AS object created. control filepath is: /data/PSVS/PSVS-v1.4-dev/results/CSR4_NMR_em_bcr3/rpf_calc/input/ctrl_file bmrb: chem_shift.bmrb sequence: CSR4_NMR_em_bcr3_seq.bmrb parsing bmrb: /data/PSVS/PSVS-v1.4-dev/results/CSR4_NMR_em_bcr3/rpf_calc/input/chem_shift.bmrb new residue 2 adding: *1* *2* *Pro* *HA* *H* *4.40* *.* *1* old residue 2 adding: *2* *2* *Pro* *HB2* *H* *1.97* *.* *2* old residue 2 adding: *3* *2* *Pro* *HB3* *H* *2.42* *.* *2* old residue 2 adding: *4* *2* *Pro* *HG2* *H* *1.97* *.* *2* old residue 2 adding: *5* *2* *Pro* *HG3* *H* *2.03* *.* *2* old residue 2 adding: *6* *2* *Pro* *HD2* *H* *3.37* *.* *2* old residue 2 adding: *7* *2* *Pro* *HD3* *H* *3.37* *.* *2* old residue 2 adding: *8* *2* *Pro* *C* *C* *172.3* *.* *1* old residue 2 adding: *9* *2* *Pro* *CA* *C* *62.2* *.* *1* old residue 2 adding: *10* *2* *Pro* *CB* *C* *32.6* *.* *1* old residue 2 adding: *11* *2* *Pro* *CG* *C* *26.3* *.* *1* old residue 2 adding: *12* *2* *Pro* *CD* *C* *49.3* *.* *1* new residue 3 adding: *13* *3* *Ile* *H* *H* *8.63* *.* *1* old residue 3 adding: *14* *3* *Ile* *HA* *H* *4.19* *.* *1* old residue 3 adding: *15* *3* *Ile* *HB* *H* *1.80* *.* *1* old residue 3 adding: *16* *3* *Ile* *HG12* *H* *1.16* *.* *2* old residue 3 adding: *17* *3* *Ile* *HG13* *H* *1.46* *.* *2* old residue 3 adding: *18* *3* *Ile* *HG2* *H* *0.87* *.* *1* old residue 3 adding: *19* *3* *Ile* *HD1* *H* *0.83* *.* *1* old residue 3 adding: *20* *3* *Ile* *C* *C* *176.1* *.* *1* old residue 3 adding: *21* *3* *Ile* *CA* *C* *61.5* *.* *1* old residue 3 adding: *22* *3* *Ile* *CB* *C* *38.6* *.* *1* old residue 3 adding: *23* *3* *Ile* *CG1* *C* *27.2* *.* *1* old residue 3 adding: *24* *3* *Ile* *CG2* *C* *17.4* *.* *1* old residue 3 adding: *25* *3* *Ile* *CD1* *C* *12.8* *.* *1* old residue 3 adding: *26* *3* *Ile* *N* *N* *120.7* *.* *1* new residue 4 adding: *27* *4* *Val* *H* *H* *8.38* *.* *1* old residue 4 adding: *28* *4* *Val* *HA* *H* *4.14* *.* *1* old residue 4 adding: *29* *4* *Val* *HB* *H* *2.01* *.* *1* old residue 4 adding: *30* *4* *Val* *HG1* *H* *0.93* *.* *1* old residue 4 adding: *31* *4* *Val* *HG2* *H* *0.91* *.* *1* old residue 4 adding: *32* *4* *Val* *C* *C* *175.8* *.* *1* old residue 4 adding: *33* *4* *Val* *CA* *C* *62.1* *.* *1* old residue 4 adding: *34* *4* *Val* *CB* *C* *32.8* *.* *1* old residue 4 adding: *35* *4* *Val* *CG1* *C* *22.6* *.* *1* old residue 4 adding: *36* *4* *Val* *CG2* *C* *20.5* *.* *1* old residue 4 adding: *37* *4* *Val* *N* *N* *125.5* *.* *1* new residue 5 adding: *38* *5* *Ser* *H* *H* *8.45* *.* *1* old residue 5 adding: *39* *5* *Ser* *HA* *H* *4.42* *.* *1* old residue 5 adding: *40* *5* *Ser* *HB2* *H* *3.75* *.* *2* old residue 5 adding: *41* *5* *Ser* *HB3* *H* *3.83* *.* *2* old residue 5 adding: *42* *5* *Ser* *C* *C* *174.3* *.* *1* old residue 5 adding: *43* *5* *Ser* *CA* *C* *57.9* *.* *1* old residue 5 adding: *44* *5* *Ser* *CB* *C* *64.0* *.* *1* old residue 5 adding: *45* *5* *Ser* *N* *N* *120.5* *.* *1* new residue 6 adding: *46* *6* *Lys* *H* *H* *8.33* *.* *1* old residue 6 adding: *47* *6* *Lys* *HA* *H* *4.15* *.* *1* old residue 6 adding: *48* *6* *Lys* *HB2* *H* *1.58* *.* *2* old residue 6 adding: *49* *6* *Lys* *HB3* *H* *1.58* *.* *2* old residue 6 adding: *50* *6* *Lys* *HG2* *H* *1.14* *.* *2* old residue 6 adding: *51* *6* *Lys* *HG3* *H* *1.14* *.* *2* old residue 6 adding: *52* *6* *Lys* *HD2* *H* *1.57* *.* *2* old residue 6 adding: *53* *6* *Lys* *HD3* *H* *1.57* *.* *2* old residue 6 adding: *54* *6* *Lys* *HE2* *H* *2.74* *.* *2* old residue 6 adding: *55* *6* *Lys* *HE3* *H* *2.93* *.* *2* old residue 6 adding: *56* *6* *Lys* *C* *C* *176.0* *.* *1* old residue 6 adding: *57* *6* *Lys* *CA* *C* *56.8* *.* *1* old residue 6 adding: *58* *6* *Lys* *CB* *C* *33.0* *.* *1* old residue 6 adding: *59* *6* *Lys* *CG* *C* *24.5* *.* *1* old residue 6 adding: *60* *6* *Lys* *CD* *C* *28.9* *.* *1* old residue 6 adding: *61* *6* *Lys* *CE* *C* *39.2* *.* *1* old residue 6 adding: *62* *6* *Lys* *N* *N* *123.4* *.* *1* new residue 7 adding: *63* *7* *Tyr* *H* *H* *8.15* *.* *1* old residue 7 adding: *64* *7* *Tyr* *HA* *H* *4.64* *.* *1* old residue 7 adding: *65* *7* *Tyr* *HB2* *H* *2.73* *.* *2* old residue 7 adding: *66* *7* *Tyr* *HB3* *H* *2.93* *.* *2* old residue 7 adding: *67* *7* *Tyr* *HD1* *H* *7.02* *.* *3* old residue 7 adding: *68* *7* *Tyr* *HD2* *H* *7.02* *.* *3* old residue 7 adding: *69* *7* *Tyr* *HE1* *H* *6.77* *.* *3* old residue 7 adding: *70* *7* *Tyr* *HE2* *H* *6.77* *.* *3* old residue 7 adding: *71* *7* *Tyr* *C* *C* *175.4* *.* *1* old residue 7 adding: *72* *7* *Tyr* *CA* *C* *56.7* *.* *1* old residue 7 adding: *73* *7* *Tyr* *CB* *C* *39.3* *.* *1* old residue 7 adding: *74* *7* *Tyr* *CD1* *C* *133.1* *.* *3* old residue 7 adding: *75* *7* *Tyr* *CD2* *C* *133.1* *.* *3* old residue 7 adding: *76* *7* *Tyr* *CE1* *C* *118.0* *.* *3* old residue 7 adding: *77* *7* *Tyr* *CE2* *C* *118.0* *.* *3* old residue 7 adding: *78* *7* *Tyr* *N* *N* *120.0* *.* *1* new residue 8 adding: *79* *8* *Ser* *H* *H* *8.36* *.* *1* old residue 8 adding: *80* *8* *Ser* *HA* *H* *4.40* *.* *1* old residue 8 adding: *81* *8* *Ser* *HB2* *H* *3.94* *.* *2* old residue 8 adding: *82* *8* *Ser* *HB3* *H* *4.15* *.* *2* old residue 8 adding: *83* *8* *Ser* *C* *C* *174.7* *.* *1* old residue 8 adding: *84* *8* *Ser* *CA* *C* *57.6* *.* *1* old residue 8 adding: *85* *8* *Ser* *CB* *C* *64.0* *.* *1* old residue 8 adding: *86* *8* *Ser* *N* *N* *118.1* *.* *1* new residue 9 adding: *87* *9* *Asn* *H* *H* *8.90* *.* *1* old residue 9 adding: *88* *9* *Asn* *HA* *H* *4.40* *.* *1* old residue 9 adding: *89* *9* *Asn* *HB2* *H* *2.79* *.* *2* old residue 9 adding: *90* *9* *Asn* *HB3* *H* *2.79* *.* *2* old residue 9 adding: *91* *9* *Asn* *HD21* *H* *7.73* *.* *1* old residue 9 adding: *92* *9* *Asn* *HD22* *H* *6.95* *.* *1* old residue 9 adding: *93* *9* *Asn* *C* *C* *176.8* *.* *1* old residue 9 adding: *94* *9* *Asn* *CA* *C* *55.9* *.* *1* old residue 9 adding: *95* *9* *Asn* *CB* *C* *38.3* *.* *1* old residue 9 adding: *96* *9* *Asn* *CG* *C* *176.3* *.* *1* old residue 9 adding: *97* *9* *Asn* *N* *N* *122.3* *.* *1* old residue 9 adding: *98* *9* *Asn* *ND2* *N* *113.4* *.* *1* new residue 10 adding: *99* *10* *Glu* *H* *H* *8.74* *.* *1* old residue 10 adding: *100* *10* *Glu* *HA* *H* *4.00* *.* *1* old residue 10 adding: *101* *10* *Glu* *HB2* *H* *1.95* *.* *2* old residue 10 adding: *102* *10* *Glu* *HB3* *H* *2.00* *.* *2* old residue 10 adding: *103* *10* *Glu* *HG2* *H* *2.31* *.* *2* old residue 10 adding: *104* *10* *Glu* *HG3* *H* *2.31* *.* *2* old residue 10 adding: *105* *10* *Glu* *C* *C* *178.5* *.* *1* old residue 10 adding: *106* *10* *Glu* *CA* *C* *59.9* *.* *1* old residue 10 adding: *107* *10* *Glu* *CB* *C* *29.0* *.* *1* old residue 10 adding: *108* *10* *Glu* *CG* *C* *36.6* *.* *1* old residue 10 adding: *109* *10* *Glu* *N* *N* *119.0* *.* *1* new residue 11 adding: *110* *11* *Arg* *H* *H* *7.75* *.* *1* old residue 11 adding: *111* *11* *Arg* *HA* *H* *4.07* *.* *1* old residue 11 adding: *112* *11* *Arg* *HB2* *H* *1.95* *.* *2* old residue 11 adding: *113* *11* *Arg* *HB3* *H* *1.95* *.* *2* old residue 11 adding: *114* *11* *Arg* *HG2* *H* *1.52* *.* *2* old residue 11 adding: *115* *11* *Arg* *HG3* *H* *1.72* *.* *2* old residue 11 adding: *116* *11* *Arg* *HD2* *H* *3.08* *.* *2* old residue 11 adding: *117* *11* *Arg* *HD3* *H* *3.23* *.* *2* old residue 11 adding: *118* *11* *Arg* *HE* *H* *7.45* *.* *1* old residue 11 adding: *119* *11* *Arg* *C* *C* *178.0* *.* *1* old residue 11 adding: *120* *11* *Arg* *CA* *C* *58.8* *.* *1* old residue 11 adding: *121* *11* *Arg* *CB* *C* *30.1* *.* *1* old residue 11 adding: *122* *11* *Arg* *CG* *C* *27.0* *.* *1* old residue 11 adding: *123* *11* *Arg* *CD* *C* *43.5* *.* *1* old residue 11 adding: *124* *11* *Arg* *N* *N* *121.5* *.* *1* old residue 11 adding: *125* *11* *Arg* *NE* *N* *84.6* *.* *1* new residue 12 adding: *126* *12* *Val* *H* *H* *7.83* *.* *1* old residue 12 adding: *127* *12* *Val* *HA* *H* *3.42* *.* *1* old residue 12 adding: *128* *12* *Val* *HB* *H* *2.09* *.* *1* old residue 12 adding: *129* *12* *Val* *HG1* *H* *0.90* *.* *1* old residue 12 adding: *130* *12* *Val* *HG2* *H* *0.96* *.* *1* old residue 12 adding: *131* *12* *Val* *C* *C* *177.4* *.* *1* old residue 12 adding: *132* *12* *Val* *CA* *C* *67.0* *.* *1* old residue 12 adding: *133* *12* *Val* *CB* *C* *32.1* *.* *1* old residue 12 adding: *134* *12* *Val* *CG1* *C* *21.6* *.* *1* old residue 12 adding: *135* *12* *Val* *CG2* *C* *23.5* *.* *1* old residue 12 adding: *136* *12* *Val* *N* *N* *118.8* *.* *1* new residue 13 adding: *137* *13* *Glu* *H* *H* *8.22* *.* *1* old residue 13 adding: *138* *13* *Glu* *HA* *H* *3.89* *.* *1* old residue 13 adding: *139* *13* *Glu* *HB2* *H* *2.00* *.* *2* old residue 13 adding: *140* *13* *Glu* *HB3* *H* *2.00* *.* *2* old residue 13 adding: *141* *13* *Glu* *HG2* *H* *2.25* *.* *2* old residue 13 adding: *142* *13* *Glu* *HG3* *H* *2.39* *.* *2* old residue 13 adding: *143* *13* *Glu* *C* *C* *178.9* *.* *1* old residue 13 adding: *144* *13* *Glu* *CA* *C* *59.5* *.* *1* old residue 13 adding: *145* *13* *Glu* *CB* *C* *29.0* *.* *1* old residue 13 adding: *146* *13* *Glu* *CG* *C* *36.2* *.* *1* old residue 13 adding: *147* *13* *Glu* *N* *N* *116.8* *.* *1* new residue 14 adding: *148* *14* *Lys* *H* *H* *7.60* *.* *1* old residue 14 adding: *149* *14* *Lys* *HA* *H* *4.03* *.* *1* old residue 14 adding: *150* *14* *Lys* *HB2* *H* *1.90* *.* *2* old residue 14 adding: *151* *14* *Lys* *HB3* *H* *2.03* *.* *2* old residue 14 adding: *152* *14* *Lys* *HG2* *H* *1.44* *.* *2* old residue 14 adding: *153* *14* *Lys* *HG3* *H* *1.44* *.* *2* old residue 14 adding: *154* *14* *Lys* *HD2* *H* *1.57* *.* *2* old residue 14 adding: *155* *14* *Lys* *HD3* *H* *1.70* *.* *2* old residue 14 adding: *156* *14* *Lys* *HE2* *H* *2.93* *.* *2* old residue 14 adding: *157* *14* *Lys* *HE3* *H* *2.93* *.* *2* old residue 14 adding: *158* *14* *Lys* *C* *C* *177.7* *.* *1* old residue 14 adding: *159* *14* *Lys* *CA* *C* *59.1* *.* *1* old residue 14 adding: *160* *14* *Lys* *CB* *C* *32.1* *.* *1* old residue 14 adding: *161* *14* *Lys* *CG* *C* *24.8* *.* *1* old residue 14 adding: *162* *14* *Lys* *CD* *C* *28.9* *.* *1* old residue 14 adding: *163* *14* *Lys* *CE* *C* *41.9* *.* *1* old residue 14 adding: *164* *14* *Lys* *N* *N* *120.4* *.* *1* new residue 15 adding: *165* *15* *Ile* *H* *H* *7.83* *.* *1* old residue 15 adding: *166* *15* *Ile* *HA* *H* *3.63* *.* *1* old residue 15 adding: *167* *15* *Ile* *HB* *H* *2.10* *.* *1* old residue 15 adding: *168* *15* *Ile* *HG12* *H* *0.82* *.* *2* old residue 15 adding: *169* *15* *Ile* *HG13* *H* *1.97* *.* *2* old residue 15 adding: *170* *15* *Ile* *HG2* *H* *0.77* *.* *1* old residue 15 adding: *171* *15* *Ile* *HD1* *H* *0.74* *.* *1* old residue 15 adding: *172* *15* *Ile* *C* *C* *178.2* *.* *1* old residue 15 adding: *173* *15* *Ile* *CA* *C* *65.7* *.* *1* old residue 15 adding: *174* *15* *Ile* *CB* *C* *37.5* *.* *1* old residue 15 adding: *175* *15* *Ile* *CG1* *C* *29.2* *.* *1* old residue 15 adding: *176* *15* *Ile* *CG2* *C* *18.4* *.* *1* old residue 15 adding: *177* *15* *Ile* *CD1* *C* *14.3* *.* *1* old residue 15 adding: *178* *15* *Ile* *N* *N* *119.7* *.* *1* new residue 16 adding: *179* *16* *Ile* *H* *H* *8.08* *.* *1* old residue 16 adding: *180* *16* *Ile* *HA* *H* *3.36* *.* *1* old residue 16 adding: *181* *16* *Ile* *HB* *H* *1.79* *.* *1* old residue 16 adding: *182* *16* *Ile* *HG12* *H* *1.14* *.* *2* old residue 16 adding: *183* *16* *Ile* *HG13* *H* *1.88* *.* *2* old residue 16 adding: *184* *16* *Ile* *HG2* *H* *0.76* *.* *1* old residue 16 adding: *185* *16* *Ile* *HD1* *H* *0.83* *.* *1* old residue 16 adding: *186* *16* *Ile* *C* *C* *177.5* *.* *1* old residue 16 adding: *187* *16* *Ile* *CA* *C* *66.6* *.* *1* old residue 16 adding: *188* *16* *Ile* *CB* *C* *38.3* *.* *1* old residue 16 adding: *189* *16* *Ile* *CG1* *C* *29.6* *.* *1* old residue 16 adding: *190* *16* *Ile* *CG2* *C* *17.0* *.* *1* old residue 16 adding: *191* *16* *Ile* *CD1* *C* *15.8* *.* *1* old residue 16 adding: *192* *16* *Ile* *N* *N* *117.9* *.* *1* new residue 17 adding: *193* *17* *Gln* *H* *H* *8.01* *.* *1* old residue 17 adding: *194* *17* *Gln* *HA* *H* *3.83* *.* *1* old residue 17 adding: *195* *17* *Gln* *HB2* *H* *2.17* *.* *2* old residue 17 adding: *196* *17* *Gln* *HB3* *H* *2.17* *.* *2* old residue 17 adding: *197* *17* *Gln* *HG2* *H* *2.39* *.* *2* old residue 17 adding: *198* *17* *Gln* *HG3* *H* *2.45* *.* *2* old residue 17 adding: *199* *17* *Gln* *HE21* *H* *7.81* *.* *1* old residue 17 adding: *200* *17* *Gln* *HE22* *H* *6.84* *.* *1* old residue 17 adding: *201* *17* *Gln* *C* *C* *178.0* *.* *1* old residue 17 adding: *202* *17* *Gln* *CA* *C* *58.4* *.* *1* old residue 17 adding: *203* *17* *Gln* *CB* *C* *28.1* *.* *1* old residue 17 adding: *204* *17* *Gln* *CG* *C* *33.9* *.* *1* old residue 17 adding: *205* *17* *Gln* *N* *N* *117.9* *.* *1* old residue 17 adding: *206* *17* *Gln* *NE2* *N* *115.5* *.* *1* new residue 18 adding: *207* *18* *Asp* *H* *H* *8.71* *.* *1* old residue 18 adding: *208* *18* *Asp* *HA* *H* *4.40* *.* *1* old residue 18 adding: *209* *18* *Asp* *HB2* *H* *2.53* *.* *2* old residue 18 adding: *210* *18* *Asp* *HB3* *H* *3.05* *.* *2* old residue 18 adding: *211* *18* *Asp* *C* *C* *179.8* *.* *1* old residue 18 adding: *212* *18* *Asp* *CA* *C* *57.4* *.* *1* old residue 18 adding: *213* *18* *Asp* *CB* *C* *39.9* *.* *1* old residue 18 adding: *214* *18* *Asp* *N* *N* *121.0* *.* *1* new residue 19 adding: *215* *19* *Leu* *H* *H* *8.26* *.* *1* old residue 19 adding: *216* *19* *Leu* *HA* *H* *4.01* *.* *1* old residue 19 adding: *217* *19* *Leu* *HB2* *H* *1.00* *.* *2* old residue 19 adding: *218* *19* *Leu* *HB3* *H* *2.33* *.* *2* old residue 19 adding: *219* *19* *Leu* *HG* *H* *2.10* *.* *1* old residue 19 adding: *220* *19* *Leu* *HD1* *H* *0.69* *.* *1* old residue 19 adding: *221* *19* *Leu* *HD2* *H* *0.83* *.* *1* old residue 19 adding: *222* *19* *Leu* *C* *C* *178.2* *.* *1* old residue 19 adding: *223* *19* *Leu* *CA* *C* *58.1* *.* *1* old residue 19 adding: *224* *19* *Leu* *CB* *C* *42.4* *.* *1* old residue 19 adding: *225* *19* *Leu* *CG* *C* *26.1* *.* *1* old residue 19 adding: *226* *19* *Leu* *CD1* *C* *26.8* *.* *1* old residue 19 adding: *227* *19* *Leu* *CD2* *C* *24.1* *.* *1* old residue 19 adding: *228* *19* *Leu* *N* *N* *120.8* *.* *1* new residue 20 adding: *229* *20* *Leu* *H* *H* *8.16* *.* *1* old residue 20 adding: *230* *20* *Leu* *HA* *H* *3.94* *.* *1* old residue 20 adding: *231* *20* *Leu* *HB2* *H* *1.40* *.* *2* old residue 20 adding: *232* *20* *Leu* *HB3* *H* *1.92* *.* *2* old residue 20 adding: *233* *20* *Leu* *HG* *H* *1.84* *.* *1* old residue 20 adding: *234* *20* *Leu* *HD1* *H* *0.77* *.* *1* old residue 20 adding: *235* *20* *Leu* *HD2* *H* *0.85* *.* *1* old residue 20 adding: *236* *20* *Leu* *C* *C* *180.1* *.* *1* old residue 20 adding: *237* *20* *Leu* *CA* *C* *57.9* *.* *1* old residue 20 adding: *238* *20* *Leu* *CB* *C* *40.8* *.* *1* old residue 20 adding: *239* *20* *Leu* *CG* *C* *26.8* *.* *1* old residue 20 adding: *240* *20* *Leu* *CD1* *C* *26.0* *.* *1* old residue 20 adding: *241* *20* *Leu* *CD2* *C* *22.0* *.* *1* old residue 20 adding: *242* *20* *Leu* *N* *N* *117.3* *.* *1* new residue 21 adding: *243* *21* *Asp* *H* *H* *9.00* *.* *1* old residue 21 adding: *244* *21* *Asp* *HA* *H* *4.42* *.* *1* old residue 21 adding: *245* *21* *Asp* *HB2* *H* *2.92* *.* *2* old residue 21 adding: *246* *21* *Asp* *HB3* *H* *2.60* *.* *2* old residue 21 adding: *247* *21* *Asp* *C* *C* *179.0* *.* *1* old residue 21 adding: *248* *21* *Asp* *CA* *C* *57.3* *.* *1* old residue 21 adding: *249* *21* *Asp* *CB* *C* *40.5* *.* *1* old residue 21 adding: *250* *21* *Asp* *N* *N* *120.0* *.* *1* new residue 22 adding: *251* *22* *Val* *H* *H* *7.37* *.* *1* old residue 22 adding: *252* *22* *Val* *HA* *H* *3.60* *.* *1* old residue 22 adding: *253* *22* *Val* *HB* *H* *2.42* *.* *1* old residue 22 adding: *254* *22* *Val* *HG1* *H* *0.94* *.* *1* old residue 22 adding: *255* *22* *Val* *HG2* *H* *1.09* *.* *1* old residue 22 adding: *256* *22* *Val* *C* *C* *177.7* *.* *1* old residue 22 adding: *257* *22* *Val* *CA* *C* *66.3* *.* *1* old residue 22 adding: *258* *22* *Val* *CB* *C* *32.0* *.* *1* old residue 22 adding: *259* *22* *Val* *CG1* *C* *22.0* *.* *1* old residue 22 adding: *260* *22* *Val* *CG2* *C* *22.4* *.* *1* old residue 22 adding: *261* *22* *Val* *N* *N* *119.8* *.* *1* new residue 23 adding: *262* *23* *Leu* *H* *H* *6.88* *.* *1* old residue 23 adding: *263* *23* *Leu* *HA* *H* *3.88* *.* *1* old residue 23 adding: *264* *23* *Leu* *HB2* *H* *1.39* *.* *2* old residue 23 adding: *265* *23* *Leu* *HB3* *H* *2.17* *.* *2* old residue 23 adding: *266* *23* *Leu* *HG* *H* *1.97* *.* *1* old residue 23 adding: *267* *23* *Leu* *HD1* *H* *0.77* *.* *1* old residue 23 adding: *268* *23* *Leu* *HD2* *H* *0.87* *.* *1* old residue 23 adding: *269* *23* *Leu* *C* *C* *179.1* *.* *1* old residue 23 adding: *270* *23* *Leu* *CA* *C* *57.1* *.* *1* old residue 23 adding: *271* *23* *Leu* *CB* *C* *40.6* *.* *1* old residue 23 adding: *272* *23* *Leu* *CG* *C* *26.1* *.* *1* old residue 23 adding: *273* *23* *Leu* *CD1* *C* *22.6* *.* *1* old residue 23 adding: *274* *23* *Leu* *CD2* *C* *26.1* *.* *1* old residue 23 adding: *275* *23* *Leu* *N* *N* *116.5* *.* *1* new residue 24 adding: *276* *24* *Val* *H* *H* *8.43* *.* *1* old residue 24 adding: *277* *24* *Val* *HA* *H* *3.78* *.* *1* old residue 24 adding: *278* *24* *Val* *HB* *H* *2.11* *.* *1* old residue 24 adding: *279* *24* *Val* *HG1* *H* *0.93* *.* *1* old residue 24 adding: *280* *24* *Val* *HG2* *H* *1.05* *.* *1* old residue 24 adding: *281* *24* *Val* *C* *C* *180.8* *.* *1* old residue 24 adding: *282* *24* *Val* *CA* *C* *65.9* *.* *1* old residue 24 adding: *283* *24* *Val* *CB* *C* *32.2* *.* *1* old residue 24 adding: *284* *24* *Val* *CG1* *C* *21.1* *.* *1* old residue 24 adding: *285* *24* *Val* *CG2* *C* *22.7* *.* *1* old residue 24 adding: *286* *24* *Val* *N* *N* *120.3* *.* *1* new residue 25 adding: *287* *25* *Lys* *H* *H* *8.38* *.* *1* old residue 25 adding: *288* *25* *Lys* *HA* *H* *4.03* *.* *1* old residue 25 adding: *289* *25* *Lys* *HB2* *H* *1.92* *.* *2* old residue 25 adding: *290* *25* *Lys* *HB3* *H* *1.92* *.* *2* old residue 25 adding: *291* *25* *Lys* *HG2* *H* *1.47* *.* *2* old residue 25 adding: *292* *25* *Lys* *HG3* *H* *1.55* *.* *2* old residue 25 adding: *293* *25* *Lys* *HD2* *H* *1.65* *.* *2* old residue 25 adding: *294* *25* *Lys* *HD3* *H* *1.65* *.* *2* old residue 25 adding: *295* *25* *Lys* *HE2* *H* *2.91* *.* *2* old residue 25 adding: *296* *25* *Lys* *HE3* *H* *2.91* *.* *2* old residue 25 adding: *297* *25* *Lys* *C* *C* *178.5* *.* *1* old residue 25 adding: *298* *25* *Lys* *CA* *C* *59.4* *.* *1* old residue 25 adding: *299* *25* *Lys* *CB* *C* *32.3* *.* *1* old residue 25 adding: *300* *25* *Lys* *CG* *C* *25.3* *.* *1* old residue 25 adding: *301* *25* *Lys* *CD* *C* *29.2* *.* *1* old residue 25 adding: *302* *25* *Lys* *CE* *C* *42.0* *.* *1* old residue 25 adding: *303* *25* *Lys* *N* *N* *121.9* *.* *1* new residue 26 adding: *304* *26* *Glu* *H* *H* *7.36* *.* *1* old residue 26 adding: *305* *26* *Glu* *HA* *H* *4.33* *.* *1* old residue 26 adding: *306* *26* *Glu* *HB2* *H* *1.79* *.* *2* old residue 26 adding: *307* *26* *Glu* *HB3* *H* *2.30* *.* *2* old residue 26 adding: *308* *26* *Glu* *HG2* *H* *2.30* *.* *2* old residue 26 adding: *309* *26* *Glu* *HG3* *H* *2.45* *.* *2* old residue 26 adding: *310* *26* *Glu* *C* *C* *175.0* *.* *1* old residue 26 adding: *311* *26* *Glu* *CA* *C* *56.0* *.* *1* old residue 26 adding: *312* *26* *Glu* *CB* *C* *29.8* *.* *1* old residue 26 adding: *313* *26* *Glu* *CG* *C* *35.4* *.* *1* old residue 26 adding: *314* *26* *Glu* *N* *N* *115.0* *.* *1* new residue 27 adding: *315* *27* *Glu* *H* *H* *7.98* *.* *1* old residue 27 adding: *316* *27* *Glu* *HA* *H* *3.95* *.* *1* old residue 27 adding: *317* *27* *Glu* *HB2* *H* *2.15* *.* *2* old residue 27 adding: *318* *27* *Glu* *HB3* *H* *2.15* *.* *2* old residue 27 adding: *319* *27* *Glu* *HG2* *H* *2.19* *.* *2* old residue 27 adding: *320* *27* *Glu* *HG3* *H* *2.19* *.* *2* old residue 27 adding: *321* *27* *Glu* *C* *C* *175.9* *.* *1* old residue 27 adding: *322* *27* *Glu* *CA* *C* *56.9* *.* *1* old residue 27 adding: *323* *27* *Glu* *CB* *C* *27.1* *.* *1* old residue 27 adding: *324* *27* *Glu* *CG* *C* *36.6* *.* *1* old residue 27 adding: *325* *27* *Glu* *N* *N* *116.3* *.* *1* new residue 28 adding: *326* *28* *Val* *H* *H* *7.37* *.* *1* old residue 28 adding: *327* *28* *Val* *HA* *H* *4.20* *.* *1* old residue 28 adding: *328* *28* *Val* *HB* *H* *2.13* *.* *1* old residue 28 adding: *329* *28* *Val* *HG1* *H* *0.93* *.* *1* old residue 28 adding: *330* *28* *Val* *HG2* *H* *0.61* *.* *1* old residue 28 adding: *331* *28* *Val* *C* *C* *176.7* *.* *1* old residue 28 adding: *332* *28* *Val* *CA* *C* *61.6* *.* *1* old residue 28 adding: *333* *28* *Val* *CB* *C* *32.6* *.* *1* old residue 28 adding: *334* *28* *Val* *CG1* *C* *22.6* *.* *1* old residue 28 adding: *335* *28* *Val* *CG2* *C* *25.4* *.* *1* old residue 28 adding: *336* *28* *Val* *N* *N* *112.2* *.* *1* new residue 29 adding: *337* *29* *Thr* *H* *H* *7.40* *.* *1* old residue 29 adding: *338* *29* *Thr* *HA* *H* *4.64* *.* *1* old residue 29 adding: *339* *29* *Thr* *HB* *H* *4.66* *.* *1* old residue 29 adding: *340* *29* *Thr* *HG2* *H* *1.44* *.* *1* old residue 29 adding: *341* *29* *Thr* *CA* *C* *59.9* *.* *1* old residue 29 adding: *342* *29* *Thr* *CB* *C* *67.9* *.* *1* old residue 29 adding: *343* *29* *Thr* *CG2* *C* *22.7* *.* *1* old residue 29 adding: *344* *29* *Thr* *N* *N* *113.9* *.* *1* new residue 30 adding: *345* *30* *Pro* *HA* *H* *4.13* *.* *1* old residue 30 adding: *346* *30* *Pro* *HB2* *H* *1.84* *.* *2* old residue 30 adding: *347* *30* *Pro* *HB3* *H* *2.10* *.* *2* old residue 30 adding: *348* *30* *Pro* *HG2* *H* *2.03* *.* *2* old residue 30 adding: *349* *30* *Pro* *HG3* *H* *2.12* *.* *2* old residue 30 adding: *350* *30* *Pro* *HD2* *H* *3.84* *.* *2* old residue 30 adding: *351* *30* *Pro* *HD3* *H* *3.92* *.* *2* old residue 30 adding: *352* *30* *Pro* *C* *C* *177.6* *.* *1* old residue 30 adding: *353* *30* *Pro* *CA* *C* *66.3* *.* *1* old residue 30 adding: *354* *30* *Pro* *CB* *C* *31.5* *.* *1* old residue 30 adding: *355* *30* *Pro* *CG* *C* *27.9* *.* *1* old residue 30 adding: *356* *30* *Pro* *CD* *C* *50.2* *.* *1* new residue 31 adding: *357* *31* *Asp* *H* *H* *8.39* *.* *1* old residue 31 adding: *358* *31* *Asp* *HA* *H* *4.24* *.* *1* old residue 31 adding: *359* *31* *Asp* *HB2* *H* *2.55* *.* *2* old residue 31 adding: *360* *31* *Asp* *HB3* *H* *2.67* *.* *2* old residue 31 adding: *361* *31* *Asp* *C* *C* *178.9* *.* *1* old residue 31 adding: *362* *31* *Asp* *CA* *C* *57.0* *.* *1* old residue 31 adding: *363* *31* *Asp* *CB* *C* *40.0* *.* *1* old residue 31 adding: *364* *31* *Asp* *N* *N* *113.2* *.* *1* new residue 32 adding: *365* *32* *Leu* *H* *H* *7.46* *.* *1* old residue 32 adding: *366* *32* *Leu* *HA* *H* *4.19* *.* *1* old residue 32 adding: *367* *32* *Leu* *HB2* *H* *1.62* *.* *2* old residue 32 adding: *368* *32* *Leu* *HB3* *H* *1.31* *.* *2* old residue 32 adding: *369* *32* *Leu* *HG* *H* *1.34* *.* *1* old residue 32 adding: *370* *32* *Leu* *HD1* *H* *0.71* *.* *1* old residue 32 adding: *371* *32* *Leu* *HD2* *H* *0.62* *.* *1* old residue 32 adding: *372* *32* *Leu* *C* *C* *178.9* *.* *1* old residue 32 adding: *373* *32* *Leu* *CA* *C* *57.0* *.* *1* old residue 32 adding: *374* *32* *Leu* *CB* *C* *41.3* *.* *1* old residue 32 adding: *375* *32* *Leu* *CG* *C* *27.0* *.* *1* old residue 32 adding: *376* *32* *Leu* *CD1* *C* *24.0* *.* *1* old residue 32 adding: *377* *32* *Leu* *CD2* *C* *25.4* *.* *1* old residue 32 adding: *378* *32* *Leu* *N* *N* *123.0* *.* *1* new residue 33 adding: *379* *33* *Ala* *H* *H* *8.93* *.* *1* old residue 33 adding: *380* *33* *Ala* *HA* *H* *3.73* *.* *1* old residue 33 adding: *381* *33* *Ala* *HB* *H* *1.48* *.* *1* old residue 33 adding: *382* *33* *Ala* *C* *C* *179.8* *.* *1* old residue 33 adding: *383* *33* *Ala* *CA* *C* *55.9* *.* *1* old residue 33 adding: *384* *33* *Ala* *CB* *C* *19.1* *.* *1* old residue 33 adding: *385* *33* *Ala* *N* *N* *122.7* *.* *1* new residue 34 adding: *386* *34* *Leu* *H* *H* *8.42* *.* *1* old residue 34 adding: *387* *34* *Leu* *HA* *H* *4.01* *.* *1* old residue 34 adding: *388* *34* *Leu* *HB2* *H* *1.57* *.* *2* old residue 34 adding: *389* *34* *Leu* *HB3* *H* *1.98* *.* *2* old residue 34 adding: *390* *34* *Leu* *HG* *H* *1.83* *.* *1* old residue 34 adding: *391* *34* *Leu* *HD1* *H* *0.66* *.* *1* old residue 34 adding: *392* *34* *Leu* *HD2* *H* *0.53* *.* *1* old residue 34 adding: *393* *34* *Leu* *C* *C* *179.7* *.* *1* old residue 34 adding: *394* *34* *Leu* *CA* *C* *58.2* *.* *1* old residue 34 adding: *395* *34* *Leu* *CB* *C* *41.2* *.* *1* old residue 34 adding: *396* *34* *Leu* *CG* *C* *26.9* *.* *1* old residue 34 adding: *397* *34* *Leu* *CD1* *C* *25.6* *.* *1* old residue 34 adding: *398* *34* *Leu* *CD2* *C* *23.6* *.* *1* old residue 34 adding: *399* *34* *Leu* *N* *N* *115.8* *.* *1* new residue 35 adding: *400* *35* *Met* *H* *H* *7.73* *.* *1* old residue 35 adding: *401* *35* *Met* *HA* *H* *4.24* *.* *1* old residue 35 adding: *402* *35* *Met* *HB2* *H* *2.31* *.* *2* old residue 35 adding: *403* *35* *Met* *HB3* *H* *2.31* *.* *2* old residue 35 adding: *404* *35* *Met* *HG2* *H* *2.42* *.* *2* old residue 35 adding: *405* *35* *Met* *HG3* *H* *2.70* *.* *2* old residue 35 adding: *406* *35* *Met* *HE* *H* *2.06* *.* *1* old residue 35 adding: *407* *35* *Met* *C* *C* *179.5* *.* *1* old residue 35 adding: *408* *35* *Met* *CA* *C* *59.3* *.* *1* old residue 35 adding: *409* *35* *Met* *CB* *C* *32.9* *.* *1* old residue 35 adding: *410* *35* *Met* *CG* *C* *31.6* *.* *1* old residue 35 adding: *411* *35* *Met* *CE* *C* *17.3* *.* *1* old residue 35 adding: *412* *35* *Met* *N* *N* *121.4* *.* *1* new residue 36 adding: *413* *36* *Cys* *H* *H* *8.42* *.* *1* old residue 36 adding: *414* *36* *Cys* *HA* *H* *3.95* *.* *1* old residue 36 adding: *415* *36* *Cys* *HB2* *H* *2.42* *.* *2* old residue 36 adding: *416* *36* *Cys* *HB3* *H* *2.96* *.* *2* old residue 36 adding: *417* *36* *Cys* *C* *C* *177.0* *.* *1* old residue 36 adding: *418* *36* *Cys* *CA* *C* *64.2* *.* *1* old residue 36 adding: *419* *36* *Cys* *CB* *C* *27.2* *.* *1* old residue 36 adding: *420* *36* *Cys* *N* *N* *118.6* *.* *1* new residue 37 adding: *421* *37* *Leu* *H* *H* *9.02* *.* *1* old residue 37 adding: *422* *37* *Leu* *HA* *H* *3.94* *.* *1* old residue 37 adding: *423* *37* *Leu* *HB2* *H* *1.31* *.* *2* old residue 37 adding: *424* *37* *Leu* *HB3* *H* *2.03* *.* *2* old residue 37 adding: *425* *37* *Leu* *HG* *H* *1.73* *.* *1* old residue 37 adding: *426* *37* *Leu* *HD1* *H* *0.67* *.* *1* old residue 37 adding: *427* *37* *Leu* *HD2* *H* *0.87* *.* *1* old residue 37 adding: *428* *37* *Leu* *C* *C* *179.1* *.* *1* old residue 37 adding: *429* *37* *Leu* *CA* *C* *58.3* *.* *1* old residue 37 adding: *430* *37* *Leu* *CB* *C* *42.2* *.* *1* old residue 37 adding: *431* *37* *Leu* *CG* *C* *27.7* *.* *1* old residue 37 adding: *432* *37* *Leu* *CD1* *C* *26.0* *.* *1* old residue 37 adding: *433* *37* *Leu* *CD2* *C* *24.2* *.* *1* old residue 37 adding: *434* *37* *Leu* *N* *N* *119.6* *.* *1* new residue 38 adding: *435* *38* *Gly* *H* *H* *8.94* *.* *1* old residue 38 adding: *436* *38* *Gly* *HA2* *H* *3.61* *.* *2* old residue 38 adding: *437* *38* *Gly* *HA3* *H* *3.97* *.* *2* old residue 38 adding: *438* *38* *Gly* *C* *C* *179.8* *.* *1* old residue 38 adding: *439* *38* *Gly* *CA* *C* *47.9* *.* *1* old residue 38 adding: *440* *38* *Gly* *N* *N* *106.6* *.* *1* new residue 39 adding: *441* *39* *Asn* *H* *H* *7.79* *.* *1* old residue 39 adding: *442* *39* *Asn* *HA* *H* *4.44* *.* *1* old residue 39 adding: *443* *39* *Asn* *HB2* *H* *2.62* *.* *2* old residue 39 adding: *444* *39* *Asn* *HB3* *H* *2.77* *.* *2* old residue 39 adding: *445* *39* *Asn* *HD21* *H* *7.15* *.* *2* old residue 39 adding: *446* *39* *Asn* *HD22* *H* *7.15* *.* *2* old residue 39 adding: *447* *39* *Asn* *C* *C* *178.0* *.* *1* old residue 39 adding: *448* *39* *Asn* *CA* *C* *56.3* *.* *1* old residue 39 adding: *449* *39* *Asn* *CB* *C* *39.5* *.* *1* old residue 39 adding: *450* *39* *Asn* *CG* *C* *175.8* *.* *1* old residue 39 adding: *451* *39* *Asn* *N* *N* *120.9* *.* *1* old residue 39 adding: *452* *39* *Asn* *ND2* *N* *111.8* *.* *1* new residue 40 adding: *453* *40* *Ala* *H* *H* *8.26* *.* *1* old residue 40 adding: *454* *40* *Ala* *HA* *H* *3.97* *.* *1* old residue 40 adding: *455* *40* *Ala* *HB* *H* *1.47* *.* *1* old residue 40 adding: *456* *40* *Ala* *C* *C* *178.2* *.* *1* old residue 40 adding: *457* *40* *Ala* *CA* *C* *55.9* *.* *1* old residue 40 adding: *458* *40* *Ala* *CB* *C* *17.2* *.* *1* old residue 40 adding: *459* *40* *Ala* *N* *N* *123.9* *.* *1* new residue 41 adding: *460* *41* *Val* *H* *H* *8.41* *.* *1* old residue 41 adding: *461* *41* *Val* *HA* *H* *3.18* *.* *1* old residue 41 adding: *462* *41* *Val* *HB* *H* *2.23* *.* *1* old residue 41 adding: *463* *41* *Val* *HG1* *H* *0.29* *.* *1* old residue 41 adding: *464* *41* *Val* *HG2* *H* *0.97* *.* *1* old residue 41 adding: *465* *41* *Val* *C* *C* *177.8* *.* *1* old residue 41 adding: *466* *41* *Val* *CA* *C* *67.0* *.* *1* old residue 41 adding: *467* *41* *Val* *CB* *C* *30.9* *.* *1* old residue 41 adding: *468* *41* *Val* *CG1* *C* *22.3* *.* *1* old residue 41 adding: *469* *41* *Val* *CG2* *C* *24.6* *.* *1* old residue 41 adding: *470* *41* *Val* *N* *N* *116.9* *.* *1* new residue 42 adding: *471* *42* *Thr* *H* *H* *8.21* *.* *1* old residue 42 adding: *472* *42* *Thr* *HA* *H* *3.43* *.* *1* old residue 42 adding: *473* *42* *Thr* *HB* *H* *4.20* *.* *1* old residue 42 adding: *474* *42* *Thr* *HG2* *H* *1.05* *.* *1* old residue 42 adding: *475* *42* *Thr* *C* *C* *175.9* *.* *1* old residue 42 adding: *476* *42* *Thr* *CA* *C* *67.5* *.* *1* old residue 42 adding: *477* *42* *Thr* *CB* *C* *68.0* *.* *1* old residue 42 adding: *478* *42* *Thr* *CG2* *C* *21.6* *.* *1* old residue 42 adding: *479* *42* *Thr* *N* *N* *114.8* *.* *1* new residue 43 adding: *480* *43* *Asn* *H* *H* *7.60* *.* *1* old residue 43 adding: *481* *43* *Asn* *HA* *H* *4.17* *.* *1* old residue 43 adding: *482* *43* *Asn* *HB2* *H* *2.76* *.* *2* old residue 43 adding: *483* *43* *Asn* *HB3* *H* *2.81* *.* *2* old residue 43 adding: *484* *43* *Asn* *HD21* *H* *7.04* *.* *1* old residue 43 adding: *485* *43* *Asn* *HD22* *H* *6.95* *.* *1* old residue 43 adding: *486* *43* *Asn* *C* *C* *177.3* *.* *1* old residue 43 adding: *487* *43* *Asn* *CA* *C* *57.0* *.* *1* old residue 43 adding: *488* *43* *Asn* *CB* *C* *39.4* *.* *1* old residue 43 adding: *489* *43* *Asn* *CG* *C* *175.5* *.* *1* old residue 43 adding: *490* *43* *Asn* *N* *N* *120.3* *.* *1* old residue 43 adding: *491* *43* *Asn* *ND2* *N* *112.1* *.* *1* new residue 44 adding: *492* *44* *Ile* *H* *H* *7.63* *.* *1* old residue 44 adding: *493* *44* *Ile* *HA* *H* *3.77* *.* *1* old residue 44 adding: *494* *44* *Ile* *HB* *H* *2.03* *.* *1* old residue 44 adding: *495* *44* *Ile* *HG12* *H* *1.01* *.* *2* old residue 44 adding: *496* *44* *Ile* *HG13* *H* *1.66* *.* *2* old residue 44 adding: *497* *44* *Ile* *HG2* *H* *0.77* *.* *1* old residue 44 adding: *498* *44* *Ile* *HD1* *H* *0.57* *.* *1* old residue 44 adding: *499* *44* *Ile* *C* *C* *179.2* *.* *1* old residue 44 adding: *500* *44* *Ile* *CA* *C* *62.1* *.* *1* old residue 44 adding: *501* *44* *Ile* *CB* *C* *35.7* *.* *1* old residue 44 adding: *502* *44* *Ile* *CG1* *C* *27.0* *.* *1* old residue 44 adding: *503* *44* *Ile* *CG2* *C* *18.2* *.* *1* old residue 44 adding: *504* *44* *Ile* *CD1* *C* *9.1* *.* *1* old residue 44 adding: *505* *44* *Ile* *N* *N* *119.7* *.* *1* new residue 45 adding: *506* *45* *Ile* *H* *H* *8.46* *.* *1* old residue 45 adding: *507* *45* *Ile* *HA* *H* *3.55* *.* *1* old residue 45 adding: *508* *45* *Ile* *HB* *H* *1.72* *.* *1* old residue 45 adding: *509* *45* *Ile* *HG12* *H* *0.85* *.* *2* old residue 45 adding: *510* *45* *Ile* *HG13* *H* *1.70* *.* *2* old residue 45 adding: *511* *45* *Ile* *HG2* *H* *0.79* *.* *1* old residue 45 adding: *512* *45* *Ile* *HD1* *H* *0.48* *.* *1* old residue 45 adding: *513* *45* *Ile* *C* *C* *177.1* *.* *1* old residue 45 adding: *514* *45* *Ile* *CA* *C* *65.1* *.* *1* old residue 45 adding: *515* *45* *Ile* *CB* *C* *36.6* *.* *1* old residue 45 adding: *516* *45* *Ile* *CG1* *C* *29.9* *.* *1* old residue 45 adding: *517* *45* *Ile* *CG2* *C* *18.0* *.* *1* old residue 45 adding: *518* *45* *Ile* *CD1* *C* *13.4* *.* *1* old residue 45 adding: *519* *45* *Ile* *N* *N* *120.3* *.* *1* new residue 46 adding: *520* *46* *Ala* *H* *H* *7.75* *.* *1* old residue 46 adding: *521* *46* *Ala* *HA* *H* *3.95* *.* *1* old residue 46 adding: *522* *46* *Ala* *HB* *H* *1.34* *.* *1* old residue 46 adding: *523* *46* *Ala* *C* *C* *178.0* *.* *1* old residue 46 adding: *524* *46* *Ala* *CA* *C* *54.0* *.* *1* old residue 46 adding: *525* *46* *Ala* *CB* *C* *17.9* *.* *1* old residue 46 adding: *526* *46* *Ala* *N* *N* *120.0* *.* *1* new residue 47 adding: *527* *47* *Gln* *H* *H* *7.61* *.* *1* old residue 47 adding: *528* *47* *Gln* *HA* *H* *4.19* *.* *1* old residue 47 adding: *529* *47* *Gln* *HB2* *H* *2.16* *.* *2* old residue 47 adding: *530* *47* *Gln* *HB3* *H* *2.30* *.* *2* old residue 47 adding: *531* *47* *Gln* *HG2* *H* *2.35* *.* *2* old residue 47 adding: *532* *47* *Gln* *HG3* *H* *2.60* *.* *2* old residue 47 adding: *533* *47* *Gln* *HE21* *H* *7.15* *.* *1* old residue 47 adding: *534* *47* *Gln* *HE22* *H* *6.82* *.* *1* old residue 47 adding: *535* *47* *Gln* *C* *C* *177.1* *.* *1* old residue 47 adding: *536* *47* *Gln* *CA* *C* *56.0* *.* *1* old residue 47 adding: *537* *47* *Gln* *CB* *C* *29.0* *.* *1* old residue 47 adding: *538* *47* *Gln* *CG* *C* *33.9* *.* *1* old residue 47 adding: *539* *47* *Gln* *CD* *C* *180.3* *.* *1* old residue 47 adding: *540* *47* *Gln* *N* *N* *114.0* *.* *1* old residue 47 adding: *541* *47* *Gln* *NE2* *N* *111.6* *.* *1* new residue 48 adding: *542* *48* *Val* *H* *H* *7.74* *.* *1* old residue 48 adding: *543* *48* *Val* *HA* *H* *4.39* *.* *1* old residue 48 adding: *544* *48* *Val* *HB* *H* *2.52* *.* *1* old residue 48 adding: *545* *48* *Val* *HG1* *H* *1.05* *.* *1* old residue 48 adding: *546* *48* *Val* *HG2* *H* *1.07* *.* *1* old residue 48 adding: *547* *48* *Val* *CA* *C* *59.9* *.* *1* old residue 48 adding: *548* *48* *Val* *CB* *C* *31.9* *.* *1* old residue 48 adding: *549* *48* *Val* *CG1* *C* *20.4* *.* *1* old residue 48 adding: *550* *48* *Val* *CG2* *C* *21.0* *.* *1* old residue 48 adding: *551* *48* *Val* *N* *N* *122.4* *.* *1* new residue 49 adding: *552* *49* *Pro* *HA* *H* *4.34* *.* *1* old residue 49 adding: *553* *49* *Pro* *HB2* *H* *1.72* *.* *2* old residue 49 adding: *554* *49* *Pro* *HB3* *H* *2.44* *.* *2* old residue 49 adding: *555* *49* *Pro* *HG2* *H* *2.07* *.* *2* old residue 49 adding: *556* *49* *Pro* *HG3* *H* *2.07* *.* *2* old residue 49 adding: *557* *49* *Pro* *HD2* *H* *3.56* *.* *2* old residue 49 adding: *558* *49* *Pro* *HD3* *H* *3.94* *.* *2* old residue 49 adding: *559* *49* *Pro* *C* *C* *177.7* *.* *1* old residue 49 adding: *560* *49* *Pro* *CA* *C* *63.7* *.* *1* old residue 49 adding: *561* *49* *Pro* *CB* *C* *32.3* *.* *1* old residue 49 adding: *562* *49* *Pro* *CG* *C* *27.9* *.* *1* old residue 49 adding: *563* *49* *Pro* *CD* *C* *50.9* *.* *1* new residue 50 adding: *564* *50* *Glu* *H* *H* *8.96* *.* *1* old residue 50 adding: *565* *50* *Glu* *HA* *H* *3.58* *.* *1* old residue 50 adding: *566* *50* *Glu* *HB2* *H* *2.06* *.* *2* old residue 50 adding: *567* *50* *Glu* *HB3* *H* *2.06* *.* *2* old residue 50 adding: *568* *50* *Glu* *HG2* *H* *2.32* *.* *2* old residue 50 adding: *569* *50* *Glu* *HG3* *H* *2.32* *.* *2* old residue 50 adding: *570* *50* *Glu* *C* *C* *178.3* *.* *1* old residue 50 adding: *571* *50* *Glu* *CA* *C* *60.8* *.* *1* old residue 50 adding: *572* *50* *Glu* *CB* *C* *29.9* *.* *1* old residue 50 adding: *573* *50* *Glu* *CG* *C* *36.1* *.* *1* old residue 50 adding: *574* *50* *Glu* *N* *N* *124.4* *.* *1* new residue 51 adding: *575* *51* *Ser* *H* *H* *8.64* *.* *1* old residue 51 adding: *576* *51* *Ser* *HA* *H* *4.24* *.* *1* old residue 51 adding: *577* *51* *Ser* *HB2* *H* *3.95* *.* *2* old residue 51 adding: *578* *51* *Ser* *HB3* *H* *4.00* *.* *2* old residue 51 adding: *579* *51* *Ser* *C* *C* *175.2* *.* *1* old residue 51 adding: *580* *51* *Ser* *CA* *C* *60.6* *.* *1* old residue 51 adding: *581* *51* *Ser* *CB* *C* *62.6* *.* *1* old residue 51 adding: *582* *51* *Ser* *N* *N* *112.0* *.* *1* new residue 52 adding: *583* *52* *Lys* *H* *H* *7.95* *.* *1* old residue 52 adding: *584* *52* *Lys* *HA* *H* *4.65* *.* *1* old residue 52 adding: *585* *52* *Lys* *HB2* *H* *1.64* *.* *2* old residue 52 adding: *586* *52* *Lys* *HB3* *H* *1.98* *.* *2* old residue 52 adding: *587* *52* *Lys* *HG2* *H* *1.42* *.* *2* old residue 52 adding: *588* *52* *Lys* *HG3* *H* *1.42* *.* *2* old residue 52 adding: *589* *52* *Lys* *HD2* *H* *1.57* *.* *2* old residue 52 adding: *590* *52* *Lys* *HD3* *H* *1.64* *.* *2* old residue 52 adding: *591* *52* *Lys* *HE2* *H* *2.92* *.* *2* old residue 52 adding: *592* *52* *Lys* *HE3* *H* *2.92* *.* *2* old residue 52 adding: *593* *52* *Lys* *C* *C* *176.7* *.* *1* old residue 52 adding: *594* *52* *Lys* *CA* *C* *55.5* *.* *1* old residue 52 adding: *595* *52* *Lys* *CB* *C* *34.0* *.* *1* old residue 52 adding: *596* *52* *Lys* *CG* *C* *25.1* *.* *1* old residue 52 adding: *597* *52* *Lys* *CD* *C* *28.8* *.* *1* old residue 52 adding: *598* *52* *Lys* *CE* *C* *42.0* *.* *1* old residue 52 adding: *599* *52* *Lys* *N* *N* *119.6* *.* *1* new residue 53 adding: *600* *53* *Arg* *H* *H* *7.29* *.* *1* old residue 53 adding: *601* *53* *Arg* *HA* *H* *3.53* *.* *1* old residue 53 adding: *602* *53* *Arg* *HB2* *H* *1.54* *.* *2* old residue 53 adding: *603* *53* *Arg* *HB3* *H* *1.80* *.* *2* old residue 53 adding: *604* *53* *Arg* *HG2* *H* *1.53* *.* *2* old residue 53 adding: *605* *53* *Arg* *HG3* *H* *1.87* *.* *2* old residue 53 adding: *606* *53* *Arg* *HD2* *H* *3.05* *.* *2* old residue 53 adding: *607* *53* *Arg* *HD3* *H* *3.14* *.* *2* old residue 53 adding: *608* *53* *Arg* *HE* *H* *6.84* *.* *1* old residue 53 adding: *609* *53* *Arg* *HH21* *H* *6.50* *.* *2* old residue 53 adding: *610* *53* *Arg* *HH22* *H* *7.22* *.* *2* old residue 53 adding: *611* *53* *Arg* *C* *C* *177.3* *.* *1* old residue 53 adding: *612* *53* *Arg* *CA* *C* *61.7* *.* *1* old residue 53 adding: *613* *53* *Arg* *CB* *C* *30.8* *.* *1* old residue 53 adding: *614* *53* *Arg* *CG* *C* *28.5* *.* *1* old residue 53 adding: *615* *53* *Arg* *CD* *C* *44.2* *.* *1* old residue 53 adding: *616* *53* *Arg* *N* *N* *119.0* *.* *1* old residue 53 adding: *617* *53* *Arg* *NE* *N* *84.9* *.* *1* new residue 54 adding: *618* *54* *Val* *H* *H* *8.44* *.* *1* old residue 54 adding: *619* *54* *Val* *HA* *H* *3.46* *.* *1* old residue 54 adding: *620* *54* *Val* *HB* *H* *1.95* *.* *1* old residue 54 adding: *621* *54* *Val* *HG1* *H* *0.86* *.* *1* old residue 54 adding: *622* *54* *Val* *HG2* *H* *0.96* *.* *1* old residue 54 adding: *623* *54* *Val* *C* *C* *177.4* *.* *1* old residue 54 adding: *624* *54* *Val* *CA* *C* *67.2* *.* *1* old residue 54 adding: *625* *54* *Val* *CB* *C* *31.0* *.* *1* old residue 54 adding: *626* *54* *Val* *CG1* *C* *21.2* *.* *1* old residue 54 adding: *627* *54* *Val* *CG2* *C* *23.5* *.* *1* old residue 54 adding: *628* *54* *Val* *N* *N* *118.4* *.* *1* new residue 55 adding: *629* *55* *Ala* *H* *H* *8.12* *.* *1* old residue 55 adding: *630* *55* *Ala* *HA* *H* *4.18* *.* *1* old residue 55 adding: *631* *55* *Ala* *HB* *H* *1.44* *.* *1* old residue 55 adding: *632* *55* *Ala* *C* *C* *180.7* *.* *1* old residue 55 adding: *633* *55* *Ala* *CA* *C* *55.0* *.* *1* old residue 55 adding: *634* *55* *Ala* *CB* *C* *17.9* *.* *1* old residue 55 adding: *635* *55* *Ala* *N* *N* *122.3* *.* *1* new residue 56 adding: *636* *56* *Val* *H* *H* *8.04* *.* *1* old residue 56 adding: *637* *56* *Val* *HA* *H* *3.78* *.* *1* old residue 56 adding: *638* *56* *Val* *HB* *H* *2.12* *.* *1* old residue 56 adding: *639* *56* *Val* *HG1* *H* *0.89* *.* *1* old residue 56 adding: *640* *56* *Val* *HG2* *H* *1.12* *.* *1* old residue 56 adding: *641* *56* *Val* *C* *C* *179.4* *.* *1* old residue 56 adding: *642* *56* *Val* *CA* *C* *66.7* *.* *1* old residue 56 adding: *643* *56* *Val* *CB* *C* *31.4* *.* *1* old residue 56 adding: *644* *56* *Val* *CG1* *C* *21.9* *.* *1* old residue 56 adding: *645* *56* *Val* *CG2* *C* *23.6* *.* *1* old residue 56 adding: *646* *56* *Val* *N* *N* *117.9* *.* *1* new residue 57 adding: *647* *57* *Val* *H* *H* *8.51* *.* *1* old residue 57 adding: *648* *57* *Val* *HA* *H* *3.76* *.* *1* old residue 57 adding: *649* *57* *Val* *HB* *H* *2.21* *.* *1* old residue 57 adding: *650* *57* *Val* *HG1* *H* *1.05* *.* *1* old residue 57 adding: *651* *57* *Val* *HG2* *H* *0.98* *.* *1* old residue 57 adding: *652* *57* *Val* *C* *C* *177.9* *.* *1* old residue 57 adding: *653* *57* *Val* *CA* *C* *66.7* *.* *1* old residue 57 adding: *654* *57* *Val* *CB* *C* *31.4* *.* *1* old residue 57 adding: *655* *57* *Val* *CG1* *C* *21.5* *.* *1* old residue 57 adding: *656* *57* *Val* *CG2* *C* *24.7* *.* *1* old residue 57 adding: *657* *57* *Val* *N* *N* *121.6* *.* *1* new residue 58 adding: *658* *58* *Asp* *H* *H* *8.80* *.* *1* old residue 58 adding: *659* *58* *Asp* *HA* *H* *4.42* *.* *1* old residue 58 adding: *660* *58* *Asp* *HB2* *H* *2.83* *.* *2* old residue 58 adding: *661* *58* *Asp* *HB3* *H* *2.64* *.* *2* old residue 58 adding: *662* *58* *Asp* *C* *C* *178.5* *.* *1* old residue 58 adding: *663* *58* *Asp* *CA* *C* *57.8* *.* *1* old residue 58 adding: *664* *58* *Asp* *CB* *C* *40.0* *.* *1* old residue 58 adding: *665* *58* *Asp* *N* *N* *124.8* *.* *1* new residue 59 adding: *666* *59* *Asn* *H* *H* *8.50* *.* *1* old residue 59 adding: *667* *59* *Asn* *HA* *H* *4.46* *.* *1* old residue 59 adding: *668* *59* *Asn* *HB2* *H* *2.86* *.* *2* old residue 59 adding: *669* *59* *Asn* *HB3* *H* *2.96* *.* *2* old residue 59 adding: *670* *59* *Asn* *HD21* *H* *7.73* *.* *1* old residue 59 adding: *671* *59* *Asn* *HD22* *H* *7.02* *.* *1* old residue 59 adding: *672* *59* *Asn* *C* *C* *177.7* *.* *1* old residue 59 adding: *673* *59* *Asn* *CA* *C* *56.5* *.* *1* old residue 59 adding: *674* *59* *Asn* *CB* *C* *38.3* *.* *1* old residue 59 adding: *675* *59* *Asn* *CG* *C* *176.0* *.* *1* old residue 59 adding: *676* *59* *Asn* *N* *N* *118.8* *.* *1* old residue 59 adding: *677* *59* *Asn* *ND2* *N* *113.0* *.* *1* new residue 60 adding: *678* *60* *Phe* *H* *H* *8.54* *.* *1* old residue 60 adding: *679* *60* *Phe* *HA* *H* *4.21* *.* *1* old residue 60 adding: *680* *60* *Phe* *HB2* *H* *3.28* *.* *2* old residue 60 adding: *681* *60* *Phe* *HB3* *H* *3.29* *.* *2* old residue 60 adding: *682* *60* *Phe* *HD1* *H* *7.16* *.* *3* old residue 60 adding: *683* *60* *Phe* *HD2* *H* *7.16* *.* *3* old residue 60 adding: *684* *60* *Phe* *HE1* *H* *7.38* *.* *3* old residue 60 adding: *685* *60* *Phe* *HE2* *H* *7.38* *.* *3* old residue 60 adding: *686* *60* *Phe* *HZ* *H* *6.90* *.* *1* old residue 60 adding: *687* *60* *Phe* *C* *C* *177.7* *.* *1* old residue 60 adding: *688* *60* *Phe* *CA* *C* *61.6* *.* *1* old residue 60 adding: *689* *60* *Phe* *CB* *C* *39.8* *.* *1* old residue 60 adding: *690* *60* *Phe* *CD1* *C* *132.1* *.* *3* old residue 60 adding: *691* *60* *Phe* *CD2* *C* *132.1* *.* *3* old residue 60 adding: *692* *60* *Phe* *CE1* *C* *131.0* *.* *3* old residue 60 adding: *693* *60* *Phe* *CE2* *C* *131.0* *.* *3* old residue 60 adding: *694* *60* *Phe* *CZ* *C* *128.6* *.* *1* old residue 60 adding: *695* *60* *Phe* *N* *N* *121.8* *.* *1* new residue 61 adding: *696* *61* *Thr* *H* *H* *8.82* *.* *1* old residue 61 adding: *697* *61* *Thr* *HA* *H* *3.82* *.* *1* old residue 61 adding: *698* *61* *Thr* *HB* *H* *4.45* *.* *1* old residue 61 adding: *699* *61* *Thr* *HG1* *H* *5.11* *.* *1* old residue 61 adding: *700* *61* *Thr* *HG2* *H* *1.51* *.* *1* old residue 61 adding: *701* *61* *Thr* *C* *C* *176.7* *.* *1* old residue 61 adding: *702* *61* *Thr* *CA* *C* *66.2* *.* *1* old residue 61 adding: *703* *61* *Thr* *CB* *C* *68.4* *.* *1* old residue 61 adding: *704* *61* *Thr* *CG2* *C* *23.0* *.* *1* old residue 61 adding: *705* *61* *Thr* *N* *N* *112.2* *.* *1* new residue 62 adding: *706* *62* *Lys* *H* *H* *8.19* *.* *1* old residue 62 adding: *707* *62* *Lys* *HA* *H* *4.01* *.* *1* old residue 62 adding: *708* *62* *Lys* *HB2* *H* *1.88* *.* *2* old residue 62 adding: *709* *62* *Lys* *HB3* *H* *1.95* *.* *2* old residue 62 adding: *710* *62* *Lys* *HG2* *H* *1.37* *.* *2* old residue 62 adding: *711* *62* *Lys* *HG3* *H* *1.59* *.* *2* old residue 62 adding: *712* *62* *Lys* *HD2* *H* *1.65* *.* *2* old residue 62 adding: *713* *62* *Lys* *HD3* *H* *1.65* *.* *2* old residue 62 adding: *714* *62* *Lys* *HE2* *H* *2.93* *.* *2* old residue 62 adding: *715* *62* *Lys* *HE3* *H* *2.93* *.* *2* old residue 62 adding: *716* *62* *Lys* *C* *C* *179.1* *.* *1* old residue 62 adding: *717* *62* *Lys* *CA* *C* *60.1* *.* *1* old residue 62 adding: *718* *62* *Lys* *CB* *C* *32.5* *.* *1* old residue 62 adding: *719* *62* *Lys* *CG* *C* *25.3* *.* *1* old residue 62 adding: *720* *62* *Lys* *CD* *C* *29.5* *.* *1* old residue 62 adding: *721* *62* *Lys* *CE* *C* *42.0* *.* *1* old residue 62 adding: *722* *62* *Lys* *N* *N* *124.0* *.* *1* new residue 63 adding: *723* *63* *Ala* *H* *H* *7.80* *.* *1* old residue 63 adding: *724* *63* *Ala* *HA* *H* *4.07* *.* *1* old residue 63 adding: *725* *63* *Ala* *HB* *H* *1.37* *.* *1* old residue 63 adding: *726* *63* *Ala* *C* *C* *180.4* *.* *1* old residue 63 adding: *727* *63* *Ala* *CA* *C* *54.7* *.* *1* old residue 63 adding: *728* *63* *Ala* *CB* *C* *17.8* *.* *1* old residue 63 adding: *729* *63* *Ala* *N* *N* *121.5* *.* *1* new residue 64 adding: *730* *64* *Leu* *H* *H* *7.85* *.* *1* old residue 64 adding: *731* *64* *Leu* *HA* *H* *3.90* *.* *1* old residue 64 adding: *732* *64* *Leu* *HB2* *H* *1.23* *.* *2* old residue 64 adding: *733* *64* *Leu* *HB3* *H* *1.46* *.* *2* old residue 64 adding: *734* *64* *Leu* *HG* *H* *1.30* *.* *1* old residue 64 adding: *735* *64* *Leu* *HD1* *H* *0.63* *.* *1* old residue 64 adding: *736* *64* *Leu* *HD2* *H* *0.67* *.* *1* old residue 64 adding: *737* *64* *Leu* *C* *C* *178.6* *.* *1* old residue 64 adding: *738* *64* *Leu* *CA* *C* *57.3* *.* *1* old residue 64 adding: *739* *64* *Leu* *CB* *C* *41.9* *.* *1* old residue 64 adding: *740* *64* *Leu* *CG* *C* *26.4* *.* *1* old residue 64 adding: *741* *64* *Leu* *CD1* *C* *24.8* *.* *1* old residue 64 adding: *742* *64* *Leu* *CD2* *C* *26.3* *.* *1* old residue 64 adding: *743* *64* *Leu* *N* *N* *120.1* *.* *1* new residue 65 adding: *744* *65* *Lys* *H* *H* *7.97* *.* *1* old residue 65 adding: *745* *65* *Lys* *HA* *H* *3.73* *.* *1* old residue 65 adding: *746* *65* *Lys* *HB2* *H* *1.90* *.* *2* old residue 65 adding: *747* *65* *Lys* *HB3* *H* *1.90* *.* *2* old residue 65 adding: *748* *65* *Lys* *HG2* *H* *1.43* *.* *2* old residue 65 adding: *749* *65* *Lys* *HG3* *H* *1.43* *.* *2* old residue 65 adding: *750* *65* *Lys* *HD2* *H* *1.70* *.* *2* old residue 65 adding: *751* *65* *Lys* *HD3* *H* *1.70* *.* *2* old residue 65 adding: *752* *65* *Lys* *HE2* *H* *2.89* *.* *2* old residue 65 adding: *753* *65* *Lys* *HE3* *H* *2.89* *.* *2* old residue 65 adding: *754* *65* *Lys* *C* *C* *178.3* *.* *1* old residue 65 adding: *755* *65* *Lys* *CA* *C* *60.4* *.* *1* old residue 65 adding: *756* *65* *Lys* *CB* *C* *31.9* *.* *1* old residue 65 adding: *757* *65* *Lys* *CG* *C* *26.4* *.* *1* old residue 65 adding: *758* *65* *Lys* *CD* *C* *29.3* *.* *1* old residue 65 adding: *759* *65* *Lys* *CE* *C* *41.9* *.* *1* old residue 65 adding: *760* *65* *Lys* *N* *N* *118.1* *.* *1* new residue 66 adding: *761* *66* *Gln* *H* *H* *7.82* *.* *1* old residue 66 adding: *762* *66* *Gln* *HA* *H* *3.95* *.* *1* old residue 66 adding: *763* *66* *Gln* *HB2* *H* *2.04* *.* *2* old residue 66 adding: *764* *66* *Gln* *HB3* *H* *2.10* *.* *2* old residue 66 adding: *765* *66* *Gln* *HG2* *H* *2.33* *.* *2* old residue 66 adding: *766* *66* *Gln* *HG3* *H* *2.40* *.* *2* old residue 66 adding: *767* *66* *Gln* *HE21* *H* *7.63* *.* *1* old residue 66 adding: *768* *66* *Gln* *HE22* *H* *6.80* *.* *1* old residue 66 adding: *769* *66* *Gln* *C* *C* *178.0* *.* *1* old residue 66 adding: *770* *66* *Gln* *CA* *C* *58.7* *.* *1* old residue 66 adding: *771* *66* *Gln* *CB* *C* *28.2* *.* *1* old residue 66 adding: *772* *66* *Gln* *CG* *C* *33.6* *.* *1* old residue 66 adding: *773* *66* *Gln* *CD* *C* *180.0* *.* *1* old residue 66 adding: *774* *66* *Gln* *N* *N* *116.8* *.* *1* old residue 66 adding: *775* *66* *Gln* *NE2* *N* *112.0* *.* *1* new residue 67 adding: *776* *67* *Ser* *H* *H* *8.06* *.* *1* old residue 67 adding: *777* *67* *Ser* *HA* *H* *4.15* *.* *1* old residue 67 adding: *778* *67* *Ser* *HB2* *H* *3.94* *.* *2* old residue 67 adding: *779* *67* *Ser* *HB3* *H* *3.94* *.* *2* old residue 67 adding: *780* *67* *Ser* *C* *C* *176.9* *.* *1* old residue 67 adding: *781* *67* *Ser* *CA* *C* *61.5* *.* *1* old residue 67 adding: *782* *67* *Ser* *CB* *C* *63.0* *.* *1* old residue 67 adding: *783* *67* *Ser* *N* *N* *114.2* *.* *1* new residue 68 adding: *784* *68* *Val* *H* *H* *7.86* *.* *1* old residue 68 adding: *785* *68* *Val* *HA* *H* *3.85* *.* *1* old residue 68 adding: *786* *68* *Val* *HB* *H* *2.09* *.* *1* old residue 68 adding: *787* *68* *Val* *HG1* *H* *0.81* *.* *1* old residue 68 adding: *788* *68* *Val* *HG2* *H* *0.96* *.* *1* old residue 68 adding: *789* *68* *Val* *C* *C* *177.6* *.* *1* old residue 68 adding: *790* *68* *Val* *CA* *C* *64.9* *.* *1* old residue 68 adding: *791* *68* *Val* *CB* *C* *32.0* *.* *1* old residue 68 adding: *792* *68* *Val* *CG1* *C* *21.6* *.* *1* old residue 68 adding: *793* *68* *Val* *CG2* *C* *22.9* *.* *1* old residue 68 adding: *794* *68* *Val* *N* *N* *119.3* *.* *1* new residue 69 adding: *795* *69* *Leu* *H* *H* *7.88* *.* *1* old residue 69 adding: *796* *69* *Leu* *HA* *H* *4.15* *.* *1* old residue 69 adding: *797* *69* *Leu* *HB2* *H* *1.52* *.* *2* old residue 69 adding: *798* *69* *Leu* *HB3* *H* *1.81* *.* *2* old residue 69 adding: *799* *69* *Leu* *HG* *H* *1.70* *.* *1* old residue 69 adding: *800* *69* *Leu* *HD1* *H* *0.86* *.* *1* old residue 69 adding: *801* *69* *Leu* *HD2* *H* *0.79* *.* *1* old residue 69 adding: *802* *69* *Leu* *C* *C* *178.4* *.* *1* old residue 69 adding: *803* *69* *Leu* *CA* *C* *56.5* *.* *1* old residue 69 adding: *804* *69* *Leu* *CB* *C* *41.8* *.* *1* old residue 69 adding: *805* *69* *Leu* *CG* *C* *27.0* *.* *1* old residue 69 adding: *806* *69* *Leu* *CD1* *C* *25.2* *.* *1* old residue 69 adding: *807* *69* *Leu* *CD2* *C* *23.0* *.* *1* old residue 69 adding: *808* *69* *Leu* *N* *N* *119.8* *.* *1* new residue 70 adding: *809* *70* *Glu* *H* *H* *7.82* *.* *1* old residue 70 adding: *810* *70* *Glu* *HA* *H* *4.13* *.* *1* old residue 70 adding: *811* *70* *Glu* *HB2* *H* *1.94* *.* *2* old residue 70 adding: *812* *70* *Glu* *HB3* *H* *1.94* *.* *2* old residue 70 adding: *813* *70* *Glu* *HG2* *H* *2.16* *.* *2* old residue 70 adding: *814* *70* *Glu* *HG3* *H* *2.30* *.* *2* old residue 70 adding: *815* *70* *Glu* *C* *C* *176.7* *.* *1* old residue 70 adding: *816* *70* *Glu* *CA* *C* *56.9* *.* *1* old residue 70 adding: *817* *70* *Glu* *CB* *C* *29.8* *.* *1* old residue 70 adding: *818* *70* *Glu* *CG* *C* *36.1* *.* *1* old residue 70 adding: *819* *70* *Glu* *N* *N* *118.0* *.* *1* new residue 71 adding: *820* *71* *His* *H* *H* *7.95* *.* *1* old residue 71 adding: *821* *71* *His* *HA* *H* *4.46* *.* *1* old residue 71 adding: *822* *71* *His* *HB2* *H* *3.14* *.* *2* old residue 71 adding: *823* *71* *His* *HB3* *H* *3.14* *.* *2* old residue 71 adding: *824* *71* *His* *C* *C* *174.7* *.* *1* old residue 71 adding: *825* *71* *His* *CA* *C* *56.3* *.* *1* old residue 71 adding: *826* *71* *His* *CB* *C* *28.8* *.* *1* old residue 71 adding: *827* *71* *His* *N* *N* *117.8* *.* *1* new residue 72 adding: *828* *72* *His* *H* *H* *8.26* *.* *1* old residue 72 adding: *829* *72* *His* *HA* *H* *4.59* *.* *1* old residue 72 adding: *830* *72* *His* *HB2* *H* *3.04* *.* *2* old residue 72 adding: *831* *72* *His* *HB3* *H* *3.12* *.* *2* old residue 72 adding: *832* *72* *His* *C* *C* *174.5* *.* *1* old residue 72 adding: *833* *72* *His* *CA* *C* *55.7* *.* *1* old residue 72 adding: *834* *72* *His* *CB* *C* *29.6* *.* *1* old residue 72 adding: *835* *72* *His* *N* *N* *119.1* *.* *1* new residue 73 adding: *836* *73* *His* *H* *H* *8.42* *.* *1* old residue 73 adding: *837* *73* *His* *HA* *H* *4.58* *.* *1* old residue 73 adding: *838* *73* *His* *HB2* *H* *3.07* *.* *2* old residue 73 adding: *839* *73* *His* *HB3* *H* *3.07* *.* *2* old residue 73 adding: *840* *73* *His* *C* *C* *174.4* *.* *1* old residue 73 adding: *841* *73* *His* *CA* *C* *55.5* *.* *1* old residue 73 adding: *842* *73* *His* *CB* *C* *29.6* *.* *1* old residue 73 adding: *843* *73* *His* *N* *N* *119.7* *.* *1* new residue 74 adding: *844* *74* *His* *H* *H* *8.47* *.* *1* old residue 74 adding: *845* *74* *His* *HA* *H* *4.57* *.* *1* old residue 74 adding: *846* *74* *His* *HB2* *H* *3.13* *.* *2* old residue 74 adding: *847* *74* *His* *HB3* *H* *3.13* *.* *2* old residue 74 adding: *848* *74* *His* *C* *C* *173.6* *.* *1* old residue 74 adding: *849* *74* *His* *CA* *C* *55.6* *.* *1* old residue 74 adding: *850* *74* *His* *CB* *C* *29.5* *.* *1* old residue 74 adding: *851* *74* *His* *N* *N* *120.5* *.* *1* new residue 75 adding: *852* *75* *His* *H* *H* *8.29* *.* *1* old residue 75 adding: *853* *75* *His* *HA* *H* *4.40* *.* *1* old residue 75 adding: *854* *75* *His* *HB2* *H* *3.07* *.* *2* old residue 75 adding: *855* *75* *His* *HB3* *H* *3.19* *.* *2* old residue 75 adding: *856* *75* *His* *CA* *C* *57.1* *.* *1* old residue 75 adding: *857* *75* *His* *CB* *C* *29.7* *.* *1* old residue 75 adding: *858* *75* *His* *N* *N* *125.4* *.* *1* seqcode size is : 74 seqcode: 33 shift counts are : 7 seqcode: 32 shift counts are : 14 seqcode: 63 shift counts are : 7 seqcode: 21 shift counts are : 8 seqcode: 71 shift counts are : 8 seqcode: 7 shift counts are : 16 seqcode: 26 shift counts are : 11 seqcode: 18 shift counts are : 8 seqcode: 72 shift counts are : 8 seqcode: 16 shift counts are : 14 seqcode: 44 shift counts are : 14 seqcode: 55 shift counts are : 7 seqcode: 74 shift counts are : 8 seqcode: 27 shift counts are : 11 seqcode: 57 shift counts are : 11 seqcode: 61 shift counts are : 10 seqcode: 20 shift counts are : 14 seqcode: 10 shift counts are : 11 seqcode: 31 shift counts are : 8 seqcode: 35 shift counts are : 13 seqcode: 11 shift counts are : 16 seqcode: 48 shift counts are : 10 seqcode: 65 shift counts are : 17 seqcode: 29 shift counts are : 8 seqcode: 50 shift counts are : 11 seqcode: 39 shift counts are : 12 seqcode: 64 shift counts are : 14 seqcode: 58 shift counts are : 8 seqcode: 41 shift counts are : 11 seqcode: 12 shift counts are : 11 seqcode: 15 shift counts are : 14 seqcode: 52 shift counts are : 17 seqcode: 60 shift counts are : 18 seqcode: 56 shift counts are : 11 seqcode: 66 shift counts are : 15 seqcode: 45 shift counts are : 14 seqcode: 73 shift counts are : 8 seqcode: 19 shift counts are : 14 seqcode: 62 shift counts are : 17 seqcode: 54 shift counts are : 11 seqcode: 67 shift counts are : 8 seqcode: 70 shift counts are : 11 seqcode: 68 shift counts are : 11 seqcode: 2 shift counts are : 12 seqcode: 17 shift counts are : 14 seqcode: 30 shift counts are : 12 seqcode: 25 shift counts are : 17 seqcode: 28 shift counts are : 11 seqcode: 75 shift counts are : 7 seqcode: 40 shift counts are : 7 seqcode: 14 shift counts are : 17 seqcode: 69 shift counts are : 14 seqcode: 59 shift counts are : 12 seqcode: 49 shift counts are : 12 seqcode: 24 shift counts are : 11 seqcode: 53 shift counts are : 18 seqcode: 22 shift counts are : 11 seqcode: 42 shift counts are : 9 seqcode: 46 shift counts are : 7 seqcode: 23 shift counts are : 14 seqcode: 13 shift counts are : 11 seqcode: 6 shift counts are : 17 seqcode: 3 shift counts are : 14 seqcode: 36 shift counts are : 8 seqcode: 9 shift counts are : 12 seqcode: 51 shift counts are : 8 seqcode: 47 shift counts are : 15 seqcode: 8 shift counts are : 8 seqcode: 38 shift counts are : 6 seqcode: 4 shift counts are : 11 seqcode: 34 shift counts are : 14 seqcode: 37 shift counts are : 14 seqcode: 43 shift counts are : 12 seqcode: 5 shift counts are : 8 setting ambig code at 377 for HD2 to 2 setting ambig code at 376 for HD1 to 2 setting ambig code at 656 for HG2 to 2 setting ambig code at 655 for HG1 to 2 setting ambig code at 241 for HD2 to 2 setting ambig code at 240 for HD1 to 2 setting ambig code at 550 for HG2 to 2 setting ambig code at 549 for HG1 to 2 setting ambig code at 742 for HD2 to 2 setting ambig code at 741 for HD1 to 2 setting ambig code at 469 for HG2 to 2 setting ambig code at 468 for HG1 to 2 setting ambig code at 135 for HG2 to 2 setting ambig code at 134 for HG1 to 2 setting ambig code at 645 for HG2 to 2 setting ambig code at 644 for HG1 to 2 setting ambig code at 227 for HD2 to 2 setting ambig code at 226 for HD1 to 2 setting ambig code at 627 for HG2 to 2 setting ambig code at 626 for HG1 to 2 setting ambig code at 793 for HG2 to 2 setting ambig code at 792 for HG1 to 2 setting ambig code at 335 for HG2 to 2 setting ambig code at 334 for HG1 to 2 setting ambig code at 807 for HD2 to 2 setting ambig code at 806 for HD1 to 2 setting ambig code at 285 for HG2 to 2 setting ambig code at 284 for HG1 to 2 setting ambig code at 260 for HG2 to 2 setting ambig code at 259 for HG1 to 2 setting ambig code at 274 for HD2 to 2 setting ambig code at 273 for HD1 to 2 setting ambig code at 36 for HG2 to 2 setting ambig code at 35 for HG1 to 2 setting ambig code at 398 for HD2 to 2 setting ambig code at 397 for HD1 to 2 setting ambig code at 433 for HD2 to 2 setting ambig code at 432 for HD1 to 2 1 2 PRO HA H 4.40 . 1 2 2 PRO HB2 H 1.97 . 2 3 2 PRO HB3 H 2.42 . 2 4 2 PRO HG2 H 1.97 . 2 5 2 PRO HG3 H 2.03 . 2 6 2 PRO HD2 H 3.37 . 2 7 2 PRO HD3 H 3.37 . 2 8 2 PRO C C 172.3 . 1 9 2 PRO CA C 62.2 . 1 10 2 PRO CB C 32.6 . 1 11 2 PRO CG C 26.3 . 1 12 2 PRO CD C 49.3 . 1 13 3 ILE H H 8.63 . 1 14 3 ILE HA H 4.19 . 1 15 3 ILE HB H 1.80 . 1 16 3 ILE HG12 H 1.16 . 2 17 3 ILE HG13 H 1.46 . 2 18 3 ILE HG2 H 0.87 . 1 19 3 ILE HD1 H 0.83 . 1 20 3 ILE C C 176.1 . 1 21 3 ILE CA C 61.5 . 1 22 3 ILE CB C 38.6 . 1 23 3 ILE CG1 C 27.2 . 1 24 3 ILE CG2 C 17.4 . 1 25 3 ILE CD1 C 12.8 . 1 26 3 ILE N N 120.7 . 1 27 4 VAL H H 8.38 . 1 28 4 VAL HA H 4.14 . 1 29 4 VAL HB H 2.01 . 1 30 4 VAL HG1 H 0.93 . 2 31 4 VAL HG2 H 0.91 . 2 32 4 VAL C C 175.8 . 1 33 4 VAL CA C 62.1 . 1 34 4 VAL CB C 32.8 . 1 35 4 VAL CG1 C 22.6 . 2 36 4 VAL CG2 C 20.5 . 2 37 4 VAL N N 125.5 . 1 38 5 SER H H 8.45 . 1 39 5 SER HA H 4.42 . 1 40 5 SER HB2 H 3.75 . 2 41 5 SER HB3 H 3.83 . 2 42 5 SER C C 174.3 . 1 43 5 SER CA C 57.9 . 1 44 5 SER CB C 64.0 . 1 45 5 SER N N 120.5 . 1 46 6 LYS H H 8.33 . 1 47 6 LYS HA H 4.15 . 1 48 6 LYS HB2 H 1.58 . 2 49 6 LYS HB3 H 1.58 . 2 50 6 LYS HG2 H 1.14 . 2 51 6 LYS HG3 H 1.14 . 2 52 6 LYS HD2 H 1.57 . 2 53 6 LYS HD3 H 1.57 . 2 54 6 LYS HE2 H 2.74 . 2 55 6 LYS HE3 H 2.93 . 2 56 6 LYS C C 176.0 . 1 57 6 LYS CA C 56.8 . 1 58 6 LYS CB C 33.0 . 1 59 6 LYS CG C 24.5 . 1 60 6 LYS CD C 28.9 . 1 61 6 LYS CE C 39.2 . 1 62 6 LYS N N 123.4 . 1 63 7 TYR H H 8.15 . 1 64 7 TYR HA H 4.64 . 1 65 7 TYR HB2 H 2.73 . 2 66 7 TYR HB3 H 2.93 . 2 67 7 TYR HD1 H 7.02 . 3 68 7 TYR HD2 H 7.02 . 3 69 7 TYR HE1 H 6.77 . 3 70 7 TYR HE2 H 6.77 . 3 71 7 TYR C C 175.4 . 1 72 7 TYR CA C 56.7 . 1 73 7 TYR CB C 39.3 . 1 74 7 TYR CD1 C 133.1 . 3 75 7 TYR CD2 C 133.1 . 3 76 7 TYR CE1 C 118.0 . 3 77 7 TYR CE2 C 118.0 . 3 78 7 TYR N N 120.0 . 1 79 8 SER H H 8.36 . 1 80 8 SER HA H 4.40 . 1 81 8 SER HB2 H 3.94 . 2 82 8 SER HB3 H 4.15 . 2 83 8 SER C C 174.7 . 1 84 8 SER CA C 57.6 . 1 85 8 SER CB C 64.0 . 1 86 8 SER N N 118.1 . 1 87 9 ASN H H 8.90 . 1 88 9 ASN HA H 4.40 . 1 89 9 ASN HB2 H 2.79 . 2 90 9 ASN HB3 H 2.79 . 2 91 9 ASN HD21 H 7.73 . 1 92 9 ASN HD22 H 6.95 . 1 93 9 ASN C C 176.8 . 1 94 9 ASN CA C 55.9 . 1 95 9 ASN CB C 38.3 . 1 96 9 ASN CG C 176.3 . 1 97 9 ASN N N 122.3 . 1 98 9 ASN ND2 N 113.4 . 1 99 10 GLU H H 8.74 . 1 100 10 GLU HA H 4.00 . 1 101 10 GLU HB2 H 1.95 . 2 102 10 GLU HB3 H 2.00 . 2 103 10 GLU HG2 H 2.31 . 2 104 10 GLU HG3 H 2.31 . 2 105 10 GLU C C 178.5 . 1 106 10 GLU CA C 59.9 . 1 107 10 GLU CB C 29.0 . 1 108 10 GLU CG C 36.6 . 1 109 10 GLU N N 119.0 . 1 110 11 ARG H H 7.75 . 1 111 11 ARG HA H 4.07 . 1 112 11 ARG HB2 H 1.95 . 2 113 11 ARG HB3 H 1.95 . 2 114 11 ARG HG2 H 1.52 . 2 115 11 ARG HG3 H 1.72 . 2 116 11 ARG HD2 H 3.08 . 2 117 11 ARG HD3 H 3.23 . 2 118 11 ARG HE H 7.45 . 1 119 11 ARG C C 178.0 . 1 120 11 ARG CA C 58.8 . 1 121 11 ARG CB C 30.1 . 1 122 11 ARG CG C 27.0 . 1 123 11 ARG CD C 43.5 . 1 124 11 ARG N N 121.5 . 1 125 11 ARG NE N 84.6 . 1 126 12 VAL H H 7.83 . 1 127 12 VAL HA H 3.42 . 1 128 12 VAL HB H 2.09 . 1 129 12 VAL HG1 H 0.90 . 2 130 12 VAL HG2 H 0.96 . 2 131 12 VAL C C 177.4 . 1 132 12 VAL CA C 67.0 . 1 133 12 VAL CB C 32.1 . 1 134 12 VAL CG1 C 21.6 . 2 135 12 VAL CG2 C 23.5 . 2 136 12 VAL N N 118.8 . 1 137 13 GLU H H 8.22 . 1 138 13 GLU HA H 3.89 . 1 139 13 GLU HB2 H 2.00 . 2 140 13 GLU HB3 H 2.00 . 2 141 13 GLU HG2 H 2.25 . 2 142 13 GLU HG3 H 2.39 . 2 143 13 GLU C C 178.9 . 1 144 13 GLU CA C 59.5 . 1 145 13 GLU CB C 29.0 . 1 146 13 GLU CG C 36.2 . 1 147 13 GLU N N 116.8 . 1 148 14 LYS H H 7.60 . 1 149 14 LYS HA H 4.03 . 1 150 14 LYS HB2 H 1.90 . 2 151 14 LYS HB3 H 2.03 . 2 152 14 LYS HG2 H 1.44 . 2 153 14 LYS HG3 H 1.44 . 2 154 14 LYS HD2 H 1.57 . 2 155 14 LYS HD3 H 1.70 . 2 156 14 LYS HE2 H 2.93 . 2 157 14 LYS HE3 H 2.93 . 2 158 14 LYS C C 177.7 . 1 159 14 LYS CA C 59.1 . 1 160 14 LYS CB C 32.1 . 1 161 14 LYS CG C 24.8 . 1 162 14 LYS CD C 28.9 . 1 163 14 LYS CE C 41.9 . 1 164 14 LYS N N 120.4 . 1 165 15 ILE H H 7.83 . 1 166 15 ILE HA H 3.63 . 1 167 15 ILE HB H 2.10 . 1 168 15 ILE HG12 H 0.82 . 2 169 15 ILE HG13 H 1.97 . 2 170 15 ILE HG2 H 0.77 . 1 171 15 ILE HD1 H 0.74 . 1 172 15 ILE C C 178.2 . 1 173 15 ILE CA C 65.7 . 1 174 15 ILE CB C 37.5 . 1 175 15 ILE CG1 C 29.2 . 1 176 15 ILE CG2 C 18.4 . 1 177 15 ILE CD1 C 14.3 . 1 178 15 ILE N N 119.7 . 1 179 16 ILE H H 8.08 . 1 180 16 ILE HA H 3.36 . 1 181 16 ILE HB H 1.79 . 1 182 16 ILE HG12 H 1.14 . 2 183 16 ILE HG13 H 1.88 . 2 184 16 ILE HG2 H 0.76 . 1 185 16 ILE HD1 H 0.83 . 1 186 16 ILE C C 177.5 . 1 187 16 ILE CA C 66.6 . 1 188 16 ILE CB C 38.3 . 1 189 16 ILE CG1 C 29.6 . 1 190 16 ILE CG2 C 17.0 . 1 191 16 ILE CD1 C 15.8 . 1 192 16 ILE N N 117.9 . 1 193 17 GLN H H 8.01 . 1 194 17 GLN HA H 3.83 . 1 195 17 GLN HB2 H 2.17 . 2 196 17 GLN HB3 H 2.17 . 2 197 17 GLN HG2 H 2.39 . 2 198 17 GLN HG3 H 2.45 . 2 199 17 GLN HE21 H 7.81 . 1 200 17 GLN HE22 H 6.84 . 1 201 17 GLN C C 178.0 . 1 202 17 GLN CA C 58.4 . 1 203 17 GLN CB C 28.1 . 1 204 17 GLN CG C 33.9 . 1 205 17 GLN N N 117.9 . 1 206 17 GLN NE2 N 115.5 . 1 207 18 ASP H H 8.71 . 1 208 18 ASP HA H 4.40 . 1 209 18 ASP HB2 H 2.53 . 2 210 18 ASP HB3 H 3.05 . 2 211 18 ASP C C 179.8 . 1 212 18 ASP CA C 57.4 . 1 213 18 ASP CB C 39.9 . 1 214 18 ASP N N 121.0 . 1 215 19 LEU H H 8.26 . 1 216 19 LEU HA H 4.01 . 1 217 19 LEU HB2 H 1.00 . 2 218 19 LEU HB3 H 2.33 . 2 219 19 LEU HG H 2.10 . 1 220 19 LEU HD1 H 0.69 . 2 221 19 LEU HD2 H 0.83 . 2 222 19 LEU C C 178.2 . 1 223 19 LEU CA C 58.1 . 1 224 19 LEU CB C 42.4 . 1 225 19 LEU CG C 26.1 . 1 226 19 LEU CD1 C 26.8 . 2 227 19 LEU CD2 C 24.1 . 2 228 19 LEU N N 120.8 . 1 229 20 LEU H H 8.16 . 1 230 20 LEU HA H 3.94 . 1 231 20 LEU HB2 H 1.40 . 2 232 20 LEU HB3 H 1.92 . 2 233 20 LEU HG H 1.84 . 1 234 20 LEU HD1 H 0.77 . 2 235 20 LEU HD2 H 0.85 . 2 236 20 LEU C C 180.1 . 1 237 20 LEU CA C 57.9 . 1 238 20 LEU CB C 40.8 . 1 239 20 LEU CG C 26.8 . 1 240 20 LEU CD1 C 26.0 . 2 241 20 LEU CD2 C 22.0 . 2 242 20 LEU N N 117.3 . 1 243 21 ASP H H 9.00 . 1 244 21 ASP HA H 4.42 . 1 245 21 ASP HB2 H 2.92 . 2 246 21 ASP HB3 H 2.60 . 2 247 21 ASP C C 179.0 . 1 248 21 ASP CA C 57.3 . 1 249 21 ASP CB C 40.5 . 1 250 21 ASP N N 120.0 . 1 251 22 VAL H H 7.37 . 1 252 22 VAL HA H 3.60 . 1 253 22 VAL HB H 2.42 . 1 254 22 VAL HG1 H 0.94 . 2 255 22 VAL HG2 H 1.09 . 2 256 22 VAL C C 177.7 . 1 257 22 VAL CA C 66.3 . 1 258 22 VAL CB C 32.0 . 1 259 22 VAL CG1 C 22.0 . 2 260 22 VAL CG2 C 22.4 . 2 261 22 VAL N N 119.8 . 1 262 23 LEU H H 6.88 . 1 263 23 LEU HA H 3.88 . 1 264 23 LEU HB2 H 1.39 . 2 265 23 LEU HB3 H 2.17 . 2 266 23 LEU HG H 1.97 . 1 267 23 LEU HD1 H 0.77 . 2 268 23 LEU HD2 H 0.87 . 2 269 23 LEU C C 179.1 . 1 270 23 LEU CA C 57.1 . 1 271 23 LEU CB C 40.6 . 1 272 23 LEU CG C 26.1 . 1 273 23 LEU CD1 C 22.6 . 2 274 23 LEU CD2 C 26.1 . 2 275 23 LEU N N 116.5 . 1 276 24 VAL H H 8.43 . 1 277 24 VAL HA H 3.78 . 1 278 24 VAL HB H 2.11 . 1 279 24 VAL HG1 H 0.93 . 2 280 24 VAL HG2 H 1.05 . 2 281 24 VAL C C 180.8 . 1 282 24 VAL CA C 65.9 . 1 283 24 VAL CB C 32.2 . 1 284 24 VAL CG1 C 21.1 . 2 285 24 VAL CG2 C 22.7 . 2 286 24 VAL N N 120.3 . 1 287 25 LYS H H 8.38 . 1 288 25 LYS HA H 4.03 . 1 289 25 LYS HB2 H 1.92 . 2 290 25 LYS HB3 H 1.92 . 2 291 25 LYS HG2 H 1.47 . 2 292 25 LYS HG3 H 1.55 . 2 293 25 LYS HD2 H 1.65 . 2 294 25 LYS HD3 H 1.65 . 2 295 25 LYS HE2 H 2.91 . 2 296 25 LYS HE3 H 2.91 . 2 297 25 LYS C C 178.5 . 1 298 25 LYS CA C 59.4 . 1 299 25 LYS CB C 32.3 . 1 300 25 LYS CG C 25.3 . 1 301 25 LYS CD C 29.2 . 1 302 25 LYS CE C 42.0 . 1 303 25 LYS N N 121.9 . 1 304 26 GLU H H 7.36 . 1 305 26 GLU HA H 4.33 . 1 306 26 GLU HB2 H 1.79 . 2 307 26 GLU HB3 H 2.30 . 2 308 26 GLU HG2 H 2.30 . 2 309 26 GLU HG3 H 2.45 . 2 310 26 GLU C C 175.0 . 1 311 26 GLU CA C 56.0 . 1 312 26 GLU CB C 29.8 . 1 313 26 GLU CG C 35.4 . 1 314 26 GLU N N 115.0 . 1 315 27 GLU H H 7.98 . 1 316 27 GLU HA H 3.95 . 1 317 27 GLU HB2 H 2.15 . 2 318 27 GLU HB3 H 2.15 . 2 319 27 GLU HG2 H 2.19 . 2 320 27 GLU HG3 H 2.19 . 2 321 27 GLU C C 175.9 . 1 322 27 GLU CA C 56.9 . 1 323 27 GLU CB C 27.1 . 1 324 27 GLU CG C 36.6 . 1 325 27 GLU N N 116.3 . 1 326 28 VAL H H 7.37 . 1 327 28 VAL HA H 4.20 . 1 328 28 VAL HB H 2.13 . 1 329 28 VAL HG1 H 0.93 . 2 330 28 VAL HG2 H 0.61 . 2 331 28 VAL C C 176.7 . 1 332 28 VAL CA C 61.6 . 1 333 28 VAL CB C 32.6 . 1 334 28 VAL CG1 C 22.6 . 2 335 28 VAL CG2 C 25.4 . 2 336 28 VAL N N 112.2 . 1 337 29 THR H H 7.40 . 1 338 29 THR HA H 4.64 . 1 339 29 THR HB H 4.66 . 1 340 29 THR HG2 H 1.44 . 1 341 29 THR CA C 59.9 . 1 342 29 THR CB C 67.9 . 1 343 29 THR CG2 C 22.7 . 1 344 29 THR N N 113.9 . 1 345 30 PRO HA H 4.13 . 1 346 30 PRO HB2 H 1.84 . 2 347 30 PRO HB3 H 2.10 . 2 348 30 PRO HG2 H 2.03 . 2 349 30 PRO HG3 H 2.12 . 2 350 30 PRO HD2 H 3.84 . 2 351 30 PRO HD3 H 3.92 . 2 352 30 PRO C C 177.6 . 1 353 30 PRO CA C 66.3 . 1 354 30 PRO CB C 31.5 . 1 355 30 PRO CG C 27.9 . 1 356 30 PRO CD C 50.2 . 1 357 31 ASP H H 8.39 . 1 358 31 ASP HA H 4.24 . 1 359 31 ASP HB2 H 2.55 . 2 360 31 ASP HB3 H 2.67 . 2 361 31 ASP C C 178.9 . 1 362 31 ASP CA C 57.0 . 1 363 31 ASP CB C 40.0 . 1 364 31 ASP N N 113.2 . 1 365 32 LEU H H 7.46 . 1 366 32 LEU HA H 4.19 . 1 367 32 LEU HB2 H 1.62 . 2 368 32 LEU HB3 H 1.31 . 2 369 32 LEU HG H 1.34 . 1 370 32 LEU HD1 H 0.71 . 2 371 32 LEU HD2 H 0.62 . 2 372 32 LEU C C 178.9 . 1 373 32 LEU CA C 57.0 . 1 374 32 LEU CB C 41.3 . 1 375 32 LEU CG C 27.0 . 1 376 32 LEU CD1 C 24.0 . 2 377 32 LEU CD2 C 25.4 . 2 378 32 LEU N N 123.0 . 1 379 33 ALA H H 8.93 . 1 380 33 ALA HA H 3.73 . 1 381 33 ALA HB H 1.48 . 1 382 33 ALA C C 179.8 . 1 383 33 ALA CA C 55.9 . 1 384 33 ALA CB C 19.1 . 1 385 33 ALA N N 122.7 . 1 386 34 LEU H H 8.42 . 1 387 34 LEU HA H 4.01 . 1 388 34 LEU HB2 H 1.57 . 2 389 34 LEU HB3 H 1.98 . 2 390 34 LEU HG H 1.83 . 1 391 34 LEU HD1 H 0.66 . 2 392 34 LEU HD2 H 0.53 . 2 393 34 LEU C C 179.7 . 1 394 34 LEU CA C 58.2 . 1 395 34 LEU CB C 41.2 . 1 396 34 LEU CG C 26.9 . 1 397 34 LEU CD1 C 25.6 . 2 398 34 LEU CD2 C 23.6 . 2 399 34 LEU N N 115.8 . 1 400 35 MET H H 7.73 . 1 401 35 MET HA H 4.24 . 1 402 35 MET HB2 H 2.31 . 2 403 35 MET HB3 H 2.31 . 2 404 35 MET HG2 H 2.42 . 2 405 35 MET HG3 H 2.70 . 2 406 35 MET HE H 2.06 . 1 407 35 MET C C 179.5 . 1 408 35 MET CA C 59.3 . 1 409 35 MET CB C 32.9 . 1 410 35 MET CG C 31.6 . 1 411 35 MET CE C 17.3 . 1 412 35 MET N N 121.4 . 1 413 36 CYS H H 8.42 . 1 414 36 CYS HA H 3.95 . 1 415 36 CYS HB2 H 2.42 . 2 416 36 CYS HB3 H 2.96 . 2 417 36 CYS C C 177.0 . 1 418 36 CYS CA C 64.2 . 1 419 36 CYS CB C 27.2 . 1 420 36 CYS N N 118.6 . 1 421 37 LEU H H 9.02 . 1 422 37 LEU HA H 3.94 . 1 423 37 LEU HB2 H 1.31 . 2 424 37 LEU HB3 H 2.03 . 2 425 37 LEU HG H 1.73 . 1 426 37 LEU HD1 H 0.67 . 2 427 37 LEU HD2 H 0.87 . 2 428 37 LEU C C 179.1 . 1 429 37 LEU CA C 58.3 . 1 430 37 LEU CB C 42.2 . 1 431 37 LEU CG C 27.7 . 1 432 37 LEU CD1 C 26.0 . 2 433 37 LEU CD2 C 24.2 . 2 434 37 LEU N N 119.6 . 1 435 38 GLY H H 8.94 . 1 436 38 GLY HA2 H 3.61 . 2 437 38 GLY HA3 H 3.97 . 2 438 38 GLY C C 179.8 . 1 439 38 GLY CA C 47.9 . 1 440 38 GLY N N 106.6 . 1 441 39 ASN H H 7.79 . 1 442 39 ASN HA H 4.44 . 1 443 39 ASN HB2 H 2.62 . 2 444 39 ASN HB3 H 2.77 . 2 445 39 ASN HD21 H 7.15 . 2 446 39 ASN HD22 H 7.15 . 2 447 39 ASN C C 178.0 . 1 448 39 ASN CA C 56.3 . 1 449 39 ASN CB C 39.5 . 1 450 39 ASN CG C 175.8 . 1 451 39 ASN N N 120.9 . 1 452 39 ASN ND2 N 111.8 . 1 453 40 ALA H H 8.26 . 1 454 40 ALA HA H 3.97 . 1 455 40 ALA HB H 1.47 . 1 456 40 ALA C C 178.2 . 1 457 40 ALA CA C 55.9 . 1 458 40 ALA CB C 17.2 . 1 459 40 ALA N N 123.9 . 1 460 41 VAL H H 8.41 . 1 461 41 VAL HA H 3.18 . 1 462 41 VAL HB H 2.23 . 1 463 41 VAL HG1 H 0.29 . 2 464 41 VAL HG2 H 0.97 . 2 465 41 VAL C C 177.8 . 1 466 41 VAL CA C 67.0 . 1 467 41 VAL CB C 30.9 . 1 468 41 VAL CG1 C 22.3 . 2 469 41 VAL CG2 C 24.6 . 2 470 41 VAL N N 116.9 . 1 471 42 THR H H 8.21 . 1 472 42 THR HA H 3.43 . 1 473 42 THR HB H 4.20 . 1 474 42 THR HG2 H 1.05 . 1 475 42 THR C C 175.9 . 1 476 42 THR CA C 67.5 . 1 477 42 THR CB C 68.0 . 1 478 42 THR CG2 C 21.6 . 1 479 42 THR N N 114.8 . 1 480 43 ASN H H 7.60 . 1 481 43 ASN HA H 4.17 . 1 482 43 ASN HB2 H 2.76 . 2 483 43 ASN HB3 H 2.81 . 2 484 43 ASN HD21 H 7.04 . 1 485 43 ASN HD22 H 6.95 . 1 486 43 ASN C C 177.3 . 1 487 43 ASN CA C 57.0 . 1 488 43 ASN CB C 39.4 . 1 489 43 ASN CG C 175.5 . 1 490 43 ASN N N 120.3 . 1 491 43 ASN ND2 N 112.1 . 1 492 44 ILE H H 7.63 . 1 493 44 ILE HA H 3.77 . 1 494 44 ILE HB H 2.03 . 1 495 44 ILE HG12 H 1.01 . 2 496 44 ILE HG13 H 1.66 . 2 497 44 ILE HG2 H 0.77 . 1 498 44 ILE HD1 H 0.57 . 1 499 44 ILE C C 179.2 . 1 500 44 ILE CA C 62.1 . 1 501 44 ILE CB C 35.7 . 1 502 44 ILE CG1 C 27.0 . 1 503 44 ILE CG2 C 18.2 . 1 504 44 ILE CD1 C 9.1 . 1 505 44 ILE N N 119.7 . 1 506 45 ILE H H 8.46 . 1 507 45 ILE HA H 3.55 . 1 508 45 ILE HB H 1.72 . 1 509 45 ILE HG12 H 0.85 . 2 510 45 ILE HG13 H 1.70 . 2 511 45 ILE HG2 H 0.79 . 1 512 45 ILE HD1 H 0.48 . 1 513 45 ILE C C 177.1 . 1 514 45 ILE CA C 65.1 . 1 515 45 ILE CB C 36.6 . 1 516 45 ILE CG1 C 29.9 . 1 517 45 ILE CG2 C 18.0 . 1 518 45 ILE CD1 C 13.4 . 1 519 45 ILE N N 120.3 . 1 520 46 ALA H H 7.75 . 1 521 46 ALA HA H 3.95 . 1 522 46 ALA HB H 1.34 . 1 523 46 ALA C C 178.0 . 1 524 46 ALA CA C 54.0 . 1 525 46 ALA CB C 17.9 . 1 526 46 ALA N N 120.0 . 1 527 47 GLN H H 7.61 . 1 528 47 GLN HA H 4.19 . 1 529 47 GLN HB2 H 2.16 . 2 530 47 GLN HB3 H 2.30 . 2 531 47 GLN HG2 H 2.35 . 2 532 47 GLN HG3 H 2.60 . 2 533 47 GLN HE21 H 7.15 . 1 534 47 GLN HE22 H 6.82 . 1 535 47 GLN C C 177.1 . 1 536 47 GLN CA C 56.0 . 1 537 47 GLN CB C 29.0 . 1 538 47 GLN CG C 33.9 . 1 539 47 GLN CD C 180.3 . 1 540 47 GLN N N 114.0 . 1 541 47 GLN NE2 N 111.6 . 1 542 48 VAL H H 7.74 . 1 543 48 VAL HA H 4.39 . 1 544 48 VAL HB H 2.52 . 1 545 48 VAL HG1 H 1.05 . 2 546 48 VAL HG2 H 1.07 . 2 547 48 VAL CA C 59.9 . 1 548 48 VAL CB C 31.9 . 1 549 48 VAL CG1 C 20.4 . 2 550 48 VAL CG2 C 21.0 . 2 551 48 VAL N N 122.4 . 1 552 49 PRO HA H 4.34 . 1 553 49 PRO HB2 H 1.72 . 2 554 49 PRO HB3 H 2.44 . 2 555 49 PRO HG2 H 2.07 . 2 556 49 PRO HG3 H 2.07 . 2 557 49 PRO HD2 H 3.56 . 2 558 49 PRO HD3 H 3.94 . 2 559 49 PRO C C 177.7 . 1 560 49 PRO CA C 63.7 . 1 561 49 PRO CB C 32.3 . 1 562 49 PRO CG C 27.9 . 1 563 49 PRO CD C 50.9 . 1 564 50 GLU H H 8.96 . 1 565 50 GLU HA H 3.58 . 1 566 50 GLU HB2 H 2.06 . 2 567 50 GLU HB3 H 2.06 . 2 568 50 GLU HG2 H 2.32 . 2 569 50 GLU HG3 H 2.32 . 2 570 50 GLU C C 178.3 . 1 571 50 GLU CA C 60.8 . 1 572 50 GLU CB C 29.9 . 1 573 50 GLU CG C 36.1 . 1 574 50 GLU N N 124.4 . 1 575 51 SER H H 8.64 . 1 576 51 SER HA H 4.24 . 1 577 51 SER HB2 H 3.95 . 2 578 51 SER HB3 H 4.00 . 2 579 51 SER C C 175.2 . 1 580 51 SER CA C 60.6 . 1 581 51 SER CB C 62.6 . 1 582 51 SER N N 112.0 . 1 583 52 LYS H H 7.95 . 1 584 52 LYS HA H 4.65 . 1 585 52 LYS HB2 H 1.64 . 2 586 52 LYS HB3 H 1.98 . 2 587 52 LYS HG2 H 1.42 . 2 588 52 LYS HG3 H 1.42 . 2 589 52 LYS HD2 H 1.57 . 2 590 52 LYS HD3 H 1.64 . 2 591 52 LYS HE2 H 2.92 . 2 592 52 LYS HE3 H 2.92 . 2 593 52 LYS C C 176.7 . 1 594 52 LYS CA C 55.5 . 1 595 52 LYS CB C 34.0 . 1 596 52 LYS CG C 25.1 . 1 597 52 LYS CD C 28.8 . 1 598 52 LYS CE C 42.0 . 1 599 52 LYS N N 119.6 . 1 600 53 ARG H H 7.29 . 1 601 53 ARG HA H 3.53 . 1 602 53 ARG HB2 H 1.54 . 2 603 53 ARG HB3 H 1.80 . 2 604 53 ARG HG2 H 1.53 . 2 605 53 ARG HG3 H 1.87 . 2 606 53 ARG HD2 H 3.05 . 2 607 53 ARG HD3 H 3.14 . 2 608 53 ARG HE H 6.84 . 1 609 53 ARG HH21 H 6.50 . 2 610 53 ARG HH22 H 7.22 . 2 611 53 ARG C C 177.3 . 1 612 53 ARG CA C 61.7 . 1 613 53 ARG CB C 30.8 . 1 614 53 ARG CG C 28.5 . 1 615 53 ARG CD C 44.2 . 1 616 53 ARG N N 119.0 . 1 617 53 ARG NE N 84.9 . 1 618 54 VAL H H 8.44 . 1 619 54 VAL HA H 3.46 . 1 620 54 VAL HB H 1.95 . 1 621 54 VAL HG1 H 0.86 . 2 622 54 VAL HG2 H 0.96 . 2 623 54 VAL C C 177.4 . 1 624 54 VAL CA C 67.2 . 1 625 54 VAL CB C 31.0 . 1 626 54 VAL CG1 C 21.2 . 2 627 54 VAL CG2 C 23.5 . 2 628 54 VAL N N 118.4 . 1 629 55 ALA H H 8.12 . 1 630 55 ALA HA H 4.18 . 1 631 55 ALA HB H 1.44 . 1 632 55 ALA C C 180.7 . 1 633 55 ALA CA C 55.0 . 1 634 55 ALA CB C 17.9 . 1 635 55 ALA N N 122.3 . 1 636 56 VAL H H 8.04 . 1 637 56 VAL HA H 3.78 . 1 638 56 VAL HB H 2.12 . 1 639 56 VAL HG1 H 0.89 . 2 640 56 VAL HG2 H 1.12 . 2 641 56 VAL C C 179.4 . 1 642 56 VAL CA C 66.7 . 1 643 56 VAL CB C 31.4 . 1 644 56 VAL CG1 C 21.9 . 2 645 56 VAL CG2 C 23.6 . 2 646 56 VAL N N 117.9 . 1 647 57 VAL H H 8.51 . 1 648 57 VAL HA H 3.76 . 1 649 57 VAL HB H 2.21 . 1 650 57 VAL HG1 H 1.05 . 2 651 57 VAL HG2 H 0.98 . 2 652 57 VAL C C 177.9 . 1 653 57 VAL CA C 66.7 . 1 654 57 VAL CB C 31.4 . 1 655 57 VAL CG1 C 21.5 . 2 656 57 VAL CG2 C 24.7 . 2 657 57 VAL N N 121.6 . 1 658 58 ASP H H 8.80 . 1 659 58 ASP HA H 4.42 . 1 660 58 ASP HB2 H 2.83 . 2 661 58 ASP HB3 H 2.64 . 2 662 58 ASP C C 178.5 . 1 663 58 ASP CA C 57.8 . 1 664 58 ASP CB C 40.0 . 1 665 58 ASP N N 124.8 . 1 666 59 ASN H H 8.50 . 1 667 59 ASN HA H 4.46 . 1 668 59 ASN HB2 H 2.86 . 2 669 59 ASN HB3 H 2.96 . 2 670 59 ASN HD21 H 7.73 . 1 671 59 ASN HD22 H 7.02 . 1 672 59 ASN C C 177.7 . 1 673 59 ASN CA C 56.5 . 1 674 59 ASN CB C 38.3 . 1 675 59 ASN CG C 176.0 . 1 676 59 ASN N N 118.8 . 1 677 59 ASN ND2 N 113.0 . 1 678 60 PHE H H 8.54 . 1 679 60 PHE HA H 4.21 . 1 680 60 PHE HB2 H 3.28 . 2 681 60 PHE HB3 H 3.29 . 2 682 60 PHE HD1 H 7.16 . 3 683 60 PHE HD2 H 7.16 . 3 684 60 PHE HE1 H 7.38 . 3 685 60 PHE HE2 H 7.38 . 3 686 60 PHE HZ H 6.90 . 1 687 60 PHE C C 177.7 . 1 688 60 PHE CA C 61.6 . 1 689 60 PHE CB C 39.8 . 1 690 60 PHE CD1 C 132.1 . 3 691 60 PHE CD2 C 132.1 . 3 692 60 PHE CE1 C 131.0 . 3 693 60 PHE CE2 C 131.0 . 3 694 60 PHE CZ C 128.6 . 1 695 60 PHE N N 121.8 . 1 696 61 THR H H 8.82 . 1 697 61 THR HA H 3.82 . 1 698 61 THR HB H 4.45 . 1 699 61 THR HG1 H 5.11 . 1 700 61 THR HG2 H 1.51 . 1 701 61 THR C C 176.7 . 1 702 61 THR CA C 66.2 . 1 703 61 THR CB C 68.4 . 1 704 61 THR CG2 C 23.0 . 1 705 61 THR N N 112.2 . 1 706 62 LYS H H 8.19 . 1 707 62 LYS HA H 4.01 . 1 708 62 LYS HB2 H 1.88 . 2 709 62 LYS HB3 H 1.95 . 2 710 62 LYS HG2 H 1.37 . 2 711 62 LYS HG3 H 1.59 . 2 712 62 LYS HD2 H 1.65 . 2 713 62 LYS HD3 H 1.65 . 2 714 62 LYS HE2 H 2.93 . 2 715 62 LYS HE3 H 2.93 . 2 716 62 LYS C C 179.1 . 1 717 62 LYS CA C 60.1 . 1 718 62 LYS CB C 32.5 . 1 719 62 LYS CG C 25.3 . 1 720 62 LYS CD C 29.5 . 1 721 62 LYS CE C 42.0 . 1 722 62 LYS N N 124.0 . 1 723 63 ALA H H 7.80 . 1 724 63 ALA HA H 4.07 . 1 725 63 ALA HB H 1.37 . 1 726 63 ALA C C 180.4 . 1 727 63 ALA CA C 54.7 . 1 728 63 ALA CB C 17.8 . 1 729 63 ALA N N 121.5 . 1 730 64 LEU H H 7.85 . 1 731 64 LEU HA H 3.90 . 1 732 64 LEU HB2 H 1.23 . 2 733 64 LEU HB3 H 1.46 . 2 734 64 LEU HG H 1.30 . 1 735 64 LEU HD1 H 0.63 . 2 736 64 LEU HD2 H 0.67 . 2 737 64 LEU C C 178.6 . 1 738 64 LEU CA C 57.3 . 1 739 64 LEU CB C 41.9 . 1 740 64 LEU CG C 26.4 . 1 741 64 LEU CD1 C 24.8 . 2 742 64 LEU CD2 C 26.3 . 2 743 64 LEU N N 120.1 . 1 744 65 LYS H H 7.97 . 1 745 65 LYS HA H 3.73 . 1 746 65 LYS HB2 H 1.90 . 2 747 65 LYS HB3 H 1.90 . 2 748 65 LYS HG2 H 1.43 . 2 749 65 LYS HG3 H 1.43 . 2 750 65 LYS HD2 H 1.70 . 2 751 65 LYS HD3 H 1.70 . 2 752 65 LYS HE2 H 2.89 . 2 753 65 LYS HE3 H 2.89 . 2 754 65 LYS C C 178.3 . 1 755 65 LYS CA C 60.4 . 1 756 65 LYS CB C 31.9 . 1 757 65 LYS CG C 26.4 . 1 758 65 LYS CD C 29.3 . 1 759 65 LYS CE C 41.9 . 1 760 65 LYS N N 118.1 . 1 761 66 GLN H H 7.82 . 1 762 66 GLN HA H 3.95 . 1 763 66 GLN HB2 H 2.04 . 2 764 66 GLN HB3 H 2.10 . 2 765 66 GLN HG2 H 2.33 . 2 766 66 GLN HG3 H 2.40 . 2 767 66 GLN HE21 H 7.63 . 1 768 66 GLN HE22 H 6.80 . 1 769 66 GLN C C 178.0 . 1 770 66 GLN CA C 58.7 . 1 771 66 GLN CB C 28.2 . 1 772 66 GLN CG C 33.6 . 1 773 66 GLN CD C 180.0 . 1 774 66 GLN N N 116.8 . 1 775 66 GLN NE2 N 112.0 . 1 776 67 SER H H 8.06 . 1 777 67 SER HA H 4.15 . 1 778 67 SER HB2 H 3.94 . 2 779 67 SER HB3 H 3.94 . 2 780 67 SER C C 176.9 . 1 781 67 SER CA C 61.5 . 1 782 67 SER CB C 63.0 . 1 783 67 SER N N 114.2 . 1 784 68 VAL H H 7.86 . 1 785 68 VAL HA H 3.85 . 1 786 68 VAL HB H 2.09 . 1 787 68 VAL HG1 H 0.81 . 2 788 68 VAL HG2 H 0.96 . 2 789 68 VAL C C 177.6 . 1 790 68 VAL CA C 64.9 . 1 791 68 VAL CB C 32.0 . 1 792 68 VAL CG1 C 21.6 . 2 793 68 VAL CG2 C 22.9 . 2 794 68 VAL N N 119.3 . 1 795 69 LEU H H 7.88 . 1 796 69 LEU HA H 4.15 . 1 797 69 LEU HB2 H 1.52 . 2 798 69 LEU HB3 H 1.81 . 2 799 69 LEU HG H 1.70 . 1 800 69 LEU HD1 H 0.86 . 2 801 69 LEU HD2 H 0.79 . 2 802 69 LEU C C 178.4 . 1 803 69 LEU CA C 56.5 . 1 804 69 LEU CB C 41.8 . 1 805 69 LEU CG C 27.0 . 1 806 69 LEU CD1 C 25.2 . 2 807 69 LEU CD2 C 23.0 . 2 808 69 LEU N N 119.8 . 1 809 70 GLU H H 7.82 . 1 810 70 GLU HA H 4.13 . 1 811 70 GLU HB2 H 1.94 . 2 812 70 GLU HB3 H 1.94 . 2 813 70 GLU HG2 H 2.16 . 2 814 70 GLU HG3 H 2.30 . 2 815 70 GLU C C 176.7 . 1 816 70 GLU CA C 56.9 . 1 817 70 GLU CB C 29.8 . 1 818 70 GLU CG C 36.1 . 1 819 70 GLU N N 118.0 . 1 820 71 HIS H H 7.95 . 1 821 71 HIS HA H 4.46 . 1 822 71 HIS HB2 H 3.14 . 2 823 71 HIS HB3 H 3.14 . 2 824 71 HIS C C 174.7 . 1 825 71 HIS CA C 56.3 . 1 826 71 HIS CB C 28.8 . 1 827 71 HIS N N 117.8 . 1 828 72 HIS H H 8.26 . 1 829 72 HIS HA H 4.59 . 1 830 72 HIS HB2 H 3.04 . 2 831 72 HIS HB3 H 3.12 . 2 832 72 HIS C C 174.5 . 1 833 72 HIS CA C 55.7 . 1 834 72 HIS CB C 29.6 . 1 835 72 HIS N N 119.1 . 1 836 73 HIS H H 8.42 . 1 837 73 HIS HA H 4.58 . 1 838 73 HIS HB2 H 3.07 . 2 839 73 HIS HB3 H 3.07 . 2 840 73 HIS C C 174.4 . 1 841 73 HIS CA C 55.5 . 1 842 73 HIS CB C 29.6 . 1 843 73 HIS N N 119.7 . 1 844 74 HIS H H 8.47 . 1 845 74 HIS HA H 4.57 . 1 846 74 HIS HB2 H 3.13 . 2 847 74 HIS HB3 H 3.13 . 2 848 74 HIS C C 173.6 . 1 849 74 HIS CA C 55.6 . 1 850 74 HIS CB C 29.5 . 1 851 74 HIS N N 120.5 . 1 852 75 HIS H H 8.29 . 1 853 75 HIS HA H 4.40 . 1 854 75 HIS HB2 H 3.07 . 2 855 75 HIS HB3 H 3.19 . 2 856 75 HIS CA C 57.1 . 1 857 75 HIS CB C 29.7 . 1 858 75 HIS N N 125.4 . 1 cwd: /data/PSVS/PSVS-v1.4-dev/results/CSR4_NMR_em_bcr3 command to execute is: /farm/software/asdp/asdp-1.0-release/bin//../bin/noesyassign -c /data/PSVS/PSVS-v1.4-dev/results/CSR4_NMR_em_bcr3/rpf_calc/input/ctrl_file -o rpf_calc -q CSR4_NMR_em_bcr3.pdb.iupac 2>&1| ASDP Version 1.0 Copyright(C) 2010 Center for Advanced Biotechnology and Medicine (CABM) Rutgers University Reading Control_File ...  Doing SimpleMatch for n.peaks ...   Doing SimpleMatch for ali.peaks ...   Doing SimpleMatch for aro.peaks ...   Reading ComparePdbFile: CSR4_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: CSR4_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: CSR4_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: CSR4_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: CSR4_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: CSR4_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: CSR4_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: CSR4_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: CSR4_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: CSR4_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: CSR4_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: CSR4_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: CSR4_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: CSR4_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: CSR4_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: CSR4_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: CSR4_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: CSR4_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: CSR4_NMR_em_bcr3.pdb.iupac  Reading ComparePdbFile: CSR4_NMR_em_bcr3.pdb.iupac  quality-estimation for n.peaks ...   Doing Recall analysis for n.peaks ...  Doing Precision analysis for n.peaks ...  Doing Recall analysis for n.peaks ...  Doing Precision analysis for n.peaks ... prtSimleMatchPeakAtom for n.peaks ...   quality-estimation for ali.peaks ...   quality-estimation for aro.peaks ...   Doing Recall analysis for aro.peaks ...  Doing Precision analysis for aro.peaks ...  Doing Recall analysis for aro.peaks ...  Doing Precision analysis for aro.peaks ... prtSimleMatchPeakAtom for aro.peaks ...