148* *Asp* *H* *H* *8.921* *.* *1* old residue 148 adding: *704* *148* *Asp* *C* *C* *176.585* *.* *1* old residue 148 adding: *705* *148* *Asp* *CA* *C* *57.798* *.* *1* old residue 148 adding: *706* *148* *Asp* *CB* *C* *42.397* *.* *1* old residue 148 adding: *707* *148* *Asp* *N* *N* *119.488* *.* *1* new residue 149 adding: *708* *149* *Leu* *H* *H* *7.597* *.* *1* old residue 149 adding: *709* *149* *Leu* *HD1* *H* *0.963* *.* *2* old residue 149 adding: *710* *149* *Leu* *HD2* *H* *0.843* *.* *2* old residue 149 adding: *711* *149* *Leu* *C* *C* *176.630* *.* *1* old residue 149 adding: *712* *149* *Leu* *CA* *C* *56.077* *.* *1* old residue 149 adding: *713* *149* *Leu* *CD1* *C* *25.379* *.* *2* old residue 149 adding: *714* *149* *Leu* *CD2* *C* *24.941* *.* *2* old residue 149 adding: *715* *149* *Leu* *N* *N* *114.860* *.* *1* new residue 150 adding: *716* *150* *Leu* *H* *H* *7.517* *.* *1* old residue 150 adding: *717* *150* *Leu* *HD1* *H* *0.644* *.* *2* old residue 150 adding: *718* *150* *Leu* *HD2* *H* *0.447* *.* *2* old residue 150 adding: *719* *150* *Leu* *C* *C* *172.072* *.* *1* old residue 150 adding: *720* *150* *Leu* *CA* *C* *52.047* *.* *1* old residue 150 adding: *721* *150* *Leu* *CB* *C* *43.208* *.* *1* old residue 150 adding: *722* *150* *Leu* *CD1* *C* *25.821* *.* *2* old residue 150 adding: *723* *150* *Leu* *CD2* *C* *24.250* *.* *2* old residue 150 adding: *724* *150* *Leu* *N* *N* *121.337* *.* *1* new residue 151 adding: *725* *151* *Pro* *C* *C* *177.348* *.* *1* old residue 151 adding: *726* *151* *Pro* *CA* *C* *62.926* *.* *1* old residue 151 adding: *727* *151* *Pro* *CB* *C* *31.485* *.* *1* new residue 152 adding: *728* *152* *Lys* *H* *H* *7.834* *.* *1* old residue 152 adding: *729* *152* *Lys* *C* *C* *177.498* *.* *1* old residue 152 adding: *730* *152* *Lys* *CA* *C* *56.070* *.* *1* old residue 152 adding: *731* *152* *Lys* *CB* *C* *33.664* *.* *1* old residue 152 adding: *732* *152* *Lys* *N* *N* *115.945* *.* *1* new residue 153 adding: *733* *153* *Leu* *H* *H* *8.975* *.* *1* old residue 153 adding: *734* *153* *Leu* *HD1* *H* *0.851* *.* *2* old residue 153 adding: *735* *153* *Leu* *HD2* *H* *0.534* *.* *2* old residue 153 adding: *736* *153* *Leu* *C* *C* *178.481* *.* *1* old residue 153 adding: *737* *153* *Leu* *CA* *C* *60.297* *.* *1* old residue 153 adding: *738* *153* *Leu* *CB* *C* *42.076* *.* *1* old residue 153 adding: *739* *153* *Leu* *CD1* *C* *24.992* *.* *2* old residue 153 adding: *740* *153* *Leu* *CD2* *C* *25.130* *.* *2* old residue 153 adding: *741* *153* *Leu* *N* *N* *123.717* *.* *1* new residue 154 adding: *742* *154* *Glu* *H* *H* *9.600* *.* *1* old residue 154 adding: *743* *154* *Glu* *C* *C* *180.025* *.* *1* old residue 154 adding: *744* *154* *Glu* *CA* *C* *59.926* *.* *1* old residue 154 adding: *745* *154* *Glu* *CB* *C* *28.323* *.* *1* old residue 154 adding: *746* *154* *Glu* *N* *N* *115.080* *.* *1* new residue 155 adding: *747* *155* *Thr* *H* *H* *7.116* *.* *1* old residue 155 adding: *748* *155* *Thr* *C* *C* *177.169* *.* *1* old residue 155 adding: *749* *155* *Thr* *CA* *C* *65.920* *.* *1* old residue 155 adding: *750* *155* *Thr* *CB* *C* *68.176* *.* *1* old residue 155 adding: *751* *155* *Thr* *N* *N* *118.663* *.* *1* new residue 156 adding: *752* *156* *Leu* *H* *H* *8.079* *.* *1* old residue 156 adding: *753* *156* *Leu* *HD1* *H* *0.849* *.* *2* old residue 156 adding: *754* *156* *Leu* *HD2* *H* *0.967* *.* *2* old residue 156 adding: *755* *156* *Leu* *C* *C* *179.424* *.* *1* old residue 156 adding: *756* *156* *Leu* *CA* *C* *58.737* *.* *1* old residue 156 adding: *757* *156* *Leu* *CB* *C* *42.194* *.* *1* old residue 156 adding: *758* *156* *Leu* *CD1* *C* *26.037* *.* *2* old residue 156 adding: *759* *156* *Leu* *CD2* *C* *24.634* *.* *2* old residue 156 adding: *760* *156* *Leu* *N* *N* *124.217* *.* *1* new residue 157 adding: *761* *157* *Gln* *H* *H* *7.952* *.* *1* old residue 157 adding: *762* *157* *Gln* *C* *C* *179.111* *.* *1* old residue 157 adding: *763* *157* *Gln* *CA* *C* *59.779* *.* *1* old residue 157 adding: *764* *157* *Gln* *CB* *C* *28.990* *.* *1* old residue 157 adding: *765* *157* *Gln* *N* *N* *113.283* *.* *1* new residue 158 adding: *766* *158* *Ser* *H* *H* *7.547* *.* *1* old residue 158 adding: *767* *158* *Ser* *C* *C* *175.490* *.* *1* old residue 158 adding: *768* *158* *Ser* *CA* *C* *61.029* *.* *1* old residue 158 adding: *769* *158* *Ser* *CB* *C* *63.548* *.* *1* old residue 158 adding: *770* *158* *Ser* *N* *N* *113.327* *.* *1* new residue 159 adding: *771* *159* *Glu* *H* *H* *7.730* *.* *1* old residue 159 adding: *772* *159* *Glu* *C* *C* *177.210* *.* *1* old residue 159 adding: *773* *159* *Glu* *CA* *C* *57.780* *.* *1* old residue 159 adding: *774* *159* *Glu* *CB* *C* *30.214* *.* *1* old residue 159 adding: *775* *159* *Glu* *N* *N* *122.361* *.* *1* new residue 160 adding: *776* *160* *Leu* *H* *H* *7.198* *.* *1* old residue 160 adding: *777* *160* *Leu* *HD1* *H* *0.179* *.* *2* old residue 160 adding: *778* *160* *Leu* *HD2* *H* *0.334* *.* *2* old residue 160 adding: *779* *160* *Leu* *C* *C* *174.555* *.* *1* old residue 160 adding: *780* *160* *Leu* *CA* *C* *53.628* *.* *1* old residue 160 adding: *781* *160* *Leu* *CB* *C* *43.435* *.* *1* old residue 160 adding: *782* *160* *Leu* *CD1* *C* *26.555* *.* *2* old residue 160 adding: *783* *160* *Leu* *CD2* *C* *24.500* *.* *2* old residue 160 adding: *784* *160* *Leu* *N* *N* *121.241* *.* *1* new residue 161 adding: *785* *161* *Pro* *C* *C* *178.914* *.* *1* old residue 161 adding: *786* *161* *Pro* *CA* *C* *64.852* *.* *1* old residue 161 adding: *787* *161* *Pro* *CB* *C* *32.014* *.* *1* new residue 162 adding: *788* *162* *Ser* *H* *H* *8.015* *.* *1* old residue 162 adding: *789* *162* *Ser* *C* *C* *175.658* *.* *1* old residue 162 adding: *790* *162* *Ser* *CA* *C* *59.347* *.* *1* old residue 162 adding: *791* *162* *Ser* *CB* *C* *62.545* *.* *1* old residue 162 adding: *792* *162* *Ser* *N* *N* *111.812* *.* *1* new residue 163 adding: *793* *163* *Leu* *H* *H* *6.859* *.* *1* old residue 163 adding: *794* *163* *Leu* *HD1* *H* *0.558* *.* *2* old residue 163 adding: *795* *163* *Leu* *HD2* *H* *0.537* *.* *2* old residue 163 adding: *796* *163* *Leu* *C* *C* *174.434* *.* *1* old residue 163 adding: *797* *163* *Leu* *CA* *C* *54.764* *.* *1* old residue 163 adding: *798* *163* *Leu* *CB* *C* *41.002* *.* *1* old residue 163 adding: *799* *163* *Leu* *CD1* *C* *27.431* *.* *2* old residue 163 adding: *800* *163* *Leu* *CD2* *C* *22.974* *.* *2* old residue 163 adding: *801* *163* *Leu* *N* *N* *119.869* *.* *1* new residue 164 adding: *802* *164* *Asn* *H* *H* *8.429* *.* *1* old residue 164 adding: *803* *164* *Asn* *C* *C* *175.523* *.* *1* old residue 164 adding: *804* *164* *Asn* *CA* *C* *52.239* *.* *1* old residue 164 adding: *805* *164* *Asn* *CB* *C* *39.647* *.* *1* old residue 164 adding: *806* *164* *Asn* *N* *N* *117.709* *.* *1* new residue 165 adding: *807* *165* *Trp* *H* *H* *8.682* *.* *1* old residue 165 adding: *808* *165* *Trp* *HE1* *H* *10.420* *.* *1* old residue 165 adding: *809* *165* *Trp* *C* *C* *175.795* *.* *1* old residue 165 adding: *810* *165* *Trp* *CA* *C* *56.593* *.* *1* old residue 165 adding: *811* *165* *Trp* *CB* *C* *27.808* *.* *1* old residue 165 adding: *812* *165* *Trp* *N* *N* *127.557* *.* *1* old residue 165 adding: *813* *165* *Trp* *NE1* *N* *130.509* *.* *1* new residue 166 adding: *814* *166* *Leu* *H* *H* *8.862* *.* *1* old residue 166 adding: *815* *166* *Leu* *HD1* *H* *0.837* *.* *2* old residue 166 adding: *816* *166* *Leu* *HD2* *H* *0.828* *.* *2* old residue 166 adding: *817* *166* *Leu* *C* *C* *178.547* *.* *1* old residue 166 adding: *818* *166* *Leu* *CA* *C* *56.838* *.* *1* old residue 166 adding: *819* *166* *Leu* *CB* *C* *42.389* *.* *1* old residue 166 adding: *820* *166* *Leu* *CD1* *C* *24.673* *.* *2* old residue 166 adding: *821* *166* *Leu* *CD2* *C* *22.445* *.* *2* old residue 166 adding: *822* *166* *Leu* *N* *N* *129.121* *.* *1* new residue 167 adding: *823* *167* *Ile* *H* *H* *8.112* *.* *1* old residue 167 adding: *824* *167* *Ile* *HD1* *H* *0.959* *.* *1* old residue 167 adding: *825* *167* *Ile* *C* *C* *174.882* *.* *1* old residue 167 adding: *826* *167* *Ile* *CA* *C* *61.688* *.* *1* old residue 167 adding: *827* *167* *Ile* *CB* *C* *42.425* *.* *1* old residue 167 adding: *828* *167* *Ile* *CD1* *C* *14.220* *.* *1* old residue 167 adding: *829* *167* *Ile* *N* *N* *117.198* *.* *1* new residue 168 adding: *830* *168* *Ala* *H* *H* *8.602* *.* *1* old residue 168 adding: *831* *168* *Ala* *C* *C* *174.903* *.* *1* old residue 168 adding: *832* *168* *Ala* *CA* *C* *52.171* *.* *1* old residue 168 adding: *833* *168* *Ala* *CB* *C* *19.070* *.* *1* old residue 168 adding: *834* *168* *Ala* *N* *N* *129.540* *.* *1* new residue 169 adding: *835* *169* *Asn* *H* *H* *9.175* *.* *1* old residue 169 adding: *836* *169* *Asn* *C* *C* *173.972* *.* *1* old residue 169 adding: *837* *169* *Asn* *CA* *C* *52.063* *.* *1* old residue 169 adding: *838* *169* *Asn* *CB* *C* *42.401* *.* *1* old residue 169 adding: *839* *169* *Asn* *N* *N* *120.681* *.* *1* new residue 170 adding: *840* *170* *Asn* *H* *H* *8.352* *.* *1* old residue 170 adding: *841* *170* *Asn* *C* *C* *174.226* *.* *1* old residue 170 adding: *842* *170* *Asn* *CA* *C* *53.162* *.* *1* old residue 170 adding: *843* *170* *Asn* *CB* *C* *40.778* *.* *1* old residue 170 adding: *844* *170* *Asn* *N* *N* *120.623* *.* *1* new residue 171 adding: *845* *171* *Leu* *H* *H* *8.838* *.* *1* old residue 171 adding: *846* *171* *Leu* *HD1* *H* *0.662* *.* *2* old residue 171 adding: *847* *171* *Leu* *HD2* *H* *0.607* *.* *2* old residue 171 adding: *848* *171* *Leu* *C* *C* *174.415* *.* *1* old residue 171 adding: *849* *171* *Leu* *CA* *C* *54.940* *.* *1* old residue 171 adding: *850* *171* *Leu* *CB* *C* *43.593* *.* *1* old residue 171 adding: *851* *171* *Leu* *CD1* *C* *24.651* *.* *2* old residue 171 adding: *852* *171* *Leu* *CD2* *C* *25.200* *.* *2* old residue 171 adding: *853* *171* *Leu* *N* *N* *122.720* *.* *1* new residue 172 adding: *854* *172* *Glu* *H* *H* *8.223* *.* *1* old residue 172 adding: *855* *172* *Glu* *C* *C* *176.587* *.* *1* old residue 172 adding: *856* *172* *Glu* *CA* *C* *55.076* *.* *1* old residue 172 adding: *857* *172* *Glu* *CB* *C* *32.323* *.* *1* old residue 172 adding: *858* *172* *Glu* *N* *N* *119.202* *.* *1* new residue 173 adding: *859* *173* *Arg* *H* *H* *8.579* *.* *1* old residue 173 adding: *860* *173* *Arg* *C* *C* *174.113* *.* *1* old residue 173 adding: *861* *173* *Arg* *CA* *C* *54.820* *.* *1* old residue 173 adding: *862* *173* *Arg* *CB* *C* *33.018* *.* *1* old residue 173 adding: *863* *173* *Arg* *N* *N* *119.868* *.* *1* new residue 174 adding: *864* *174* *Asn* *H* *H* *8.648* *.* *1* old residue 174 adding: *865* *174* *Asn* *C* *C* *174.906* *.* *1* old residue 174 adding: *866* *174* *Asn* *CA* *C* *53.521* *.* *1* old residue 174 adding: *867* *174* *Asn* *CB* *C* *38.467* *.* *1* old residue 174 adding: *868* *174* *Asn* *N* *N* *119.858* *.* *1* new residue 175 adding: *869* *175* *Leu* *H* *H* *8.321* *.* *1* old residue 175 adding: *870* *175* *Leu* *HD1* *H* *0.705* *.* *2* old residue 175 adding: *871* *175* *Leu* *HD2* *H* *0.660* *.* *2* old residue 175 adding: *872* *175* *Leu* *C* *C* *176.213* *.* *1* old residue 175 adding: *873* *175* *Leu* *CA* *C* *54.934* *.* *1* old residue 175 adding: *874* *175* *Leu* *CB* *C* *42.612* *.* *1* old residue 175 adding: *875* *175* *Leu* *CD1* *C* *25.658* *.* *2* old residue 175 adding: *876* *175* *Leu* *CD2* *C* *23.867* *.* *2* old residue 175 adding: *877* *175* *Leu* *N* *N* *126.887* *.* *1* new residue 176 adding: *878* *176* *Asp* *C* *C* *177.490* *.* *1* old residue 176 adding: *879* *176* *Asp* *CB* *C* *43.156* *.* *1* new residue 177 adding: *880* *177* *Glu* *H* *H* *8.350* *.* *1* old residue 177 adding: *881* *177* *Glu* *CA* *C* *55.032* *.* *1* old residue 177 adding: *882* *177* *Glu* *N* *N* *122.110* *.* *1* new residue 181 adding: *883* *181* *His* *C* *C* *174.851* *.* *1* new residue 182 adding: *884* *182* *Gln* *H* *H* *8.240* *.* *1* old residue 182 adding: *885* *182* *Gln* *N* *N* *121.488* *.* *1* new residue 183 adding: *886* *183* *Gly* *CA* *C* *44.823* *.* *1* new residue 184 adding: *887* *184* *Lys* *H* *H* *8.234* *.* *1* old residue 184 adding: *888* *184* *Lys* *C* *C* *175.482* *.* *1* old residue 184 adding: *889* *184* *Lys* *CA* *C* *57.556* *.* *1* old residue 184 adding: *890* *184* *Lys* *CB* *C* *32.915* *.* *1* old residue 184 adding: *891* *184* *Lys* *N* *N* *122.188* *.* *1* new residue 185 adding: *892* *185* *Ala* *H* *H* *8.449* *.* *1* old residue 185 adding: *893* *185* *Ala* *C* *C* *174.932* *.* *1* old residue 185 adding: *894* *185* *Ala* *CA* *C* *50.748* *.* *1* old residue 185 adding: *895* *185* *Ala* *CB* *C* *23.518* *.* *1* old residue 185 adding: *896* *185* *Ala* *N* *N* *126.304* *.* *1* new residue 186 adding: *897* *186* *Ala* *H* *H* *8.647* *.* *1* old residue 186 adding: *898* *186* *Ala* *C* *C* *176.771* *.* *1* old residue 186 adding: *899* *186* *Ala* *CA* *C* *51.367* *.* *1* old residue 186 adding: *900* *186* *Ala* *CB* *C* *19.773* *.* *1* old residue 186 adding: *901* *186* *Ala* *N* *N* *122.760* *.* *1* new residue 187 adding: *902* *187* *Leu* *H* *H* *9.024* *.* *1* old residue 187 adding: *903* *187* *Leu* *HD1* *H* *0.701* *.* *2* old residue 187 adding: *904* *187* *Leu* *HD2* *H* *0.629* *.* *2* old residue 187 adding: *905* *187* *Leu* *C* *C* *176.110* *.* *1* old residue 187 adding: *906* *187* *Leu* *CA* *C* *54.205* *.* *1* old residue 187 adding: *907* *187* *Leu* *CB* *C* *46.232* *.* *1* old residue 187 adding: *908* *187* *Leu* *CD1* *C* *27.310* *.* *2* old residue 187 adding: *909* *187* *Leu* *CD2* *C* *25.331* *.* *2* old residue 187 adding: *910* *187* *Leu* *N* *N* *123.365* *.* *1* new residue 188 adding: *911* *188* *Ile* *H* *H* *8.881* *.* *1* old residue 188 adding: *912* *188* *Ile* *HD1* *H* *0.813* *.* *1* old residue 188 adding: *913* *188* *Ile* *C* *C* *174.813* *.* *1* old residue 188 adding: *914* *188* *Ile* *CA* *C* *59.775* *.* *1* old residue 188 adding: *915* *188* *Ile* *CB* *C* *41.458* *.* *1* old residue 188 adding: *916* *188* *Ile* *CD1* *C* *14.688* *.* *1* old residue 188 adding: *917* *188* *Ile* *N* *N* *118.984* *.* *1* new residue 189 adding: *918* *189* *Gln* *H* *H* *8.260* *.* *1* old residue 189 adding: *919* *189* *Gln* *C* *C* *175.112* *.* *1* old residue 189 adding: *920* *189* *Gln* *CA* *C* *53.322* *.* *1* old residue 189 adding: *921* *189* *Gln* *CB* *C* *30.127* *.* *1* old residue 189 adding: *922* *189* *Gln* *N* *N* *120.660* *.* *1* new residue 190 adding: *923* *190* *Leu* *H* *H* *9.272* *.* *1* old residue 190 adding: *924* *190* *Leu* *HD1* *H* *0.499* *.* *2* old residue 190 adding: *925* *190* *Leu* *HD2* *H* *0.363* *.* *2* old residue 190 adding: *926* *190* *Leu* *C* *C* *175.779* *.* *1* old residue 190 adding: *927* *190* *Leu* *CA* *C* *53.580* *.* *1* old residue 190 adding: *928* *190* *Leu* *CB* *C* *47.231* *.* *1* old residue 190 adding: *929* *190* *Leu* *CD1* *C* *25.912* *.* *2* old residue 190 adding: *930* *190* *Leu* *CD2* *C* *23.326* *.* *2* old residue 190 adding: *931* *190* *Leu* *N* *N* *120.776* *.* *1* new residue 191 adding: *932* *191* *Leu* *H* *H* *9.082* *.* *1* old residue 191 adding: *933* *191* *Leu* *HD1* *H* *0.795* *.* *2* old residue 191 adding: *934* *191* *Leu* *HD2* *H* *0.807* *.* *2* old residue 191 adding: *935* *191* *Leu* *C* *C* *176.491* *.* *1* old residue 191 adding: *936* *191* *Leu* *CA* *C* *55.459* *.* *1* old residue 191 adding: *937* *191* *Leu* *CB* *C* *45.421* *.* *1* old residue 191 adding: *938* *191* *Leu* *CD1* *C* *25.292* *.* *2* old residue 191 adding: *939* *191* *Leu* *CD2* *C* *25.887* *.* *2* old residue 191 adding: *940* *191* *Leu* *N* *N* *121.498* *.* *1* new residue 192 adding: *941* *192* *Gly* *H* *H* *9.969* *.* *1* old residue 192 adding: *942* *192* *Gly* *C* *C* *171.077* *.* *1* old residue 192 adding: *943* *192* *Gly* *CA* *C* *44.916* *.* *1* old residue 192 adding: *944* *192* *Gly* *N* *N* *115.171* *.* *1* new residue 193 adding: *945* *193* *Gln* *H* *H* *9.188* *.* *1* old residue 193 adding: *946* *193* *Gln* *C* *C* *174.774* *.* *1* old residue 193 adding: *947* *193* *Gln* *CA* *C* *53.675* *.* *1* old residue 193 adding: *948* *193* *Gln* *CB* *C* *33.519* *.* *1* old residue 193 adding: *949* *193* *Gln* *N* *N* *123.097* *.* *1* new residue 194 adding: *950* *194* *Lys* *H* *H* *8.898* *.* *1* old residue 194 adding: *951* *194* *Lys* *C* *C* *175.712* *.* *1* old residue 194 adding: *952* *194* *Lys* *CA* *C* *55.843* *.* *1* old residue 194 adding: *953* *194* *Lys* *CB* *C* *33.159* *.* *1* old residue 194 adding: *954* *194* *Lys* *N* *N* *129.517* *.* *1* new residue 195 adding: *955* *195* *Leu* *H* *H* *8.815* *.* *1* old residue 195 adding: *956* *195* *Leu* *HD1* *H* *0.856* *.* *2* old residue 195 adding: *957* *195* *Leu* *HD2* *H* *0.809* *.* *2* old residue 195 adding: *958* *195* *Leu* *C* *C* *177.092* *.* *1* old residue 195 adding: *959* *195* *Leu* *CA* *C* *55.045* *.* *1* old residue 195 adding: *960* *195* *Leu* *CB* *C* *42.790* *.* *1* old residue 195 adding: *961* *195* *Leu* *CD1* *C* *24.872* *.* *2* old residue 195 adding: *962* *195* *Leu* *CD2* *C* *22.953* *.* *2* old residue 195 adding: *963* *195* *Leu* *N* *N* *129.542* *.* *1* new residue 196 adding: *964* *196* *Glu* *H* *H* *8.386* *.* *1* old residue 196 adding: *965* *196* *Glu* *C* *C* *176.210* *.* *1* old residue 196 adding: *966* *196* *Glu* *CA* *C* *56.706* *.* *1* old residue 196 adding: *967* *196* *Glu* *CB* *C* *30.546* *.* *1* old residue 196 adding: *968* *196* *Glu* *N* *N* *120.654* *.* *1* new residue 197 adding: *969* *197* *His* *H* *H* *8.442* *.* *1* old residue 197 adding: *970* *197* *His* *C* *C* *175.195* *.* *1* old residue 197 adding: *971* *197* *His* *CA* *C* *56.381* *.* *1* old residue 197 adding: *972* *197* *His* *CB* *C* *30.501* *.* *1* old residue 197 adding: *973* *197* *His* *N* *N* *120.121* *.* *1* seqcode size is : 172 seqcode: 127 shift counts are : 5 seqcode: 32 shift counts are : 5 seqcode: 90 shift counts are : 7 seqcode: 118 shift counts are : 5 seqcode: 71 shift counts are : 5 seqcode: 102 shift counts are : 5 seqcode: 125 shift counts are : 4 seqcode: 44 shift counts are : 5 seqcode: 55 shift counts are : 5 seqcode: 84 shift counts are : 4 seqcode: 27 shift counts are : 5 seqcode: 190 shift counts are : 9 seqcode: 161 shift counts are : 3 seqcode: 194 shift counts are : 5 seqcode: 95 shift counts are : 6 seqcode: 57 shift counts are : 9 seqcode: 163 shift counts are : 9 seqcode: 109 shift counts are : 9 seqcode: 151 shift counts are : 3 seqcode: 89 shift counts are : 5 seqcode: 175 shift counts are : 9 seqcode: 148 shift counts are : 5 seqcode: 31 shift counts are : 4 seqcode: 35 shift counts are : 5 seqcode: 78 shift counts are : 7 seqcode: 93 shift counts are : 5 seqcode: 106 shift counts are : 3 seqcode: 157 shift counts are : 5 seqcode: 65 shift counts are : 5 seqcode: 29 shift counts are : 3 seqcode: 197 shift counts are : 5 seqcode: 138 shift counts are : 5 seqcode: 114 shift counts are : 5 seqcode: 58 shift counts are : 5 seqcode: 153 shift counts are : 9 seqcode: 137 shift counts are : 9 seqcode: 81 shift counts are : 9 seqcode: 60 shift counts are : 5 seqcode: 101 shift counts are : 7 seqcode: 73 shift counts are : 5 seqcode: 86 shift counts are : 5 seqcode: 76 shift counts are : 9 seqcode: 62 shift counts are : 9 seqcode: 67 shift counts are : 5 seqcode: 165 shift counts are : 7 seqcode: 139 shift counts are : 5 seqcode: 129 shift counts are : 9 seqcode: 2 shift counts are : 2 seqcode: 186 shift counts are : 5 seqcode: 110 shift counts are : 5 seqcode: 82 shift counts are : 5 seqcode: 147 shift counts are : 9 seqcode: 168 shift counts are : 5 seqcode: 184 shift counts are : 5 seqcode: 135 shift counts are : 5 seqcode: 112 shift counts are : 5 seqcode: 69 shift counts are : 5 seqcode: 191 shift counts are : 9 seqcode: 172 shift counts are : 5 seqcode: 145 shift counts are : 5 seqcode: 49 shift counts are : 5 seqcode: 24 shift counts are : 9 seqcode: 187 shift counts are : 9 seqcode: 140 shift counts are : 5 seqcode: 124 shift counts are : 4 seqcode: 104 shift counts are : 5 seqcode: 131 shift counts are : 4 seqcode: 181 shift counts are : 1 seqcode: 121 shift counts are : 9 seqcode: 79 shift counts are : 5 seqcode: 154 shift counts are : 5 seqcode: 23 shift counts are : 5 seqcode: 126 shift counts are : 7 seqcode: 159 shift counts are : 5 seqcode: 160 shift counts are : 9 seqcode: 176 shift counts are : 2 seqcode: 47 shift counts are : 9 seqcode: 8 shift counts are : 2 seqcode: 98 shift counts are : 5 seqcode: 37 shift counts are : 5 seqcode: 117 shift counts are : 9 seqcode: 43 shift counts are : 5 seqcode: 195 shift counts are : 9 seqcode: 170 shift counts are : 5 seqcode: 33 shift counts are : 7 seqcode: 21 shift counts are : 9 seqcode: 63 shift counts are : 4 seqcode: 26 shift counts are : 5 seqcode: 80 shift counts are : 5 seqcode: 193 shift counts are : 5 seqcode: 119 shift counts are : 5 seqcode: 99 shift counts are : 9 seqcode: 162 shift counts are : 5 seqcode: 72 shift counts are : 5 seqcode: 74 shift counts are : 5 seqcode: 182 shift counts are : 2 seqcode: 61 shift counts are : 5 seqcode: 108 shift counts are : 5 seqcode: 115 shift counts are : 3 seqcode: 92 shift counts are : 5 seqcode: 103 shift counts are : 5 seqcode: 113 shift counts are : 9 seqcode: 152 shift counts are : 5 seqcode: 189 shift counts are : 5 seqcode: 142 shift counts are : 4 seqcode: 91 shift counts are : 9 seqcode: 167 shift counts are : 7 seqcode: 48 shift counts are : 5 seqcode: 107 shift counts are : 5 seqcode: 87 shift counts are : 5 seqcode: 174 shift counts are : 5 seqcode: 77 shift counts are : 5 seqcode: 133 shift counts are : 5 seqcode: 123 shift counts are : 3 seqcode: 149 shift counts are : 8 seqcode: 50 shift counts are : 9 seqcode: 64 shift counts are : 9 seqcode: 97 shift counts are : 2 seqcode: 41 shift counts are : 2 seqcode: 12 shift counts are : 4 seqcode: 52 shift counts are : 5 seqcode: 173 shift counts are : 5 seqcode: 56 shift counts are : 5 seqcode: 45 shift counts are : 5 seqcode: 66 shift counts are : 5 seqcode: 54 shift counts are : 9 seqcode: 70 shift counts are : 7 seqcode: 188 shift counts are : 7 seqcode: 68 shift counts are : 5 seqcode: 166 shift counts are : 9 seqcode: 88 shift counts are : 5 seqcode: 116 shift counts are : 5 seqcode: 136 shift counts are : 5 seqcode: 30 shift counts are : 5 seqcode: 141 shift counts are : 5 seqcode: 144 shift counts are : 3 seqcode: 100 shift counts are : 5 seqcode: 25 shift counts are : 5 seqcode: 128 shift counts are : 7 seqcode: 28 shift counts are : 7 seqcode: 120 shift counts are : 4 seqcode: 156 shift counts are : 9 seqcode: 83 shift counts are : 5 seqcode: 75 shift counts are : 4 seqcode: 134 shift counts are : 3 seqcode: 192 shift counts are : 4 seqcode: 59 shift counts are : 5 seqcode: 177 shift counts are : 3 seqcode: 150 shift counts are : 9 seqcode: 155 shift counts are : 5 seqcode: 130 shift counts are : 5 seqcode: 53 shift counts are : 5 seqcode: 143 shift counts are : 4 seqcode: 158 shift counts are : 5 seqcode: 22 shift counts are : 9 seqcode: 42 shift counts are : 5 seqcode: 46 shift counts are : 5 seqcode: 105 shift counts are : 9 seqcode: 85 shift counts are : 9 seqcode: 185 shift counts are : 5 seqcode: 36 shift counts are : 9 seqcode: 183 shift counts are : 1 seqcode: 94 shift counts are : 5 seqcode: 51 shift counts are : 4 seqcode: 111 shift counts are : 5 seqcode: 146 shift counts are : 5 seqcode: 34 shift counts are : 9 seqcode: 169 shift counts are : 5 seqcode: 164 shift counts are : 5 seqcode: 132 shift counts are : 5 seqcode: 196 shift counts are : 5 seqcode: 171 shift counts are : 9 setting ambig code at 929 for HD1 to 2 setting ambig code at 930 for HD2 to 2 setting ambig code at 210 for HG2 to 2 setting ambig code at 209 for HG1 to 2 setting ambig code at 799 for HD1 to 2 setting ambig code at 800 for HD2 to 2 setting ambig code at 501 for HD1 to 2 setting ambig code at 502 for HD2 to 2 setting ambig code at 875 for HD1 to 2 setting ambig code at 876 for HD2 to 2 setting ambig code at 739 for HD1 to 2 setting ambig code at 740 for HD2 to 2 setting ambig code at 650 for HD1 to 2 setting ambig code at 651 for HD2 to 2 setting ambig code at 348 for HG2 to 2 setting ambig code at 347 for HG1 to 2 setting ambig code at 317 for HG2 to 2 setting ambig code at 316 for HG1 to 2 setting ambig code at 239 for HG2 to 2 setting ambig code at 238 for HG1 to 2 setting ambig code at 609 for HD1 to 2 setting ambig code at 610 for HD2 to 2 setting ambig code at 700 for HD1 to 2 setting ambig code at 701 for HD2 to 2 setting ambig code at 938 for HD1 to 2 setting ambig code at 939 for HD2 to 2 setting ambig code at 39 for HG2 to 2 setting ambig code at 38 for HG1 to 2 setting ambig code at 908 for HD1 to 2 setting ambig code at 909 for HD2 to 2 setting ambig code at 570 for HD1 to 2 setting ambig code at 571 for HD2 to 2 setting ambig code at 590 for HG2 to 2 setting ambig code at 589 for HG1 to 2 setting ambig code at 782 for HD1 to 2 setting ambig code at 783 for HD2 to 2 setting ambig code at 148 for HD1 to 2 setting ambig code at 149 for HD2 to 2 setting ambig code at 548 for HG2 to 2 setting ambig code at 547 for HG1 to 2 setting ambig code at 961 for HD1 to 2 setting ambig code at 962 for HD2 to 2 setting ambig code at 15 for HD1 to 2 setting ambig code at 16 for HD2 to 2 setting ambig code at 444 for HG2 to 2 setting ambig code at 443 for HG1 to 2 setting ambig code at 525 for HD1 to 2 setting ambig code at 526 for HD2 to 2 setting ambig code at 407 for HG2 to 2 setting ambig code at 406 for HG1 to 2 setting ambig code at 713 for HD1 to 2 setting ambig code at 714 for HD2 to 2 setting ambig code at 167 for HD1 to 2 setting ambig code at 168 for HD2 to 2 setting ambig code at 251 for HD1 to 2 setting ambig code at 252 for HD2 to 2 setting ambig code at 8 for HG2 to 2 setting ambig code at 7 for HG1 to 2 setting ambig code at 191 for HG2 to 2 setting ambig code at 190 for HG1 to 2 setting ambig code at 284 for HD1 to 2 setting ambig code at 820 for HD1 to 2 setting ambig code at 821 for HD2 to 2 setting ambig code at 758 for HD1 to 2 setting ambig code at 759 for HD2 to 2 setting ambig code at 722 for HD1 to 2 setting ambig code at 723 for HD2 to 2 setting ambig code at 25 for HG2 to 2 setting ambig code at 24 for HG1 to 2 setting ambig code at 479 for HD1 to 2 setting ambig code at 480 for HD2 to 2 setting ambig code at 370 for HD1 to 2 setting ambig code at 371 for HD2 to 2 setting ambig code at 107 for HD1 to 2 setting ambig code at 108 for HD2 to 2 setting ambig code at 93 for HD1 to 2 setting ambig code at 94 for HD2 to 2 setting ambig code at 851 for HD1 to 2 setting ambig code at 852 for HD2 to 2 1 2 TRP HE1 H 10.182 . 1 2 2 TRP NE1 N 129.364 . 1 3 8 GLN H H 8.446 . 1 4 8 GLN N N 121.976 . 1 5 12 VAL HG1 H 0.716 . 2 6 12 VAL HG2 H 0.752 . 2 7 12 VAL CG1 C 20.903 . 2 8 12 VAL CG2 C 20.749 . 2 9 21 LEU H H 8.503 . 1 10 21 LEU HD1 H 0.774 . 2 11 21 LEU HD2 H 0.936 . 2 12 21 LEU C C 178.031 . 1 13 21 LEU CA C 57.976 . 1 14 21 LEU CB C 41.831 . 1 15 21 LEU CD1 C 23.623 . 2 16 21 LEU CD2 C 26.298 . 2 17 21 LEU N N 124.586 . 1 18 22 VAL H H 7.889 . 1 19 22 VAL HG1 H 0.757 . 2 20 22 VAL HG2 H 0.212 . 2 21 22 VAL C C 179.007 . 1 22 22 VAL CA C 66.543 . 1 23 22 VAL CB C 31.744 . 1 24 22 VAL CG1 C 20.731 . 2 25 22 VAL CG2 C 21.487 . 2 26 22 VAL N N 115.794 . 1 27 23 SER H H 7.620 . 1 28 23 SER C C 176.013 . 1 29 23 SER CA C 61.344 . 1 30 23 SER CB C 63.576 . 1 31 23 SER N N 114.438 . 1 32 24 VAL H H 7.153 . 1 33 24 VAL HG1 H 0.346 . 2 34 24 VAL HG2 H 0.222 . 2 35 24 VAL C C 177.092 . 1 36 24 VAL CA C 61.176 . 1 37 24 VAL CB C 32.230 . 1 38 24 VAL CG1 C 21.520 . 2 39 24 VAL CG2 C 17.612 . 2 40 24 VAL N N 111.911 . 1 41 25 ALA H H 7.619 . 1 42 25 ALA C C 178.065 . 1 43 25 ALA CA C 55.707 . 1 44 25 ALA CB C 17.553 . 1 45 25 ALA N N 125.280 . 1 46 26 ASN H H 8.204 . 1 47 26 ASN C C 176.888 . 1 48 26 ASN CA C 54.771 . 1 49 26 ASN CB C 37.341 . 1 50 26 ASN N N 109.515 . 1 51 27 GLN H H 8.305 . 1 52 27 GLN C C 175.842 . 1 53 27 GLN CA C 56.083 . 1 54 27 GLN CB C 28.964 . 1 55 27 GLN N N 117.788 . 1 56 28 ILE H H 7.674 . 1 57 28 ILE HD1 H 0.307 . 1 58 28 ILE C C 175.651 . 1 59 28 ILE CA C 59.983 . 1 60 28 ILE CB C 37.627 . 1 61 28 ILE CD1 C 13.820 . 1 62 28 ILE N N 120.944 . 1 63 29 PRO C C 175.430 . 1 64 29 PRO CA C 63.730 . 1 65 29 PRO CB C 31.596 . 1 66 30 GLN H H 7.994 . 1 67 30 GLN C C 176.838 . 1 68 30 GLN CA C 57.600 . 1 69 30 GLN CB C 28.377 . 1 70 30 GLN N N 117.512 . 1 71 31 GLY H H 7.388 . 1 72 31 GLY C C 172.651 . 1 73 31 GLY CA C 45.604 . 1 74 31 GLY N N 109.764 . 1 75 32 LYS H H 9.707 . 1 76 32 LYS C C 176.964 . 1 77 32 LYS CA C 56.201 . 1 78 32 LYS CB C 35.004 . 1 79 32 LYS N N 126.107 . 1 80 33 ILE H H 8.778 . 1 81 33 ILE HD1 H 0.223 . 1 82 33 ILE C C 173.323 . 1 83 33 ILE CA C 58.669 . 1 84 33 ILE CB C 41.740 . 1 85 33 ILE CD1 C 14.396 . 1 86 33 ILE N N 120.931 . 1 87 34 LEU H H 8.210 . 1 88 34 LEU HD1 H 0.339 . 2 89 34 LEU HD2 H 0.280 . 2 90 34 LEU C C 175.238 . 1 91 34 LEU CA C 52.911 . 1 92 34 LEU CB C 42.608 . 1 93 34 LEU CD1 C 22.662 . 2 94 34 LEU CD2 C 25.404 . 2 95 34 LEU N N 130.293 . 1 96 35 CYS H H 9.130 . 1 97 35 CYS C C 175.640 . 1 98 35 CYS CA C 58.020 . 1 99 35 CYS CB C 29.302 . 1 100 35 CYS N N 124.073 . 1 101 36 LEU H H 8.100 . 1 102 36 LEU HD1 H 0.862 . 2 103 36 LEU HD2 H 0.618 . 2 104 36 LEU C C 176.248 . 1 105 36 LEU CA C 54.618 . 1 106 36 LEU CB C 42.107 . 1 107 36 LEU CD1 C 25.135 . 2 108 36 LEU CD2 C 21.810 . 2 109 36 LEU N N 122.749 . 1 110 37 ALA H H 7.785 . 1 111 37 ALA C C 177.527 . 1 112 37 ALA CA C 53.330 . 1 113 37 ALA CB C 17.160 . 1 114 37 ALA N N 124.510 . 1 115 41 GLY C C 176.068 . 1 116 41 GLY CA C 47.326 . 1 117 42 ARG H H 7.866 . 1 118 42 ARG C C 178.614 . 1 119 42 ARG CA C 58.713 . 1 120 42 ARG CB C 28.288 . 1 121 42 ARG N N 118.964 . 1 122 43 ASN H H 8.883 . 1 123 43 ASN C C 177.653 . 1 124 43 ASN CA C 57.009 . 1 125 43 ASN CB C 38.026 . 1 126 43 ASN N N 119.555 . 1 127 44 ALA H H 9.656 . 1 128 44 ALA C C 179.832 . 1 129 44 ALA CA C 55.579 . 1 130 44 ALA CB C 18.435 . 1 131 44 ALA N N 124.769 . 1 132 45 CYS H H 8.694 . 1 133 45 CYS C C 177.623 . 1 134 45 CYS CA C 64.542 . 1 135 45 CYS CB C 26.692 . 1 136 45 CYS N N 112.322 . 1 137 46 PHE H H 6.979 . 1 138 46 PHE C C 178.201 . 1 139 46 PHE CA C 60.655 . 1 140 46 PHE CB C 38.954 . 1 141 46 PHE N N 120.419 . 1 142 47 LEU H H 8.091 . 1 143 47 LEU HD1 H 0.642 . 2 144 47 LEU HD2 H 0.453 . 2 145 47 LEU C C 179.663 . 1 146 47 LEU CA C 57.946 . 1 147 47 LEU CB C 41.577 . 1 148 47 LEU CD1 C 25.925 . 2 149 47 LEU CD2 C 21.324 . 2 150 47 LEU N N 120.097 . 1 151 48 ALA H H 8.543 . 1 152 48 ALA C C 182.532 . 1 153 48 ALA CA C 54.842 . 1 154 48 ALA CB C 18.194 . 1 155 48 ALA N N 122.491 . 1 156 49 SER H H 8.021 . 1 157 49 SER C C 174.987 . 1 158 49 SER CA C 61.560 . 1 159 49 SER CB C 62.883 . 1 160 49 SER N N 117.016 . 1 161 50 LEU H H 7.146 . 1 162 50 LEU HD1 H 0.624 . 2 163 50 LEU HD2 H 0.700 . 2 164 50 LEU C C 177.841 . 1 165 50 LEU CA C 54.944 . 1 166 50 LEU CB C 42.081 . 1 167 50 LEU CD1 C 26.054 . 2 168 50 LEU CD2 C 21.727 . 2 169 50 LEU N N 120.750 . 1 170 51 GLY H H 7.776 . 1 171 51 GLY C C 174.999 . 1 172 51 GLY CA C 44.925 . 1 173 51 GLY N N 105.208 . 1 174 52 TYR H H 7.088 . 1 175 52 TYR C C 175.330 . 1 176 52 TYR CA C 59.333 . 1 177 52 TYR CB C 38.877 . 1 178 52 TYR N N 118.637 . 1 179 53 GLU H H 8.439 . 1 180 53 GLU C C 177.573 . 1 181 53 GLU CA C 55.784 . 1 182 53 GLU CB C 29.971 . 1 183 53 GLU N N 122.887 . 1 184 54 VAL H H 9.620 . 1 185 54 VAL HG1 H 0.955 . 2 186 54 VAL HG2 H 0.931 . 2 187 54 VAL C C 176.109 . 1 188 54 VAL CA C 63.265 . 1 189 54 VAL CB C 34.959 . 1 190 54 VAL CG1 C 22.509 . 2 191 54 VAL CG2 C 22.205 . 2 192 54 VAL N N 129.989 . 1 193 55 THR H H 9.477 . 1 194 55 THR C C 172.125 . 1 195 55 THR CA C 62.059 . 1 196 55 THR CB C 71.193 . 1 197 55 THR N N 125.500 . 1 198 56 ALA H H 9.368 . 1 199 56 ALA C C 174.034 . 1 200 56 ALA CA C 50.296 . 1 201 56 ALA CB C 20.643 . 1 202 56 ALA N N 130.486 . 1 203 57 VAL H H 8.001 . 1 204 57 VAL HG1 H 0.453 . 2 205 57 VAL HG2 H 0.153 . 2 206 57 VAL C C 175.055 . 1 207 57 VAL CA C 58.830 . 1 208 57 VAL CB C 34.538 . 1 209 57 VAL CG1 C 20.501 . 2 210 57 VAL CG2 C 21.480 . 2 211 57 VAL N N 121.126 . 1 212 58 ASP H H 8.412 . 1 213 58 ASP C C 174.923 . 1 214 58 ASP CA C 54.675 . 1 215 58 ASP CB C 46.800 . 1 216 58 ASP N N 125.094 . 1 217 59 GLN H H 8.476 . 1 218 59 GLN C C 177.044 . 1 219 59 GLN CA C 57.419 . 1 220 59 GLN CB C 29.094 . 1 221 59 GLN N N 120.047 . 1 222 60 SER H H 9.158 . 1 223 60 SER C C 175.734 . 1 224 60 SER CA C 56.940 . 1 225 60 SER CB C 64.352 . 1 226 60 SER N N 115.261 . 1 227 61 SER H H 8.974 . 1 228 61 SER C C 177.834 . 1 229 61 SER CA C 61.303 . 1 230 61 SER CB C 62.517 . 1 231 61 SER N N 124.466 . 1 232 62 VAL H H 7.845 . 1 233 62 VAL HG1 H 0.929 . 2 234 62 VAL HG2 H 1.024 . 2 235 62 VAL C C 178.961 . 1 236 62 VAL CA C 65.966 . 1 237 62 VAL CB C 32.141 . 1 238 62 VAL CG1 C 20.705 . 2 239 62 VAL CG2 C 21.883 . 2 240 62 VAL N N 123.568 . 1 241 63 GLY H H 8.223 . 1 242 63 GLY C C 176.479 . 1 243 63 GLY CA C 47.825 . 1 244 63 GLY N N 109.354 . 1 245 64 LEU H H 7.783 . 1 246 64 LEU HD1 H 0.797 . 2 247 64 LEU HD2 H 0.656 . 2 248 64 LEU C C 179.478 . 1 249 64 LEU CA C 57.520 . 1 250 64 LEU CB C 41.233 . 1 251 64 LEU CD1 C 25.462 . 2 252 64 LEU CD2 C 21.173 . 2 253 64 LEU N N 119.433 . 1 254 65 ALA H H 7.928 . 1 255 65 ALA C C 182.018 . 1 256 65 ALA CA C 55.598 . 1 257 65 ALA CB C 17.619 . 1 258 65 ALA N N 121.987 . 1 259 66 LYS H H 7.951 . 1 260 66 LYS C C 179.872 . 1 261 66 LYS CA C 59.767 . 1 262 66 LYS CB C 31.338 . 1 263 66 LYS N N 120.547 . 1 264 67 ALA H H 8.187 . 1 265 67 ALA C C 179.542 . 1 266 67 ALA CA C 55.544 . 1 267 67 ALA CB C 16.688 . 1 268 67 ALA N N 124.216 . 1 269 68 LYS H H 8.083 . 1 270 68 LYS C C 180.064 . 1 271 68 LYS CA C 59.688 . 1 272 68 LYS CB C 31.968 . 1 273 68 LYS N N 116.475 . 1 274 69 GLN H H 7.935 . 1 275 69 GLN C C 178.504 . 1 276 69 GLN CA C 59.146 . 1 277 69 GLN CB C 28.119 . 1 278 69 GLN N N 120.633 . 1 279 70 LEU H H 8.290 . 1 280 70 LEU HD1 H 0.526 . 2 281 70 LEU C C 178.826 . 1 282 70 LEU CA C 57.839 . 1 283 70 LEU CB C 40.693 . 1 284 70 LEU CD1 C 25.250 . 2 285 70 LEU N N 122.888 . 1 286 71 ALA H H 8.270 . 1 287 71 ALA C C 180.004 . 1 288 71 ALA CA C 55.602 . 1 289 71 ALA CB C 17.436 . 1 290 71 ALA N N 120.809 . 1 291 72 GLN H H 7.797 . 1 292 72 GLN C C 180.345 . 1 293 72 GLN CA C 59.039 . 1 294 72 GLN CB C 28.100 . 1 295 72 GLN N N 117.093 . 1 296 73 GLU H H 8.227 . 1 297 73 GLU C C 179.404 . 1 298 73 GLU CA C 59.463 . 1 299 73 GLU CB C 29.272 . 1 300 73 GLU N N 121.109 . 1 301 74 LYS H H 8.338 . 1 302 74 LYS C C 177.156 . 1 303 74 LYS CA C 55.996 . 1 304 74 LYS CB C 32.618 . 1 305 74 LYS N N 116.178 . 1 306 75 GLY H H 7.990 . 1 307 75 GLY C C 175.545 . 1 308 75 GLY CA C 46.839 . 1 309 75 GLY N N 109.425 . 1 310 76 VAL H H 8.186 . 1 311 76 VAL HG1 H 0.744 . 2 312 76 VAL HG2 H 0.800 . 2 313 76 VAL C C 174.054 . 1 314 76 VAL CA C 58.617 . 1 315 76 VAL CB C 35.204 . 1 316 76 VAL CG1 C 20.786 . 2 317 76 VAL CG2 C 18.036 . 2 318 76 VAL N N 111.321 . 1 319 77 LYS H H 8.503 . 1 320 77 LYS C C 176.177 . 1 321 77 LYS CA C 55.360 . 1 322 77 LYS CB C 34.063 . 1 323 77 LYS N N 120.320 . 1 324 78 ILE H H 8.242 . 1 325 78 ILE HD1 H 0.517 . 1 326 78 ILE C C 174.940 . 1 327 78 ILE CA C 60.016 . 1 328 78 ILE CB C 42.383 . 1 329 78 ILE CD1 C 13.755 . 1 330 78 ILE N N 114.883 . 1 331 79 THR H H 8.604 . 1 332 79 THR C C 174.209 . 1 333 79 THR CA C 62.846 . 1 334 79 THR CB C 69.940 . 1 335 79 THR N N 119.982 . 1 336 80 THR H H 8.762 . 1 337 80 THR C C 174.173 . 1 338 80 THR CA C 59.280 . 1 339 80 THR CB C 70.898 . 1 340 80 THR N N 116.688 . 1 341 81 VAL H H 8.722 . 1 342 81 VAL HG1 H 0.977 . 2 343 81 VAL HG2 H 0.931 . 2 344 81 VAL C C 173.093 . 1 345 81 VAL CA C 61.765 . 1 346 81 VAL CB C 35.818 . 1 347 81 VAL CG1 C 20.691 . 2 348 81 VAL CG2 C 20.674 . 2 349 81 VAL N N 123.228 . 1 350 82 GLN H H 8.602 . 1 351 82 GLN C C 176.096 . 1 352 82 GLN CA C 54.020 . 1 353 82 GLN CB C 27.746 . 1 354 82 GLN N N 127.669 . 1 355 83 SER H H 7.810 . 1 356 83 SER C C 173.817 . 1 357 83 SER CA C 58.332 . 1 358 83 SER CB C 65.729 . 1 359 83 SER N N 120.905 . 1 360 84 ASN H H 8.855 . 1 361 84 ASN CA C 54.060 . 1 362 84 ASN CB C 38.330 . 1 363 84 ASN N N 122.834 . 1 364 85 LEU H H 9.341 . 1 365 85 LEU HD1 H 0.919 . 2 366 85 LEU HD2 H 0.692 . 2 367 85 LEU C C 178.161 . 1 368 85 LEU CA C 58.428 . 1 369 85 LEU CB C 40.591 . 1 370 85 LEU CD1 C 26.426 . 2 371 85 LEU CD2 C 23.330 . 2 372 85 LEU N N 126.559 . 1 373 86 ALA H H 8.561 . 1 374 86 ALA C C 178.234 . 1 375 86 ALA CA C 54.448 . 1 376 86 ALA CB C 18.490 . 1 377 86 ALA N N 118.989 . 1 378 87 ASP H H 7.451 . 1 379 87 ASP C C 175.668 . 1 380 87 ASP CA C 54.041 . 1 381 87 ASP CB C 42.171 . 1 382 87 ASP N N 113.796 . 1 383 88 PHE H H 7.067 . 1 384 88 PHE C C 174.041 . 1 385 88 PHE CA C 58.590 . 1 386 88 PHE CB C 40.067 . 1 387 88 PHE N N 121.115 . 1 388 89 ASP H H 7.862 . 1 389 89 ASP C C 174.394 . 1 390 89 ASP CA C 53.834 . 1 391 89 ASP CB C 41.518 . 1 392 89 ASP N N 128.128 . 1 393 90 ILE H H 7.617 . 1 394 90 ILE HD1 H 0.722 . 1 395 90 ILE C C 175.534 . 1 396 90 ILE CA C 61.248 . 1 397 90 ILE CB C 38.388 . 1 398 90 ILE CD1 C 13.070 . 1 399 90 ILE N N 123.620 . 1 400 91 VAL H H 9.216 . 1 401 91 VAL HG1 H 0.962 . 2 402 91 VAL HG2 H 0.910 . 2 403 91 VAL C C 174.586 . 1 404 91 VAL CA C 63.858 . 1 405 91 VAL CB C 31.781 . 1 406 91 VAL CG1 C 21.139 . 2 407 91 VAL CG2 C 22.098 . 2 408 91 VAL N N 133.913 . 1 409 92 ALA H H 7.932 . 1 410 92 ALA C C 178.809 . 1 411 92 ALA CA C 52.681 . 1 412 92 ALA CB C 18.488 . 1 413 92 ALA N N 124.969 . 1 414 93 ASP H H 9.041 . 1 415 93 ASP C C 174.964 . 1 416 93 ASP CA C 55.834 . 1 417 93 ASP CB C 40.020 . 1 418 93 ASP N N 117.292 . 1 419 94 ALA H H 7.781 . 1 420 94 ALA C C 178.685 . 1 421 94 ALA CA C 53.071 . 1 422 94 ALA CB C 21.593 . 1 423 94 ALA N N 117.418 . 1 424 95 TRP H H 8.370 . 1 425 95 TRP HE1 H 9.854 . 1 426 95 TRP CA C 56.537 . 1 427 95 TRP CB C 30.878 . 1 428 95 TRP N N 119.602 . 1 429 95 TRP NE1 N 126.742 . 1 430 97 GLY H H 7.851 . 1 431 97 GLY N N 101.270 . 1 432 98 ILE HD1 H 0.816 . 1 433 98 ILE C C 173.726 . 1 434 98 ILE CA C 61.922 . 1 435 98 ILE CB C 41.173 . 1 436 98 ILE CD1 C 14.538 . 1 437 99 VAL H H 8.941 . 1 438 99 VAL HG1 H 0.762 . 2 439 99 VAL HG2 H 0.562 . 2 440 99 VAL C C 174.309 . 1 441 99 VAL CA C 61.416 . 1 442 99 VAL CB C 35.148 . 1 443 99 VAL CG1 C 22.178 . 2 444 99 VAL CG2 C 21.156 . 2 445 99 VAL N N 126.024 . 1 446 100 SER H H 9.130 . 1 447 100 SER C C 172.346 . 1 448 100 SER CA C 55.965 . 1 449 100 SER CB C 64.349 . 1 450 100 SER N N 121.601 . 1 451 101 ILE H H 9.412 . 1 452 101 ILE HD1 H 0.535 . 1 453 101 ILE C C 174.472 . 1 454 101 ILE CA C 58.487 . 1 455 101 ILE CB C 35.386 . 1 456 101 ILE CD1 C 29.463 . 1 457 101 ILE N N 128.506 . 1 458 102 PHE H H 8.780 . 1 459 102 PHE C C 173.427 . 1 460 102 PHE CA C 61.139 . 1 461 102 PHE CB C 36.702 . 1 462 102 PHE N N 122.152 . 1 463 103 CYS H H 8.715 . 1 464 103 CYS C C 174.356 . 1 465 103 CYS CA C 57.748 . 1 466 103 CYS CB C 25.239 . 1 467 103 CYS N N 122.042 . 1 468 104 HIS H H 8.621 . 1 469 104 HIS C C 174.813 . 1 470 104 HIS CA C 56.219 . 1 471 104 HIS CB C 30.090 . 1 472 104 HIS N N 127.009 . 1 473 105 LEU H H 8.969 . 1 474 105 LEU HD1 H 0.677 . 2 475 105 LEU HD2 H 0.884 . 2 476 105 LEU C C 173.533 . 1 477 105 LEU CA C 51.807 . 1 478 105 LEU CB C 45.385 . 1 479 105 LEU CD1 C 26.479 . 2 480 105 LEU CD2 C 22.832 . 2 481 105 LEU N N 124.562 . 1 482 106 PRO C C 178.657 . 1 483 106 PRO CA C 62.605 . 1 484 106 PRO CB C 32.214 . 1 485 107 SER H H 9.051 . 1 486 107 SER C C 177.297 . 1 487 107 SER CA C 63.284 . 1 488 107 SER CB C 61.734 . 1 489 107 SER N N 122.544 . 1 490 108 SER H H 8.814 . 1 491 108 SER C C 176.639 . 1 492 108 SER CA C 61.375 . 1 493 108 SER CB C 62.026 . 1 494 108 SER N N 116.205 . 1 495 109 LEU H H 6.973 . 1 496 109 LEU HD1 H 0.980 . 2 497 109 LEU HD2 H 0.956 . 2 498 109 LEU C C 179.902 . 1 499 109 LEU CA C 56.900 . 1 500 109 LEU CB C 41.919 . 1 501 109 LEU CD1 C 23.601 . 2 502 109 LEU CD2 C 25.877 . 2 503 109 LEU N N 122.072 . 1 504 110 ARG H H 8.340 . 1 505 110 ARG C C 178.355 . 1 506 110 ARG CA C 61.873 . 1 507 110 ARG CB C 28.890 . 1 508 110 ARG N N 121.024 . 1 509 111 GLN H H 7.906 . 1 510 111 GLN C C 177.374 . 1 511 111 GLN CA C 58.338 . 1 512 111 GLN CB C 28.048 . 1 513 111 GLN N N 113.105 . 1 514 112 GLN H H 7.007 . 1 515 112 GLN C C 177.927 . 1 516 112 GLN CA C 57.029 . 1 517 112 GLN CB C 29.999 . 1 518 112 GLN N N 114.483 . 1 519 113 LEU H H 8.603 . 1 520 113 LEU HD1 H 1.036 . 2 521 113 LEU HD2 H 0.854 . 2 522 113 LEU C C 179.051 . 1 523 113 LEU CA C 57.474 . 1 524 113 LEU CB C 43.682 . 1 525 113 LEU CD1 C 23.235 . 2 526 113 LEU CD2 C 26.699 . 2 527 113 LEU N N 119.883 . 1 528 114 TYR H H 9.185 . 1 529 114 TYR C C 177.053 . 1 530 114 TYR CA C 60.103 . 1 531 114 TYR CB C 31.986 . 1 532 114 TYR N N 119.712 . 1 533 115 PRO C C 180.126 . 1 534 115 PRO CA C 66.986 . 1 535 115 PRO CB C 31.137 . 1 536 116 LYS H H 6.982 . 1 537 116 LYS C C 180.255 . 1 538 116 LYS CA C 58.999 . 1 539 116 LYS CB C 32.649 . 1 540 116 LYS N N 115.015 . 1 541 117 VAL H H 8.226 . 1 542 117 VAL HG1 H 0.464 . 2 543 117 VAL HG2 H 0.948 . 2 544 117 VAL C C 176.567 . 1 545 117 VAL CA C 66.490 . 1 546 117 VAL CB C 31.289 . 1 547 117 VAL CG1 C 20.166 . 2 548 117 VAL CG2 C 22.632 . 2 549 117 VAL N N 122.120 . 1 550 118 TYR H H 8.056 . 1 551 118 TYR C C 178.921 . 1 552 118 TYR CA C 62.805 . 1 553 118 TYR CB C 37.923 . 1 554 118 TYR N N 116.005 . 1 555 119 GLN H H 8.049 . 1 556 119 GLN C C 177.438 . 1 557 119 GLN CA C 58.225 . 1 558 119 GLN CB C 28.727 . 1 559 119 GLN N N 116.047 . 1 560 120 GLY H H 8.063 . 1 561 120 GLY C C 173.849 . 1 562 120 GLY CA C 46.411 . 1 563 120 GLY N N 108.779 . 1 564 121 LEU H H 6.955 . 1 565 121 LEU HD1 H 0.632 . 2 566 121 LEU HD2 H 0.704 . 2 567 121 LEU C C 177.555 . 1 568 121 LEU CA C 54.419 . 1 569 121 LEU CB C 43.076 . 1 570 121 LEU CD1 C 26.223 . 2 571 121 LEU CD2 C 23.346 . 2 572 121 LEU N N 120.365 . 1 573 123 PRO C C 178.291 . 1 574 123 PRO CA C 64.964 . 1 575 123 PRO CB C 30.875 . 1 576 124 GLY H H 8.957 . 1 577 124 GLY C C 173.666 . 1 578 124 GLY CA C 45.605 . 1 579 124 GLY N N 116.207 . 1 580 125 GLY H H 9.014 . 1 581 125 GLY C C 172.926 . 1 582 125 GLY CA C 45.423 . 1 583 125 GLY N N 108.848 . 1 584 126 VAL HG1 H 0.911 . 2 585 126 VAL HG2 H 0.928 . 2 586 126 VAL C C 173.462 . 1 587 126 VAL CA C 58.819 . 1 588 126 VAL CB C 35.958 . 1 589 126 VAL CG1 C 21.153 . 2 590 126 VAL CG2 C 19.892 . 2 591 127 PHE H H 9.126 . 1 592 127 PHE C C 174.237 . 1 593 127 PHE CA C 54.697 . 1 594 127 PHE CB C 43.117 . 1 595 127 PHE N N 122.396 . 1 596 128 ILE H H 7.986 . 1 597 128 ILE HD1 H 0.481 . 1 598 128 ILE C C 172.508 . 1 599 128 ILE CA C 60.088 . 1 600 128 ILE CB C 41.278 . 1 601 128 ILE CD1 C 14.893 . 1 602 128 ILE N N 127.144 . 1 603 129 LEU H H 9.084 . 1 604 129 LEU HD1 H 0.931 . 2 605 129 LEU HD2 H 0.330 . 2 606 129 LEU C C 175.481 . 1 607 129 LEU CA C 53.579 . 1 608 129 LEU CB C 45.899 . 1 609 129 LEU CD1 C 27.425 . 2 610 129 LEU CD2 C 23.667 . 2 611 129 LEU N N 128.415 . 1 612 130 GLU H H 7.951 . 1 613 130 GLU C C 175.929 . 1 614 130 GLU CA C 56.477 . 1 615 130 GLU CB C 32.779 . 1 616 130 GLU N N 123.630 . 1 617 131 GLY H H 8.349 . 1 618 131 GLY C C 171.038 . 1 619 131 GLY CA C 44.404 . 1 620 131 GLY N N 114.394 . 1 621 132 PHE H H 10.500 . 1 622 132 PHE C C 174.938 . 1 623 132 PHE CA C 60.371 . 1 624 132 PHE CB C 39.080 . 1 625 132 PHE N N 119.370 . 1 626 133 ALA H H 8.744 . 1 627 133 ALA C C 176.412 . 1 628 133 ALA CA C 49.444 . 1 629 133 ALA CB C 19.527 . 1 630 133 ALA N N 124.079 . 1 631 134 PRO C C 179.488 . 1 632 134 PRO CA C 65.935 . 1 633 134 PRO CB C 30.246 . 1 634 135 GLU H H 8.765 . 1 635 135 GLU C C 177.167 . 1 636 135 GLU CA C 60.249 . 1 637 135 GLU CB C 28.435 . 1 638 135 GLU N N 117.678 . 1 639 136 GLN H H 8.510 . 1 640 136 GLN C C 178.283 . 1 641 136 GLN CA C 57.115 . 1 642 136 GLN CB C 27.010 . 1 643 136 GLN N N 121.058 . 1 644 137 LEU H H 7.384 . 1 645 137 LEU HD1 H 0.863 . 2 646 137 LEU HD2 H 0.783 . 2 647 137 LEU C C 178.917 . 1 648 137 LEU CA C 57.259 . 1 649 137 LEU CB C 41.025 . 1 650 137 LEU CD1 C 25.495 . 2 651 137 LEU CD2 C 23.264 . 2 652 137 LEU N N 117.057 . 1 653 138 GLN H H 7.608 . 1 654 138 GLN C C 176.554 . 1 655 138 GLN CA C 56.696 . 1 656 138 GLN CB C 28.802 . 1 657 138 GLN N N 114.792 . 1 658 139 TYR H H 7.985 . 1 659 139 TYR C C 176.478 . 1 660 139 TYR CA C 57.373 . 1 661 139 TYR CB C 39.474 . 1 662 139 TYR N N 120.301 . 1 663 140 ASN H H 8.514 . 1 664 140 ASN C C 176.647 . 1 665 140 ASN CA C 53.381 . 1 666 140 ASN CB C 38.435 . 1 667 140 ASN N N 115.095 . 1 668 141 THR H H 7.257 . 1 669 141 THR C C 174.127 . 1 670 141 THR CA C 60.564 . 1 671 141 THR CB C 68.629 . 1 672 141 THR N N 105.367 . 1 673 142 GLY H H 8.070 . 1 674 142 GLY C C 174.533 . 1 675 142 GLY CA C 44.450 . 1 676 142 GLY N N 107.918 . 1 677 143 GLY H H 8.132 . 1 678 143 GLY C C 171.717 . 1 679 143 GLY CA C 44.594 . 1 680 143 GLY N N 104.894 . 1 681 144 PRO C C 175.978 . 1 682 144 PRO CA C 62.910 . 1 683 144 PRO CB C 32.464 . 1 684 145 LYS H H 8.295 . 1 685 145 LYS C C 175.478 . 1 686 145 LYS CA C 54.553 . 1 687 145 LYS CB C 32.425 . 1 688 145 LYS N N 116.163 . 1 689 146 ASP H H 6.653 . 1 690 146 ASP C C 177.145 . 1 691 146 ASP CA C 52.968 . 1 692 146 ASP CB C 43.090 . 1 693 146 ASP N N 117.896 . 1 694 147 LEU H H 8.854 . 1 695 147 LEU HD1 H 0.973 . 2 696 147 LEU HD2 H 0.945 . 2 697 147 LEU C C 179.889 . 1 698 147 LEU CA C 58.125 . 1 699 147 LEU CB C 41.873 . 1 700 147 LEU CD1 C 24.519 . 2 701 147 LEU CD2 C 24.191 . 2 702 147 LEU N N 126.919 . 1 703 148 ASP H H 8.921 . 1 704 148 ASP C C 176.585 . 1 705 148 ASP CA C 57.798 . 1 706 148 ASP CB C 42.397 . 1 707 148 ASP N N 119.488 . 1 708 149 LEU H H 7.597 . 1 709 149 LEU HD1 H 0.963 . 2 710 149 LEU HD2 H 0.843 . 2 711 149 LEU C C 176.630 . 1 712 149 LEU CA C 56.077 . 1 713 149 LEU CD1 C 25.379 . 2 714 149 LEU CD2 C 24.941 . 2 715 149 LEU N N 114.860 . 1 716 150 LEU H H 7.517 . 1 717 150 LEU HD1 H 0.644 . 2 718 150 LEU HD2 H 0.447 . 2 719 150 LEU C C 172.072 . 1 720 150 LEU CA C 52.047 . 1 721 150 LEU CB C 43.208 . 1 722 150 LEU CD1 C 25.821 . 2 723 150 LEU CD2 C 24.250 . 2 724 150 LEU N N 121.337 . 1 725 151 PRO C C 177.348 . 1 726 151 PRO CA C 62.926 . 1 727 151 PRO CB C 31.485 . 1 728 152 LYS H H 7.834 . 1 729 152 LYS C C 177.498 . 1 730 152 LYS CA C 56.070 . 1 731 152 LYS CB C 33.664 . 1 732 152 LYS N N 115.945 . 1 733 153 LEU H H 8.975 . 1 734 153 LEU HD1 H 0.851 . 2 735 153 LEU HD2 H 0.534 . 2 736 153 LEU C C 178.481 . 1 737 153 LEU CA C 60.297 . 1 738 153 LEU CB C 42.076 . 1 739 153 LEU CD1 C 24.992 . 2 740 153 LEU CD2 C 25.130 . 2 741 153 LEU N N 123.717 . 1 742 154 GLU H H 9.600 . 1 743 154 GLU C C 180.025 . 1 744 154 GLU CA C 59.926 . 1 745 154 GLU CB C 28.323 . 1 746 154 GLU N N 115.080 . 1 747 155 THR H H 7.116 . 1 748 155 THR C C 177.169 . 1 749 155 THR CA C 65.920 . 1 750 155 THR CB C 68.176 . 1 751 155 THR N N 118.663 . 1 752 156 LEU H H 8.079 . 1 753 156 LEU HD1 H 0.849 . 2 754 156 LEU HD2 H 0.967 . 2 755 156 LEU C C 179.424 . 1 756 156 LEU CA C 58.737 . 1 757 156 LEU CB C 42.194 . 1 758 156 LEU CD1 C 26.037 . 2 759 156 LEU CD2 C 24.634 . 2 760 156 LEU N N 124.217 . 1 761 157 GLN H H 7.952 . 1 762 157 GLN C C 179.111 . 1 763 157 GLN CA C 59.779 . 1 764 157 GLN CB C 28.990 . 1 765 157 GLN N N 113.283 . 1 766 158 SER H H 7.547 . 1 767 158 SER C C 175.490 . 1 768 158 SER CA C 61.029 . 1 769 158 SER CB C 63.548 . 1 770 158 SER N N 113.327 . 1 771 159 GLU H H 7.730 . 1 772 159 GLU C C 177.210 . 1 773 159 GLU CA C 57.780 . 1 774 159 GLU CB C 30.214 . 1 775 159 GLU N N 122.361 . 1 776 160 LEU H H 7.198 . 1 777 160 LEU HD1 H 0.179 . 2 778 160 LEU HD2 H 0.334 . 2 779 160 LEU C C 174.555 . 1 780 160 LEU CA C 53.628 . 1 781 160 LEU CB C 43.435 . 1 782 160 LEU CD1 C 26.555 . 2 783 160 LEU CD2 C 24.500 . 2 784 160 LEU N N 121.241 . 1 785 161 PRO C C 178.914 . 1 786 161 PRO CA C 64.852 . 1 787 161 PRO CB C 32.014 . 1 788 162 SER H H 8.015 . 1 789 162 SER C C 175.658 . 1 790 162 SER CA C 59.347 . 1 791 162 SER CB C 62.545 . 1 792 162 SER N N 111.812 . 1 793 163 LEU H H 6.859 . 1 794 163 LEU HD1 H 0.558 . 2 795 163 LEU HD2 H 0.537 . 2 796 163 LEU C C 174.434 . 1 797 163 LEU CA C 54.764 . 1 798 163 LEU CB C 41.002 . 1 799 163 LEU CD1 C 27.431 . 2 800 163 LEU CD2 C 22.974 . 2 801 163 LEU N N 119.869 . 1 802 164 ASN H H 8.429 . 1 803 164 ASN C C 175.523 . 1 804 164 ASN CA C 52.239 . 1 805 164 ASN CB C 39.647 . 1 806 164 ASN N N 117.709 . 1 807 165 TRP H H 8.682 . 1 808 165 TRP HE1 H 10.420 . 1 809 165 TRP C C 175.795 . 1 810 165 TRP CA C 56.593 . 1 811 165 TRP CB C 27.808 . 1 812 165 TRP N N 127.557 . 1 813 165 TRP NE1 N 130.509 . 1 814 166 LEU H H 8.862 . 1 815 166 LEU HD1 H 0.837 . 2 816 166 LEU HD2 H 0.828 . 2 817 166 LEU C C 178.547 . 1 818 166 LEU CA C 56.838 . 1 819 166 LEU CB C 42.389 . 1 820 166 LEU CD1 C 24.673 . 2 821 166 LEU CD2 C 22.445 . 2 822 166 LEU N N 129.121 . 1 823 167 ILE H H 8.112 . 1 824 167 ILE HD1 H 0.959 . 1 825 167 ILE C C 174.882 . 1 826 167 ILE CA C 61.688 . 1 827 167 ILE CB C 42.425 . 1 828 167 ILE CD1 C 14.220 . 1 829 167 ILE N N 117.198 . 1 830 168 ALA H H 8.602 . 1 831 168 ALA C C 174.903 . 1 832 168 ALA CA C 52.171 . 1 833 168 ALA CB C 19.070 . 1 834 168 ALA N N 129.540 . 1 835 169 ASN H H 9.175 . 1 836 169 ASN C C 173.972 . 1 837 169 ASN CA C 52.063 . 1 838 169 ASN CB C 42.401 . 1 839 169 ASN N N 120.681 . 1 840 170 ASN H H 8.352 . 1 841 170 ASN C C 174.226 . 1 842 170 ASN CA C 53.162 . 1 843 170 ASN CB C 40.778 . 1 844 170 ASN N N 120.623 . 1 845 171 LEU H H 8.838 . 1 846 171 LEU HD1 H 0.662 . 2 847 171 LEU HD2 H 0.607 . 2 848 171 LEU C C 174.415 . 1 849 171 LEU CA C 54.940 . 1 850 171 LEU CB C 43.593 . 1 851 171 LEU CD1 C 24.651 . 2 852 171 LEU CD2 C 25.200 . 2 853 171 LEU N N 122.720 . 1 854 172 GLU H H 8.223 . 1 855 172 GLU C C 176.587 . 1 856 172 GLU CA C 55.076 . 1 857 172 GLU CB C 32.323 . 1 858 172 GLU N N 119.202 . 1 859 173 ARG H H 8.579 . 1 860 173 ARG C C 174.113 . 1 861 173 ARG CA C 54.820 . 1 862 173 ARG CB C 33.018 . 1 863 173 ARG N N 119.868 . 1 864 174 ASN H H 8.648 . 1 865 174 ASN C C 174.906 . 1 866 174 ASN CA C 53.521 . 1 867 174 ASN CB C 38.467 . 1 868 174 ASN N N 119.858 . 1 869 175 LEU H H 8.321 . 1 870 175 LEU HD1 H 0.705 . 2 871 175 LEU HD2 H 0.660 . 2 872 175 LEU C C 176.213 . 1 873 175 LEU CA C 54.934 . 1 874 175 LEU CB C 42.612 . 1 875 175 LEU CD1 C 25.658 . 2 876 175 LEU CD2 C 23.867 . 2 877 175 LEU N N 126.887 . 1 878 176 ASP C C 177.490 . 1 879 176 ASP CB C 43.156 . 1 880 177 GLU H H 8.350 . 1 881 177 GLU CA C 55.032 . 1 882 177 GLU N N 122.110 . 1 883 181 HIS C C 174.851 . 1 884 182 GLN H H 8.240 . 1 885 182 GLN N N 121.488 . 1 886 183 GLY CA C 44.823 . 1 887 184 LYS H H 8.234 . 1 888 184 LYS C C 175.482 . 1 889 184 LYS CA C 57.556 . 1 890 184 LYS CB C 32.915 . 1 891 184 LYS N N 122.188 . 1 892 185 ALA H H 8.449 . 1 893 185 ALA C C 174.932 . 1 894 185 ALA CA C 50.748 . 1 895 185 ALA CB C 23.518 . 1 896 185 ALA N N 126.304 . 1 897 186 ALA H H 8.647 . 1 898 186 ALA C C 176.771 . 1 899 186 ALA CA C 51.367 . 1 900 186 ALA CB C 19.773 . 1 901 186 ALA N N 122.760 . 1 902 187 LEU H H 9.024 . 1 903 187 LEU HD1 H 0.701 . 2 904 187 LEU HD2 H 0.629 . 2 905 187 LEU C C 176.110 . 1 906 187 LEU CA C 54.205 . 1 907 187 LEU CB C 46.232 . 1 908 187 LEU CD1 C 27.310 . 2 909 187 LEU CD2 C 25.331 . 2 910 187 LEU N N 123.365 . 1 911 188 ILE H H 8.881 . 1 912 188 ILE HD1 H 0.813 . 1 913 188 ILE C C 174.813 . 1 914 188 ILE CA C 59.775 . 1 915 188 ILE CB C 41.458 . 1 916 188 ILE CD1 C 14.688 . 1 917 188 ILE N N 118.984 . 1 918 189 GLN H H 8.260 . 1 919 189 GLN C C 175.112 . 1 920 189 GLN CA C 53.322 . 1 921 189 GLN CB C 30.127 . 1 922 189 GLN N N 120.660 . 1 923 190 LEU H H 9.272 . 1 924 190 LEU HD1 H 0.499 . 2 925 190 LEU HD2 H 0.363 . 2 926 190 LEU C C 175.779 . 1 927 190 LEU CA C 53.580 . 1 928 190 LEU CB C 47.231 . 1 929 190 LEU CD1 C 25.912 . 2 930 190 LEU CD2 C 23.326 . 2 931 190 LEU N N 120.776 . 1 932 191 LEU H H 9.082 . 1 933 191 LEU HD1 H 0.795 . 2 934 191 LEU HD2 H 0.807 . 2 935 191 LEU C C 176.491 . 1 936 191 LEU CA C 55.459 . 1 937 191 LEU CB C 45.421 . 1 938 191 LEU CD1 C 25.292 . 2 939 191 LEU CD2 C 25.887 . 2 940 191 LEU N N 121.498 . 1 941 192 GLY H H 9.969 . 1 942 192 GLY C C 171.077 . 1 943 192 GLY CA C 44.916 . 1 944 192 GLY N N 115.171 . 1 945 193 GLN H H 9.188 . 1 946 193 GLN C C 174.774 . 1 947 193 GLN CA C 53.675 . 1 948 193 GLN CB C 33.519 . 1 949 193 GLN N N 123.097 . 1 950 194 LYS H H 8.898 . 1 951 194 LYS C C 175.712 . 1 952 194 LYS CA C 55.843 . 1 953 194 LYS CB C 33.159 . 1 954 194 LYS N N 129.517 . 1 955 195 LEU H H 8.815 . 1 956 195 LEU HD1 H 0.856 . 2 957 195 LEU HD2 H 0.809 . 2 958 195 LEU C C 177.092 . 1 959 195 LEU CA C 55.045 . 1 960 195 LEU CB C 42.790 . 1 961 195 LEU CD1 C 24.872 . 2 962 195 LEU CD2 C 22.953 . 2 963 195 LEU N N 129.542 . 1 964 196 GLU H H 8.386 . 1 965 196 GLU C C 176.210 . 1 966 196 GLU CA C 56.706 . 1 967 196 GLU CB C 30.546 . 1 968 196 GLU N N 120.654 . 1 969 197 HIS H H 8.442 . 1 970 197 HIS C C 175.195 . 1 971 197 HIS CA C 56.381 . 1 972 197 HIS CB C 30.501 . 1 973 197 HIS N N 120.121 . 1 cwd: /data/PSVS/PSVS-v1.4-dev/results/SGR145_R3_em_bcr3 command to execute is: /farm/software/asdp/asdp-1.0-release/bin//../bin/noesyassign -c /data/PSVS/PSVS-v1.4-dev/results/SGR145_R3_em_bcr3/rpf_calc/input/ctrl_file -o rpf_calc -q SGR145_R3_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 c6-cycle7.peaks ...   Doing SimpleMatch for n6-cycle7.peaks ...   Reading ComparePdbFile: SGR145_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SGR145_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SGR145_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SGR145_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SGR145_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SGR145_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SGR145_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SGR145_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SGR145_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SGR145_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SGR145_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SGR145_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SGR145_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SGR145_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SGR145_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SGR145_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SGR145_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SGR145_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SGR145_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SGR145_R3_em_bcr3.pdb.iupac  quality-estimation for c6-cycle7.peaks ...   Doing Recall analysis for c6-cycle7.peaks ...  Doing Precision analysis for c6-cycle7.peaks ...  Doing Recall analysis for c6-cycle7.peaks ...  Doing Precision analysis for c6-cycle7.peaks ... prtSimleMatchPeakAtom for c6-cycle7.peaks ...   quality-estimation for n6-cycle7.peaks ...   Doing Recall analysis for n6-cycle7.peaks ...  Doing Precision analysis for n6-cycle7.peaks ...  Doing Recall analysis for n6-cycle7.peaks ...  Doing Precision analysis for n6-cycle7.peaks ... prtSimleMatchPeakAtom for n6-cycle7.peaks ...