AS object created. control filepath is: /data/PSVS/PSVS-v1.4-dev/results/SSR10_R3_em_bcr3/rpf_calc/input/ctrl_file bmrb: chem_shift.bmrb sequence: SSR10_R3_em_bcr3_seq.bmrb parsing bmrb: /data/PSVS/PSVS-v1.4-dev/results/SSR10_R3_em_bcr3/rpf_calc/input/chem_shift.bmrb new residue 1 adding: *1* *1* *Met* *C* *C* *177.6* *.* *1* new residue 2 adding: *2* *2* *Ser* *H* *H* *8.27* *.* *1* old residue 2 adding: *3* *2* *Ser* *HA* *H* *4.51* *.* *1* old residue 2 adding: *4* *2* *Ser* *HB2* *H* *3.92* *.* *2* old residue 2 adding: *5* *2* *Ser* *HB3* *H* *3.80* *.* *2* old residue 2 adding: *6* *2* *Ser* *C* *C* *174.3* *.* *1* old residue 2 adding: *7* *2* *Ser* *CA* *C* *58.2* *.* *1* old residue 2 adding: *8* *2* *Ser* *CB* *C* *64.0* *.* *1* old residue 2 adding: *9* *2* *Ser* *N* *N* *115.9* *.* *1* new residue 3 adding: *10* *3* *Ile* *H* *H* *8.15* *.* *1* old residue 3 adding: *11* *3* *Ile* *HA* *H* *4.24* *.* *1* old residue 3 adding: *12* *3* *Ile* *HB* *H* *1.82* *.* *1* old residue 3 adding: *13* *3* *Ile* *HG12* *H* *1.46* *.* *2* old residue 3 adding: *14* *3* *Ile* *HG13* *H* *1.15* *.* *2* old residue 3 adding: *15* *3* *Ile* *HG2* *H* *0.90* *.* *1* old residue 3 adding: *16* *3* *Ile* *HD1* *H* *0.81* *.* *1* old residue 3 adding: *17* *3* *Ile* *C* *C* *176.1* *.* *1* old residue 3 adding: *18* *3* *Ile* *CA* *C* *61.3* *.* *1* old residue 3 adding: *19* *3* *Ile* *CB* *C* *38.9* *.* *1* old residue 3 adding: *20* *3* *Ile* *CG1* *C* *27.2* *.* *1* old residue 3 adding: *21* *3* *Ile* *CG2* *C* *17.9* *.* *1* old residue 3 adding: *22* *3* *Ile* *CD1* *C* *13.2* *.* *1* old residue 3 adding: *23* *3* *Ile* *N* *N* *121.7* *.* *1* new residue 4 adding: *24* *4* *Ser* *H* *H* *8.58* *.* *1* old residue 4 adding: *25* *4* *Ser* *HA* *H* *4.53* *.* *1* old residue 4 adding: *26* *4* *Ser* *HB2* *H* *3.76* *.* *2* old residue 4 adding: *27* *4* *Ser* *HB3* *H* *3.76* *.* *2* old residue 4 adding: *28* *4* *Ser* *C* *C* *174.1* *.* *1* old residue 4 adding: *29* *4* *Ser* *CA* *C* *58.6* *.* *1* old residue 4 adding: *30* *4* *Ser* *CB* *C* *64.2* *.* *1* old residue 4 adding: *31* *4* *Ser* *N* *N* *120.4* *.* *1* new residue 5 adding: *32* *5* *Thr* *H* *H* *8.11* *.* *1* old residue 5 adding: *33* *5* *Thr* *HA* *H* *4.53* *.* *1* old residue 5 adding: *34* *5* *Thr* *HB* *H* *4.37* *.* *1* old residue 5 adding: *35* *5* *Thr* *HG2* *H* *1.23* *.* *1* old residue 5 adding: *36* *5* *Thr* *C* *C* *175.2* *.* *1* old residue 5 adding: *37* *5* *Thr* *CA* *C* *61.0* *.* *1* old residue 5 adding: *38* *5* *Thr* *CB* *C* *71.8* *.* *1* old residue 5 adding: *39* *5* *Thr* *CG2* *C* *22.1* *.* *1* old residue 5 adding: *40* *5* *Thr* *N* *N* *114.0* *.* *1* new residue 6 adding: *41* *6* *Ser* *H* *H* *8.78* *.* *1* old residue 6 adding: *42* *6* *Ser* *HA* *H* *3.96* *.* *1* old residue 6 adding: *43* *6* *Ser* *HB2* *H* *3.73* *.* *2* old residue 6 adding: *44* *6* *Ser* *HB3* *H* *3.71* *.* *2* old residue 6 adding: *45* *6* *Ser* *C* *C* *175.9* *.* *1* old residue 6 adding: *46* *6* *Ser* *CA* *C* *61.0* *.* *1* old residue 6 adding: *47* *6* *Ser* *CB* *C* *62.1* *.* *1* old residue 6 adding: *48* *6* *Ser* *N* *N* *118.6* *.* *1* new residue 7 adding: *49* *7* *Ala* *H* *H* *7.95* *.* *1* old residue 7 adding: *50* *7* *Ala* *HA* *H* *4.15* *.* *1* old residue 7 adding: *51* *7* *Ala* *HB* *H* *1.41* *.* *1* old residue 7 adding: *52* *7* *Ala* *C* *C* *178.2* *.* *1* old residue 7 adding: *53* *7* *Ala* *CA* *C* *56.0* *.* *1* old residue 7 adding: *54* *7* *Ala* *CB* *C* *18.6* *.* *1* old residue 7 adding: *55* *7* *Ala* *N* *N* *121.5* *.* *1* new residue 8 adding: *56* *8* *Glu* *H* *H* *7.51* *.* *1* old residue 8 adding: *57* *8* *Glu* *HA* *H* *3.92* *.* *1* old residue 8 adding: *58* *8* *Glu* *HB2* *H* *2.16* *.* *2* old residue 8 adding: *59* *8* *Glu* *HB3* *H* *2.16* *.* *2* old residue 8 adding: *60* *8* *Glu* *HG2* *H* *2.06* *.* *2* old residue 8 adding: *61* *8* *Glu* *HG3* *H* *2.18* *.* *2* old residue 8 adding: *62* *8* *Glu* *C* *C* *178.7* *.* *1* old residue 8 adding: *63* *8* *Glu* *CA* *C* *59.1* *.* *1* old residue 8 adding: *64* *8* *Glu* *CB* *C* *30.7* *.* *1* old residue 8 adding: *65* *8* *Glu* *CG* *C* *37.5* *.* *1* old residue 8 adding: *66* *8* *Glu* *N* *N* *114.5* *.* *1* new residue 9 adding: *67* *9* *Val* *H* *H* *7.83* *.* *1* old residue 9 adding: *68* *9* *Val* *HA* *H* *3.58* *.* *1* old residue 9 adding: *69* *9* *Val* *HB* *H* *1.85* *.* *1* old residue 9 adding: *70* *9* *Val* *HG1* *H* *0.89* *.* *2* old residue 9 adding: *71* *9* *Val* *HG2* *H* *0.68* *.* *2* old residue 9 adding: *72* *9* *Val* *C* *C* *179.2* *.* *1* old residue 9 adding: *73* *9* *Val* *CA* *C* *66.6* *.* *1* old residue 9 adding: *74* *9* *Val* *CB* *C* *31.4* *.* *1* old residue 9 adding: *75* *9* *Val* *CG1* *C* *22.5* *.* *1* old residue 9 adding: *76* *9* *Val* *CG2* *C* *20.7* *.* *1* old residue 9 adding: *77* *9* *Val* *N* *N* *121.6* *.* *1* new residue 10 adding: *78* *10* *Tyr* *H* *H* *8.18* *.* *1* old residue 10 adding: *79* *10* *Tyr* *HA* *H* *4.48* *.* *1* old residue 10 adding: *80* *10* *Tyr* *HB2* *H* *3.44* *.* *2* old residue 10 adding: *81* *10* *Tyr* *HB3* *H* *2.73* *.* *2* old residue 10 adding: *82* *10* *Tyr* *HD1* *H* *6.97* *.* *3* old residue 10 adding: *83* *10* *Tyr* *HD2* *H* *6.97* *.* *3* old residue 10 adding: *84* *10* *Tyr* *HE1* *H* *6.79* *.* *3* old residue 10 adding: *85* *10* *Tyr* *HE2* *H* *6.79* *.* *3* old residue 10 adding: *86* *10* *Tyr* *C* *C* *177.6* *.* *1* old residue 10 adding: *87* *10* *Tyr* *CA* *C* *60.1* *.* *1* old residue 10 adding: *88* *10* *Tyr* *CB* *C* *36.9* *.* *1* old residue 10 adding: *89* *10* *Tyr* *CD1* *C* *131.8* *.* *1* old residue 10 adding: *90* *10* *Tyr* *CE1* *C* *117.5* *.* *1* old residue 10 adding: *91* *10* *Tyr* *N* *N* *117.8* *.* *1* new residue 11 adding: *92* *11* *Tyr* *H* *H* *8.11* *.* *1* old residue 11 adding: *93* *11* *Tyr* *HA* *H* *3.74* *.* *1* old residue 11 adding: *94* *11* *Tyr* *HB2* *H* *3.05* *.* *2* old residue 11 adding: *95* *11* *Tyr* *HB3* *H* *3.31* *.* *2* old residue 11 adding: *96* *11* *Tyr* *HD1* *H* *7.07* *.* *3* old residue 11 adding: *97* *11* *Tyr* *HD2* *H* *7.07* *.* *3* old residue 11 adding: *98* *11* *Tyr* *HE1* *H* *6.79* *.* *3* old residue 11 adding: *99* *11* *Tyr* *HE2* *H* *6.79* *.* *3* old residue 11 adding: *100* *11* *Tyr* *C* *C* *176.2* *.* *1* old residue 11 adding: *101* *11* *Tyr* *CA* *C* *63.3* *.* *1* old residue 11 adding: *102* *11* *Tyr* *CB* *C* *38.9* *.* *1* old residue 11 adding: *103* *11* *Tyr* *CD1* *C* *132.0* *.* *1* old residue 11 adding: *104* *11* *Tyr* *CE1* *C* *117.9* *.* *1* old residue 11 adding: *105* *11* *Tyr* *N* *N* *120.0* *.* *1* new residue 12 adding: *106* *12* *Glu* *H* *H* *8.31* *.* *1* old residue 12 adding: *107* *12* *Glu* *HA* *H* *3.97* *.* *1* old residue 12 adding: *108* *12* *Glu* *HB2* *H* *2.24* *.* *2* old residue 12 adding: *109* *12* *Glu* *HB3* *H* *2.17* *.* *2* old residue 12 adding: *110* *12* *Glu* *HG2* *H* *2.61* *.* *2* old residue 12 adding: *111* *12* *Glu* *HG3* *H* *2.61* *.* *2* old residue 12 adding: *112* *12* *Glu* *C* *C* *179.7* *.* *1* old residue 12 adding: *113* *12* *Glu* *CA* *C* *59.0* *.* *1* old residue 12 adding: *114* *12* *Glu* *CB* *C* *28.0* *.* *1* old residue 12 adding: *115* *12* *Glu* *CG* *C* *34.4* *.* *1* old residue 12 adding: *116* *12* *Glu* *N* *N* *117.6* *.* *1* new residue 13 adding: *117* *13* *Glu* *H* *H* *8.27* *.* *1* old residue 13 adding: *118* *13* *Glu* *HA* *H* *3.82* *.* *1* old residue 13 adding: *119* *13* *Glu* *HB2* *H* *1.83* *.* *2* old residue 13 adding: *120* *13* *Glu* *HB3* *H* *2.39* *.* *2* old residue 13 adding: *121* *13* *Glu* *HG2* *H* *2.26* *.* *2* old residue 13 adding: *122* *13* *Glu* *HG3* *H* *2.71* *.* *2* old residue 13 adding: *123* *13* *Glu* *C* *C* *178.9* *.* *1* old residue 13 adding: *124* *13* *Glu* *CA* *C* *58.7* *.* *1* old residue 13 adding: *125* *13* *Glu* *CB* *C* *28.9* *.* *1* old residue 13 adding: *126* *13* *Glu* *CG* *C* *34.9* *.* *1* old residue 13 adding: *127* *13* *Glu* *N* *N* *119.8* *.* *1* new residue 14 adding: *128* *14* *Ala* *H* *H* *8.21* *.* *1* old residue 14 adding: *129* *14* *Ala* *HA* *H* *3.67* *.* *1* old residue 14 adding: *130* *14* *Ala* *HB* *H* *0.35* *.* *1* old residue 14 adding: *131* *14* *Ala* *C* *C* *178.8* *.* *1* old residue 14 adding: *132* *14* *Ala* *CA* *C* *56.1* *.* *1* old residue 14 adding: *133* *14* *Ala* *CB* *C* *17.5* *.* *1* old residue 14 adding: *134* *14* *Ala* *N* *N* *123.3* *.* *1* new residue 15 adding: *135* *15* *Glu* *H* *H* *7.94* *.* *1* old residue 15 adding: *136* *15* *Glu* *HA* *H* *3.96* *.* *1* old residue 15 adding: *137* *15* *Glu* *HB2* *H* *2.32* *.* *2* old residue 15 adding: *138* *15* *Glu* *HB3* *H* *1.99* *.* *2* old residue 15 adding: *139* *15* *Glu* *HG2* *H* *2.25* *.* *2* old residue 15 adding: *140* *15* *Glu* *HG3* *H* *1.93* *.* *2* old residue 15 adding: *141* *15* *Glu* *C* *C* *180.1* *.* *1* old residue 15 adding: *142* *15* *Glu* *CA* *C* *58.7* *.* *1* old residue 15 adding: *143* *15* *Glu* *CB* *C* *30.2* *.* *1* old residue 15 adding: *144* *15* *Glu* *CG* *C* *38.0* *.* *1* old residue 15 adding: *145* *15* *Glu* *N* *N* *116.7* *.* *1* new residue 16 adding: *146* *16* *Glu* *H* *H* *7.68* *.* *1* old residue 16 adding: *147* *16* *Glu* *HA* *H* *4.05* *.* *1* old residue 16 adding: *148* *16* *Glu* *HB2* *H* *1.99* *.* *2* old residue 16 adding: *149* *16* *Glu* *HB3* *H* *1.86* *.* *2* old residue 16 adding: *150* *16* *Glu* *HG2* *H* *2.34* *.* *2* old residue 16 adding: *151* *16* *Glu* *HG3* *H* *2.15* *.* *2* old residue 16 adding: *152* *16* *Glu* *C* *C* *179.9* *.* *1* old residue 16 adding: *153* *16* *Glu* *CA* *C* *58.9* *.* *1* old residue 16 adding: *154* *16* *Glu* *CB* *C* *28.1* *.* *1* old residue 16 adding: *155* *16* *Glu* *CG* *C* *34.6* *.* *1* old residue 16 adding: *156* *16* *Glu* *N* *N* *120.7* *.* *1* new residue 17 adding: *157* *17* *Phe* *H* *H* *8.03* *.* *1* old residue 17 adding: *158* *17* *Phe* *HA* *H* *4.37* *.* *1* old residue 17 adding: *159* *17* *Phe* *HB2* *H* *2.83* *.* *2* old residue 17 adding: *160* *17* *Phe* *HB3* *H* *3.57* *.* *2* old residue 17 adding: *161* *17* *Phe* *HD1* *H* *7.10* *.* *3* old residue 17 adding: *162* *17* *Phe* *HD2* *H* *7.10* *.* *3* old residue 17 adding: *163* *17* *Phe* *HE1* *H* *7.21* *.* *3* old residue 17 adding: *164* *17* *Phe* *HE2* *H* *7.21* *.* *3* old residue 17 adding: *165* *17* *Phe* *C* *C* *178.6* *.* *1* old residue 17 adding: *166* *17* *Phe* *CA* *C* *62.0* *.* *1* old residue 17 adding: *167* *17* *Phe* *CB* *C* *37.8* *.* *1* old residue 17 adding: *168* *17* *Phe* *CD1* *C* *130.7* *.* *1* old residue 17 adding: *169* *17* *Phe* *CE1* *C* *130.8* *.* *1* old residue 17 adding: *170* *17* *Phe* *N* *N* *119.5* *.* *1* new residue 18 adding: *171* *18* *Leu* *H* *H* *9.12* *.* *1* old residue 18 adding: *172* *18* *Leu* *HA* *H* *3.79* *.* *1* old residue 18 adding: *173* *18* *Leu* *HB2* *H* *1.60* *.* *2* old residue 18 adding: *174* *18* *Leu* *HB3* *H* *2.13* *.* *2* old residue 18 adding: *175* *18* *Leu* *HG* *H* *1.61* *.* *1* old residue 18 adding: *176* *18* *Leu* *HD1* *H* *1.04* *.* *2* old residue 18 adding: *177* *18* *Leu* *HD2* *H* *0.92* *.* *2* old residue 18 adding: *178* *18* *Leu* *C* *C* *180.6* *.* *1* old residue 18 adding: *179* *18* *Leu* *CA* *C* *58.7* *.* *1* old residue 18 adding: *180* *18* *Leu* *CB* *C* *41.6* *.* *1* old residue 18 adding: *181* *18* *Leu* *CG* *C* *26.9* *.* *1* old residue 18 adding: *182* *18* *Leu* *CD1* *C* *26.8* *.* *1* old residue 18 adding: *183* *18* *Leu* *CD2* *C* *24.3* *.* *1* old residue 18 adding: *184* *18* *Leu* *N* *N* *122.2* *.* *1* new residue 19 adding: *185* *19* *Ser* *H* *H* *8.18* *.* *1* old residue 19 adding: *186* *19* *Ser* *HA* *H* *4.21* *.* *1* old residue 19 adding: *187* *19* *Ser* *HB2* *H* *4.04* *.* *2* old residue 19 adding: *188* *19* *Ser* *HB3* *H* *4.04* *.* *2* old residue 19 adding: *189* *19* *Ser* *C* *C* *175.6* *.* *1* old residue 19 adding: *190* *19* *Ser* *CA* *C* *61.3* *.* *1* old residue 19 adding: *191* *19* *Ser* *CB* *C* *62.8* *.* *1* old residue 19 adding: *192* *19* *Ser* *N* *N* *115.9* *.* *1* new residue 20 adding: *193* *20* *Lys* *H* *H* *7.41* *.* *1* old residue 20 adding: *194* *20* *Lys* *HA* *H* *4.45* *.* *1* old residue 20 adding: *195* *20* *Lys* *HB2* *H* *1.95* *.* *2* old residue 20 adding: *196* *20* *Lys* *HB3* *H* *2.12* *.* *2* old residue 20 adding: *197* *20* *Lys* *HG2* *H* *1.61* *.* *2* old residue 20 adding: *198* *20* *Lys* *HG3* *H* *1.61* *.* *2* old residue 20 adding: *199* *20* *Lys* *HD2* *H* *1.70* *.* *2* old residue 20 adding: *200* *20* *Lys* *HD3* *H* *1.70* *.* *2* old residue 20 adding: *201* *20* *Lys* *HE2* *H* *2.93* *.* *2* old residue 20 adding: *202* *20* *Lys* *HE3* *H* *2.93* *.* *2* old residue 20 adding: *203* *20* *Lys* *C* *C* *176.8* *.* *1* old residue 20 adding: *204* *20* *Lys* *CA* *C* *56.0* *.* *1* old residue 20 adding: *205* *20* *Lys* *CB* *C* *33.1* *.* *1* old residue 20 adding: *206* *20* *Lys* *CG* *C* *25.1* *.* *1* old residue 20 adding: *207* *20* *Lys* *CD* *C* *29.3* *.* *1* old residue 20 adding: *208* *20* *Lys* *CE* *C* *42.1* *.* *1* old residue 20 adding: *209* *20* *Lys* *N* *N* *118.7* *.* *1* new residue 21 adding: *210* *21* *Gly* *H* *H* *8.02* *.* *1* old residue 21 adding: *211* *21* *Gly* *HA2* *H* *4.29* *.* *2* old residue 21 adding: *212* *21* *Gly* *HA3* *H* *3.72* *.* *2* old residue 21 adding: *213* *21* *Gly* *C* *C* *173.9* *.* *1* old residue 21 adding: *214* *21* *Gly* *CA* *C* *45.5* *.* *1* old residue 21 adding: *215* *21* *Gly* *N* *N* *107.9* *.* *1* new residue 22 adding: *216* *22* *Asp* *H* *H* *8.20* *.* *1* old residue 22 adding: *217* *22* *Asp* *HA* *H* *4.92* *.* *1* old residue 22 adding: *218* *22* *Asp* *HB2* *H* *3.09* *.* *2* old residue 22 adding: *219* *22* *Asp* *HB3* *H* *2.58* *.* *2* old residue 22 adding: *220* *22* *Asp* *C* *C* *175.6* *.* *1* old residue 22 adding: *221* *22* *Asp* *CA* *C* *51.6* *.* *1* old residue 22 adding: *222* *22* *Asp* *CB* *C* *38.8* *.* *1* old residue 22 adding: *223* *22* *Asp* *N* *N* *121.8* *.* *1* new residue 23 adding: *224* *23* *Leu* *H* *H* *7.89* *.* *1* old residue 23 adding: *225* *23* *Leu* *HA* *H* *3.89* *.* *1* old residue 23 adding: *226* *23* *Leu* *HB2* *H* *1.91* *.* *2* old residue 23 adding: *227* *23* *Leu* *HB3* *H* *1.40* *.* *2* old residue 23 adding: *228* *23* *Leu* *HG* *H* *1.76* *.* *1* old residue 23 adding: *229* *23* *Leu* *HD1* *H* *0.87* *.* *2* old residue 23 adding: *230* *23* *Leu* *HD2* *H* *0.77* *.* *2* old residue 23 adding: *231* *23* *Leu* *C* *C* *178.8* *.* *1* old residue 23 adding: *232* *23* *Leu* *CA* *C* *58.1* *.* *1* old residue 23 adding: *233* *23* *Leu* *CB* *C* *41.6* *.* *1* old residue 23 adding: *234* *23* *Leu* *CG* *C* *27.3* *.* *1* old residue 23 adding: *235* *23* *Leu* *CD1* *C* *25.3* *.* *1* old residue 23 adding: *236* *23* *Leu* *CD2* *C* *23.1* *.* *1* old residue 23 adding: *237* *23* *Leu* *N* *N* *121.7* *.* *1* new residue 24 adding: *238* *24* *Val* *H* *H* *8.25* *.* *1* old residue 24 adding: *239* *24* *Val* *HA* *H* *3.48* *.* *1* old residue 24 adding: *240* *24* *Val* *HB* *H* *1.99* *.* *1* old residue 24 adding: *241* *24* *Val* *HG1* *H* *0.86* *.* *2* old residue 24 adding: *242* *24* *Val* *HG2* *H* *1.05* *.* *2* old residue 24 adding: *243* *24* *Val* *C* *C* *178.5* *.* *1* old residue 24 adding: *244* *24* *Val* *CA* *C* *67.2* *.* *1* old residue 24 adding: *245* *24* *Val* *CB* *C* *31.9* *.* *1* old residue 24 adding: *246* *24* *Val* *CG1* *C* *21.0* *.* *1* old residue 24 adding: *247* *24* *Val* *CG2* *C* *23.0* *.* *1* old residue 24 adding: *248* *24* *Val* *N* *N* *119.7* *.* *1* new residue 25 adding: *249* *25* *Gln* *H* *H* *7.42* *.* *1* old residue 25 adding: *250* *25* *Gln* *HA* *H* *3.76* *.* *1* old residue 25 adding: *251* *25* *Gln* *HB2* *H* *0.53* *.* *2* old residue 25 adding: *252* *25* *Gln* *HB3* *H* *0.73* *.* *2* old residue 25 adding: *253* *25* *Gln* *HG2* *H* *1.77* *.* *2* old residue 25 adding: *254* *25* *Gln* *HG3* *H* *2.09* *.* *2* old residue 25 adding: *255* *25* *Gln* *HE21* *H* *7.67* *.* *2* old residue 25 adding: *256* *25* *Gln* *HE22* *H* *6.72* *.* *2* old residue 25 adding: *257* *25* *Gln* *C* *C* *178.9* *.* *1* old residue 25 adding: *258* *25* *Gln* *CA* *C* *58.8* *.* *1* old residue 25 adding: *259* *25* *Gln* *CB* *C* *26.7* *.* *1* old residue 25 adding: *260* *25* *Gln* *CG* *C* *35.3* *.* *1* old residue 25 adding: *261* *25* *Gln* *N* *N* *116.2* *.* *1* old residue 25 adding: *262* *25* *Gln* *NE2* *N* *113.7* *.* *1* new residue 26 adding: *263* *26* *Ala* *H* *H* *7.98* *.* *1* old residue 26 adding: *264* *26* *Ala* *HA* *H* *3.87* *.* *1* old residue 26 adding: *265* *26* *Ala* *HB* *H* *1.52* *.* *1* old residue 26 adding: *266* *26* *Ala* *C* *C* *178.1* *.* *1* old residue 26 adding: *267* *26* *Ala* *CA* *C* *56.2* *.* *1* old residue 26 adding: *268* *26* *Ala* *CB* *C* *17.7* *.* *1* old residue 26 adding: *269* *26* *Ala* *N* *N* *119.8* *.* *1* new residue 27 adding: *270* *27* *Cys* *H* *H* *8.35* *.* *1* old residue 27 adding: *271* *27* *Cys* *HA* *H* *4.10* *.* *1* old residue 27 adding: *272* *27* *Cys* *HB2* *H* *3.18* *.* *2* old residue 27 adding: *273* *27* *Cys* *HB3* *H* *2.94* *.* *2* old residue 27 adding: *274* *27* *Cys* *C* *C* *176.1* *.* *1* old residue 27 adding: *275* *27* *Cys* *CA* *C* *66.5* *.* *1* old residue 27 adding: *276* *27* *Cys* *CB* *C* *26.8* *.* *1* old residue 27 adding: *277* *27* *Cys* *N* *N* *114.1* *.* *1* new residue 28 adding: *278* *28* *Glu* *H* *H* *7.17* *.* *1* old residue 28 adding: *279* *28* *Glu* *HA* *H* *4.48* *.* *1* old residue 28 adding: *280* *28* *Glu* *HB2* *H* *1.82* *.* *2* old residue 28 adding: *281* *28* *Glu* *HB3* *H* *1.82* *.* *2* old residue 28 adding: *282* *28* *Glu* *HG2* *H* *2.28* *.* *2* old residue 28 adding: *283* *28* *Glu* *HG3* *H* *2.02* *.* *2* old residue 28 adding: *284* *28* *Glu* *C* *C* *179.2* *.* *1* old residue 28 adding: *285* *28* *Glu* *CA* *C* *57.9* *.* *1* old residue 28 adding: *286* *28* *Glu* *CB* *C* *28.8* *.* *1* old residue 28 adding: *287* *28* *Glu* *CG* *C* *34.2* *.* *1* old residue 28 adding: *288* *28* *Glu* *N* *N* *116.6* *.* *1* new residue 29 adding: *289* *29* *Lys* *H* *H* *7.81* *.* *1* old residue 29 adding: *290* *29* *Lys* *HA* *H* *4.05* *.* *1* old residue 29 adding: *291* *29* *Lys* *HB2* *H* *2.17* *.* *2* old residue 29 adding: *292* *29* *Lys* *HB3* *H* *1.87* *.* *2* old residue 29 adding: *293* *29* *Lys* *HG2* *H* *1.46* *.* *2* old residue 29 adding: *294* *29* *Lys* *HG3* *H* *1.37* *.* *2* old residue 29 adding: *295* *29* *Lys* *HD2* *H* *1.61* *.* *2* old residue 29 adding: *296* *29* *Lys* *HD3* *H* *1.61* *.* *2* old residue 29 adding: *297* *29* *Lys* *HE2* *H* *2.93* *.* *2* old residue 29 adding: *298* *29* *Lys* *HE3* *H* *2.93* *.* *2* old residue 29 adding: *299* *29* *Lys* *C* *C* *178.6* *.* *1* old residue 29 adding: *300* *29* *Lys* *CA* *C* *58.0* *.* *1* old residue 29 adding: *301* *29* *Lys* *CB* *C* *31.6* *.* *1* old residue 29 adding: *302* *29* *Lys* *CG* *C* *26.4* *.* *1* old residue 29 adding: *303* *29* *Lys* *CD* *C* *28.8* *.* *1* old residue 29 adding: *304* *29* *Lys* *CE* *C* *41.8* *.* *1* old residue 29 adding: *305* *29* *Lys* *N* *N* *118.9* *.* *1* new residue 30 adding: *306* *30* *Tyr* *H* *H* *9.08* *.* *1* old residue 30 adding: *307* *30* *Tyr* *HA* *H* *4.29* *.* *1* old residue 30 adding: *308* *30* *Tyr* *HB2* *H* *3.05* *.* *2* old residue 30 adding: *309* *30* *Tyr* *HB3* *H* *3.05* *.* *2* old residue 30 adding: *310* *30* *Tyr* *HD1* *H* *7.02* *.* *3* old residue 30 adding: *311* *30* *Tyr* *HD2* *H* *7.02* *.* *3* old residue 30 adding: *312* *30* *Tyr* *HE1* *H* *6.78* *.* *3* old residue 30 adding: *313* *30* *Tyr* *HE2* *H* *6.78* *.* *3* old residue 30 adding: *314* *30* *Tyr* *C* *C* *178.4* *.* *1* old residue 30 adding: *315* *30* *Tyr* *CA* *C* *62.0* *.* *1* old residue 30 adding: *316* *30* *Tyr* *CB* *C* *38.8* *.* *1* old residue 30 adding: *317* *30* *Tyr* *CD1* *C* *132.2* *.* *1* old residue 30 adding: *318* *30* *Tyr* *CE1* *C* *117.5* *.* *1* old residue 30 adding: *319* *30* *Tyr* *N* *N* *120.5* *.* *1* new residue 31 adding: *320* *31* *Tyr* *H* *H* *8.23* *.* *1* old residue 31 adding: *321* *31* *Tyr* *HA* *H* *4.07* *.* *1* old residue 31 adding: *322* *31* *Tyr* *HB2* *H* *3.14* *.* *2* old residue 31 adding: *323* *31* *Tyr* *HB3* *H* *2.98* *.* *2* old residue 31 adding: *324* *31* *Tyr* *HD1* *H* *6.75* *.* *3* old residue 31 adding: *325* *31* *Tyr* *HD2* *H* *6.75* *.* *3* old residue 31 adding: *326* *31* *Tyr* *HE1* *H* *6.52* *.* *3* old residue 31 adding: *327* *31* *Tyr* *HE2* *H* *6.52* *.* *3* old residue 31 adding: *328* *31* *Tyr* *C* *C* *176.7* *.* *1* old residue 31 adding: *329* *31* *Tyr* *CA* *C* *62.3* *.* *1* old residue 31 adding: *330* *31* *Tyr* *CB* *C* *37.3* *.* *1* old residue 31 adding: *331* *31* *Tyr* *CD1* *C* *132.3* *.* *1* old residue 31 adding: *332* *31* *Tyr* *CE1* *C* *118.0* *.* *1* old residue 31 adding: *333* *31* *Tyr* *N* *N* *118.8* *.* *1* new residue 32 adding: *334* *32* *Lys* *H* *H* *8.11* *.* *1* old residue 32 adding: *335* *32* *Lys* *HA* *H* *3.71* *.* *1* old residue 32 adding: *336* *32* *Lys* *HB2* *H* *1.41* *.* *2* old residue 32 adding: *337* *32* *Lys* *HB3* *H* *1.03* *.* *2* old residue 32 adding: *338* *32* *Lys* *HG2* *H* *1.30* *.* *2* old residue 32 adding: *339* *32* *Lys* *HG3* *H* *1.20* *.* *2* old residue 32 adding: *340* *32* *Lys* *HD2* *H* *1.26* *.* *2* old residue 32 adding: *341* *32* *Lys* *HD3* *H* *1.40* *.* *2* old residue 32 adding: *342* *32* *Lys* *HE2* *H* *2.76* *.* *2* old residue 32 adding: *343* *32* *Lys* *HE3* *H* *2.76* *.* *2* old residue 32 adding: *344* *32* *Lys* *C* *C* *178.9* *.* *1* old residue 32 adding: *345* *32* *Lys* *CA* *C* *58.6* *.* *1* old residue 32 adding: *346* *32* *Lys* *CB* *C* *31.0* *.* *1* old residue 32 adding: *347* *32* *Lys* *CG* *C* *25.0* *.* *1* old residue 32 adding: *348* *32* *Lys* *CD* *C* *28.4* *.* *1* old residue 32 adding: *349* *32* *Lys* *CE* *C* *41.9* *.* *1* old residue 32 adding: *350* *32* *Lys* *N* *N* *118.9* *.* *1* new residue 33 adding: *351* *33* *Ala* *H* *H* *8.37* *.* *1* old residue 33 adding: *352* *33* *Ala* *HA* *H* *4.17* *.* *1* old residue 33 adding: *353* *33* *Ala* *HB* *H* *1.81* *.* *1* old residue 33 adding: *354* *33* *Ala* *C* *C* *178.9* *.* *1* old residue 33 adding: *355* *33* *Ala* *CA* *C* *56.0* *.* *1* old residue 33 adding: *356* *33* *Ala* *CB* *C* *18.2* *.* *1* old residue 33 adding: *357* *33* *Ala* *N* *N* *121.2* *.* *1* new residue 34 adding: *358* *34* *Ala* *H* *H* *7.97* *.* *1* old residue 34 adding: *359* *34* *Ala* *HA* *H* *3.99* *.* *1* old residue 34 adding: *360* *34* *Ala* *HB* *H* *1.67* *.* *1* old residue 34 adding: *361* *34* *Ala* *C* *C* *178.9* *.* *1* old residue 34 adding: *362* *34* *Ala* *CA* *C* *54.9* *.* *1* old residue 34 adding: *363* *34* *Ala* *CB* *C* *20.3* *.* *1* old residue 34 adding: *364* *34* *Ala* *N* *N* *119.3* *.* *1* new residue 35 adding: *365* *35* *Glu* *H* *H* *8.92* *.* *1* old residue 35 adding: *366* *35* *Glu* *HA* *H* *3.67* *.* *1* old residue 35 adding: *367* *35* *Glu* *HB2* *H* *1.86* *.* *2* old residue 35 adding: *368* *35* *Glu* *HB3* *H* *1.88* *.* *2* old residue 35 adding: *369* *35* *Glu* *HG2* *H* *2.06* *.* *2* old residue 35 adding: *370* *35* *Glu* *HG3* *H* *1.81* *.* *2* old residue 35 adding: *371* *35* *Glu* *C* *C* *178.5* *.* *1* old residue 35 adding: *372* *35* *Glu* *CA* *C* *59.9* *.* *1* old residue 35 adding: *373* *35* *Glu* *CB* *C* *29.6* *.* *1* old residue 35 adding: *374* *35* *Glu* *CG* *C* *36.0* *.* *1* old residue 35 adding: *375* *35* *Glu* *N* *N* *119.1* *.* *1* new residue 36 adding: *376* *36* *Glu* *H* *H* *8.37* *.* *1* old residue 36 adding: *377* *36* *Glu* *HA* *H* *3.79* *.* *1* old residue 36 adding: *378* *36* *Glu* *HB2* *H* *2.17* *.* *2* old residue 36 adding: *379* *36* *Glu* *HB3* *H* *2.05* *.* *2* old residue 36 adding: *380* *36* *Glu* *HG2* *H* *2.66* *.* *2* old residue 36 adding: *381* *36* *Glu* *HG3* *H* *2.27* *.* *2* old residue 36 adding: *382* *36* *Glu* *C* *C* *179.1* *.* *1* old residue 36 adding: *383* *36* *Glu* *CA* *C* *58.1* *.* *1* old residue 36 adding: *384* *36* *Glu* *CB* *C* *28.6* *.* *1* old residue 36 adding: *385* *36* *Glu* *CG* *C* *36.8* *.* *1* old residue 36 adding: *386* *36* *Glu* *N* *N* *115.9* *.* *1* new residue 37 adding: *387* *37* *Ala* *H* *H* *8.44* *.* *1* old residue 37 adding: *388* *37* *Ala* *HA* *H* *3.87* *.* *1* old residue 37 adding: *389* *37* *Ala* *HB* *H* *1.52* *.* *1* old residue 37 adding: *390* *37* *Ala* *C* *C* *178.6* *.* *1* old residue 37 adding: *391* *37* *Ala* *CA* *C* *55.4* *.* *1* old residue 37 adding: *392* *37* *Ala* *CB* *C* *18.7* *.* *1* old residue 37 adding: *393* *37* *Ala* *N* *N* *123.7* *.* *1* new residue 38 adding: *394* *38* *Ile* *H* *H* *8.21* *.* *1* old residue 38 adding: *395* *38* *Ile* *HA* *H* *3.60* *.* *1* old residue 38 adding: *396* *38* *Ile* *HB* *H* *1.92* *.* *1* old residue 38 adding: *397* *38* *Ile* *HG12* *H* *0.87* *.* *2* old residue 38 adding: *398* *38* *Ile* *HG13* *H* *1.71* *.* *2* old residue 38 adding: *399* *38* *Ile* *HG2* *H* *0.43* *.* *1* old residue 38 adding: *400* *38* *Ile* *HD1* *H* *0.40* *.* *1* old residue 38 adding: *401* *38* *Ile* *C* *C* *177.7* *.* *1* old residue 38 adding: *402* *38* *Ile* *CA* *C* *62.2* *.* *1* old residue 38 adding: *403* *38* *Ile* *CB* *C* *34.4* *.* *1* old residue 38 adding: *404* *38* *Ile* *CG1* *C* *27.4* *.* *1* old residue 38 adding: *405* *38* *Ile* *CG2* *C* *18.2* *.* *1* old residue 38 adding: *406* *38* *Ile* *CD1* *C* *9.0* *.* *1* old residue 38 adding: *407* *38* *Ile* *N* *N* *117.3* *.* *1* new residue 39 adding: *408* *39* *Lys* *H* *H* *7.84* *.* *1* old residue 39 adding: *409* *39* *Lys* *HA* *H* *3.34* *.* *1* old residue 39 adding: *410* *39* *Lys* *HB2* *H* *1.37* *.* *2* old residue 39 adding: *411* *39* *Lys* *HB3* *H* *1.37* *.* *2* old residue 39 adding: *412* *39* *Lys* *HG2* *H* *1.38* *.* *2* old residue 39 adding: *413* *39* *Lys* *HG3* *H* *1.44* *.* *2* old residue 39 adding: *414* *39* *Lys* *HD2* *H* *1.64* *.* *2* old residue 39 adding: *415* *39* *Lys* *HD3* *H* *1.61* *.* *2* old residue 39 adding: *416* *39* *Lys* *HE2* *H* *2.93* *.* *2* old residue 39 adding: *417* *39* *Lys* *HE3* *H* *2.93* *.* *2* old residue 39 adding: *418* *39* *Lys* *C* *C* *178.6* *.* *1* old residue 39 adding: *419* *39* *Lys* *CA* *C* *60.5* *.* *1* old residue 39 adding: *420* *39* *Lys* *CB* *C* *32.1* *.* *1* old residue 39 adding: *421* *39* *Lys* *CG* *C* *24.9* *.* *1* old residue 39 adding: *422* *39* *Lys* *CD* *C* *28.8* *.* *1* old residue 39 adding: *423* *39* *Lys* *CE* *C* *42.1* *.* *1* old residue 39 adding: *424* *39* *Lys* *N* *N* *118.7* *.* *1* new residue 40 adding: *425* *40* *Leu* *H* *H* *7.89* *.* *1* old residue 40 adding: *426* *40* *Leu* *HA* *H* *4.07* *.* *1* old residue 40 adding: *427* *40* *Leu* *HB2* *H* *1.87* *.* *2* old residue 40 adding: *428* *40* *Leu* *HB3* *H* *1.65* *.* *2* old residue 40 adding: *429* *40* *Leu* *HG* *H* *1.78* *.* *1* old residue 40 adding: *430* *40* *Leu* *HD1* *H* *0.96* *.* *2* old residue 40 adding: *431* *40* *Leu* *HD2* *H* *0.92* *.* *2* old residue 40 adding: *432* *40* *Leu* *C* *C* *179.4* *.* *1* old residue 40 adding: *433* *40* *Leu* *CA* *C* *57.9* *.* *1* old residue 40 adding: *434* *40* *Leu* *CB* *C* *42.2* *.* *1* old residue 40 adding: *435* *40* *Leu* *CG* *C* *26.7* *.* *1* old residue 40 adding: *436* *40* *Leu* *CD1* *C* *24.7* *.* *1* old residue 40 adding: *437* *40* *Leu* *CD2* *C* *24.3* *.* *1* old residue 40 adding: *438* *40* *Leu* *N* *N* *118.0* *.* *1* new residue 41 adding: *439* *41* *Leu* *H* *H* *8.13* *.* *1* old residue 41 adding: *440* *41* *Leu* *HA* *H* *4.00* *.* *1* old residue 41 adding: *441* *41* *Leu* *HB2* *H* *2.17* *.* *2* old residue 41 adding: *442* *41* *Leu* *HB3* *H* *1.37* *.* *2* old residue 41 adding: *443* *41* *Leu* *HG* *H* *1.83* *.* *1* old residue 41 adding: *444* *41* *Leu* *HD1* *H* *0.97* *.* *2* old residue 41 adding: *445* *41* *Leu* *HD2* *H* *0.85* *.* *2* old residue 41 adding: *446* *41* *Leu* *C* *C* *180.3* *.* *1* old residue 41 adding: *447* *41* *Leu* *CA* *C* *58.0* *.* *1* old residue 41 adding: *448* *41* *Leu* *CB* *C* *43.5* *.* *1* old residue 41 adding: *449* *41* *Leu* *CG* *C* *27.7* *.* *1* old residue 41 adding: *450* *41* *Leu* *CD1* *C* *26.1* *.* *1* old residue 41 adding: *451* *41* *Leu* *CD2* *C* *24.2* *.* *1* old residue 41 adding: *452* *41* *Leu* *N* *N* *119.5* *.* *1* new residue 42 adding: *453* *42* *Val* *H* *H* *8.73* *.* *1* old residue 42 adding: *454* *42* *Val* *HA* *H* *3.59* *.* *1* old residue 42 adding: *455* *42* *Val* *HB* *H* *2.60* *.* *1* old residue 42 adding: *456* *42* *Val* *HG1* *H* *1.12* *.* *2* old residue 42 adding: *457* *42* *Val* *HG2* *H* *1.18* *.* *2* old residue 42 adding: *458* *42* *Val* *C* *C* *177.5* *.* *1* old residue 42 adding: *459* *42* *Val* *CA* *C* *67.0* *.* *1* old residue 42 adding: *460* *42* *Val* *CB* *C* *31.5* *.* *1* old residue 42 adding: *461* *42* *Val* *CG1* *C* *22.3* *.* *1* old residue 42 adding: *462* *42* *Val* *CG2* *C* *25.3* *.* *1* old residue 42 adding: *463* *42* *Val* *N* *N* *121.9* *.* *1* new residue 43 adding: *464* *43* *Ile* *H* *H* *7.89* *.* *1* old residue 43 adding: *465* *43* *Ile* *HA* *H* *3.86* *.* *1* old residue 43 adding: *466* *43* *Ile* *HB* *H* *2.06* *.* *1* old residue 43 adding: *467* *43* *Ile* *HG12* *H* *1.35* *.* *2* old residue 43 adding: *468* *43* *Ile* *HG13* *H* *1.81* *.* *2* old residue 43 adding: *469* *43* *Ile* *HG2* *H* *0.97* *.* *1* old residue 43 adding: *470* *43* *Ile* *HD1* *H* *0.95* *.* *1* old residue 43 adding: *471* *43* *Ile* *C* *C* *180.8* *.* *1* old residue 43 adding: *472* *43* *Ile* *CA* *C* *64.4* *.* *1* old residue 43 adding: *473* *43* *Ile* *CB* *C* *38.1* *.* *1* old residue 43 adding: *474* *43* *Ile* *CG1* *C* *29.1* *.* *1* old residue 43 adding: *475* *43* *Ile* *CG2* *C* *17.2* *.* *1* old residue 43 adding: *476* *43* *Ile* *CD1* *C* *13.0* *.* *1* old residue 43 adding: *477* *43* *Ile* *N* *N* *120.1* *.* *1* new residue 44 adding: *478* *44* *Glu* *H* *H* *8.88* *.* *1* old residue 44 adding: *479* *44* *Glu* *HA* *H* *4.06* *.* *1* old residue 44 adding: *480* *44* *Glu* *HB2* *H* *1.97* *.* *2* old residue 44 adding: *481* *44* *Glu* *HB3* *H* *2.06* *.* *2* old residue 44 adding: *482* *44* *Glu* *HG2* *H* *2.47* *.* *2* old residue 44 adding: *483* *44* *Glu* *HG3* *H* *2.36* *.* *2* old residue 44 adding: *484* *44* *Glu* *C* *C* *177.3* *.* *1* old residue 44 adding: *485* *44* *Glu* *CA* *C* *58.1* *.* *1* old residue 44 adding: *486* *44* *Glu* *CB* *C* *29.0* *.* *1* old residue 44 adding: *487* *44* *Glu* *CG* *C* *33.8* *.* *1* old residue 44 adding: *488* *44* *Glu* *N* *N* *119.8* *.* *1* new residue 45 adding: *489* *45* *Asn* *H* *H* *7.56* *.* *1* old residue 45 adding: *490* *45* *Asn* *HA* *H* *4.71* *.* *1* old residue 45 adding: *491* *45* *Asn* *HB2* *H* *2.84* *.* *2* old residue 45 adding: *492* *45* *Asn* *HB3* *H* *2.58* *.* *2* old residue 45 adding: *493* *45* *Asn* *HD21* *H* *7.36* *.* *2* old residue 45 adding: *494* *45* *Asn* *HD22* *H* *7.65* *.* *2* old residue 45 adding: *495* *45* *Asn* *C* *C* *173.2* *.* *1* old residue 45 adding: *496* *45* *Asn* *CA* *C* *54.1* *.* *1* old residue 45 adding: *497* *45* *Asn* *CB* *C* *39.3* *.* *1* old residue 45 adding: *498* *45* *Asn* *N* *N* *112.7* *.* *1* old residue 45 adding: *499* *45* *Asn* *ND2* *N* *113.3* *.* *1* new residue 46 adding: *500* *46* *Asn* *H* *H* *7.93* *.* *1* old residue 46 adding: *501* *46* *Asn* *HA* *H* *4.42* *.* *1* old residue 46 adding: *502* *46* *Asn* *HB2* *H* *2.63* *.* *2* old residue 46 adding: *503* *46* *Asn* *HB3* *H* *3.17* *.* *2* old residue 46 adding: *504* *46* *Asn* *HD21* *H* *7.62* *.* *2* old residue 46 adding: *505* *46* *Asn* *HD22* *H* *6.82* *.* *2* old residue 46 adding: *506* *46* *Asn* *C* *C* *175.1* *.* *1* old residue 46 adding: *507* *46* *Asn* *CA* *C* *53.9* *.* *1* old residue 46 adding: *508* *46* *Asn* *CB* *C* *37.4* *.* *1* old residue 46 adding: *509* *46* *Asn* *N* *N* *117.7* *.* *1* old residue 46 adding: *510* *46* *Asn* *ND2* *N* *112.0* *.* *1* new residue 47 adding: *511* *47* *Leu* *H* *H* *7.80* *.* *1* old residue 47 adding: *512* *47* *Leu* *HA* *H* *4.65* *.* *1* old residue 47 adding: *513* *47* *Leu* *HB2* *H* *1.85* *.* *2* old residue 47 adding: *514* *47* *Leu* *HB3* *H* *1.51* *.* *2* old residue 47 adding: *515* *47* *Leu* *HG* *H* *1.62* *.* *1* old residue 47 adding: *516* *47* *Leu* *HD1* *H* *0.92* *.* *2* old residue 47 adding: *517* *47* *Leu* *HD2* *H* *0.91* *.* *2* old residue 47 adding: *518* *47* *Leu* *C* *C* *177.2* *.* *1* old residue 47 adding: *519* *47* *Leu* *CA* *C* *53.9* *.* *1* old residue 47 adding: *520* *47* *Leu* *CB* *C* *40.3* *.* *1* old residue 47 adding: *521* *47* *Leu* *CG* *C* *26.8* *.* *1* old residue 47 adding: *522* *47* *Leu* *CD1* *C* *26.3* *.* *1* old residue 47 adding: *523* *47* *Leu* *CD2* *C* *23.6* *.* *1* old residue 47 adding: *524* *47* *Leu* *N* *N* *118.1* *.* *1* new residue 48 adding: *525* *48* *Lys* *H* *H* *8.04* *.* *1* old residue 48 adding: *526* *48* *Lys* *HA* *H* *4.15* *.* *1* old residue 48 adding: *527* *48* *Lys* *HB2* *H* *1.75* *.* *2* old residue 48 adding: *528* *48* *Lys* *HB3* *H* *1.77* *.* *2* old residue 48 adding: *529* *48* *Lys* *HG2* *H* *1.38* *.* *2* old residue 48 adding: *530* *48* *Lys* *HG3* *H* *1.45* *.* *2* old residue 48 adding: *531* *48* *Lys* *HD2* *H* *1.67* *.* *2* old residue 48 adding: *532* *48* *Lys* *HD3* *H* *1.67* *.* *2* old residue 48 adding: *533* *48* *Lys* *HE2* *H* *3.00* *.* *2* old residue 48 adding: *534* *48* *Lys* *HE3* *H* *3.00* *.* *2* old residue 48 adding: *535* *48* *Lys* *C* *C* *177.4* *.* *1* old residue 48 adding: *536* *48* *Lys* *CA* *C* *58.1* *.* *1* old residue 48 adding: *537* *48* *Lys* *CB* *C* *32.3* *.* *1* old residue 48 adding: *538* *48* *Lys* *CG* *C* *24.9* *.* *1* old residue 48 adding: *539* *48* *Lys* *CD* *C* *29.0* *.* *1* old residue 48 adding: *540* *48* *Lys* *CE* *C* *42.1* *.* *1* old residue 48 adding: *541* *48* *Lys* *N* *N* *126.3* *.* *1* new residue 49 adding: *542* *49* *Glu* *H* *H* *9.18* *.* *1* old residue 49 adding: *543* *49* *Glu* *HA* *H* *4.04* *.* *1* old residue 49 adding: *544* *49* *Glu* *HB2* *H* *2.02* *.* *2* old residue 49 adding: *545* *49* *Glu* *HB3* *H* *1.85* *.* *2* old residue 49 adding: *546* *49* *Glu* *HG2* *H* *2.21* *.* *2* old residue 49 adding: *547* *49* *Glu* *HG3* *H* *2.25* *.* *2* old residue 49 adding: *548* *49* *Glu* *C* *C* *178.0* *.* *1* old residue 49 adding: *549* *49* *Glu* *CA* *C* *58.8* *.* *1* old residue 49 adding: *550* *49* *Glu* *CB* *C* *29.2* *.* *1* old residue 49 adding: *551* *49* *Glu* *CG* *C* *36.0* *.* *1* old residue 49 adding: *552* *49* *Glu* *N* *N* *118.1* *.* *1* new residue 50 adding: *553* *50* *Ile* *H* *H* *7.57* *.* *1* old residue 50 adding: *554* *50* *Ile* *HA* *H* *4.07* *.* *1* old residue 50 adding: *555* *50* *Ile* *HB* *H* *2.19* *.* *1* old residue 50 adding: *556* *50* *Ile* *HG12* *H* *1.26* *.* *2* old residue 50 adding: *557* *50* *Ile* *HG13* *H* *1.45* *.* *2* old residue 50 adding: *558* *50* *Ile* *HG2* *H* *0.76* *.* *1* old residue 50 adding: *559* *50* *Ile* *HD1* *H* *0.74* *.* *1* old residue 50 adding: *560* *50* *Ile* *C* *C* *177.6* *.* *1* old residue 50 adding: *561* *50* *Ile* *CA* *C* *60.5* *.* *1* old residue 50 adding: *562* *50* *Ile* *CB* *C* *36.3* *.* *1* old residue 50 adding: *563* *50* *Ile* *CG1* *C* *27.4* *.* *1* old residue 50 adding: *564* *50* *Ile* *CG2* *C* *18.4* *.* *1* old residue 50 adding: *565* *50* *Ile* *CD1* *C* *9.8* *.* *1* old residue 50 adding: *566* *50* *Ile* *N* *N* *116.1* *.* *1* new residue 51 adding: *567* *51* *Thr* *H* *H* *7.81* *.* *1* old residue 51 adding: *568* *51* *Thr* *HA* *H* *3.71* *.* *1* old residue 51 adding: *569* *51* *Thr* *HB* *H* *4.16* *.* *1* old residue 51 adding: *570* *51* *Thr* *HG2* *H* *1.09* *.* *1* old residue 51 adding: *571* *51* *Thr* *C* *C* *176.4* *.* *1* old residue 51 adding: *572* *51* *Thr* *CA* *C* *64.7* *.* *1* old residue 51 adding: *573* *51* *Thr* *CB* *C* *68.2* *.* *1* old residue 51 adding: *574* *51* *Thr* *CG2* *C* *22.5* *.* *1* old residue 51 adding: *575* *51* *Thr* *N* *N* *112.2* *.* *1* new residue 52 adding: *576* *52* *Asn* *H* *H* *8.64* *.* *1* old residue 52 adding: *577* *52* *Asn* *HA* *H* *4.49* *.* *1* old residue 52 adding: *578* *52* *Asn* *HB2* *H* *2.75* *.* *2* old residue 52 adding: *579* *52* *Asn* *HB3* *H* *2.75* *.* *2* old residue 52 adding: *580* *52* *Asn* *HD21* *H* *7.52* *.* *2* old residue 52 adding: *581* *52* *Asn* *HD22* *H* *6.84* *.* *2* old residue 52 adding: *582* *52* *Asn* *C* *C* *176.0* *.* *1* old residue 52 adding: *583* *52* *Asn* *CA* *C* *54.6* *.* *1* old residue 52 adding: *584* *52* *Asn* *CB* *C* *38.0* *.* *1* old residue 52 adding: *585* *52* *Asn* *N* *N* *119.8* *.* *1* old residue 52 adding: *586* *52* *Asn* *ND2* *N* *111.5* *.* *1* new residue 53 adding: *587* *53* *Asn* *H* *H* *7.56* *.* *1* old residue 53 adding: *588* *53* *Asn* *HA* *H* *4.64* *.* *1* old residue 53 adding: *589* *53* *Asn* *HB2* *H* *2.81* *.* *2* old residue 53 adding: *590* *53* *Asn* *HB3* *H* *2.68* *.* *2* old residue 53 adding: *591* *53* *Asn* *HD21* *H* *7.58* *.* *2* old residue 53 adding: *592* *53* *Asn* *HD22* *H* *6.95* *.* *2* old residue 53 adding: *593* *53* *Asn* *C* *C* *175.6* *.* *1* old residue 53 adding: *594* *53* *Asn* *CA* *C* *54.2* *.* *1* old residue 53 adding: *595* *53* *Asn* *CB* *C* *39.5* *.* *1* old residue 53 adding: *596* *53* *Asn* *N* *N* *117.5* *.* *1* old residue 53 adding: *597* *53* *Asn* *ND2* *N* *113.0* *.* *1* new residue 54 adding: *598* *54* *Val* *H* *H* *7.52* *.* *1* old residue 54 adding: *599* *54* *Val* *HA* *H* *3.77* *.* *1* old residue 54 adding: *600* *54* *Val* *HB* *H* *1.70* *.* *1* old residue 54 adding: *601* *54* *Val* *HG1* *H* *0.17* *.* *2* old residue 54 adding: *602* *54* *Val* *HG2* *H* *0.31* *.* *2* old residue 54 adding: *603* *54* *Val* *C* *C* *176.8* *.* *1* old residue 54 adding: *604* *54* *Val* *CA* *C* *63.3* *.* *1* old residue 54 adding: *605* *54* *Val* *CB* *C* *31.8* *.* *1* old residue 54 adding: *606* *54* *Val* *CG1* *C* *19.9* *.* *1* old residue 54 adding: *607* *54* *Val* *CG2* *C* *20.3* *.* *1* old residue 54 adding: *608* *54* *Val* *N* *N* *119.4* *.* *1* new residue 55 adding: *609* *55* *Lys* *H* *H* *8.08* *.* *1* old residue 55 adding: *610* *55* *Lys* *HA* *H* *4.15* *.* *1* old residue 55 adding: *611* *55* *Lys* *HB2* *H* *1.85* *.* *2* old residue 55 adding: *612* *55* *Lys* *HB3* *H* *1.78* *.* *2* old residue 55 adding: *613* *55* *Lys* *HG2* *H* *1.46* *.* *2* old residue 55 adding: *614* *55* *Lys* *HG3* *H* *1.37* *.* *2* old residue 55 adding: *615* *55* *Lys* *HD2* *H* *1.69* *.* *2* old residue 55 adding: *616* *55* *Lys* *HD3* *H* *1.69* *.* *2* old residue 55 adding: *617* *55* *Lys* *HE2* *H* *3.00* *.* *2* old residue 55 adding: *618* *55* *Lys* *HE3* *H* *3.00* *.* *2* old residue 55 adding: *619* *55* *Lys* *C* *C* *177.2* *.* *1* old residue 55 adding: *620* *55* *Lys* *CA* *C* *57.3* *.* *1* old residue 55 adding: *621* *55* *Lys* *CB* *C* *32.4* *.* *1* old residue 55 adding: *622* *55* *Lys* *CG* *C* *24.9* *.* *1* old residue 55 adding: *623* *55* *Lys* *CD* *C* *29.0* *.* *1* old residue 55 adding: *624* *55* *Lys* *CE* *C* *42.0* *.* *1* old residue 55 adding: *625* *55* *Lys* *N* *N* *122.2* *.* *1* new residue 56 adding: *626* *56* *Asn* *H* *H* *8.10* *.* *1* old residue 56 adding: *627* *56* *Asn* *HA* *H* *4.62* *.* *1* old residue 56 adding: *628* *56* *Asn* *HB2* *H* *2.89* *.* *2* old residue 56 adding: *629* *56* *Asn* *HB3* *H* *2.82* *.* *2* old residue 56 adding: *630* *56* *Asn* *HD21* *H* *7.63* *.* *2* old residue 56 adding: *631* *56* *Asn* *HD22* *H* *6.92* *.* *2* old residue 56 adding: *632* *56* *Asn* *C* *C* *175.7* *.* *1* old residue 56 adding: *633* *56* *Asn* *CA* *C* *54.0* *.* *1* old residue 56 adding: *634* *56* *Asn* *CB* *C* *38.8* *.* *1* old residue 56 adding: *635* *56* *Asn* *N* *N* *117.6* *.* *1* old residue 56 adding: *636* *56* *Asn* *ND2* *N* *112.8* *.* *1* new residue 57 adding: *637* *57* *Lys* *H* *H* *8.29* *.* *1* old residue 57 adding: *638* *57* *Lys* *HA* *H* *4.27* *.* *1* old residue 57 adding: *639* *57* *Lys* *HB2* *H* *1.95* *.* *2* old residue 57 adding: *640* *57* *Lys* *HB3* *H* *1.87* *.* *2* old residue 57 adding: *641* *57* *Lys* *HG2* *H* *1.49* *.* *2* old residue 57 adding: *642* *57* *Lys* *HG3* *H* *1.47* *.* *2* old residue 57 adding: *643* *57* *Lys* *HD2* *H* *1.69* *.* *2* old residue 57 adding: *644* *57* *Lys* *HD3* *H* *1.69* *.* *2* old residue 57 adding: *645* *57* *Lys* *HE2* *H* *3.01* *.* *2* old residue 57 adding: *646* *57* *Lys* *HE3* *H* *3.01* *.* *2* old residue 57 adding: *647* *57* *Lys* *C* *C* *177.3* *.* *1* old residue 57 adding: *648* *57* *Lys* *CA* *C* *56.7* *.* *1* old residue 57 adding: *649* *57* *Lys* *CB* *C* *32.3* *.* *1* old residue 57 adding: *650* *57* *Lys* *CG* *C* *25.0* *.* *1* old residue 57 adding: *651* *57* *Lys* *CD* *C* *28.8* *.* *1* old residue 57 adding: *652* *57* *Lys* *CE* *C* *42.2* *.* *1* old residue 57 adding: *653* *57* *Lys* *N* *N* *119.1* *.* *1* new residue 58 adding: *654* *58* *Gly* *H* *H* *8.32* *.* *1* old residue 58 adding: *655* *58* *Gly* *HA2* *H* *4.02* *.* *2* old residue 58 adding: *656* *58* *Gly* *HA3* *H* *3.95* *.* *2* old residue 58 adding: *657* *58* *Gly* *C* *C* *173.9* *.* *1* old residue 58 adding: *658* *58* *Gly* *CA* *C* *45.4* *.* *1* old residue 58 adding: *659* *58* *Gly* *N* *N* *108.4* *.* *1* new residue 59 adding: *660* *59* *Arg* *H* *H* *7.86* *.* *1* old residue 59 adding: *661* *59* *Arg* *HA* *H* *4.48* *.* *1* old residue 59 adding: *662* *59* *Arg* *HB2* *H* *1.87* *.* *2* old residue 59 adding: *663* *59* *Arg* *HB3* *H* *1.77* *.* *2* old residue 59 adding: *664* *59* *Arg* *HG2* *H* *1.48* *.* *2* old residue 59 adding: *665* *59* *Arg* *HG3* *H* *1.48* *.* *2* old residue 59 adding: *666* *59* *Arg* *HD2* *H* *3.19* *.* *2* old residue 59 adding: *667* *59* *Arg* *HD3* *H* *3.19* *.* *2* old residue 59 adding: *668* *59* *Arg* *C* *C* *175.6* *.* *1* old residue 59 adding: *669* *59* *Arg* *CA* *C* *55.7* *.* *1* old residue 59 adding: *670* *59* *Arg* *CB* *C* *31.0* *.* *1* old residue 59 adding: *671* *59* *Arg* *CG* *C* *26.4* *.* *1* old residue 59 adding: *672* *59* *Arg* *CD* *C* *43.4* *.* *1* old residue 59 adding: *673* *59* *Arg* *N* *N* *119.1* *.* *1* new residue 60 adding: *674* *60* *Trp* *H* *H* *8.87* *.* *1* old residue 60 adding: *675* *60* *Trp* *HA* *H* *4.65* *.* *1* old residue 60 adding: *676* *60* *Trp* *HB2* *H* *3.08* *.* *2* old residue 60 adding: *677* *60* *Trp* *HB3* *H* *3.10* *.* *2* old residue 60 adding: *678* *60* *Trp* *HD1* *H* *7.31* *.* *1* old residue 60 adding: *679* *60* *Trp* *HE1* *H* *10.30* *.* *1* old residue 60 adding: *680* *60* *Trp* *HE3* *H* *7.16* *.* *1* old residue 60 adding: *681* *60* *Trp* *HZ2* *H* *7.47* *.* *1* old residue 60 adding: *682* *60* *Trp* *HZ3* *H* *6.58* *.* *1* old residue 60 adding: *683* *60* *Trp* *HH2* *H* *6.91* *.* *1* old residue 60 adding: *684* *60* *Trp* *C* *C* *176.4* *.* *1* old residue 60 adding: *685* *60* *Trp* *CA* *C* *56.9* *.* *1* old residue 60 adding: *686* *60* *Trp* *CB* *C* *29.0* *.* *1* old residue 60 adding: *687* *60* *Trp* *CD1* *C* *125.7* *.* *1* old residue 60 adding: *688* *60* *Trp* *CE3* *C* *119.7* *.* *1* old residue 60 adding: *689* *60* *Trp* *CZ2* *C* *114.2* *.* *1* old residue 60 adding: *690* *60* *Trp* *CZ3* *C* *119.9* *.* *1* old residue 60 adding: *691* *60* *Trp* *CH2* *C* *123.1* *.* *1* old residue 60 adding: *692* *60* *Trp* *N* *N* *123.4* *.* *1* old residue 60 adding: *693* *60* *Trp* *NE1* *N* *130.2* *.* *1* new residue 61 adding: *694* *61* *Lys* *H* *H* *8.58* *.* *1* old residue 61 adding: *695* *61* *Lys* *HA* *H* *4.71* *.* *1* old residue 61 adding: *696* *61* *Lys* *HB2* *H* *1.84* *.* *2* old residue 61 adding: *697* *61* *Lys* *HB3* *H* *2.27* *.* *2* old residue 61 adding: *698* *61* *Lys* *HG2* *H* *1.58* *.* *2* old residue 61 adding: *699* *61* *Lys* *HG3* *H* *1.66* *.* *2* old residue 61 adding: *700* *61* *Lys* *HD2* *H* *1.66* *.* *2* old residue 61 adding: *701* *61* *Lys* *HD3* *H* *1.61* *.* *2* old residue 61 adding: *702* *61* *Lys* *HE2* *H* *2.93* *.* *2* old residue 61 adding: *703* *61* *Lys* *HE3* *H* *2.93* *.* *2* old residue 61 adding: *704* *61* *Lys* *C* *C* *178.8* *.* *1* old residue 61 adding: *705* *61* *Lys* *CA* *C* *47.2* *.* *1* old residue 61 adding: *706* *61* *Lys* *CB* *C* *33.6* *.* *1* old residue 61 adding: *707* *61* *Lys* *CG* *C* *25.1* *.* *1* old residue 61 adding: *708* *61* *Lys* *CD* *C* *28.8* *.* *1* old residue 61 adding: *709* *61* *Lys* *CE* *C* *41.7* *.* *1* old residue 61 adding: *710* *61* *Lys* *N* *N* *122.0* *.* *1* new residue 62 adding: *711* *62* *Ser* *H* *H* *9.31* *.* *1* old residue 62 adding: *712* *62* *Ser* *HA* *H* *4.11* *.* *1* old residue 62 adding: *713* *62* *Ser* *HB2* *H* *4.29* *.* *2* old residue 62 adding: *714* *62* *Ser* *HB3* *H* *4.35* *.* *2* old residue 62 adding: *715* *62* *Ser* *C* *C* *176.9* *.* *1* old residue 62 adding: *716* *62* *Ser* *CA* *C* *62.6* *.* *1* old residue 62 adding: *717* *62* *Ser* *CB* *C* *62.6* *.* *1* old residue 62 adding: *718* *62* *Ser* *N* *N* *120.1* *.* *1* new residue 63 adding: *719* *63* *Glu* *H* *H* *9.53* *.* *1* old residue 63 adding: *720* *63* *Glu* *HA* *H* *4.25* *.* *1* old residue 63 adding: *721* *63* *Glu* *HB2* *H* *2.07* *.* *2* old residue 63 adding: *722* *63* *Glu* *HB3* *H* *2.02* *.* *2* old residue 63 adding: *723* *63* *Glu* *HG2* *H* *2.33* *.* *2* old residue 63 adding: *724* *63* *Glu* *HG3* *H* *2.33* *.* *2* old residue 63 adding: *725* *63* *Glu* *C* *C* *179.1* *.* *1* old residue 63 adding: *726* *63* *Glu* *CA* *C* *59.9* *.* *1* old residue 63 adding: *727* *63* *Glu* *CB* *C* *28.9* *.* *1* old residue 63 adding: *728* *63* *Glu* *CG* *C* *35.8* *.* *1* old residue 63 adding: *729* *63* *Glu* *N* *N* *120.9* *.* *1* new residue 64 adding: *730* *64* *Asn* *H* *H* *7.60* *.* *1* old residue 64 adding: *731* *64* *Asn* *HA* *H* *4.72* *.* *1* old residue 64 adding: *732* *64* *Asn* *HB2* *H* *2.94* *.* *2* old residue 64 adding: *733* *64* *Asn* *HB3* *H* *2.66* *.* *2* old residue 64 adding: *734* *64* *Asn* *HD21* *H* *7.62* *.* *2* old residue 64 adding: *735* *64* *Asn* *HD22* *H* *7.00* *.* *2* old residue 64 adding: *736* *64* *Asn* *C* *C* *177.1* *.* *1* old residue 64 adding: *737* *64* *Asn* *CA* *C* *55.6* *.* *1* old residue 64 adding: *738* *64* *Asn* *CB* *C* *39.4* *.* *1* old residue 64 adding: *739* *64* *Asn* *N* *N* *117.4* *.* *1* old residue 64 adding: *740* *64* *Asn* *ND2* *N* *112.1* *.* *1* new residue 65 adding: *741* *65* *Leu* *H* *H* *7.68* *.* *1* old residue 65 adding: *742* *65* *Leu* *HA* *H* *3.77* *.* *1* old residue 65 adding: *743* *65* *Leu* *HB2* *H* *1.90* *.* *2* old residue 65 adding: *744* *65* *Leu* *HB3* *H* *0.64* *.* *2* old residue 65 adding: *745* *65* *Leu* *HG* *H* *1.76* *.* *1* old residue 65 adding: *746* *65* *Leu* *HD1* *H* *0.53* *.* *2* old residue 65 adding: *747* *65* *Leu* *HD2* *H* *1.11* *.* *2* old residue 65 adding: *748* *65* *Leu* *C* *C* *178.7* *.* *1* old residue 65 adding: *749* *65* *Leu* *CA* *C* *57.8* *.* *1* old residue 65 adding: *750* *65* *Leu* *CB* *C* *41.4* *.* *1* old residue 65 adding: *751* *65* *Leu* *CG* *C* *27.4* *.* *1* old residue 65 adding: *752* *65* *Leu* *CD1* *C* *23.6* *.* *1* old residue 65 adding: *753* *65* *Leu* *CD2* *C* *26.5* *.* *1* old residue 65 adding: *754* *65* *Leu* *N* *N* *121.6* *.* *1* new residue 66 adding: *755* *66* *Phe* *H* *H* *8.38* *.* *1* old residue 66 adding: *756* *66* *Phe* *HA* *H* *3.76* *.* *1* old residue 66 adding: *757* *66* *Phe* *HB2* *H* *3.06* *.* *2* old residue 66 adding: *758* *66* *Phe* *HB3* *H* *3.04* *.* *2* old residue 66 adding: *759* *66* *Phe* *HD1* *H* *7.35* *.* *3* old residue 66 adding: *760* *66* *Phe* *HD2* *H* *7.35* *.* *3* old residue 66 adding: *761* *66* *Phe* *HE1* *H* *6.53* *.* *3* old residue 66 adding: *762* *66* *Phe* *HE2* *H* *6.53* *.* *3* old residue 66 adding: *763* *66* *Phe* *C* *C* *179.8* *.* *1* old residue 66 adding: *764* *66* *Phe* *CA* *C* *62.4* *.* *1* old residue 66 adding: *765* *66* *Phe* *CB* *C* *38.9* *.* *1* old residue 66 adding: *766* *66* *Phe* *CD1* *C* *131.2* *.* *1* old residue 66 adding: *767* *66* *Phe* *CE1* *C* *131.1* *.* *1* old residue 66 adding: *768* *66* *Phe* *N* *N* *117.1* *.* *1* new residue 67 adding: *769* *67* *Lys* *H* *H* *7.99* *.* *1* old residue 67 adding: *770* *67* *Lys* *HA* *H* *3.98* *.* *1* old residue 67 adding: *771* *67* *Lys* *HB2* *H* *1.87* *.* *2* old residue 67 adding: *772* *67* *Lys* *HB3* *H* *1.99* *.* *2* old residue 67 adding: *773* *67* *Lys* *HG2* *H* *1.54* *.* *2* old residue 67 adding: *774* *67* *Lys* *HG3* *H* *1.35* *.* *2* old residue 67 adding: *775* *67* *Lys* *HD2* *H* *1.54* *.* *2* old residue 67 adding: *776* *67* *Lys* *HD3* *H* *1.69* *.* *2* old residue 67 adding: *777* *67* *Lys* *HE2* *H* *2.93* *.* *2* old residue 67 adding: *778* *67* *Lys* *HE3* *H* *2.86* *.* *2* old residue 67 adding: *779* *67* *Lys* *C* *C* *178.6* *.* *1* old residue 67 adding: *780* *67* *Lys* *CA* *C* *59.8* *.* *1* old residue 67 adding: *781* *67* *Lys* *CB* *C* *32.2* *.* *1* old residue 67 adding: *782* *67* *Lys* *CG* *C* *25.4* *.* *1* old residue 67 adding: *783* *67* *Lys* *CD* *C* *29.3* *.* *1* old residue 67 adding: *784* *67* *Lys* *CE* *C* *42.1* *.* *1* old residue 67 adding: *785* *67* *Lys* *N* *N* *120.8* *.* *1* new residue 68 adding: *786* *68* *Ala* *H* *H* *8.29* *.* *1* old residue 68 adding: *787* *68* *Ala* *HA* *H* *3.77* *.* *1* old residue 68 adding: *788* *68* *Ala* *HB* *H* *1.33* *.* *1* old residue 68 adding: *789* *68* *Ala* *C* *C* *178.6* *.* *1* old residue 68 adding: *790* *68* *Ala* *CA* *C* *55.3* *.* *1* old residue 68 adding: *791* *68* *Ala* *CB* *C* *18.5* *.* *1* old residue 68 adding: *792* *68* *Ala* *N* *N* *120.8* *.* *1* new residue 69 adding: *793* *69* *Ser* *H* *H* *7.93* *.* *1* old residue 69 adding: *794* *69* *Ser* *HA* *H* *3.68* *.* *1* old residue 69 adding: *795* *69* *Ser* *HB2* *H* *3.54* *.* *2* old residue 69 adding: *796* *69* *Ser* *HB3* *H* *3.42* *.* *2* old residue 69 adding: *797* *69* *Ser* *C* *C* *173.8* *.* *1* old residue 69 adding: *798* *69* *Ser* *CA* *C* *62.2* *.* *1* old residue 69 adding: *799* *69* *Ser* *CB* *C* *62.2* *.* *1* old residue 69 adding: *800* *69* *Ser* *N* *N* *112.7* *.* *1* new residue 70 adding: *801* *70* *Lys* *H* *H* *7.16* *.* *1* old residue 70 adding: *802* *70* *Lys* *HA* *H* *4.08* *.* *1* old residue 70 adding: *803* *70* *Lys* *HB2* *H* *1.93* *.* *2* old residue 70 adding: *804* *70* *Lys* *HB3* *H* *1.97* *.* *2* old residue 70 adding: *805* *70* *Lys* *HG2* *H* *1.42* *.* *2* old residue 70 adding: *806* *70* *Lys* *HG3* *H* *1.61* *.* *2* old residue 70 adding: *807* *70* *Lys* *HD2* *H* *1.70* *.* *2* old residue 70 adding: *808* *70* *Lys* *HD3* *H* *1.70* *.* *2* old residue 70 adding: *809* *70* *Lys* *HE2* *H* *2.93* *.* *2* old residue 70 adding: *810* *70* *Lys* *HE3* *H* *2.93* *.* *2* old residue 70 adding: *811* *70* *Lys* *C* *C* *180.4* *.* *1* old residue 70 adding: *812* *70* *Lys* *CA* *C* *59.2* *.* *1* old residue 70 adding: *813* *70* *Lys* *CB* *C* *32.5* *.* *1* old residue 70 adding: *814* *70* *Lys* *CG* *C* *25.5* *.* *1* old residue 70 adding: *815* *70* *Lys* *CD* *C* *29.3* *.* *1* old residue 70 adding: *816* *70* *Lys* *CE* *C* *41.8* *.* *1* old residue 70 adding: *817* *70* *Lys* *N* *N* *119.7* *.* *1* new residue 71 adding: *818* *71* *Leu* *H* *H* *8.15* *.* *1* old residue 71 adding: *819* *71* *Leu* *HA* *H* *4.15* *.* *1* old residue 71 adding: *820* *71* *Leu* *HB2* *H* *1.55* *.* *2* old residue 71 adding: *821* *71* *Leu* *HB3* *H* *1.87* *.* *2* old residue 71 adding: *822* *71* *Leu* *HG* *H* *1.85* *.* *1* old residue 71 adding: *823* *71* *Leu* *HD1* *H* *0.88* *.* *2* old residue 71 adding: *824* *71* *Leu* *HD2* *H* *0.91* *.* *2* old residue 71 adding: *825* *71* *Leu* *C* *C* *180.1* *.* *1* old residue 71 adding: *826* *71* *Leu* *CA* *C* *57.5* *.* *1* old residue 71 adding: *827* *71* *Leu* *CB* *C* *42.4* *.* *1* old residue 71 adding: *828* *71* *Leu* *CG* *C* *27.2* *.* *1* old residue 71 adding: *829* *71* *Leu* *CD1* *C* *25.7* *.* *1* old residue 71 adding: *830* *71* *Leu* *CD2* *C* *22.7* *.* *1* old residue 71 adding: *831* *71* *Leu* *N* *N* *121.7* *.* *1* new residue 72 adding: *832* *72* *Leu* *H* *H* *8.16* *.* *1* old residue 72 adding: *833* *72* *Leu* *HA* *H* *4.27* *.* *1* old residue 72 adding: *834* *72* *Leu* *HB2* *H* *1.64* *.* *2* old residue 72 adding: *835* *72* *Leu* *HB3* *H* *1.87* *.* *2* old residue 72 adding: *836* *72* *Leu* *HG* *H* *1.74* *.* *1* old residue 72 adding: *837* *72* *Leu* *HD1* *H* *0.86* *.* *2* old residue 72 adding: *838* *72* *Leu* *HD2* *H* *0.78* *.* *2* old residue 72 adding: *839* *72* *Leu* *C* *C* *177.0* *.* *1* old residue 72 adding: *840* *72* *Leu* *CA* *C* *55.9* *.* *1* old residue 72 adding: *841* *72* *Leu* *CB* *C* *42.5* *.* *1* old residue 72 adding: *842* *72* *Leu* *CG* *C* *26.8* *.* *1* old residue 72 adding: *843* *72* *Leu* *CD1* *C* *24.2* *.* *1* old residue 72 adding: *844* *72* *Leu* *CD2* *C* *27.3* *.* *1* old residue 72 adding: *845* *72* *Leu* *N* *N* *117.7* *.* *1* new residue 73 adding: *846* *73* *Arg* *H* *H* *7.49* *.* *1* old residue 73 adding: *847* *73* *Arg* *HA* *H* *4.20* *.* *1* old residue 73 adding: *848* *73* *Arg* *HB2* *H* *1.85* *.* *2* old residue 73 adding: *849* *73* *Arg* *HB3* *H* *1.96* *.* *2* old residue 73 adding: *850* *73* *Arg* *HG2* *H* *1.83* *.* *2* old residue 73 adding: *851* *73* *Arg* *HG3* *H* *1.70* *.* *2* old residue 73 adding: *852* *73* *Arg* *HD2* *H* *3.31* *.* *2* old residue 73 adding: *853* *73* *Arg* *HD3* *H* *3.31* *.* *2* old residue 73 adding: *854* *73* *Arg* *C* *C* *176.6* *.* *1* old residue 73 adding: *855* *73* *Arg* *CA* *C* *58.0* *.* *1* old residue 73 adding: *856* *73* *Arg* *CB* *C* *30.4* *.* *1* old residue 73 adding: *857* *73* *Arg* *CG* *C* *27.8* *.* *1* old residue 73 adding: *858* *73* *Arg* *CD* *C* *43.6* *.* *1* old residue 73 adding: *859* *73* *Arg* *N* *N* *121.8* *.* *1* new residue 74 adding: *860* *74* *Ser* *H* *H* *7.39* *.* *1* old residue 74 adding: *861* *74* *Ser* *HA* *H* *4.15* *.* *1* old residue 74 adding: *862* *74* *Ser* *HB2* *H* *3.92* *.* *2* old residue 74 adding: *863* *74* *Ser* *HB3* *H* *3.92* *.* *2* old residue 74 adding: *864* *74* *Ser* *C* *C* *174.9* *.* *1* old residue 74 adding: *865* *74* *Ser* *CA* *C* *60.4* *.* *1* old residue 74 adding: *866* *74* *Ser* *CB* *C* *62.7* *.* *1* old residue 74 adding: *867* *74* *Ser* *N* *N* *110.2* *.* *1* new residue 75 adding: *868* *75* *Asn* *H* *H* *7.75* *.* *1* old residue 75 adding: *869* *75* *Asn* *HA* *H* *4.67* *.* *1* old residue 75 adding: *870* *75* *Asn* *HB2* *H* *2.84* *.* *2* old residue 75 adding: *871* *75* *Asn* *HB3* *H* *2.73* *.* *2* old residue 75 adding: *872* *75* *Asn* *HD21* *H* *7.39* *.* *2* old residue 75 adding: *873* *75* *Asn* *HD22* *H* *6.77* *.* *2* old residue 75 adding: *874* *75* *Asn* *C* *C* *175.3* *.* *1* old residue 75 adding: *875* *75* *Asn* *CA* *C* *55.3* *.* *1* old residue 75 adding: *876* *75* *Asn* *CB* *C* *39.8* *.* *1* old residue 75 adding: *877* *75* *Asn* *N* *N* *119.6* *.* *1* old residue 75 adding: *878* *75* *Asn* *ND2* *N* *109.3* *.* *1* new residue 76 adding: *879* *76* *Asn* *H* *H* *7.50* *.* *1* old residue 76 adding: *880* *76* *Asn* *HA* *H* *4.62* *.* *1* old residue 76 adding: *881* *76* *Asn* *HB2* *H* *2.13* *.* *2* old residue 76 adding: *882* *76* *Asn* *HB3* *H* *2.49* *.* *2* old residue 76 adding: *883* *76* *Asn* *HD21* *H* *6.46* *.* *2* old residue 76 adding: *884* *76* *Asn* *HD22* *H* *5.89* *.* *2* old residue 76 adding: *885* *76* *Asn* *C* *C* *175.7* *.* *1* old residue 76 adding: *886* *76* *Asn* *CA* *C* *53.9* *.* *1* old residue 76 adding: *887* *76* *Asn* *CB* *C* *39.2* *.* *1* old residue 76 adding: *888* *76* *Asn* *N* *N* *115.6* *.* *1* old residue 76 adding: *889* *76* *Asn* *ND2* *N* *109.9* *.* *1* new residue 77 adding: *890* *77* *Thr* *H* *H* *8.76* *.* *1* old residue 77 adding: *891* *77* *Thr* *HA* *H* *4.14* *.* *1* old residue 77 adding: *892* *77* *Thr* *HB* *H* *4.30* *.* *1* old residue 77 adding: *893* *77* *Thr* *HG2* *H* *1.34* *.* *1* old residue 77 adding: *894* *77* *Thr* *C* *C* *175.3* *.* *1* old residue 77 adding: *895* *77* *Thr* *CA* *C* *64.8* *.* *1* old residue 77 adding: *896* *77* *Thr* *CB* *C* *68.8* *.* *1* old residue 77 adding: *897* *77* *Thr* *CG2* *C* *22.2* *.* *1* old residue 77 adding: *898* *77* *Thr* *N* *N* *119.5* *.* *1* new residue 78 adding: *899* *78* *Glu* *H* *H* *8.37* *.* *1* old residue 78 adding: *900* *78* *Glu* *HA* *H* *4.29* *.* *1* old residue 78 adding: *901* *78* *Glu* *HB2* *H* *1.95* *.* *2* old residue 78 adding: *902* *78* *Glu* *HB3* *H* *2.11* *.* *2* old residue 78 adding: *903* *78* *Glu* *HG2* *H* *2.36* *.* *2* old residue 78 adding: *904* *78* *Glu* *HG3* *H* *2.45* *.* *2* old residue 78 adding: *905* *78* *Glu* *C* *C* *178.6* *.* *1* old residue 78 adding: *906* *78* *Glu* *CA* *C* *57.0* *.* *1* old residue 78 adding: *907* *78* *Glu* *CB* *C* *30.1* *.* *1* old residue 78 adding: *908* *78* *Glu* *CG* *C* *36.2* *.* *1* old residue 78 adding: *909* *78* *Glu* *N* *N* *117.4* *.* *1* new residue 79 adding: *910* *79* *Ile* *H* *H* *7.74* *.* *1* old residue 79 adding: *911* *79* *Ile* *HA* *H* *3.65* *.* *1* old residue 79 adding: *912* *79* *Ile* *HB* *H* *1.92* *.* *1* old residue 79 adding: *913* *79* *Ile* *HG12* *H* *1.01* *.* *2* old residue 79 adding: *914* *79* *Ile* *HG13* *H* *1.01* *.* *2* old residue 79 adding: *915* *79* *Ile* *HG2* *H* *0.89* *.* *1* old residue 79 adding: *916* *79* *Ile* *HD1* *H* *0.84* *.* *1* old residue 79 adding: *917* *79* *Ile* *CA* *C* *68.2* *.* *1* old residue 79 adding: *918* *79* *Ile* *CB* *C* *34.4* *.* *1* old residue 79 adding: *919* *79* *Ile* *CG1* *C* *24.1* *.* *1* old residue 79 adding: *920* *79* *Ile* *CG2* *C* *17.2* *.* *1* old residue 79 adding: *921* *79* *Ile* *CD1* *C* *13.7* *.* *1* old residue 79 adding: *922* *79* *Ile* *N* *N* *118.4* *.* *1* new residue 80 adding: *923* *80* *Pro* *HA* *H* *4.23* *.* *1* old residue 80 adding: *924* *80* *Pro* *HB2* *H* *2.28* *.* *2* old residue 80 adding: *925* *80* *Pro* *HB3* *H* *2.02* *.* *2* old residue 80 adding: *926* *80* *Pro* *HG2* *H* *2.11* *.* *2* old residue 80 adding: *927* *80* *Pro* *HG3* *H* *2.11* *.* *2* old residue 80 adding: *928* *80* *Pro* *HD2* *H* *3.99* *.* *2* old residue 80 adding: *929* *80* *Pro* *HD3* *H* *3.49* *.* *2* old residue 80 adding: *930* *80* *Pro* *C* *C* *179.0* *.* *1* old residue 80 adding: *931* *80* *Pro* *CA* *C* *66.4* *.* *1* old residue 80 adding: *932* *80* *Pro* *CB* *C* *30.9* *.* *1* old residue 80 adding: *933* *80* *Pro* *CG* *C* *28.5* *.* *1* old residue 80 adding: *934* *80* *Pro* *CD* *C* *48.2* *.* *1* new residue 81 adding: *935* *81* *Ile* *H* *H* *7.14* *.* *1* old residue 81 adding: *936* *81* *Ile* *HA* *H* *3.90* *.* *1* old residue 81 adding: *937* *81* *Ile* *HB* *H* *2.20* *.* *1* old residue 81 adding: *938* *81* *Ile* *HG12* *H* *1.37* *.* *2* old residue 81 adding: *939* *81* *Ile* *HG13* *H* *1.64* *.* *2* old residue 81 adding: *940* *81* *Ile* *HG2* *H* *1.00* *.* *1* old residue 81 adding: *941* *81* *Ile* *HD1* *H* *0.95* *.* *1* old residue 81 adding: *942* *81* *Ile* *C* *C* *178.2* *.* *1* old residue 81 adding: *943* *81* *Ile* *CA* *C* *64.0* *.* *1* old residue 81 adding: *944* *81* *Ile* *CB* *C* *37.9* *.* *1* old residue 81 adding: *945* *81* *Ile* *CG1* *C* *28.7* *.* *1* old residue 81 adding: *946* *81* *Ile* *CG2* *C* *17.8* *.* *1* old residue 81 adding: *947* *81* *Ile* *CD1* *C* *12.9* *.* *1* old residue 81 adding: *948* *81* *Ile* *N* *N* *118.9* *.* *1* new residue 82 adding: *949* *82* *Leu* *H* *H* *8.26* *.* *1* old residue 82 adding: *950* *82* *Leu* *HA* *H* *4.12* *.* *1* old residue 82 adding: *951* *82* *Leu* *HB2* *H* *1.94* *.* *2* old residue 82 adding: *952* *82* *Leu* *HB3* *H* *1.61* *.* *2* old residue 82 adding: *953* *82* *Leu* *HG* *H* *2.08* *.* *1* old residue 82 adding: *954* *82* *Leu* *HD1* *H* *0.83* *.* *2* old residue 82 adding: *955* *82* *Leu* *HD2* *H* *0.93* *.* *2* old residue 82 adding: *956* *82* *Leu* *C* *C* *179.8* *.* *1* old residue 82 adding: *957* *82* *Leu* *CA* *C* *57.7* *.* *1* old residue 82 adding: *958* *82* *Leu* *CB* *C* *40.6* *.* *1* old residue 82 adding: *959* *82* *Leu* *CG* *C* *26.3* *.* *1* old residue 82 adding: *960* *82* *Leu* *CD1* *C* *25.4* *.* *1* old residue 82 adding: *961* *82* *Leu* *CD2* *C* *21.0* *.* *1* old residue 82 adding: *962* *82* *Leu* *N* *N* *120.4* *.* *1* new residue 83 adding: *963* *83* *Trp* *H* *H* *8.74* *.* *1* old residue 83 adding: *964* *83* *Trp* *HA* *H* *4.44* *.* *1* old residue 83 adding: *965* *83* *Trp* *HB2* *H* *3.18* *.* *2* old residue 83 adding: *966* *83* *Trp* *HB3* *H* *3.18* *.* *2* old residue 83 adding: *967* *83* *Trp* *HD1* *H* *7.14* *.* *1* old residue 83 adding: *968* *83* *Trp* *HE1* *H* *10.26* *.* *1* old residue 83 adding: *969* *83* *Trp* *HE3* *H* *7.17* *.* *1* old residue 83 adding: *970* *83* *Trp* *HZ2* *H* *7.14* *.* *1* old residue 83 adding: *971* *83* *Trp* *HZ3* *H* *6.68* *.* *1* old residue 83 adding: *972* *83* *Trp* *HH2* *H* *6.82* *.* *1* old residue 83 adding: *973* *83* *Trp* *C* *C* *176.4* *.* *1* old residue 83 adding: *974* *83* *Trp* *CA* *C* *59.1* *.* *1* old residue 83 adding: *975* *83* *Trp* *CB* *C* *29.9* *.* *1* old residue 83 adding: *976* *83* *Trp* *CD1* *C* *123.5* *.* *1* old residue 83 adding: *977* *83* *Trp* *CE3* *C* *120.4* *.* *1* old residue 83 adding: *978* *83* *Trp* *CZ2* *C* *114.2* *.* *1* old residue 83 adding: *979* *83* *Trp* *CZ3* *C* *121.6* *.* *1* old residue 83 adding: *980* *83* *Trp* *CH2* *C* *123.8* *.* *1* old residue 83 adding: *981* *83* *Trp* *N* *N* *116.6* *.* *1* old residue 83 adding: *982* *83* *Trp* *NE1* *N* *129.3* *.* *1* new residue 84 adding: *983* *84* *Lys* *H* *H* *7.51* *.* *1* old residue 84 adding: *984* *84* *Lys* *HA* *H* *3.88* *.* *1* old residue 84 adding: *985* *84* *Lys* *HB2* *H* *2.20* *.* *2* old residue 84 adding: *986* *84* *Lys* *HB3* *H* *2.11* *.* *2* old residue 84 adding: *987* *84* *Lys* *HG2* *H* *1.82* *.* *2* old residue 84 adding: *988* *84* *Lys* *HG3* *H* *1.59* *.* *2* old residue 84 adding: *989* *84* *Lys* *HD2* *H* *1.61* *.* *2* old residue 84 adding: *990* *84* *Lys* *HD3* *H* *1.86* *.* *2* old residue 84 adding: *991* *84* *Lys* *HE2* *H* *2.93* *.* *2* old residue 84 adding: *992* *84* *Lys* *HE3* *H* *2.93* *.* *2* old residue 84 adding: *993* *84* *Lys* *C* *C* *180.1* *.* *1* old residue 84 adding: *994* *84* *Lys* *CA* *C* *60.2* *.* *1* old residue 84 adding: *995* *84* *Lys* *CB* *C* *31.6* *.* *1* old residue 84 adding: *996* *84* *Lys* *CG* *C* *25.5* *.* *1* old residue 84 adding: *997* *84* *Lys* *CD* *C* *29.4* *.* *1* old residue 84 adding: *998* *84* *Lys* *CE* *C* *41.8* *.* *1* old residue 84 adding: *999* *84* *Lys* *N* *N* *117.7* *.* *1* new residue 85 adding: *1000* *85* *Ser* *H* *H* *7.81* *.* *1* old residue 85 adding: *1001* *85* *Ser* *HA* *H* *4.20* *.* *1* old residue 85 adding: *1002* *85* *Ser* *HB2* *H* *3.99* *.* *2* old residue 85 adding: *1003* *85* *Ser* *HB3* *H* *4.43* *.* *2* old residue 85 adding: *1004* *85* *Ser* *C* *C* *175.1* *.* *1* old residue 85 adding: *1005* *85* *Ser* *CA* *C* *62.3* *.* *1* old residue 85 adding: *1006* *85* *Ser* *CB* *C* *62.3* *.* *1* old residue 85 adding: *1007* *85* *Ser* *N* *N* *117.7* *.* *1* new residue 86 adding: *1008* *86* *Ala* *H* *H* *7.43* *.* *1* old residue 86 adding: *1009* *86* *Ala* *HA* *H* *3.72* *.* *1* old residue 86 adding: *1010* *86* *Ala* *HB* *H* *1.15* *.* *1* old residue 86 adding: *1011* *86* *Ala* *C* *C* *178.6* *.* *1* old residue 86 adding: *1012* *86* *Ala* *CA* *C* *55.1* *.* *1* old residue 86 adding: *1013* *86* *Ala* *CB* *C* *18.7* *.* *1* old residue 86 adding: *1014* *86* *Ala* *N* *N* *123.6* *.* *1* new residue 87 adding: *1015* *87* *Trp* *H* *H* *8.48* *.* *1* old residue 87 adding: *1016* *87* *Trp* *HA* *H* *4.03* *.* *1* old residue 87 adding: *1017* *87* *Trp* *HB2* *H* *2.51* *.* *2* old residue 87 adding: *1018* *87* *Trp* *HB3* *H* *3.19* *.* *2* old residue 87 adding: *1019* *87* *Trp* *HD1* *H* *7.33* *.* *1* old residue 87 adding: *1020* *87* *Trp* *HE1* *H* *10.27* *.* *1* old residue 87 adding: *1021* *87* *Trp* *HE3* *H* *7.28* *.* *1* old residue 87 adding: *1022* *87* *Trp* *HZ2* *H* *7.63* *.* *1* old residue 87 adding: *1023* *87* *Trp* *HZ3* *H* *7.36* *.* *1* old residue 87 adding: *1024* *87* *Trp* *HH2* *H* *7.44* *.* *1* old residue 87 adding: *1025* *87* *Trp* *C* *C* *177.6* *.* *1* old residue 87 adding: *1026* *87* *Trp* *CA* *C* *59.6* *.* *1* old residue 87 adding: *1027* *87* *Trp* *CB* *C* *28.8* *.* *1* old residue 87 adding: *1028* *87* *Trp* *CD1* *C* *126.7* *.* *1* old residue 87 adding: *1029* *87* *Trp* *CE3* *C* *120.4* *.* *1* old residue 87 adding: *1030* *87* *Trp* *CZ2* *C* *114.5* *.* *1* old residue 87 adding: *1031* *87* *Trp* *CZ3* *C* *121.3* *.* *1* old residue 87 adding: *1032* *87* *Trp* *CH2* *C* *123.8* *.* *1* old residue 87 adding: *1033* *87* *Trp* *N* *N* *118.2* *.* *1* old residue 87 adding: *1034* *87* *Trp* *NE1* *N* *129.3* *.* *1* new residue 88 adding: *1035* *88* *Thr* *H* *H* *8.27* *.* *1* old residue 88 adding: *1036* *88* *Thr* *HA* *H* *3.78* *.* *1* old residue 88 adding: *1037* *88* *Thr* *HB* *H* *4.46* *.* *1* old residue 88 adding: *1038* *88* *Thr* *HG2* *H* *1.17* *.* *1* old residue 88 adding: *1039* *88* *Thr* *C* *C* *176.1* *.* *1* old residue 88 adding: *1040* *88* *Thr* *CA* *C* *67.1* *.* *1* old residue 88 adding: *1041* *88* *Thr* *CB* *C* *68.3* *.* *1* old residue 88 adding: *1042* *88* *Thr* *CG2* *C* *22.3* *.* *1* old residue 88 adding: *1043* *88* *Thr* *N* *N* *115.8* *.* *1* new residue 89 adding: *1044* *89* *Leu* *H* *H* *7.60* *.* *1* old residue 89 adding: *1045* *89* *Leu* *HA* *H* *3.81* *.* *1* old residue 89 adding: *1046* *89* *Leu* *HB2* *H* *2.27* *.* *2* old residue 89 adding: *1047* *89* *Leu* *HB3* *H* *1.51* *.* *2* old residue 89 adding: *1048* *89* *Leu* *HG* *H* *0.71* *.* *1* old residue 89 adding: *1049* *89* *Leu* *HD1* *H* *1.03* *.* *2* old residue 89 adding: *1050* *89* *Leu* *HD2* *H* *1.03* *.* *2* old residue 89 adding: *1051* *89* *Leu* *C* *C* *177.9* *.* *1* old residue 89 adding: *1052* *89* *Leu* *CA* *C* *58.3* *.* *1* old residue 89 adding: *1053* *89* *Leu* *CB* *C* *41.4* *.* *1* old residue 89 adding: *1054* *89* *Leu* *CG* *C* *26.4* *.* *1* old residue 89 adding: *1055* *89* *Leu* *CD1* *C* *26.0* *.* *1* old residue 89 adding: *1056* *89* *Leu* *CD2* *C* *26.0* *.* *1* old residue 89 adding: *1057* *89* *Leu* *N* *N* *120.7* *.* *1* new residue 90 adding: *1058* *90* *His* *H* *H* *7.46* *.* *1* old residue 90 adding: *1059* *90* *His* *HA* *H* *3.94* *.* *1* old residue 90 adding: *1060* *90* *His* *HB2* *H* *2.59* *.* *2* old residue 90 adding: *1061* *90* *His* *HB3* *H* *2.06* *.* *2* old residue 90 adding: *1062* *90* *His* *C* *C* *175.9* *.* *1* old residue 90 adding: *1063* *90* *His* *CA* *C* *57.2* *.* *1* old residue 90 adding: *1064* *90* *His* *CB* *C* *27.8* *.* *1* old residue 90 adding: *1065* *90* *His* *N* *N* *117.1* *.* *1* new residue 91 adding: *1066* *91* *Val* *H* *H* *7.96* *.* *1* old residue 91 adding: *1067* *91* *Val* *HA* *H* *3.17* *.* *1* old residue 91 adding: *1068* *91* *Val* *HB* *H* *1.78* *.* *1* old residue 91 adding: *1069* *91* *Val* *HG1* *H* *0.43* *.* *2* old residue 91 adding: *1070* *91* *Val* *HG2* *H* *0.59* *.* *2* old residue 91 adding: *1071* *91* *Val* *C* *C* *178.2* *.* *1* old residue 91 adding: *1072* *91* *Val* *CA* *C* *64.9* *.* *1* old residue 91 adding: *1073* *91* *Val* *CB* *C* *31.9* *.* *1* old residue 91 adding: *1074* *91* *Val* *CG1* *C* *20.9* *.* *1* old residue 91 adding: *1075* *91* *Val* *CG2* *C* *21.5* *.* *1* old residue 91 adding: *1076* *91* *Val* *N* *N* *116.4* *.* *1* new residue 92 adding: *1077* *92* *Glu* *H* *H* *8.31* *.* *1* old residue 92 adding: *1078* *92* *Glu* *HA* *H* *4.06* *.* *1* old residue 92 adding: *1079* *92* *Glu* *HB2* *H* *1.86* *.* *2* old residue 92 adding: *1080* *92* *Glu* *HB3* *H* *1.99* *.* *2* old residue 92 adding: *1081* *92* *Glu* *HG2* *H* *2.16* *.* *2* old residue 92 adding: *1082* *92* *Glu* *HG3* *H* *2.34* *.* *2* old residue 92 adding: *1083* *92* *Glu* *C* *C* *178.0* *.* *1* old residue 92 adding: *1084* *92* *Glu* *CA* *C* *58.1* *.* *1* old residue 92 adding: *1085* *92* *Glu* *CB* *C* *28.1* *.* *1* old residue 92 adding: *1086* *92* *Glu* *CG* *C* *34.6* *.* *1* old residue 92 adding: *1087* *92* *Glu* *N* *N* *119.5* *.* *1* new residue 93 adding: *1088* *93* *Gly* *H* *H* *7.62* *.* *1* old residue 93 adding: *1089* *93* *Gly* *HA2* *H* *3.84* *.* *2* old residue 93 adding: *1090* *93* *Gly* *HA3* *H* *3.91* *.* *2* old residue 93 adding: *1091* *93* *Gly* *C* *C* *173.8* *.* *1* old residue 93 adding: *1092* *93* *Gly* *CA* *C* *46.6* *.* *1* old residue 93 adding: *1093* *93* *Gly* *N* *N* *106.1* *.* *1* new residue 94 adding: *1094* *94* *Phe* *H* *H* *7.37* *.* *1* old residue 94 adding: *1095* *94* *Phe* *HA* *H* *4.52* *.* *1* old residue 94 adding: *1096* *94* *Phe* *HB2* *H* *2.82* *.* *2* old residue 94 adding: *1097* *94* *Phe* *HB3* *H* *3.10* *.* *2* old residue 94 adding: *1098* *94* *Phe* *HD1* *H* *7.01* *.* *3* old residue 94 adding: *1099* *94* *Phe* *HD2* *H* *7.01* *.* *3* old residue 94 adding: *1100* *94* *Phe* *HE1* *H* *7.10* *.* *3* old residue 94 adding: *1101* *94* *Phe* *HE2* *H* *7.10* *.* *3* old residue 94 adding: *1102* *94* *Phe* *C* *C* *175.8* *.* *1* old residue 94 adding: *1103* *94* *Phe* *CA* *C* *58.2* *.* *1* old residue 94 adding: *1104* *94* *Phe* *CB* *C* *38.9* *.* *1* old residue 94 adding: *1105* *94* *Phe* *CD1* *C* *131.1* *.* *1* old residue 94 adding: *1106* *94* *Phe* *CE1* *C* *130.6* *.* *1* old residue 94 adding: *1107* *94* *Phe* *N* *N* *117.3* *.* *1* new residue 95 adding: *1108* *95* *His* *H* *H* *7.86* *.* *1* old residue 95 adding: *1109* *95* *His* *HA* *H* *4.58* *.* *1* old residue 95 adding: *1110* *95* *His* *HB2* *H* *3.21* *.* *2* old residue 95 adding: *1111* *95* *His* *HB3* *H* *3.29* *.* *2* old residue 95 adding: *1112* *95* *His* *C* *C* *176.3* *.* *1* old residue 95 adding: *1113* *95* *His* *CA* *C* *55.8* *.* *1* old residue 95 adding: *1114* *95* *His* *CB* *C* *28.5* *.* *1* old residue 95 adding: *1115* *95* *His* *N* *N* *116.4* *.* *1* new residue 96 adding: *1116* *96* *Glu* *H* *H* *8.26* *.* *1* old residue 96 adding: *1117* *96* *Glu* *HA* *H* *4.08* *.* *1* old residue 96 adding: *1118* *96* *Glu* *HB2* *H* *2.04* *.* *2* old residue 96 adding: *1119* *96* *Glu* *HB3* *H* *2.04* *.* *2* old residue 96 adding: *1120* *96* *Glu* *HG2* *H* *2.31* *.* *2* old residue 96 adding: *1121* *96* *Glu* *HG3* *H* *2.31* *.* *2* old residue 96 adding: *1122* *96* *Glu* *C* *C* *176.7* *.* *1* old residue 96 adding: *1123* *96* *Glu* *CA* *C* *57.6* *.* *1* old residue 96 adding: *1124* *96* *Glu* *CB* *C* *29.1* *.* *1* old residue 96 adding: *1125* *96* *Glu* *CG* *C* *36.0* *.* *1* old residue 96 adding: *1126* *96* *Glu* *N* *N* *118.6* *.* *1* new residue 97 adding: *1127* *97* *Leu* *H* *H* *8.04* *.* *1* old residue 97 adding: *1128* *97* *Leu* *HA* *H* *4.24* *.* *1* old residue 97 adding: *1129* *97* *Leu* *HB2* *H* *1.62* *.* *2* old residue 97 adding: *1130* *97* *Leu* *HB3* *H* *1.71* *.* *2* old residue 97 adding: *1131* *97* *Leu* *HG* *H* *1.54* *.* *1* old residue 97 adding: *1132* *97* *Leu* *HD1* *H* *0.87* *.* *2* old residue 97 adding: *1133* *97* *Leu* *HD2* *H* *0.85* *.* *2* old residue 97 adding: *1134* *97* *Leu* *C* *C* *177.7* *.* *1* old residue 97 adding: *1135* *97* *Leu* *CA* *C* *56.3* *.* *1* old residue 97 adding: *1136* *97* *Leu* *CB* *C* *41.1* *.* *1* old residue 97 adding: *1137* *97* *Leu* *CG* *C* *27.1* *.* *1* old residue 97 adding: *1138* *97* *Leu* *CD1* *C* *25.1* *.* *1* old residue 97 adding: *1139* *97* *Leu* *CD2* *C* *24.2* *.* *1* old residue 97 adding: *1140* *97* *Leu* *N* *N* *119.5* *.* *1* new residue 98 adding: *1141* *98* *Ser* *H* *H* *8.28* *.* *1* old residue 98 adding: *1142* *98* *Ser* *HA* *H* *4.52* *.* *1* old residue 98 adding: *1143* *98* *Ser* *HB2* *H* *3.93* *.* *2* old residue 98 adding: *1144* *98* *Ser* *HB3* *H* *3.81* *.* *2* old residue 98 adding: *1145* *98* *Ser* *C* *C* *174.4* *.* *1* old residue 98 adding: *1146* *98* *Ser* *CA* *C* *58.1* *.* *1* old residue 98 adding: *1147* *98* *Ser* *CB* *C* *64.0* *.* *1* old residue 98 adding: *1148* *98* *Ser* *N* *N* *113.7* *.* *1* new residue 99 adding: *1149* *99* *Leu* *H* *H* *7.54* *.* *1* old residue 99 adding: *1150* *99* *Leu* *HA* *H* *4.52* *.* *1* old residue 99 adding: *1151* *99* *Leu* *HB2* *H* *1.61* *.* *2* old residue 99 adding: *1152* *99* *Leu* *HB3* *H* *1.34* *.* *2* old residue 99 adding: *1153* *99* *Leu* *HG* *H* *1.47* *.* *1* old residue 99 adding: *1154* *99* *Leu* *HD1* *H* *0.77* *.* *2* old residue 99 adding: *1155* *99* *Leu* *HD2* *H* *0.71* *.* *2* old residue 99 adding: *1156* *99* *Leu* *C* *C* *176.3* *.* *1* old residue 99 adding: *1157* *99* *Leu* *CA* *C* *54.5* *.* *1* old residue 99 adding: *1158* *99* *Leu* *CB* *C* *44.0* *.* *1* old residue 99 adding: *1159* *99* *Leu* *CG* *C* *26.5* *.* *1* old residue 99 adding: *1160* *99* *Leu* *CD1* *C* *26.4* *.* *1* old residue 99 adding: *1161* *99* *Leu* *CD2* *C* *23.8* *.* *1* old residue 99 adding: *1162* *99* *Leu* *N* *N* *122.1* *.* *1* new residue 100 adding: *1163* *100* *Asn* *H* *H* *8.27* *.* *1* old residue 100 adding: *1164* *100* *Asn* *HA* *H* *4.84* *.* *1* old residue 100 adding: *1165* *100* *Asn* *HB2* *H* *3.01* *.* *2* old residue 100 adding: *1166* *100* *Asn* *HB3* *H* *2.88* *.* *2* old residue 100 adding: *1167* *100* *Asn* *HD21* *H* *7.60* *.* *2* old residue 100 adding: *1168* *100* *Asn* *HD22* *H* *6.91* *.* *2* old residue 100 adding: *1169* *100* *Asn* *C* *C* *175.0* *.* *1* old residue 100 adding: *1170* *100* *Asn* *CA* *C* *51.4* *.* *1* old residue 100 adding: *1171* *100* *Asn* *CB* *C* *40.3* *.* *1* old residue 100 adding: *1172* *100* *Asn* *N* *N* *118.9* *.* *1* old residue 100 adding: *1173* *100* *Asn* *ND2* *N* *113.0* *.* *1* new residue 101 adding: *1174* *101* *Glu* *H* *H* *8.99* *.* *1* old residue 101 adding: *1175* *101* *Glu* *HA* *H* *3.69* *.* *1* old residue 101 adding: *1176* *101* *Glu* *HB2* *H* *2.07* *.* *2* old residue 101 adding: *1177* *101* *Glu* *HB3* *H* *2.19* *.* *2* old residue 101 adding: *1178* *101* *Glu* *HG2* *H* *2.29* *.* *2* old residue 101 adding: *1179* *101* *Glu* *HG3* *H* *2.29* *.* *2* old residue 101 adding: *1180* *101* *Glu* *C* *C* *177.1* *.* *1* old residue 101 adding: *1181* *101* *Glu* *CA* *C* *60.5* *.* *1* old residue 101 adding: *1182* *101* *Glu* *CB* *C* *29.1* *.* *1* old residue 101 adding: *1183* *101* *Glu* *CG* *C* *35.2* *.* *1* old residue 101 adding: *1184* *101* *Glu* *N* *N* *121.8* *.* *1* new residue 102 adding: *1185* *102* *Lys* *H* *H* *8.16* *.* *1* old residue 102 adding: *1186* *102* *Lys* *HA* *H* *3.90* *.* *1* old residue 102 adding: *1187* *102* *Lys* *HB2* *H* *1.84* *.* *2* old residue 102 adding: *1188* *102* *Lys* *HB3* *H* *1.92* *.* *2* old residue 102 adding: *1189* *102* *Lys* *HG2* *H* *1.41* *.* *2* old residue 102 adding: *1190* *102* *Lys* *HG3* *H* *1.56* *.* *2* old residue 102 adding: *1191* *102* *Lys* *HD2* *H* *1.61* *.* *2* old residue 102 adding: *1192* *102* *Lys* *HD3* *H* *1.70* *.* *2* old residue 102 adding: *1193* *102* *Lys* *HE2* *H* *2.93* *.* *2* old residue 102 adding: *1194* *102* *Lys* *HE3* *H* *2.93* *.* *2* old residue 102 adding: *1195* *102* *Lys* *C* *C* *179.6* *.* *1* old residue 102 adding: *1196* *102* *Lys* *CA* *C* *59.9* *.* *1* old residue 102 adding: *1197* *102* *Lys* *CB* *C* *32.2* *.* *1* old residue 102 adding: *1198* *102* *Lys* *CG* *C* *25.4* *.* *1* old residue 102 adding: *1199* *102* *Lys* *CD* *C* *29.4* *.* *1* old residue 102 adding: *1200* *102* *Lys* *CE* *C* *41.8* *.* *1* old residue 102 adding: *1201* *102* *Lys* *N* *N* *118.8* *.* *1* new residue 103 adding: *1202* *103* *Glu* *H* *H* *7.95* *.* *1* old residue 103 adding: *1203* *103* *Glu* *HA* *H* *4.12* *.* *1* old residue 103 adding: *1204* *103* *Glu* *HB2* *H* *2.02* *.* *2* old residue 103 adding: *1205* *103* *Glu* *HB3* *H* *2.19* *.* *2* old residue 103 adding: *1206* *103* *Glu* *HG2* *H* *2.41* *.* *2* old residue 103 adding: *1207* *103* *Glu* *HG3* *H* *2.41* *.* *2* old residue 103 adding: *1208* *103* *Glu* *C* *C* *178.7* *.* *1* old residue 103 adding: *1209* *103* *Glu* *CA* *C* *58.6* *.* *1* old residue 103 adding: *1210* *103* *Glu* *CB* *C* *29.4* *.* *1* old residue 103 adding: *1211* *103* *Glu* *CG* *C* *34.8* *.* *1* old residue 103 adding: *1212* *103* *Glu* *N* *N* *120.1* *.* *1* new residue 104 adding: *1213* *104* *Val* *H* *H* *8.15* *.* *1* old residue 104 adding: *1214* *104* *Val* *HA* *H* *3.42* *.* *1* old residue 104 adding: *1215* *104* *Val* *HB* *H* *2.05* *.* *1* old residue 104 adding: *1216* *104* *Val* *HG1* *H* *0.92* *.* *2* old residue 104 adding: *1217* *104* *Val* *HG2* *H* *0.93* *.* *2* old residue 104 adding: *1218* *104* *Val* *C* *C* *177.3* *.* *1* old residue 104 adding: *1219* *104* *Val* *CA* *C* *67.2* *.* *1* old residue 104 adding: *1220* *104* *Val* *CB* *C* *31.6* *.* *1* old residue 104 adding: *1221* *104* *Val* *CG1* *C* *21.2* *.* *1* old residue 104 adding: *1222* *104* *Val* *CG2* *C* *24.2* *.* *1* old residue 104 adding: *1223* *104* *Val* *N* *N* *119.2* *.* *1* new residue 105 adding: *1224* *105* *Lys* *H* *H* *8.33* *.* *1* old residue 105 adding: *1225* *105* *Lys* *HA* *H* *3.74* *.* *1* old residue 105 adding: *1226* *105* *Lys* *HB2* *H* *1.88* *.* *2* old residue 105 adding: *1227* *105* *Lys* *HB3* *H* *1.88* *.* *2* old residue 105 adding: *1228* *105* *Lys* *HG2* *H* *1.31* *.* *2* old residue 105 adding: *1229* *105* *Lys* *HG3* *H* *1.69* *.* *2* old residue 105 adding: *1230* *105* *Lys* *HD2* *H* *1.69* *.* *2* old residue 105 adding: *1231* *105* *Lys* *HD3* *H* *1.69* *.* *2* old residue 105 adding: *1232* *105* *Lys* *HE2* *H* *2.89* *.* *2* old residue 105 adding: *1233* *105* *Lys* *HE3* *H* *2.96* *.* *2* old residue 105 adding: *1234* *105* *Lys* *C* *C* *178.1* *.* *1* old residue 105 adding: *1235* *105* *Lys* *CA* *C* *60.3* *.* *1* old residue 105 adding: *1236* *105* *Lys* *CB* *C* *32.3* *.* *1* old residue 105 adding: *1237* *105* *Lys* *CG* *C* *28.0* *.* *1* old residue 105 adding: *1238* *105* *Lys* *CD* *C* *29.8* *.* *1* old residue 105 adding: *1239* *105* *Lys* *CE* *C* *42.1* *.* *1* old residue 105 adding: *1240* *105* *Lys* *N* *N* *116.9* *.* *1* new residue 106 adding: *1241* *106* *Lys* *H* *H* *7.41* *.* *1* old residue 106 adding: *1242* *106* *Lys* *HA* *H* *4.08* *.* *1* old residue 106 adding: *1243* *106* *Lys* *HB2* *H* *1.95* *.* *2* old residue 106 adding: *1244* *106* *Lys* *HB3* *H* *1.95* *.* *2* old residue 106 adding: *1245* *106* *Lys* *HG2* *H* *1.53* *.* *2* old residue 106 adding: *1246* *106* *Lys* *HG3* *H* *1.37* *.* *2* old residue 106 adding: *1247* *106* *Lys* *HD2* *H* *1.64* *.* *2* old residue 106 adding: *1248* *106* *Lys* *HD3* *H* *1.64* *.* *2* old residue 106 adding: *1249* *106* *Lys* *HE2* *H* *2.98* *.* *2* old residue 106 adding: *1250* *106* *Lys* *HE3* *H* *2.98* *.* *2* old residue 106 adding: *1251* *106* *Lys* *C* *C* *179.4* *.* *1* old residue 106 adding: *1252* *106* *Lys* *CA* *C* *59.1* *.* *1* old residue 106 adding: *1253* *106* *Lys* *CB* *C* *32.7* *.* *1* old residue 106 adding: *1254* *106* *Lys* *CG* *C* *24.7* *.* *1* old residue 106 adding: *1255* *106* *Lys* *CD* *C* *28.8* *.* *1* old residue 106 adding: *1256* *106* *Lys* *CE* *C* *42.1* *.* *1* old residue 106 adding: *1257* *106* *Lys* *N* *N* *118.8* *.* *1* new residue 107 adding: *1258* *107* *Leu* *H* *H* *8.12* *.* *1* old residue 107 adding: *1259* *107* *Leu* *HA* *H* *4.11* *.* *1* old residue 107 adding: *1260* *107* *Leu* *HB2* *H* *1.84* *.* *2* old residue 107 adding: *1261* *107* *Leu* *HB3* *H* *1.28* *.* *2* old residue 107 adding: *1262* *107* *Leu* *HG* *H* *1.77* *.* *1* old residue 107 adding: *1263* *107* *Leu* *HD1* *H* *0.84* *.* *2* old residue 107 adding: *1264* *107* *Leu* *HD2* *H* *1.01* *.* *2* old residue 107 adding: *1265* *107* *Leu* *C* *C* *180.4* *.* *1* old residue 107 adding: *1266* *107* *Leu* *CA* *C* *57.7* *.* *1* old residue 107 adding: *1267* *107* *Leu* *CB* *C* *42.2* *.* *1* old residue 107 adding: *1268* *107* *Leu* *CG* *C* *27.1* *.* *1* old residue 107 adding: *1269* *107* *Leu* *CD1* *C* *26.4* *.* *1* old residue 107 adding: *1270* *107* *Leu* *CD2* *C* *22.5* *.* *1* old residue 107 adding: *1271* *107* *Leu* *N* *N* *119.5* *.* *1* new residue 108 adding: *1272* *108* *Lys* *H* *H* *9.00* *.* *1* old residue 108 adding: *1273* *108* *Lys* *HA* *H* *3.60* *.* *1* old residue 108 adding: *1274* *108* *Lys* *HB2* *H* *0.45* *.* *2* old residue 108 adding: *1275* *108* *Lys* *HB3* *H* *1.01* *.* *2* old residue 108 adding: *1276* *108* *Lys* *HG2* *H* *0.92* *.* *2* old residue 108 adding: *1277* *108* *Lys* *HG3* *H* *0.92* *.* *2* old residue 108 adding: *1278* *108* *Lys* *HD2* *H* *1.84* *.* *2* old residue 108 adding: *1279* *108* *Lys* *HD3* *H* *1.28* *.* *2* old residue 108 adding: *1280* *108* *Lys* *HE2* *H* *2.93* *.* *2* old residue 108 adding: *1281* *108* *Lys* *HE3* *H* *2.93* *.* *2* old residue 108 adding: *1282* *108* *Lys* *C* *C* *178.4* *.* *1* old residue 108 adding: *1283* *108* *Lys* *CA* *C* *58.2* *.* *1* old residue 108 adding: *1284* *108* *Lys* *CB* *C* *27.8* *.* *1* old residue 108 adding: *1285* *108* *Lys* *CG* *C* *24.6* *.* *1* old residue 108 adding: *1286* *108* *Lys* *CD* *C* *28.8* *.* *1* old residue 108 adding: *1287* *108* *Lys* *CE* *C* *41.8* *.* *1* old residue 108 adding: *1288* *108* *Lys* *N* *N* *117.3* *.* *1* new residue 109 adding: *1289* *109* *Glu* *H* *H* *7.31* *.* *1* old residue 109 adding: *1290* *109* *Glu* *HA* *H* *4.40* *.* *1* old residue 109 adding: *1291* *109* *Glu* *HB2* *H* *2.13* *.* *2* old residue 109 adding: *1292* *109* *Glu* *HB3* *H* *2.13* *.* *2* old residue 109 adding: *1293* *109* *Glu* *HG2* *H* *2.52* *.* *2* old residue 109 adding: *1294* *109* *Glu* *HG3* *H* *2.42* *.* *2* old residue 109 adding: *1295* *109* *Glu* *C* *C* *178.7* *.* *1* old residue 109 adding: *1296* *109* *Glu* *CA* *C* *58.1* *.* *1* old residue 109 adding: *1297* *109* *Glu* *CB* *C* *28.6* *.* *1* old residue 109 adding: *1298* *109* *Glu* *CG* *C* *35.5* *.* *1* old residue 109 adding: *1299* *109* *Glu* *N* *N* *123.0* *.* *1* new residue 110 adding: *1300* *110* *Asp* *H* *H* *7.27* *.* *1* old residue 110 adding: *1301* *110* *Asp* *HA* *H* *4.55* *.* *1* old residue 110 adding: *1302* *110* *Asp* *HB2* *H* *3.31* *.* *2* old residue 110 adding: *1303* *110* *Asp* *HB3* *H* *2.69* *.* *2* old residue 110 adding: *1304* *110* *Asp* *C* *C* *178.4* *.* *1* old residue 110 adding: *1305* *110* *Asp* *CA* *C* *57.0* *.* *1* old residue 110 adding: *1306* *110* *Asp* *CB* *C* *40.2* *.* *1* old residue 110 adding: *1307* *110* *Asp* *N* *N* *121.1* *.* *1* new residue 111 adding: *1308* *111* *Val* *H* *H* *7.04* *.* *1* old residue 111 adding: *1309* *111* *Val* *HA* *H* *3.49* *.* *1* old residue 111 adding: *1310* *111* *Val* *HB* *H* *2.51* *.* *1* old residue 111 adding: *1311* *111* *Val* *HG1* *H* *0.93* *.* *2* old residue 111 adding: *1312* *111* *Val* *HG2* *H* *1.37* *.* *2* old residue 111 adding: *1313* *111* *Val* *C* *C* *177.1* *.* *1* old residue 111 adding: *1314* *111* *Val* *CA* *C* *67.5* *.* *1* old residue 111 adding: *1315* *111* *Val* *CB* *C* *30.9* *.* *1* old residue 111 adding: *1316* *111* *Val* *CG1* *C* *23.0* *.* *1* old residue 111 adding: *1317* *111* *Val* *CG2* *C* *22.5* *.* *1* old residue 111 adding: *1318* *111* *Val* *N* *N* *119.0* *.* *1* new residue 112 adding: *1319* *112* *Arg* *H* *H* *8.53* *.* *1* old residue 112 adding: *1320* *112* *Arg* *HA* *H* *3.15* *.* *1* old residue 112 adding: *1321* *112* *Arg* *HB2* *H* *2.03* *.* *2* old residue 112 adding: *1322* *112* *Arg* *HB3* *H* *2.16* *.* *2* old residue 112 adding: *1323* *112* *Arg* *HG2* *H* *1.34* *.* *2* old residue 112 adding: *1324* *112* *Arg* *HG3* *H* *1.03* *.* *2* old residue 112 adding: *1325* *112* *Arg* *HD2* *H* *3.02* *.* *2* old residue 112 adding: *1326* *112* *Arg* *HD3* *H* *3.21* *.* *2* old residue 112 adding: *1327* *112* *Arg* *C* *C* *177.9* *.* *1* old residue 112 adding: *1328* *112* *Arg* *CA* *C* *60.2* *.* *1* old residue 112 adding: *1329* *112* *Arg* *CB* *C* *29.1* *.* *1* old residue 112 adding: *1330* *112* *Arg* *CG* *C* *26.8* *.* *1* old residue 112 adding: *1331* *112* *Arg* *CD* *C* *42.6* *.* *1* old residue 112 adding: *1332* *112* *Arg* *N* *N* *121.2* *.* *1* new residue 113 adding: *1333* *113* *Lys* *H* *H* *7.49* *.* *1* old residue 113 adding: *1334* *113* *Lys* *HA* *H* *3.67* *.* *1* old residue 113 adding: *1335* *113* *Lys* *HB2* *H* *2.02* *.* *2* old residue 113 adding: *1336* *113* *Lys* *HB3* *H* *1.63* *.* *2* old residue 113 adding: *1337* *113* *Lys* *HG2* *H* *1.74* *.* *2* old residue 113 adding: *1338* *113* *Lys* *HG3* *H* *1.30* *.* *2* old residue 113 adding: *1339* *113* *Lys* *HD2* *H* *1.70* *.* *2* old residue 113 adding: *1340* *113* *Lys* *HD3* *H* *1.73* *.* *2* old residue 113 adding: *1341* *113* *Lys* *HE2* *H* *2.97* *.* *2* old residue 113 adding: *1342* *113* *Lys* *HE3* *H* *2.97* *.* *2* old residue 113 adding: *1343* *113* *Lys* *C* *C* *178.6* *.* *1* old residue 113 adding: *1344* *113* *Lys* *CA* *C* *60.0* *.* *1* old residue 113 adding: *1345* *113* *Lys* *CB* *C* *33.0* *.* *1* old residue 113 adding: *1346* *113* *Lys* *CG* *C* *26.1* *.* *1* old residue 113 adding: *1347* *113* *Lys* *CD* *C* *29.8* *.* *1* old residue 113 adding: *1348* *113* *Lys* *CE* *C* *42.1* *.* *1* old residue 113 adding: *1349* *113* *Lys* *N* *N* *115.4* *.* *1* new residue 114 adding: *1350* *114* *Leu* *H* *H* *7.54* *.* *1* old residue 114 adding: *1351* *114* *Leu* *HA* *H* *3.99* *.* *1* old residue 114 adding: *1352* *114* *Leu* *HB2* *H* *2.00* *.* *2* old residue 114 adding: *1353* *114* *Leu* *HB3* *H* *1.86* *.* *2* old residue 114 adding: *1354* *114* *Leu* *HG* *H* *1.77* *.* *1* old residue 114 adding: *1355* *114* *Leu* *HD1* *H* *1.09* *.* *2* old residue 114 adding: *1356* *114* *Leu* *HD2* *H* *1.01* *.* *2* old residue 114 adding: *1357* *114* *Leu* *C* *C* *177.6* *.* *1* old residue 114 adding: *1358* *114* *Leu* *CA* *C* *58.1* *.* *1* old residue 114 adding: *1359* *114* *Leu* *CB* *C* *42.3* *.* *1* old residue 114 adding: *1360* *114* *Leu* *CG* *C* *27.1* *.* *1* old residue 114 adding: *1361* *114* *Leu* *CD1* *C* *25.8* *.* *1* old residue 114 adding: *1362* *114* *Leu* *CD2* *C* *24.0* *.* *1* old residue 114 adding: *1363* *114* *Leu* *N* *N* *120.3* *.* *1* new residue 115 adding: *1364* *115* *Val* *H* *H* *8.45* *.* *1* old residue 115 adding: *1365* *115* *Val* *HA* *H* *3.33* *.* *1* old residue 115 adding: *1366* *115* *Val* *HB* *H* *2.04* *.* *1* old residue 115 adding: *1367* *115* *Val* *HG1* *H* *0.92* *.* *2* old residue 115 adding: *1368* *115* *Val* *HG2* *H* *0.67* *.* *2* old residue 115 adding: *1369* *115* *Val* *C* *C* *177.4* *.* *1* old residue 115 adding: *1370* *115* *Val* *CA* *C* *67.4* *.* *1* old residue 115 adding: *1371* *115* *Val* *CB* *C* *31.5* *.* *1* old residue 115 adding: *1372* *115* *Val* *CG1* *C* *23.4* *.* *1* old residue 115 adding: *1373* *115* *Val* *CG2* *C* *21.2* *.* *1* old residue 115 adding: *1374* *115* *Val* *N* *N* *119.3* *.* *1* new residue 116 adding: *1375* *116* *Ile* *H* *H* *8.44* *.* *1* old residue 116 adding: *1376* *116* *Ile* *HA* *H* *3.62* *.* *1* old residue 116 adding: *1377* *116* *Ile* *HB* *H* *1.82* *.* *1* old residue 116 adding: *1378* *116* *Ile* *HG12* *H* *1.46* *.* *2* old residue 116 adding: *1379* *116* *Ile* *HG13* *H* *1.23* *.* *2* old residue 116 adding: *1380* *116* *Ile* *HG2* *H* *0.84* *.* *1* old residue 116 adding: *1381* *116* *Ile* *HD1* *H* *0.68* *.* *1* old residue 116 adding: *1382* *116* *Ile* *C* *C* *178.5* *.* *1* old residue 116 adding: *1383* *116* *Ile* *CA* *C* *64.2* *.* *1* old residue 116 adding: *1384* *116* *Ile* *CB* *C* *36.9* *.* *1* old residue 116 adding: *1385* *116* *Ile* *CG1* *C* *28.6* *.* *1* old residue 116 adding: *1386* *116* *Ile* *CG2* *C* *17.3* *.* *1* old residue 116 adding: *1387* *116* *Ile* *CD1* *C* *12.3* *.* *1* old residue 116 adding: *1388* *116* *Ile* *N* *N* *118.4* *.* *1* new residue 117 adding: *1389* *117* *Phe* *H* *H* *8.13* *.* *1* old residue 117 adding: *1390* *117* *Phe* *HA* *H* *4.37* *.* *1* old residue 117 adding: *1391* *117* *Phe* *HB2* *H* *3.35* *.* *2* old residue 117 adding: *1392* *117* *Phe* *HB3* *H* *3.13* *.* *2* old residue 117 adding: *1393* *117* *Phe* *HD1* *H* *7.21* *.* *3* old residue 117 adding: *1394* *117* *Phe* *HD2* *H* *7.21* *.* *3* old residue 117 adding: *1395* *117* *Phe* *HE1* *H* *7.33* *.* *3* old residue 117 adding: *1396* *117* *Phe* *HE2* *H* *7.33* *.* *3* old residue 117 adding: *1397* *117* *Phe* *C* *C* *179.1* *.* *1* old residue 117 adding: *1398* *117* *Phe* *CA* *C* *60.9* *.* *1* old residue 117 adding: *1399* *117* *Phe* *CB* *C* *38.5* *.* *1* old residue 117 adding: *1400* *117* *Phe* *CD1* *C* *130.8* *.* *1* old residue 117 adding: *1401* *117* *Phe* *CE1* *C* *130.9* *.* *1* old residue 117 adding: *1402* *117* *Phe* *N* *N* *119.6* *.* *1* new residue 118 adding: *1403* *118* *Ala* *H* *H* *8.37* *.* *1* old residue 118 adding: *1404* *118* *Ala* *HA* *H* *4.00* *.* *1* old residue 118 adding: *1405* *118* *Ala* *HB* *H* *1.65* *.* *1* old residue 118 adding: *1406* *118* *Ala* *C* *C* *179.4* *.* *1* old residue 118 adding: *1407* *118* *Ala* *CA* *C* *55.4* *.* *1* old residue 118 adding: *1408* *118* *Ala* *CB* *C* *19.1* *.* *1* old residue 118 adding: *1409* *118* *Ala* *N* *N* *122.9* *.* *1* new residue 119 adding: *1410* *119* *Val* *H* *H* *8.84* *.* *1* old residue 119 adding: *1411* *119* *Val* *HA* *H* *3.51* *.* *1* old residue 119 adding: *1412* *119* *Val* *HB* *H* *2.07* *.* *1* old residue 119 adding: *1413* *119* *Val* *HG1* *H* *0.91* *.* *2* old residue 119 adding: *1414* *119* *Val* *HG2* *H* *0.98* *.* *2* old residue 119 adding: *1415* *119* *Val* *C* *C* *179.0* *.* *1* old residue 119 adding: *1416* *119* *Val* *CA* *C* *66.7* *.* *1* old residue 119 adding: *1417* *119* *Val* *CB* *C* *31.8* *.* *1* old residue 119 adding: *1418* *119* *Val* *CG1* *C* *21.2* *.* *1* old residue 119 adding: *1419* *119* *Val* *CG2* *C* *22.6* *.* *1* old residue 119 adding: *1420* *119* *Val* *N* *N* *119.4* *.* *1* new residue 120 adding: *1421* *120* *Asn* *H* *H* *8.75* *.* *1* old residue 120 adding: *1422* *120* *Asn* *HA* *H* *4.44* *.* *1* old residue 120 adding: *1423* *120* *Asn* *HB2* *H* *2.90* *.* *2* old residue 120 adding: *1424* *120* *Asn* *HB3* *H* *2.71* *.* *2* old residue 120 adding: *1425* *120* *Asn* *HD21* *H* *6.87* *.* *2* old residue 120 adding: *1426* *120* *Asn* *HD22* *H* *7.54* *.* *2* old residue 120 adding: *1427* *120* *Asn* *C* *C* *177.9* *.* *1* old residue 120 adding: *1428* *120* *Asn* *CA* *C* *55.6* *.* *1* old residue 120 adding: *1429* *120* *Asn* *CB* *C* *38.0* *.* *1* old residue 120 adding: *1430* *120* *Asn* *N* *N* *118.8* *.* *1* old residue 120 adding: *1431* *120* *Asn* *ND2* *N* *111.4* *.* *1* new residue 121 adding: *1432* *121* *Ser* *H* *H* *7.75* *.* *1* old residue 121 adding: *1433* *121* *Ser* *HA* *H* *4.13* *.* *1* old residue 121 adding: *1434* *121* *Ser* *HB2* *H* *3.87* *.* *2* old residue 121 adding: *1435* *121* *Ser* *HB3* *H* *3.77* *.* *2* old residue 121 adding: *1436* *121* *Ser* *C* *C* *175.5* *.* *1* old residue 121 adding: *1437* *121* *Ser* *CA* *C* *61.2* *.* *1* old residue 121 adding: *1438* *121* *Ser* *CB* *C* *62.9* *.* *1* old residue 121 adding: *1439* *121* *Ser* *N* *N* *115.9* *.* *1* new residue 122 adding: *1440* *122* *Leu* *H* *H* *7.51* *.* *1* old residue 122 adding: *1441* *122* *Leu* *HA* *H* *4.11* *.* *1* old residue 122 adding: *1442* *122* *Leu* *HB2* *H* *1.73* *.* *2* old residue 122 adding: *1443* *122* *Leu* *HB3* *H* *1.73* *.* *2* old residue 122 adding: *1444* *122* *Leu* *HG* *H* *1.76* *.* *1* old residue 122 adding: *1445* *122* *Leu* *HD1* *H* *0.94* *.* *2* old residue 122 adding: *1446* *122* *Leu* *HD2* *H* *0.89* *.* *2* old residue 122 adding: *1447* *122* *Leu* *C* *C* *178.6* *.* *1* old residue 122 adding: *1448* *122* *Leu* *CA* *C* *57.0* *.* *1* old residue 122 adding: *1449* *122* *Leu* *CB* *C* *42.2* *.* *1* old residue 122 adding: *1450* *122* *Leu* *CG* *C* *26.8* *.* *1* old residue 122 adding: *1451* *122* *Leu* *CD1* *C* *25.0* *.* *1* old residue 122 adding: *1452* *122* *Leu* *CD2* *C* *24.4* *.* *1* old residue 122 adding: *1453* *122* *Leu* *N* *N* *122.2* *.* *1* new residue 123 adding: *1454* *123* *Glu* *H* *H* *7.91* *.* *1* old residue 123 adding: *1455* *123* *Glu* *HA* *H* *4.09* *.* *1* old residue 123 adding: *1456* *123* *Glu* *HB2* *H* *1.98* *.* *2* old residue 123 adding: *1457* *123* *Glu* *HB3* *H* *1.98* *.* *2* old residue 123 adding: *1458* *123* *Glu* *HG2* *H* *2.26* *.* *2* old residue 123 adding: *1459* *123* *Glu* *HG3* *H* *2.36* *.* *2* old residue 123 adding: *1460* *123* *Glu* *C* *C* *177.4* *.* *1* old residue 123 adding: *1461* *123* *Glu* *CA* *C* *57.3* *.* *1* old residue 123 adding: *1462* *123* *Glu* *CB* *C* *29.2* *.* *1* old residue 123 adding: *1463* *123* *Glu* *CG* *C* *35.1* *.* *1* old residue 123 adding: *1464* *123* *Glu* *N* *N* *117.9* *.* *1* new residue 124 adding: *1465* *124* *His* *H* *H* *8.10* *.* *1* old residue 124 adding: *1466* *124* *His* *HA* *H* *4.59* *.* *1* old residue 124 adding: *1467* *124* *His* *HB2* *H* *3.24* *.* *2* old residue 124 adding: *1468* *124* *His* *HB3* *H* *3.14* *.* *2* old residue 124 adding: *1469* *124* *His* *C* *C* *174.8* *.* *1* old residue 124 adding: *1470* *124* *His* *CA* *C* *55.8* *.* *1* old residue 124 adding: *1471* *124* *His* *CB* *C* *28.5* *.* *1* old residue 124 adding: *1472* *124* *His* *N* *N* *116.4* *.* *1* new residue 125 adding: *1473* *125* *His* *H* *H* *8.13* *.* *1* old residue 125 adding: *1474* *125* *His* *HA* *H* *4.61* *.* *1* old residue 125 adding: *1475* *125* *His* *HB2* *H* *3.26* *.* *2* old residue 125 adding: *1476* *125* *His* *HB3* *H* *3.16* *.* *2* old residue 125 adding: *1477* *125* *His* *C* *C* *174.4* *.* *1* old residue 125 adding: *1478* *125* *His* *CA* *C* *55.8* *.* *1* old residue 125 adding: *1479* *125* *His* *CB* *C* *28.9* *.* *1* old residue 125 adding: *1480* *125* *His* *N* *N* *117.4* *.* *1* new residue 126 adding: *1481* *126* *His* *H* *H* *8.42* *.* *1* old residue 126 adding: *1482* *126* *His* *HA* *H* *4.68* *.* *1* old residue 126 adding: *1483* *126* *His* *HB2* *H* *3.15* *.* *2* old residue 126 adding: *1484* *126* *His* *HB3* *H* *3.24* *.* *2* old residue 126 adding: *1485* *126* *His* *C* *C* *174.2* *.* *1* old residue 126 adding: *1486* *126* *His* *CA* *C* *55.3* *.* *1* old residue 126 adding: *1487* *126* *His* *CB* *C* *28.8* *.* *1* old residue 126 adding: *1488* *126* *His* *N* *N* *118.6* *.* *1* new residue 127 adding: *1489* *127* *His* *H* *H* *8.54* *.* *1* old residue 127 adding: *1490* *127* *His* *HA* *H* *4.67* *.* *1* old residue 127 adding: *1491* *127* *His* *HB2* *H* *3.24* *.* *2* old residue 127 adding: *1492* *127* *His* *HB3* *H* *3.15* *.* *2* old residue 127 adding: *1493* *127* *His* *C* *C* *174.0* *.* *1* old residue 127 adding: *1494* *127* *His* *CA* *C* *55.3* *.* *1* old residue 127 adding: *1495* *127* *His* *CB* *C* *29.3* *.* *1* old residue 127 adding: *1496* *127* *His* *N* *N* *119.6* *.* *1* new residue 128 adding: *1497* *128* *His* *H* *H* *8.55* *.* *1* old residue 128 adding: *1498* *128* *His* *HA* *H* *4.68* *.* *1* old residue 128 adding: *1499* *128* *His* *HB2* *H* *3.24* *.* *2* old residue 128 adding: *1500* *128* *His* *HB3* *H* *3.24* *.* *2* old residue 128 adding: *1501* *128* *His* *C* *C* *173.5* *.* *1* old residue 128 adding: *1502* *128* *His* *CA* *C* *55.5* *.* *1* old residue 128 adding: *1503* *128* *His* *CB* *C* *29.4* *.* *1* old residue 128 adding: *1504* *128* *His* *N* *N* *120.3* *.* *1* new residue 129 adding: *1505* *129* *His* *H* *H* *8.39* *.* *1* old residue 129 adding: *1506* *129* *His* *HA* *H* *4.67* *.* *1* old residue 129 adding: *1507* *129* *His* *HB2* *H* *3.24* *.* *2* old residue 129 adding: *1508* *129* *His* *HB3* *H* *3.24* *.* *2* old residue 129 adding: *1509* *129* *His* *CA* *C* *57.0* *.* *1* old residue 129 adding: *1510* *129* *His* *CB* *C* *29.6* *.* *1* old residue 129 adding: *1511* *129* *His* *N* *N* *125.5* *.* *1* seqcode size is : 129 seqcode: 127 shift counts are : 8 seqcode: 32 shift counts are : 17 seqcode: 90 shift counts are : 8 seqcode: 118 shift counts are : 7 seqcode: 71 shift counts are : 14 seqcode: 102 shift counts are : 17 seqcode: 18 shift counts are : 14 seqcode: 125 shift counts are : 8 seqcode: 16 shift counts are : 11 seqcode: 44 shift counts are : 11 seqcode: 55 shift counts are : 17 seqcode: 84 shift counts are : 17 seqcode: 27 shift counts are : 8 seqcode: 95 shift counts are : 8 seqcode: 57 shift counts are : 17 seqcode: 20 shift counts are : 17 seqcode: 109 shift counts are : 11 seqcode: 89 shift counts are : 14 seqcode: 31 shift counts are : 14 seqcode: 35 shift counts are : 11 seqcode: 11 shift counts are : 14 seqcode: 78 shift counts are : 11 seqcode: 93 shift counts are : 6 seqcode: 106 shift counts are : 17 seqcode: 65 shift counts are : 14 seqcode: 29 shift counts are : 17 seqcode: 114 shift counts are : 14 seqcode: 58 shift counts are : 6 seqcode: 15 shift counts are : 11 seqcode: 81 shift counts are : 14 seqcode: 60 shift counts are : 20 seqcode: 101 shift counts are : 11 seqcode: 73 shift counts are : 14 seqcode: 86 shift counts are : 7 seqcode: 76 shift counts are : 11 seqcode: 62 shift counts are : 8 seqcode: 67 shift counts are : 17 seqcode: 129 shift counts are : 7 seqcode: 2 shift counts are : 8 seqcode: 17 shift counts are : 14 seqcode: 110 shift counts are : 8 seqcode: 82 shift counts are : 14 seqcode: 14 shift counts are : 7 seqcode: 112 shift counts are : 14 seqcode: 69 shift counts are : 8 seqcode: 49 shift counts are : 11 seqcode: 24 shift counts are : 11 seqcode: 124 shift counts are : 8 seqcode: 104 shift counts are : 11 seqcode: 121 shift counts are : 8 seqcode: 79 shift counts are : 13 seqcode: 23 shift counts are : 14 seqcode: 96 shift counts are : 11 seqcode: 126 shift counts are : 8 seqcode: 47 shift counts are : 14 seqcode: 8 shift counts are : 11 seqcode: 98 shift counts are : 8 seqcode: 37 shift counts are : 7 seqcode: 117 shift counts are : 14 seqcode: 43 shift counts are : 14 seqcode: 5 shift counts are : 9 seqcode: 33 shift counts are : 7 seqcode: 21 shift counts are : 6 seqcode: 63 shift counts are : 11 seqcode: 7 shift counts are : 7 seqcode: 26 shift counts are : 7 seqcode: 80 shift counts are : 12 seqcode: 119 shift counts are : 11 seqcode: 99 shift counts are : 14 seqcode: 72 shift counts are : 14 seqcode: 74 shift counts are : 8 seqcode: 61 shift counts are : 17 seqcode: 108 shift counts are : 17 seqcode: 115 shift counts are : 11 seqcode: 92 shift counts are : 11 seqcode: 103 shift counts are : 11 seqcode: 10 shift counts are : 14 seqcode: 113 shift counts are : 17 seqcode: 91 shift counts are : 11 seqcode: 48 shift counts are : 17 seqcode: 107 shift counts are : 14 seqcode: 87 shift counts are : 20 seqcode: 77 shift counts are : 9 seqcode: 123 shift counts are : 11 seqcode: 50 shift counts are : 14 seqcode: 39 shift counts are : 17 seqcode: 64 shift counts are : 11 seqcode: 97 shift counts are : 14 seqcode: 12 shift counts are : 11 seqcode: 41 shift counts are : 14 seqcode: 52 shift counts are : 11 seqcode: 56 shift counts are : 11 seqcode: 45 shift counts are : 11 seqcode: 66 shift counts are : 14 seqcode: 19 shift counts are : 8 seqcode: 54 shift counts are : 11 seqcode: 70 shift counts are : 17 seqcode: 68 shift counts are : 7 seqcode: 1 shift counts are : 1 seqcode: 88 shift counts are : 9 seqcode: 116 shift counts are : 14 seqcode: 30 shift counts are : 14 seqcode: 100 shift counts are : 11 seqcode: 25 shift counts are : 14 seqcode: 128 shift counts are : 8 seqcode: 28 shift counts are : 11 seqcode: 120 shift counts are : 11 seqcode: 40 shift counts are : 14 seqcode: 75 shift counts are : 11 seqcode: 83 shift counts are : 20 seqcode: 59 shift counts are : 14 seqcode: 53 shift counts are : 11 seqcode: 122 shift counts are : 14 seqcode: 42 shift counts are : 11 seqcode: 22 shift counts are : 8 seqcode: 46 shift counts are : 11 seqcode: 13 shift counts are : 11 seqcode: 105 shift counts are : 17 seqcode: 6 shift counts are : 8 seqcode: 85 shift counts are : 8 seqcode: 36 shift counts are : 11 seqcode: 3 shift counts are : 14 seqcode: 94 shift counts are : 14 seqcode: 51 shift counts are : 9 seqcode: 9 shift counts are : 11 seqcode: 111 shift counts are : 11 seqcode: 38 shift counts are : 14 seqcode: 4 shift counts are : 8 seqcode: 34 shift counts are : 7 setting ambig code at 830 for HD2 to 2 setting ambig code at 829 for HD1 to 2 setting ambig code at 183 for HD2 to 2 setting ambig code at 182 for HD1 to 2 setting ambig code at 1056 for HD2 to 2 setting ambig code at 1055 for HD1 to 2 setting ambig code at 753 for HD2 to 2 setting ambig code at 752 for HD1 to 2 setting ambig code at 1362 for HD2 to 2 setting ambig code at 1361 for HD1 to 2 setting ambig code at 961 for HD2 to 2 setting ambig code at 960 for HD1 to 2 setting ambig code at 247 for HG2 to 2 setting ambig code at 246 for HG1 to 2 setting ambig code at 1222 for HG2 to 2 setting ambig code at 1221 for HG1 to 2 setting ambig code at 236 for HD2 to 2 setting ambig code at 235 for HD1 to 2 setting ambig code at 523 for HD2 to 2 setting ambig code at 522 for HD1 to 2 setting ambig code at 1419 for HG2 to 2 setting ambig code at 1418 for HG1 to 2 setting ambig code at 1161 for HD2 to 2 setting ambig code at 1160 for HD1 to 2 setting ambig code at 844 for HD2 to 2 setting ambig code at 843 for HD1 to 2 setting ambig code at 1373 for HG2 to 2 setting ambig code at 1372 for HG1 to 2 setting ambig code at 1075 for HG2 to 2 setting ambig code at 1074 for HG1 to 2 setting ambig code at 1270 for HD2 to 2 setting ambig code at 1269 for HD1 to 2 setting ambig code at 1139 for HD2 to 2 setting ambig code at 1138 for HD1 to 2 setting ambig code at 451 for HD2 to 2 setting ambig code at 450 for HD1 to 2 setting ambig code at 607 for HG2 to 2 setting ambig code at 606 for HG1 to 2 setting ambig code at 437 for HD2 to 2 setting ambig code at 436 for HD1 to 2 setting ambig code at 1452 for HD2 to 2 setting ambig code at 1451 for HD1 to 2 setting ambig code at 462 for HG2 to 2 setting ambig code at 461 for HG1 to 2 setting ambig code at 76 for HG2 to 2 setting ambig code at 75 for HG1 to 2 setting ambig code at 1317 for HG2 to 2 setting ambig code at 1316 for HG1 to 2 1 1 MET C C 177.6 . 1 2 2 SER H H 8.27 . 1 3 2 SER HA H 4.51 . 1 4 2 SER HB2 H 3.92 . 2 5 2 SER HB3 H 3.80 . 2 6 2 SER C C 174.3 . 1 7 2 SER CA C 58.2 . 1 8 2 SER CB C 64.0 . 1 9 2 SER N N 115.9 . 1 10 3 ILE H H 8.15 . 1 11 3 ILE HA H 4.24 . 1 12 3 ILE HB H 1.82 . 1 13 3 ILE HG12 H 1.46 . 2 14 3 ILE HG13 H 1.15 . 2 15 3 ILE HG2 H 0.90 . 1 16 3 ILE HD1 H 0.81 . 1 17 3 ILE C C 176.1 . 1 18 3 ILE CA C 61.3 . 1 19 3 ILE CB C 38.9 . 1 20 3 ILE CG1 C 27.2 . 1 21 3 ILE CG2 C 17.9 . 1 22 3 ILE CD1 C 13.2 . 1 23 3 ILE N N 121.7 . 1 24 4 SER H H 8.58 . 1 25 4 SER HA H 4.53 . 1 26 4 SER HB2 H 3.76 . 2 27 4 SER HB3 H 3.76 . 2 28 4 SER C C 174.1 . 1 29 4 SER CA C 58.6 . 1 30 4 SER CB C 64.2 . 1 31 4 SER N N 120.4 . 1 32 5 THR H H 8.11 . 1 33 5 THR HA H 4.53 . 1 34 5 THR HB H 4.37 . 1 35 5 THR HG2 H 1.23 . 1 36 5 THR C C 175.2 . 1 37 5 THR CA C 61.0 . 1 38 5 THR CB C 71.8 . 1 39 5 THR CG2 C 22.1 . 1 40 5 THR N N 114.0 . 1 41 6 SER H H 8.78 . 1 42 6 SER HA H 3.96 . 1 43 6 SER HB2 H 3.73 . 2 44 6 SER HB3 H 3.71 . 2 45 6 SER C C 175.9 . 1 46 6 SER CA C 61.0 . 1 47 6 SER CB C 62.1 . 1 48 6 SER N N 118.6 . 1 49 7 ALA H H 7.95 . 1 50 7 ALA HA H 4.15 . 1 51 7 ALA HB H 1.41 . 1 52 7 ALA C C 178.2 . 1 53 7 ALA CA C 56.0 . 1 54 7 ALA CB C 18.6 . 1 55 7 ALA N N 121.5 . 1 56 8 GLU H H 7.51 . 1 57 8 GLU HA H 3.92 . 1 58 8 GLU HB2 H 2.16 . 2 59 8 GLU HB3 H 2.16 . 2 60 8 GLU HG2 H 2.06 . 2 61 8 GLU HG3 H 2.18 . 2 62 8 GLU C C 178.7 . 1 63 8 GLU CA C 59.1 . 1 64 8 GLU CB C 30.7 . 1 65 8 GLU CG C 37.5 . 1 66 8 GLU N N 114.5 . 1 67 9 VAL H H 7.83 . 1 68 9 VAL HA H 3.58 . 1 69 9 VAL HB H 1.85 . 1 70 9 VAL HG1 H 0.89 . 2 71 9 VAL HG2 H 0.68 . 2 72 9 VAL C C 179.2 . 1 73 9 VAL CA C 66.6 . 1 74 9 VAL CB C 31.4 . 1 75 9 VAL CG1 C 22.5 . 2 76 9 VAL CG2 C 20.7 . 2 77 9 VAL N N 121.6 . 1 78 10 TYR H H 8.18 . 1 79 10 TYR HA H 4.48 . 1 80 10 TYR HB2 H 3.44 . 2 81 10 TYR HB3 H 2.73 . 2 82 10 TYR HD1 H 6.97 . 3 83 10 TYR HD2 H 6.97 . 3 84 10 TYR HE1 H 6.79 . 3 85 10 TYR HE2 H 6.79 . 3 86 10 TYR C C 177.6 . 1 87 10 TYR CA C 60.1 . 1 88 10 TYR CB C 36.9 . 1 89 10 TYR CD1 C 131.8 . 1 90 10 TYR CE1 C 117.5 . 1 91 10 TYR N N 117.8 . 1 92 11 TYR H H 8.11 . 1 93 11 TYR HA H 3.74 . 1 94 11 TYR HB2 H 3.05 . 2 95 11 TYR HB3 H 3.31 . 2 96 11 TYR HD1 H 7.07 . 3 97 11 TYR HD2 H 7.07 . 3 98 11 TYR HE1 H 6.79 . 3 99 11 TYR HE2 H 6.79 . 3 100 11 TYR C C 176.2 . 1 101 11 TYR CA C 63.3 . 1 102 11 TYR CB C 38.9 . 1 103 11 TYR CD1 C 132.0 . 1 104 11 TYR CE1 C 117.9 . 1 105 11 TYR N N 120.0 . 1 106 12 GLU H H 8.31 . 1 107 12 GLU HA H 3.97 . 1 108 12 GLU HB2 H 2.24 . 2 109 12 GLU HB3 H 2.17 . 2 110 12 GLU HG2 H 2.61 . 2 111 12 GLU HG3 H 2.61 . 2 112 12 GLU C C 179.7 . 1 113 12 GLU CA C 59.0 . 1 114 12 GLU CB C 28.0 . 1 115 12 GLU CG C 34.4 . 1 116 12 GLU N N 117.6 . 1 117 13 GLU H H 8.27 . 1 118 13 GLU HA H 3.82 . 1 119 13 GLU HB2 H 1.83 . 2 120 13 GLU HB3 H 2.39 . 2 121 13 GLU HG2 H 2.26 . 2 122 13 GLU HG3 H 2.71 . 2 123 13 GLU C C 178.9 . 1 124 13 GLU CA C 58.7 . 1 125 13 GLU CB C 28.9 . 1 126 13 GLU CG C 34.9 . 1 127 13 GLU N N 119.8 . 1 128 14 ALA H H 8.21 . 1 129 14 ALA HA H 3.67 . 1 130 14 ALA HB H 0.35 . 1 131 14 ALA C C 178.8 . 1 132 14 ALA CA C 56.1 . 1 133 14 ALA CB C 17.5 . 1 134 14 ALA N N 123.3 . 1 135 15 GLU H H 7.94 . 1 136 15 GLU HA H 3.96 . 1 137 15 GLU HB2 H 2.32 . 2 138 15 GLU HB3 H 1.99 . 2 139 15 GLU HG2 H 2.25 . 2 140 15 GLU HG3 H 1.93 . 2 141 15 GLU C C 180.1 . 1 142 15 GLU CA C 58.7 . 1 143 15 GLU CB C 30.2 . 1 144 15 GLU CG C 38.0 . 1 145 15 GLU N N 116.7 . 1 146 16 GLU H H 7.68 . 1 147 16 GLU HA H 4.05 . 1 148 16 GLU HB2 H 1.99 . 2 149 16 GLU HB3 H 1.86 . 2 150 16 GLU HG2 H 2.34 . 2 151 16 GLU HG3 H 2.15 . 2 152 16 GLU C C 179.9 . 1 153 16 GLU CA C 58.9 . 1 154 16 GLU CB C 28.1 . 1 155 16 GLU CG C 34.6 . 1 156 16 GLU N N 120.7 . 1 157 17 PHE H H 8.03 . 1 158 17 PHE HA H 4.37 . 1 159 17 PHE HB2 H 2.83 . 2 160 17 PHE HB3 H 3.57 . 2 161 17 PHE HD1 H 7.10 . 3 162 17 PHE HD2 H 7.10 . 3 163 17 PHE HE1 H 7.21 . 3 164 17 PHE HE2 H 7.21 . 3 165 17 PHE C C 178.6 . 1 166 17 PHE CA C 62.0 . 1 167 17 PHE CB C 37.8 . 1 168 17 PHE CD1 C 130.7 . 1 169 17 PHE CE1 C 130.8 . 1 170 17 PHE N N 119.5 . 1 171 18 LEU H H 9.12 . 1 172 18 LEU HA H 3.79 . 1 173 18 LEU HB2 H 1.60 . 2 174 18 LEU HB3 H 2.13 . 2 175 18 LEU HG H 1.61 . 1 176 18 LEU HD1 H 1.04 . 2 177 18 LEU HD2 H 0.92 . 2 178 18 LEU C C 180.6 . 1 179 18 LEU CA C 58.7 . 1 180 18 LEU CB C 41.6 . 1 181 18 LEU CG C 26.9 . 1 182 18 LEU CD1 C 26.8 . 2 183 18 LEU CD2 C 24.3 . 2 184 18 LEU N N 122.2 . 1 185 19 SER H H 8.18 . 1 186 19 SER HA H 4.21 . 1 187 19 SER HB2 H 4.04 . 2 188 19 SER HB3 H 4.04 . 2 189 19 SER C C 175.6 . 1 190 19 SER CA C 61.3 . 1 191 19 SER CB C 62.8 . 1 192 19 SER N N 115.9 . 1 193 20 LYS H H 7.41 . 1 194 20 LYS HA H 4.45 . 1 195 20 LYS HB2 H 1.95 . 2 196 20 LYS HB3 H 2.12 . 2 197 20 LYS HG2 H 1.61 . 2 198 20 LYS HG3 H 1.61 . 2 199 20 LYS HD2 H 1.70 . 2 200 20 LYS HD3 H 1.70 . 2 201 20 LYS HE2 H 2.93 . 2 202 20 LYS HE3 H 2.93 . 2 203 20 LYS C C 176.8 . 1 204 20 LYS CA C 56.0 . 1 205 20 LYS CB C 33.1 . 1 206 20 LYS CG C 25.1 . 1 207 20 LYS CD C 29.3 . 1 208 20 LYS CE C 42.1 . 1 209 20 LYS N N 118.7 . 1 210 21 GLY H H 8.02 . 1 211 21 GLY HA2 H 4.29 . 2 212 21 GLY HA3 H 3.72 . 2 213 21 GLY C C 173.9 . 1 214 21 GLY CA C 45.5 . 1 215 21 GLY N N 107.9 . 1 216 22 ASP H H 8.20 . 1 217 22 ASP HA H 4.92 . 1 218 22 ASP HB2 H 3.09 . 2 219 22 ASP HB3 H 2.58 . 2 220 22 ASP C C 175.6 . 1 221 22 ASP CA C 51.6 . 1 222 22 ASP CB C 38.8 . 1 223 22 ASP N N 121.8 . 1 224 23 LEU H H 7.89 . 1 225 23 LEU HA H 3.89 . 1 226 23 LEU HB2 H 1.91 . 2 227 23 LEU HB3 H 1.40 . 2 228 23 LEU HG H 1.76 . 1 229 23 LEU HD1 H 0.87 . 2 230 23 LEU HD2 H 0.77 . 2 231 23 LEU C C 178.8 . 1 232 23 LEU CA C 58.1 . 1 233 23 LEU CB C 41.6 . 1 234 23 LEU CG C 27.3 . 1 235 23 LEU CD1 C 25.3 . 2 236 23 LEU CD2 C 23.1 . 2 237 23 LEU N N 121.7 . 1 238 24 VAL H H 8.25 . 1 239 24 VAL HA H 3.48 . 1 240 24 VAL HB H 1.99 . 1 241 24 VAL HG1 H 0.86 . 2 242 24 VAL HG2 H 1.05 . 2 243 24 VAL C C 178.5 . 1 244 24 VAL CA C 67.2 . 1 245 24 VAL CB C 31.9 . 1 246 24 VAL CG1 C 21.0 . 2 247 24 VAL CG2 C 23.0 . 2 248 24 VAL N N 119.7 . 1 249 25 GLN H H 7.42 . 1 250 25 GLN HA H 3.76 . 1 251 25 GLN HB2 H 0.53 . 2 252 25 GLN HB3 H 0.73 . 2 253 25 GLN HG2 H 1.77 . 2 254 25 GLN HG3 H 2.09 . 2 255 25 GLN HE21 H 7.67 . 2 256 25 GLN HE22 H 6.72 . 2 257 25 GLN C C 178.9 . 1 258 25 GLN CA C 58.8 . 1 259 25 GLN CB C 26.7 . 1 260 25 GLN CG C 35.3 . 1 261 25 GLN N N 116.2 . 1 262 25 GLN NE2 N 113.7 . 1 263 26 ALA H H 7.98 . 1 264 26 ALA HA H 3.87 . 1 265 26 ALA HB H 1.52 . 1 266 26 ALA C C 178.1 . 1 267 26 ALA CA C 56.2 . 1 268 26 ALA CB C 17.7 . 1 269 26 ALA N N 119.8 . 1 270 27 CYS H H 8.35 . 1 271 27 CYS HA H 4.10 . 1 272 27 CYS HB2 H 3.18 . 2 273 27 CYS HB3 H 2.94 . 2 274 27 CYS C C 176.1 . 1 275 27 CYS CA C 66.5 . 1 276 27 CYS CB C 26.8 . 1 277 27 CYS N N 114.1 . 1 278 28 GLU H H 7.17 . 1 279 28 GLU HA H 4.48 . 1 280 28 GLU HB2 H 1.82 . 2 281 28 GLU HB3 H 1.82 . 2 282 28 GLU HG2 H 2.28 . 2 283 28 GLU HG3 H 2.02 . 2 284 28 GLU C C 179.2 . 1 285 28 GLU CA C 57.9 . 1 286 28 GLU CB C 28.8 . 1 287 28 GLU CG C 34.2 . 1 288 28 GLU N N 116.6 . 1 289 29 LYS H H 7.81 . 1 290 29 LYS HA H 4.05 . 1 291 29 LYS HB2 H 2.17 . 2 292 29 LYS HB3 H 1.87 . 2 293 29 LYS HG2 H 1.46 . 2 294 29 LYS HG3 H 1.37 . 2 295 29 LYS HD2 H 1.61 . 2 296 29 LYS HD3 H 1.61 . 2 297 29 LYS HE2 H 2.93 . 2 298 29 LYS HE3 H 2.93 . 2 299 29 LYS C C 178.6 . 1 300 29 LYS CA C 58.0 . 1 301 29 LYS CB C 31.6 . 1 302 29 LYS CG C 26.4 . 1 303 29 LYS CD C 28.8 . 1 304 29 LYS CE C 41.8 . 1 305 29 LYS N N 118.9 . 1 306 30 TYR H H 9.08 . 1 307 30 TYR HA H 4.29 . 1 308 30 TYR HB2 H 3.05 . 2 309 30 TYR HB3 H 3.05 . 2 310 30 TYR HD1 H 7.02 . 3 311 30 TYR HD2 H 7.02 . 3 312 30 TYR HE1 H 6.78 . 3 313 30 TYR HE2 H 6.78 . 3 314 30 TYR C C 178.4 . 1 315 30 TYR CA C 62.0 . 1 316 30 TYR CB C 38.8 . 1 317 30 TYR CD1 C 132.2 . 1 318 30 TYR CE1 C 117.5 . 1 319 30 TYR N N 120.5 . 1 320 31 TYR H H 8.23 . 1 321 31 TYR HA H 4.07 . 1 322 31 TYR HB2 H 3.14 . 2 323 31 TYR HB3 H 2.98 . 2 324 31 TYR HD1 H 6.75 . 3 325 31 TYR HD2 H 6.75 . 3 326 31 TYR HE1 H 6.52 . 3 327 31 TYR HE2 H 6.52 . 3 328 31 TYR C C 176.7 . 1 329 31 TYR CA C 62.3 . 1 330 31 TYR CB C 37.3 . 1 331 31 TYR CD1 C 132.3 . 1 332 31 TYR CE1 C 118.0 . 1 333 31 TYR N N 118.8 . 1 334 32 LYS H H 8.11 . 1 335 32 LYS HA H 3.71 . 1 336 32 LYS HB2 H 1.41 . 2 337 32 LYS HB3 H 1.03 . 2 338 32 LYS HG2 H 1.30 . 2 339 32 LYS HG3 H 1.20 . 2 340 32 LYS HD2 H 1.26 . 2 341 32 LYS HD3 H 1.40 . 2 342 32 LYS HE2 H 2.76 . 2 343 32 LYS HE3 H 2.76 . 2 344 32 LYS C C 178.9 . 1 345 32 LYS CA C 58.6 . 1 346 32 LYS CB C 31.0 . 1 347 32 LYS CG C 25.0 . 1 348 32 LYS CD C 28.4 . 1 349 32 LYS CE C 41.9 . 1 350 32 LYS N N 118.9 . 1 351 33 ALA H H 8.37 . 1 352 33 ALA HA H 4.17 . 1 353 33 ALA HB H 1.81 . 1 354 33 ALA C C 178.9 . 1 355 33 ALA CA C 56.0 . 1 356 33 ALA CB C 18.2 . 1 357 33 ALA N N 121.2 . 1 358 34 ALA H H 7.97 . 1 359 34 ALA HA H 3.99 . 1 360 34 ALA HB H 1.67 . 1 361 34 ALA C C 178.9 . 1 362 34 ALA CA C 54.9 . 1 363 34 ALA CB C 20.3 . 1 364 34 ALA N N 119.3 . 1 365 35 GLU H H 8.92 . 1 366 35 GLU HA H 3.67 . 1 367 35 GLU HB2 H 1.86 . 2 368 35 GLU HB3 H 1.88 . 2 369 35 GLU HG2 H 2.06 . 2 370 35 GLU HG3 H 1.81 . 2 371 35 GLU C C 178.5 . 1 372 35 GLU CA C 59.9 . 1 373 35 GLU CB C 29.6 . 1 374 35 GLU CG C 36.0 . 1 375 35 GLU N N 119.1 . 1 376 36 GLU H H 8.37 . 1 377 36 GLU HA H 3.79 . 1 378 36 GLU HB2 H 2.17 . 2 379 36 GLU HB3 H 2.05 . 2 380 36 GLU HG2 H 2.66 . 2 381 36 GLU HG3 H 2.27 . 2 382 36 GLU C C 179.1 . 1 383 36 GLU CA C 58.1 . 1 384 36 GLU CB C 28.6 . 1 385 36 GLU CG C 36.8 . 1 386 36 GLU N N 115.9 . 1 387 37 ALA H H 8.44 . 1 388 37 ALA HA H 3.87 . 1 389 37 ALA HB H 1.52 . 1 390 37 ALA C C 178.6 . 1 391 37 ALA CA C 55.4 . 1 392 37 ALA CB C 18.7 . 1 393 37 ALA N N 123.7 . 1 394 38 ILE H H 8.21 . 1 395 38 ILE HA H 3.60 . 1 396 38 ILE HB H 1.92 . 1 397 38 ILE HG12 H 0.87 . 2 398 38 ILE HG13 H 1.71 . 2 399 38 ILE HG2 H 0.43 . 1 400 38 ILE HD1 H 0.40 . 1 401 38 ILE C C 177.7 . 1 402 38 ILE CA C 62.2 . 1 403 38 ILE CB C 34.4 . 1 404 38 ILE CG1 C 27.4 . 1 405 38 ILE CG2 C 18.2 . 1 406 38 ILE CD1 C 9.0 . 1 407 38 ILE N N 117.3 . 1 408 39 LYS H H 7.84 . 1 409 39 LYS HA H 3.34 . 1 410 39 LYS HB2 H 1.37 . 2 411 39 LYS HB3 H 1.37 . 2 412 39 LYS HG2 H 1.38 . 2 413 39 LYS HG3 H 1.44 . 2 414 39 LYS HD2 H 1.64 . 2 415 39 LYS HD3 H 1.61 . 2 416 39 LYS HE2 H 2.93 . 2 417 39 LYS HE3 H 2.93 . 2 418 39 LYS C C 178.6 . 1 419 39 LYS CA C 60.5 . 1 420 39 LYS CB C 32.1 . 1 421 39 LYS CG C 24.9 . 1 422 39 LYS CD C 28.8 . 1 423 39 LYS CE C 42.1 . 1 424 39 LYS N N 118.7 . 1 425 40 LEU H H 7.89 . 1 426 40 LEU HA H 4.07 . 1 427 40 LEU HB2 H 1.87 . 2 428 40 LEU HB3 H 1.65 . 2 429 40 LEU HG H 1.78 . 1 430 40 LEU HD1 H 0.96 . 2 431 40 LEU HD2 H 0.92 . 2 432 40 LEU C C 179.4 . 1 433 40 LEU CA C 57.9 . 1 434 40 LEU CB C 42.2 . 1 435 40 LEU CG C 26.7 . 1 436 40 LEU CD1 C 24.7 . 2 437 40 LEU CD2 C 24.3 . 2 438 40 LEU N N 118.0 . 1 439 41 LEU H H 8.13 . 1 440 41 LEU HA H 4.00 . 1 441 41 LEU HB2 H 2.17 . 2 442 41 LEU HB3 H 1.37 . 2 443 41 LEU HG H 1.83 . 1 444 41 LEU HD1 H 0.97 . 2 445 41 LEU HD2 H 0.85 . 2 446 41 LEU C C 180.3 . 1 447 41 LEU CA C 58.0 . 1 448 41 LEU CB C 43.5 . 1 449 41 LEU CG C 27.7 . 1 450 41 LEU CD1 C 26.1 . 2 451 41 LEU CD2 C 24.2 . 2 452 41 LEU N N 119.5 . 1 453 42 VAL H H 8.73 . 1 454 42 VAL HA H 3.59 . 1 455 42 VAL HB H 2.60 . 1 456 42 VAL HG1 H 1.12 . 2 457 42 VAL HG2 H 1.18 . 2 458 42 VAL C C 177.5 . 1 459 42 VAL CA C 67.0 . 1 460 42 VAL CB C 31.5 . 1 461 42 VAL CG1 C 22.3 . 2 462 42 VAL CG2 C 25.3 . 2 463 42 VAL N N 121.9 . 1 464 43 ILE H H 7.89 . 1 465 43 ILE HA H 3.86 . 1 466 43 ILE HB H 2.06 . 1 467 43 ILE HG12 H 1.35 . 2 468 43 ILE HG13 H 1.81 . 2 469 43 ILE HG2 H 0.97 . 1 470 43 ILE HD1 H 0.95 . 1 471 43 ILE C C 180.8 . 1 472 43 ILE CA C 64.4 . 1 473 43 ILE CB C 38.1 . 1 474 43 ILE CG1 C 29.1 . 1 475 43 ILE CG2 C 17.2 . 1 476 43 ILE CD1 C 13.0 . 1 477 43 ILE N N 120.1 . 1 478 44 GLU H H 8.88 . 1 479 44 GLU HA H 4.06 . 1 480 44 GLU HB2 H 1.97 . 2 481 44 GLU HB3 H 2.06 . 2 482 44 GLU HG2 H 2.47 . 2 483 44 GLU HG3 H 2.36 . 2 484 44 GLU C C 177.3 . 1 485 44 GLU CA C 58.1 . 1 486 44 GLU CB C 29.0 . 1 487 44 GLU CG C 33.8 . 1 488 44 GLU N N 119.8 . 1 489 45 ASN H H 7.56 . 1 490 45 ASN HA H 4.71 . 1 491 45 ASN HB2 H 2.84 . 2 492 45 ASN HB3 H 2.58 . 2 493 45 ASN HD21 H 7.36 . 2 494 45 ASN HD22 H 7.65 . 2 495 45 ASN C C 173.2 . 1 496 45 ASN CA C 54.1 . 1 497 45 ASN CB C 39.3 . 1 498 45 ASN N N 112.7 . 1 499 45 ASN ND2 N 113.3 . 1 500 46 ASN H H 7.93 . 1 501 46 ASN HA H 4.42 . 1 502 46 ASN HB2 H 2.63 . 2 503 46 ASN HB3 H 3.17 . 2 504 46 ASN HD21 H 7.62 . 2 505 46 ASN HD22 H 6.82 . 2 506 46 ASN C C 175.1 . 1 507 46 ASN CA C 53.9 . 1 508 46 ASN CB C 37.4 . 1 509 46 ASN N N 117.7 . 1 510 46 ASN ND2 N 112.0 . 1 511 47 LEU H H 7.80 . 1 512 47 LEU HA H 4.65 . 1 513 47 LEU HB2 H 1.85 . 2 514 47 LEU HB3 H 1.51 . 2 515 47 LEU HG H 1.62 . 1 516 47 LEU HD1 H 0.92 . 2 517 47 LEU HD2 H 0.91 . 2 518 47 LEU C C 177.2 . 1 519 47 LEU CA C 53.9 . 1 520 47 LEU CB C 40.3 . 1 521 47 LEU CG C 26.8 . 1 522 47 LEU CD1 C 26.3 . 2 523 47 LEU CD2 C 23.6 . 2 524 47 LEU N N 118.1 . 1 525 48 LYS H H 8.04 . 1 526 48 LYS HA H 4.15 . 1 527 48 LYS HB2 H 1.75 . 2 528 48 LYS HB3 H 1.77 . 2 529 48 LYS HG2 H 1.38 . 2 530 48 LYS HG3 H 1.45 . 2 531 48 LYS HD2 H 1.67 . 2 532 48 LYS HD3 H 1.67 . 2 533 48 LYS HE2 H 3.00 . 2 534 48 LYS HE3 H 3.00 . 2 535 48 LYS C C 177.4 . 1 536 48 LYS CA C 58.1 . 1 537 48 LYS CB C 32.3 . 1 538 48 LYS CG C 24.9 . 1 539 48 LYS CD C 29.0 . 1 540 48 LYS CE C 42.1 . 1 541 48 LYS N N 126.3 . 1 542 49 GLU H H 9.18 . 1 543 49 GLU HA H 4.04 . 1 544 49 GLU HB2 H 2.02 . 2 545 49 GLU HB3 H 1.85 . 2 546 49 GLU HG2 H 2.21 . 2 547 49 GLU HG3 H 2.25 . 2 548 49 GLU C C 178.0 . 1 549 49 GLU CA C 58.8 . 1 550 49 GLU CB C 29.2 . 1 551 49 GLU CG C 36.0 . 1 552 49 GLU N N 118.1 . 1 553 50 ILE H H 7.57 . 1 554 50 ILE HA H 4.07 . 1 555 50 ILE HB H 2.19 . 1 556 50 ILE HG12 H 1.26 . 2 557 50 ILE HG13 H 1.45 . 2 558 50 ILE HG2 H 0.76 . 1 559 50 ILE HD1 H 0.74 . 1 560 50 ILE C C 177.6 . 1 561 50 ILE CA C 60.5 . 1 562 50 ILE CB C 36.3 . 1 563 50 ILE CG1 C 27.4 . 1 564 50 ILE CG2 C 18.4 . 1 565 50 ILE CD1 C 9.8 . 1 566 50 ILE N N 116.1 . 1 567 51 THR H H 7.81 . 1 568 51 THR HA H 3.71 . 1 569 51 THR HB H 4.16 . 1 570 51 THR HG2 H 1.09 . 1 571 51 THR C C 176.4 . 1 572 51 THR CA C 64.7 . 1 573 51 THR CB C 68.2 . 1 574 51 THR CG2 C 22.5 . 1 575 51 THR N N 112.2 . 1 576 52 ASN H H 8.64 . 1 577 52 ASN HA H 4.49 . 1 578 52 ASN HB2 H 2.75 . 2 579 52 ASN HB3 H 2.75 . 2 580 52 ASN HD21 H 7.52 . 2 581 52 ASN HD22 H 6.84 . 2 582 52 ASN C C 176.0 . 1 583 52 ASN CA C 54.6 . 1 584 52 ASN CB C 38.0 . 1 585 52 ASN N N 119.8 . 1 586 52 ASN ND2 N 111.5 . 1 587 53 ASN H H 7.56 . 1 588 53 ASN HA H 4.64 . 1 589 53 ASN HB2 H 2.81 . 2 590 53 ASN HB3 H 2.68 . 2 591 53 ASN HD21 H 7.58 . 2 592 53 ASN HD22 H 6.95 . 2 593 53 ASN C C 175.6 . 1 594 53 ASN CA C 54.2 . 1 595 53 ASN CB C 39.5 . 1 596 53 ASN N N 117.5 . 1 597 53 ASN ND2 N 113.0 . 1 598 54 VAL H H 7.52 . 1 599 54 VAL HA H 3.77 . 1 600 54 VAL HB H 1.70 . 1 601 54 VAL HG1 H 0.17 . 2 602 54 VAL HG2 H 0.31 . 2 603 54 VAL C C 176.8 . 1 604 54 VAL CA C 63.3 . 1 605 54 VAL CB C 31.8 . 1 606 54 VAL CG1 C 19.9 . 2 607 54 VAL CG2 C 20.3 . 2 608 54 VAL N N 119.4 . 1 609 55 LYS H H 8.08 . 1 610 55 LYS HA H 4.15 . 1 611 55 LYS HB2 H 1.85 . 2 612 55 LYS HB3 H 1.78 . 2 613 55 LYS HG2 H 1.46 . 2 614 55 LYS HG3 H 1.37 . 2 615 55 LYS HD2 H 1.69 . 2 616 55 LYS HD3 H 1.69 . 2 617 55 LYS HE2 H 3.00 . 2 618 55 LYS HE3 H 3.00 . 2 619 55 LYS C C 177.2 . 1 620 55 LYS CA C 57.3 . 1 621 55 LYS CB C 32.4 . 1 622 55 LYS CG C 24.9 . 1 623 55 LYS CD C 29.0 . 1 624 55 LYS CE C 42.0 . 1 625 55 LYS N N 122.2 . 1 626 56 ASN H H 8.10 . 1 627 56 ASN HA H 4.62 . 1 628 56 ASN HB2 H 2.89 . 2 629 56 ASN HB3 H 2.82 . 2 630 56 ASN HD21 H 7.63 . 2 631 56 ASN HD22 H 6.92 . 2 632 56 ASN C C 175.7 . 1 633 56 ASN CA C 54.0 . 1 634 56 ASN CB C 38.8 . 1 635 56 ASN N N 117.6 . 1 636 56 ASN ND2 N 112.8 . 1 637 57 LYS H H 8.29 . 1 638 57 LYS HA H 4.27 . 1 639 57 LYS HB2 H 1.95 . 2 640 57 LYS HB3 H 1.87 . 2 641 57 LYS HG2 H 1.49 . 2 642 57 LYS HG3 H 1.47 . 2 643 57 LYS HD2 H 1.69 . 2 644 57 LYS HD3 H 1.69 . 2 645 57 LYS HE2 H 3.01 . 2 646 57 LYS HE3 H 3.01 . 2 647 57 LYS C C 177.3 . 1 648 57 LYS CA C 56.7 . 1 649 57 LYS CB C 32.3 . 1 650 57 LYS CG C 25.0 . 1 651 57 LYS CD C 28.8 . 1 652 57 LYS CE C 42.2 . 1 653 57 LYS N N 119.1 . 1 654 58 GLY H H 8.32 . 1 655 58 GLY HA2 H 4.02 . 2 656 58 GLY HA3 H 3.95 . 2 657 58 GLY C C 173.9 . 1 658 58 GLY CA C 45.4 . 1 659 58 GLY N N 108.4 . 1 660 59 ARG H H 7.86 . 1 661 59 ARG HA H 4.48 . 1 662 59 ARG HB2 H 1.87 . 2 663 59 ARG HB3 H 1.77 . 2 664 59 ARG HG2 H 1.48 . 2 665 59 ARG HG3 H 1.48 . 2 666 59 ARG HD2 H 3.19 . 2 667 59 ARG HD3 H 3.19 . 2 668 59 ARG C C 175.6 . 1 669 59 ARG CA C 55.7 . 1 670 59 ARG CB C 31.0 . 1 671 59 ARG CG C 26.4 . 1 672 59 ARG CD C 43.4 . 1 673 59 ARG N N 119.1 . 1 674 60 TRP H H 8.87 . 1 675 60 TRP HA H 4.65 . 1 676 60 TRP HB2 H 3.08 . 2 677 60 TRP HB3 H 3.10 . 2 678 60 TRP HD1 H 7.31 . 1 679 60 TRP HE1 H 10.30 . 1 680 60 TRP HE3 H 7.16 . 1 681 60 TRP HZ2 H 7.47 . 1 682 60 TRP HZ3 H 6.58 . 1 683 60 TRP HH2 H 6.91 . 1 684 60 TRP C C 176.4 . 1 685 60 TRP CA C 56.9 . 1 686 60 TRP CB C 29.0 . 1 687 60 TRP CD1 C 125.7 . 1 688 60 TRP CE3 C 119.7 . 1 689 60 TRP CZ2 C 114.2 . 1 690 60 TRP CZ3 C 119.9 . 1 691 60 TRP CH2 C 123.1 . 1 692 60 TRP N N 123.4 . 1 693 60 TRP NE1 N 130.2 . 1 694 61 LYS H H 8.58 . 1 695 61 LYS HA H 4.71 . 1 696 61 LYS HB2 H 1.84 . 2 697 61 LYS HB3 H 2.27 . 2 698 61 LYS HG2 H 1.58 . 2 699 61 LYS HG3 H 1.66 . 2 700 61 LYS HD2 H 1.66 . 2 701 61 LYS HD3 H 1.61 . 2 702 61 LYS HE2 H 2.93 . 2 703 61 LYS HE3 H 2.93 . 2 704 61 LYS C C 178.8 . 1 705 61 LYS CA C 47.2 . 1 706 61 LYS CB C 33.6 . 1 707 61 LYS CG C 25.1 . 1 708 61 LYS CD C 28.8 . 1 709 61 LYS CE C 41.7 . 1 710 61 LYS N N 122.0 . 1 711 62 SER H H 9.31 . 1 712 62 SER HA H 4.11 . 1 713 62 SER HB2 H 4.29 . 2 714 62 SER HB3 H 4.35 . 2 715 62 SER C C 176.9 . 1 716 62 SER CA C 62.6 . 1 717 62 SER CB C 62.6 . 1 718 62 SER N N 120.1 . 1 719 63 GLU H H 9.53 . 1 720 63 GLU HA H 4.25 . 1 721 63 GLU HB2 H 2.07 . 2 722 63 GLU HB3 H 2.02 . 2 723 63 GLU HG2 H 2.33 . 2 724 63 GLU HG3 H 2.33 . 2 725 63 GLU C C 179.1 . 1 726 63 GLU CA C 59.9 . 1 727 63 GLU CB C 28.9 . 1 728 63 GLU CG C 35.8 . 1 729 63 GLU N N 120.9 . 1 730 64 ASN H H 7.60 . 1 731 64 ASN HA H 4.72 . 1 732 64 ASN HB2 H 2.94 . 2 733 64 ASN HB3 H 2.66 . 2 734 64 ASN HD21 H 7.62 . 2 735 64 ASN HD22 H 7.00 . 2 736 64 ASN C C 177.1 . 1 737 64 ASN CA C 55.6 . 1 738 64 ASN CB C 39.4 . 1 739 64 ASN N N 117.4 . 1 740 64 ASN ND2 N 112.1 . 1 741 65 LEU H H 7.68 . 1 742 65 LEU HA H 3.77 . 1 743 65 LEU HB2 H 1.90 . 2 744 65 LEU HB3 H 0.64 . 2 745 65 LEU HG H 1.76 . 1 746 65 LEU HD1 H 0.53 . 2 747 65 LEU HD2 H 1.11 . 2 748 65 LEU C C 178.7 . 1 749 65 LEU CA C 57.8 . 1 750 65 LEU CB C 41.4 . 1 751 65 LEU CG C 27.4 . 1 752 65 LEU CD1 C 23.6 . 2 753 65 LEU CD2 C 26.5 . 2 754 65 LEU N N 121.6 . 1 755 66 PHE H H 8.38 . 1 756 66 PHE HA H 3.76 . 1 757 66 PHE HB2 H 3.06 . 2 758 66 PHE HB3 H 3.04 . 2 759 66 PHE HD1 H 7.35 . 3 760 66 PHE HD2 H 7.35 . 3 761 66 PHE HE1 H 6.53 . 3 762 66 PHE HE2 H 6.53 . 3 763 66 PHE C C 179.8 . 1 764 66 PHE CA C 62.4 . 1 765 66 PHE CB C 38.9 . 1 766 66 PHE CD1 C 131.2 . 1 767 66 PHE CE1 C 131.1 . 1 768 66 PHE N N 117.1 . 1 769 67 LYS H H 7.99 . 1 770 67 LYS HA H 3.98 . 1 771 67 LYS HB2 H 1.87 . 2 772 67 LYS HB3 H 1.99 . 2 773 67 LYS HG2 H 1.54 . 2 774 67 LYS HG3 H 1.35 . 2 775 67 LYS HD2 H 1.54 . 2 776 67 LYS HD3 H 1.69 . 2 777 67 LYS HE2 H 2.93 . 2 778 67 LYS HE3 H 2.86 . 2 779 67 LYS C C 178.6 . 1 780 67 LYS CA C 59.8 . 1 781 67 LYS CB C 32.2 . 1 782 67 LYS CG C 25.4 . 1 783 67 LYS CD C 29.3 . 1 784 67 LYS CE C 42.1 . 1 785 67 LYS N N 120.8 . 1 786 68 ALA H H 8.29 . 1 787 68 ALA HA H 3.77 . 1 788 68 ALA HB H 1.33 . 1 789 68 ALA C C 178.6 . 1 790 68 ALA CA C 55.3 . 1 791 68 ALA CB C 18.5 . 1 792 68 ALA N N 120.8 . 1 793 69 SER H H 7.93 . 1 794 69 SER HA H 3.68 . 1 795 69 SER HB2 H 3.54 . 2 796 69 SER HB3 H 3.42 . 2 797 69 SER C C 173.8 . 1 798 69 SER CA C 62.2 . 1 799 69 SER CB C 62.2 . 1 800 69 SER N N 112.7 . 1 801 70 LYS H H 7.16 . 1 802 70 LYS HA H 4.08 . 1 803 70 LYS HB2 H 1.93 . 2 804 70 LYS HB3 H 1.97 . 2 805 70 LYS HG2 H 1.42 . 2 806 70 LYS HG3 H 1.61 . 2 807 70 LYS HD2 H 1.70 . 2 808 70 LYS HD3 H 1.70 . 2 809 70 LYS HE2 H 2.93 . 2 810 70 LYS HE3 H 2.93 . 2 811 70 LYS C C 180.4 . 1 812 70 LYS CA C 59.2 . 1 813 70 LYS CB C 32.5 . 1 814 70 LYS CG C 25.5 . 1 815 70 LYS CD C 29.3 . 1 816 70 LYS CE C 41.8 . 1 817 70 LYS N N 119.7 . 1 818 71 LEU H H 8.15 . 1 819 71 LEU HA H 4.15 . 1 820 71 LEU HB2 H 1.55 . 2 821 71 LEU HB3 H 1.87 . 2 822 71 LEU HG H 1.85 . 1 823 71 LEU HD1 H 0.88 . 2 824 71 LEU HD2 H 0.91 . 2 825 71 LEU C C 180.1 . 1 826 71 LEU CA C 57.5 . 1 827 71 LEU CB C 42.4 . 1 828 71 LEU CG C 27.2 . 1 829 71 LEU CD1 C 25.7 . 2 830 71 LEU CD2 C 22.7 . 2 831 71 LEU N N 121.7 . 1 832 72 LEU H H 8.16 . 1 833 72 LEU HA H 4.27 . 1 834 72 LEU HB2 H 1.64 . 2 835 72 LEU HB3 H 1.87 . 2 836 72 LEU HG H 1.74 . 1 837 72 LEU HD1 H 0.86 . 2 838 72 LEU HD2 H 0.78 . 2 839 72 LEU C C 177.0 . 1 840 72 LEU CA C 55.9 . 1 841 72 LEU CB C 42.5 . 1 842 72 LEU CG C 26.8 . 1 843 72 LEU CD1 C 24.2 . 2 844 72 LEU CD2 C 27.3 . 2 845 72 LEU N N 117.7 . 1 846 73 ARG H H 7.49 . 1 847 73 ARG HA H 4.20 . 1 848 73 ARG HB2 H 1.85 . 2 849 73 ARG HB3 H 1.96 . 2 850 73 ARG HG2 H 1.83 . 2 851 73 ARG HG3 H 1.70 . 2 852 73 ARG HD2 H 3.31 . 2 853 73 ARG HD3 H 3.31 . 2 854 73 ARG C C 176.6 . 1 855 73 ARG CA C 58.0 . 1 856 73 ARG CB C 30.4 . 1 857 73 ARG CG C 27.8 . 1 858 73 ARG CD C 43.6 . 1 859 73 ARG N N 121.8 . 1 860 74 SER H H 7.39 . 1 861 74 SER HA H 4.15 . 1 862 74 SER HB2 H 3.92 . 2 863 74 SER HB3 H 3.92 . 2 864 74 SER C C 174.9 . 1 865 74 SER CA C 60.4 . 1 866 74 SER CB C 62.7 . 1 867 74 SER N N 110.2 . 1 868 75 ASN H H 7.75 . 1 869 75 ASN HA H 4.67 . 1 870 75 ASN HB2 H 2.84 . 2 871 75 ASN HB3 H 2.73 . 2 872 75 ASN HD21 H 7.39 . 2 873 75 ASN HD22 H 6.77 . 2 874 75 ASN C C 175.3 . 1 875 75 ASN CA C 55.3 . 1 876 75 ASN CB C 39.8 . 1 877 75 ASN N N 119.6 . 1 878 75 ASN ND2 N 109.3 . 1 879 76 ASN H H 7.50 . 1 880 76 ASN HA H 4.62 . 1 881 76 ASN HB2 H 2.13 . 2 882 76 ASN HB3 H 2.49 . 2 883 76 ASN HD21 H 6.46 . 2 884 76 ASN HD22 H 5.89 . 2 885 76 ASN C C 175.7 . 1 886 76 ASN CA C 53.9 . 1 887 76 ASN CB C 39.2 . 1 888 76 ASN N N 115.6 . 1 889 76 ASN ND2 N 109.9 . 1 890 77 THR H H 8.76 . 1 891 77 THR HA H 4.14 . 1 892 77 THR HB H 4.30 . 1 893 77 THR HG2 H 1.34 . 1 894 77 THR C C 175.3 . 1 895 77 THR CA C 64.8 . 1 896 77 THR CB C 68.8 . 1 897 77 THR CG2 C 22.2 . 1 898 77 THR N N 119.5 . 1 899 78 GLU H H 8.37 . 1 900 78 GLU HA H 4.29 . 1 901 78 GLU HB2 H 1.95 . 2 902 78 GLU HB3 H 2.11 . 2 903 78 GLU HG2 H 2.36 . 2 904 78 GLU HG3 H 2.45 . 2 905 78 GLU C C 178.6 . 1 906 78 GLU CA C 57.0 . 1 907 78 GLU CB C 30.1 . 1 908 78 GLU CG C 36.2 . 1 909 78 GLU N N 117.4 . 1 910 79 ILE H H 7.74 . 1 911 79 ILE HA H 3.65 . 1 912 79 ILE HB H 1.92 . 1 913 79 ILE HG12 H 1.01 . 2 914 79 ILE HG13 H 1.01 . 2 915 79 ILE HG2 H 0.89 . 1 916 79 ILE HD1 H 0.84 . 1 917 79 ILE CA C 68.2 . 1 918 79 ILE CB C 34.4 . 1 919 79 ILE CG1 C 24.1 . 1 920 79 ILE CG2 C 17.2 . 1 921 79 ILE CD1 C 13.7 . 1 922 79 ILE N N 118.4 . 1 923 80 PRO HA H 4.23 . 1 924 80 PRO HB2 H 2.28 . 2 925 80 PRO HB3 H 2.02 . 2 926 80 PRO HG2 H 2.11 . 2 927 80 PRO HG3 H 2.11 . 2 928 80 PRO HD2 H 3.99 . 2 929 80 PRO HD3 H 3.49 . 2 930 80 PRO C C 179.0 . 1 931 80 PRO CA C 66.4 . 1 932 80 PRO CB C 30.9 . 1 933 80 PRO CG C 28.5 . 1 934 80 PRO CD C 48.2 . 1 935 81 ILE H H 7.14 . 1 936 81 ILE HA H 3.90 . 1 937 81 ILE HB H 2.20 . 1 938 81 ILE HG12 H 1.37 . 2 939 81 ILE HG13 H 1.64 . 2 940 81 ILE HG2 H 1.00 . 1 941 81 ILE HD1 H 0.95 . 1 942 81 ILE C C 178.2 . 1 943 81 ILE CA C 64.0 . 1 944 81 ILE CB C 37.9 . 1 945 81 ILE CG1 C 28.7 . 1 946 81 ILE CG2 C 17.8 . 1 947 81 ILE CD1 C 12.9 . 1 948 81 ILE N N 118.9 . 1 949 82 LEU H H 8.26 . 1 950 82 LEU HA H 4.12 . 1 951 82 LEU HB2 H 1.94 . 2 952 82 LEU HB3 H 1.61 . 2 953 82 LEU HG H 2.08 . 1 954 82 LEU HD1 H 0.83 . 2 955 82 LEU HD2 H 0.93 . 2 956 82 LEU C C 179.8 . 1 957 82 LEU CA C 57.7 . 1 958 82 LEU CB C 40.6 . 1 959 82 LEU CG C 26.3 . 1 960 82 LEU CD1 C 25.4 . 2 961 82 LEU CD2 C 21.0 . 2 962 82 LEU N N 120.4 . 1 963 83 TRP H H 8.74 . 1 964 83 TRP HA H 4.44 . 1 965 83 TRP HB2 H 3.18 . 2 966 83 TRP HB3 H 3.18 . 2 967 83 TRP HD1 H 7.14 . 1 968 83 TRP HE1 H 10.26 . 1 969 83 TRP HE3 H 7.17 . 1 970 83 TRP HZ2 H 7.14 . 1 971 83 TRP HZ3 H 6.68 . 1 972 83 TRP HH2 H 6.82 . 1 973 83 TRP C C 176.4 . 1 974 83 TRP CA C 59.1 . 1 975 83 TRP CB C 29.9 . 1 976 83 TRP CD1 C 123.5 . 1 977 83 TRP CE3 C 120.4 . 1 978 83 TRP CZ2 C 114.2 . 1 979 83 TRP CZ3 C 121.6 . 1 980 83 TRP CH2 C 123.8 . 1 981 83 TRP N N 116.6 . 1 982 83 TRP NE1 N 129.3 . 1 983 84 LYS H H 7.51 . 1 984 84 LYS HA H 3.88 . 1 985 84 LYS HB2 H 2.20 . 2 986 84 LYS HB3 H 2.11 . 2 987 84 LYS HG2 H 1.82 . 2 988 84 LYS HG3 H 1.59 . 2 989 84 LYS HD2 H 1.61 . 2 990 84 LYS HD3 H 1.86 . 2 991 84 LYS HE2 H 2.93 . 2 992 84 LYS HE3 H 2.93 . 2 993 84 LYS C C 180.1 . 1 994 84 LYS CA C 60.2 . 1 995 84 LYS CB C 31.6 . 1 996 84 LYS CG C 25.5 . 1 997 84 LYS CD C 29.4 . 1 998 84 LYS CE C 41.8 . 1 999 84 LYS N N 117.7 . 1 1000 85 SER H H 7.81 . 1 1001 85 SER HA H 4.20 . 1 1002 85 SER HB2 H 3.99 . 2 1003 85 SER HB3 H 4.43 . 2 1004 85 SER C C 175.1 . 1 1005 85 SER CA C 62.3 . 1 1006 85 SER CB C 62.3 . 1 1007 85 SER N N 117.7 . 1 1008 86 ALA H H 7.43 . 1 1009 86 ALA HA H 3.72 . 1 1010 86 ALA HB H 1.15 . 1 1011 86 ALA C C 178.6 . 1 1012 86 ALA CA C 55.1 . 1 1013 86 ALA CB C 18.7 . 1 1014 86 ALA N N 123.6 . 1 1015 87 TRP H H 8.48 . 1 1016 87 TRP HA H 4.03 . 1 1017 87 TRP HB2 H 2.51 . 2 1018 87 TRP HB3 H 3.19 . 2 1019 87 TRP HD1 H 7.33 . 1 1020 87 TRP HE1 H 10.27 . 1 1021 87 TRP HE3 H 7.28 . 1 1022 87 TRP HZ2 H 7.63 . 1 1023 87 TRP HZ3 H 7.36 . 1 1024 87 TRP HH2 H 7.44 . 1 1025 87 TRP C C 177.6 . 1 1026 87 TRP CA C 59.6 . 1 1027 87 TRP CB C 28.8 . 1 1028 87 TRP CD1 C 126.7 . 1 1029 87 TRP CE3 C 120.4 . 1 1030 87 TRP CZ2 C 114.5 . 1 1031 87 TRP CZ3 C 121.3 . 1 1032 87 TRP CH2 C 123.8 . 1 1033 87 TRP N N 118.2 . 1 1034 87 TRP NE1 N 129.3 . 1 1035 88 THR H H 8.27 . 1 1036 88 THR HA H 3.78 . 1 1037 88 THR HB H 4.46 . 1 1038 88 THR HG2 H 1.17 . 1 1039 88 THR C C 176.1 . 1 1040 88 THR CA C 67.1 . 1 1041 88 THR CB C 68.3 . 1 1042 88 THR CG2 C 22.3 . 1 1043 88 THR N N 115.8 . 1 1044 89 LEU H H 7.60 . 1 1045 89 LEU HA H 3.81 . 1 1046 89 LEU HB2 H 2.27 . 2 1047 89 LEU HB3 H 1.51 . 2 1048 89 LEU HG H 0.71 . 1 1049 89 LEU HD1 H 1.03 . 2 1050 89 LEU HD2 H 1.03 . 2 1051 89 LEU C C 177.9 . 1 1052 89 LEU CA C 58.3 . 1 1053 89 LEU CB C 41.4 . 1 1054 89 LEU CG C 26.4 . 1 1055 89 LEU CD1 C 26.0 . 2 1056 89 LEU CD2 C 26.0 . 2 1057 89 LEU N N 120.7 . 1 1058 90 HIS H H 7.46 . 1 1059 90 HIS HA H 3.94 . 1 1060 90 HIS HB2 H 2.59 . 2 1061 90 HIS HB3 H 2.06 . 2 1062 90 HIS C C 175.9 . 1 1063 90 HIS CA C 57.2 . 1 1064 90 HIS CB C 27.8 . 1 1065 90 HIS N N 117.1 . 1 1066 91 VAL H H 7.96 . 1 1067 91 VAL HA H 3.17 . 1 1068 91 VAL HB H 1.78 . 1 1069 91 VAL HG1 H 0.43 . 2 1070 91 VAL HG2 H 0.59 . 2 1071 91 VAL C C 178.2 . 1 1072 91 VAL CA C 64.9 . 1 1073 91 VAL CB C 31.9 . 1 1074 91 VAL CG1 C 20.9 . 2 1075 91 VAL CG2 C 21.5 . 2 1076 91 VAL N N 116.4 . 1 1077 92 GLU H H 8.31 . 1 1078 92 GLU HA H 4.06 . 1 1079 92 GLU HB2 H 1.86 . 2 1080 92 GLU HB3 H 1.99 . 2 1081 92 GLU HG2 H 2.16 . 2 1082 92 GLU HG3 H 2.34 . 2 1083 92 GLU C C 178.0 . 1 1084 92 GLU CA C 58.1 . 1 1085 92 GLU CB C 28.1 . 1 1086 92 GLU CG C 34.6 . 1 1087 92 GLU N N 119.5 . 1 1088 93 GLY H H 7.62 . 1 1089 93 GLY HA2 H 3.84 . 2 1090 93 GLY HA3 H 3.91 . 2 1091 93 GLY C C 173.8 . 1 1092 93 GLY CA C 46.6 . 1 1093 93 GLY N N 106.1 . 1 1094 94 PHE H H 7.37 . 1 1095 94 PHE HA H 4.52 . 1 1096 94 PHE HB2 H 2.82 . 2 1097 94 PHE HB3 H 3.10 . 2 1098 94 PHE HD1 H 7.01 . 3 1099 94 PHE HD2 H 7.01 . 3 1100 94 PHE HE1 H 7.10 . 3 1101 94 PHE HE2 H 7.10 . 3 1102 94 PHE C C 175.8 . 1 1103 94 PHE CA C 58.2 . 1 1104 94 PHE CB C 38.9 . 1 1105 94 PHE CD1 C 131.1 . 1 1106 94 PHE CE1 C 130.6 . 1 1107 94 PHE N N 117.3 . 1 1108 95 HIS H H 7.86 . 1 1109 95 HIS HA H 4.58 . 1 1110 95 HIS HB2 H 3.21 . 2 1111 95 HIS HB3 H 3.29 . 2 1112 95 HIS C C 176.3 . 1 1113 95 HIS CA C 55.8 . 1 1114 95 HIS CB C 28.5 . 1 1115 95 HIS N N 116.4 . 1 1116 96 GLU H H 8.26 . 1 1117 96 GLU HA H 4.08 . 1 1118 96 GLU HB2 H 2.04 . 2 1119 96 GLU HB3 H 2.04 . 2 1120 96 GLU HG2 H 2.31 . 2 1121 96 GLU HG3 H 2.31 . 2 1122 96 GLU C C 176.7 . 1 1123 96 GLU CA C 57.6 . 1 1124 96 GLU CB C 29.1 . 1 1125 96 GLU CG C 36.0 . 1 1126 96 GLU N N 118.6 . 1 1127 97 LEU H H 8.04 . 1 1128 97 LEU HA H 4.24 . 1 1129 97 LEU HB2 H 1.62 . 2 1130 97 LEU HB3 H 1.71 . 2 1131 97 LEU HG H 1.54 . 1 1132 97 LEU HD1 H 0.87 . 2 1133 97 LEU HD2 H 0.85 . 2 1134 97 LEU C C 177.7 . 1 1135 97 LEU CA C 56.3 . 1 1136 97 LEU CB C 41.1 . 1 1137 97 LEU CG C 27.1 . 1 1138 97 LEU CD1 C 25.1 . 2 1139 97 LEU CD2 C 24.2 . 2 1140 97 LEU N N 119.5 . 1 1141 98 SER H H 8.28 . 1 1142 98 SER HA H 4.52 . 1 1143 98 SER HB2 H 3.93 . 2 1144 98 SER HB3 H 3.81 . 2 1145 98 SER C C 174.4 . 1 1146 98 SER CA C 58.1 . 1 1147 98 SER CB C 64.0 . 1 1148 98 SER N N 113.7 . 1 1149 99 LEU H H 7.54 . 1 1150 99 LEU HA H 4.52 . 1 1151 99 LEU HB2 H 1.61 . 2 1152 99 LEU HB3 H 1.34 . 2 1153 99 LEU HG H 1.47 . 1 1154 99 LEU HD1 H 0.77 . 2 1155 99 LEU HD2 H 0.71 . 2 1156 99 LEU C C 176.3 . 1 1157 99 LEU CA C 54.5 . 1 1158 99 LEU CB C 44.0 . 1 1159 99 LEU CG C 26.5 . 1 1160 99 LEU CD1 C 26.4 . 2 1161 99 LEU CD2 C 23.8 . 2 1162 99 LEU N N 122.1 . 1 1163 100 ASN H H 8.27 . 1 1164 100 ASN HA H 4.84 . 1 1165 100 ASN HB2 H 3.01 . 2 1166 100 ASN HB3 H 2.88 . 2 1167 100 ASN HD21 H 7.60 . 2 1168 100 ASN HD22 H 6.91 . 2 1169 100 ASN C C 175.0 . 1 1170 100 ASN CA C 51.4 . 1 1171 100 ASN CB C 40.3 . 1 1172 100 ASN N N 118.9 . 1 1173 100 ASN ND2 N 113.0 . 1 1174 101 GLU H H 8.99 . 1 1175 101 GLU HA H 3.69 . 1 1176 101 GLU HB2 H 2.07 . 2 1177 101 GLU HB3 H 2.19 . 2 1178 101 GLU HG2 H 2.29 . 2 1179 101 GLU HG3 H 2.29 . 2 1180 101 GLU C C 177.1 . 1 1181 101 GLU CA C 60.5 . 1 1182 101 GLU CB C 29.1 . 1 1183 101 GLU CG C 35.2 . 1 1184 101 GLU N N 121.8 . 1 1185 102 LYS H H 8.16 . 1 1186 102 LYS HA H 3.90 . 1 1187 102 LYS HB2 H 1.84 . 2 1188 102 LYS HB3 H 1.92 . 2 1189 102 LYS HG2 H 1.41 . 2 1190 102 LYS HG3 H 1.56 . 2 1191 102 LYS HD2 H 1.61 . 2 1192 102 LYS HD3 H 1.70 . 2 1193 102 LYS HE2 H 2.93 . 2 1194 102 LYS HE3 H 2.93 . 2 1195 102 LYS C C 179.6 . 1 1196 102 LYS CA C 59.9 . 1 1197 102 LYS CB C 32.2 . 1 1198 102 LYS CG C 25.4 . 1 1199 102 LYS CD C 29.4 . 1 1200 102 LYS CE C 41.8 . 1 1201 102 LYS N N 118.8 . 1 1202 103 GLU H H 7.95 . 1 1203 103 GLU HA H 4.12 . 1 1204 103 GLU HB2 H 2.02 . 2 1205 103 GLU HB3 H 2.19 . 2 1206 103 GLU HG2 H 2.41 . 2 1207 103 GLU HG3 H 2.41 . 2 1208 103 GLU C C 178.7 . 1 1209 103 GLU CA C 58.6 . 1 1210 103 GLU CB C 29.4 . 1 1211 103 GLU CG C 34.8 . 1 1212 103 GLU N N 120.1 . 1 1213 104 VAL H H 8.15 . 1 1214 104 VAL HA H 3.42 . 1 1215 104 VAL HB H 2.05 . 1 1216 104 VAL HG1 H 0.92 . 2 1217 104 VAL HG2 H 0.93 . 2 1218 104 VAL C C 177.3 . 1 1219 104 VAL CA C 67.2 . 1 1220 104 VAL CB C 31.6 . 1 1221 104 VAL CG1 C 21.2 . 2 1222 104 VAL CG2 C 24.2 . 2 1223 104 VAL N N 119.2 . 1 1224 105 LYS H H 8.33 . 1 1225 105 LYS HA H 3.74 . 1 1226 105 LYS HB2 H 1.88 . 2 1227 105 LYS HB3 H 1.88 . 2 1228 105 LYS HG2 H 1.31 . 2 1229 105 LYS HG3 H 1.69 . 2 1230 105 LYS HD2 H 1.69 . 2 1231 105 LYS HD3 H 1.69 . 2 1232 105 LYS HE2 H 2.89 . 2 1233 105 LYS HE3 H 2.96 . 2 1234 105 LYS C C 178.1 . 1 1235 105 LYS CA C 60.3 . 1 1236 105 LYS CB C 32.3 . 1 1237 105 LYS CG C 28.0 . 1 1238 105 LYS CD C 29.8 . 1 1239 105 LYS CE C 42.1 . 1 1240 105 LYS N N 116.9 . 1 1241 106 LYS H H 7.41 . 1 1242 106 LYS HA H 4.08 . 1 1243 106 LYS HB2 H 1.95 . 2 1244 106 LYS HB3 H 1.95 . 2 1245 106 LYS HG2 H 1.53 . 2 1246 106 LYS HG3 H 1.37 . 2 1247 106 LYS HD2 H 1.64 . 2 1248 106 LYS HD3 H 1.64 . 2 1249 106 LYS HE2 H 2.98 . 2 1250 106 LYS HE3 H 2.98 . 2 1251 106 LYS C C 179.4 . 1 1252 106 LYS CA C 59.1 . 1 1253 106 LYS CB C 32.7 . 1 1254 106 LYS CG C 24.7 . 1 1255 106 LYS CD C 28.8 . 1 1256 106 LYS CE C 42.1 . 1 1257 106 LYS N N 118.8 . 1 1258 107 LEU H H 8.12 . 1 1259 107 LEU HA H 4.11 . 1 1260 107 LEU HB2 H 1.84 . 2 1261 107 LEU HB3 H 1.28 . 2 1262 107 LEU HG H 1.77 . 1 1263 107 LEU HD1 H 0.84 . 2 1264 107 LEU HD2 H 1.01 . 2 1265 107 LEU C C 180.4 . 1 1266 107 LEU CA C 57.7 . 1 1267 107 LEU CB C 42.2 . 1 1268 107 LEU CG C 27.1 . 1 1269 107 LEU CD1 C 26.4 . 2 1270 107 LEU CD2 C 22.5 . 2 1271 107 LEU N N 119.5 . 1 1272 108 LYS H H 9.00 . 1 1273 108 LYS HA H 3.60 . 1 1274 108 LYS HB2 H 0.45 . 2 1275 108 LYS HB3 H 1.01 . 2 1276 108 LYS HG2 H 0.92 . 2 1277 108 LYS HG3 H 0.92 . 2 1278 108 LYS HD2 H 1.84 . 2 1279 108 LYS HD3 H 1.28 . 2 1280 108 LYS HE2 H 2.93 . 2 1281 108 LYS HE3 H 2.93 . 2 1282 108 LYS C C 178.4 . 1 1283 108 LYS CA C 58.2 . 1 1284 108 LYS CB C 27.8 . 1 1285 108 LYS CG C 24.6 . 1 1286 108 LYS CD C 28.8 . 1 1287 108 LYS CE C 41.8 . 1 1288 108 LYS N N 117.3 . 1 1289 109 GLU H H 7.31 . 1 1290 109 GLU HA H 4.40 . 1 1291 109 GLU HB2 H 2.13 . 2 1292 109 GLU HB3 H 2.13 . 2 1293 109 GLU HG2 H 2.52 . 2 1294 109 GLU HG3 H 2.42 . 2 1295 109 GLU C C 178.7 . 1 1296 109 GLU CA C 58.1 . 1 1297 109 GLU CB C 28.6 . 1 1298 109 GLU CG C 35.5 . 1 1299 109 GLU N N 123.0 . 1 1300 110 ASP H H 7.27 . 1 1301 110 ASP HA H 4.55 . 1 1302 110 ASP HB2 H 3.31 . 2 1303 110 ASP HB3 H 2.69 . 2 1304 110 ASP C C 178.4 . 1 1305 110 ASP CA C 57.0 . 1 1306 110 ASP CB C 40.2 . 1 1307 110 ASP N N 121.1 . 1 1308 111 VAL H H 7.04 . 1 1309 111 VAL HA H 3.49 . 1 1310 111 VAL HB H 2.51 . 1 1311 111 VAL HG1 H 0.93 . 2 1312 111 VAL HG2 H 1.37 . 2 1313 111 VAL C C 177.1 . 1 1314 111 VAL CA C 67.5 . 1 1315 111 VAL CB C 30.9 . 1 1316 111 VAL CG1 C 23.0 . 2 1317 111 VAL CG2 C 22.5 . 2 1318 111 VAL N N 119.0 . 1 1319 112 ARG H H 8.53 . 1 1320 112 ARG HA H 3.15 . 1 1321 112 ARG HB2 H 2.03 . 2 1322 112 ARG HB3 H 2.16 . 2 1323 112 ARG HG2 H 1.34 . 2 1324 112 ARG HG3 H 1.03 . 2 1325 112 ARG HD2 H 3.02 . 2 1326 112 ARG HD3 H 3.21 . 2 1327 112 ARG C C 177.9 . 1 1328 112 ARG CA C 60.2 . 1 1329 112 ARG CB C 29.1 . 1 1330 112 ARG CG C 26.8 . 1 1331 112 ARG CD C 42.6 . 1 1332 112 ARG N N 121.2 . 1 1333 113 LYS H H 7.49 . 1 1334 113 LYS HA H 3.67 . 1 1335 113 LYS HB2 H 2.02 . 2 1336 113 LYS HB3 H 1.63 . 2 1337 113 LYS HG2 H 1.74 . 2 1338 113 LYS HG3 H 1.30 . 2 1339 113 LYS HD2 H 1.70 . 2 1340 113 LYS HD3 H 1.73 . 2 1341 113 LYS HE2 H 2.97 . 2 1342 113 LYS HE3 H 2.97 . 2 1343 113 LYS C C 178.6 . 1 1344 113 LYS CA C 60.0 . 1 1345 113 LYS CB C 33.0 . 1 1346 113 LYS CG C 26.1 . 1 1347 113 LYS CD C 29.8 . 1 1348 113 LYS CE C 42.1 . 1 1349 113 LYS N N 115.4 . 1 1350 114 LEU H H 7.54 . 1 1351 114 LEU HA H 3.99 . 1 1352 114 LEU HB2 H 2.00 . 2 1353 114 LEU HB3 H 1.86 . 2 1354 114 LEU HG H 1.77 . 1 1355 114 LEU HD1 H 1.09 . 2 1356 114 LEU HD2 H 1.01 . 2 1357 114 LEU C C 177.6 . 1 1358 114 LEU CA C 58.1 . 1 1359 114 LEU CB C 42.3 . 1 1360 114 LEU CG C 27.1 . 1 1361 114 LEU CD1 C 25.8 . 2 1362 114 LEU CD2 C 24.0 . 2 1363 114 LEU N N 120.3 . 1 1364 115 VAL H H 8.45 . 1 1365 115 VAL HA H 3.33 . 1 1366 115 VAL HB H 2.04 . 1 1367 115 VAL HG1 H 0.92 . 2 1368 115 VAL HG2 H 0.67 . 2 1369 115 VAL C C 177.4 . 1 1370 115 VAL CA C 67.4 . 1 1371 115 VAL CB C 31.5 . 1 1372 115 VAL CG1 C 23.4 . 2 1373 115 VAL CG2 C 21.2 . 2 1374 115 VAL N N 119.3 . 1 1375 116 ILE H H 8.44 . 1 1376 116 ILE HA H 3.62 . 1 1377 116 ILE HB H 1.82 . 1 1378 116 ILE HG12 H 1.46 . 2 1379 116 ILE HG13 H 1.23 . 2 1380 116 ILE HG2 H 0.84 . 1 1381 116 ILE HD1 H 0.68 . 1 1382 116 ILE C C 178.5 . 1 1383 116 ILE CA C 64.2 . 1 1384 116 ILE CB C 36.9 . 1 1385 116 ILE CG1 C 28.6 . 1 1386 116 ILE CG2 C 17.3 . 1 1387 116 ILE CD1 C 12.3 . 1 1388 116 ILE N N 118.4 . 1 1389 117 PHE H H 8.13 . 1 1390 117 PHE HA H 4.37 . 1 1391 117 PHE HB2 H 3.35 . 2 1392 117 PHE HB3 H 3.13 . 2 1393 117 PHE HD1 H 7.21 . 3 1394 117 PHE HD2 H 7.21 . 3 1395 117 PHE HE1 H 7.33 . 3 1396 117 PHE HE2 H 7.33 . 3 1397 117 PHE C C 179.1 . 1 1398 117 PHE CA C 60.9 . 1 1399 117 PHE CB C 38.5 . 1 1400 117 PHE CD1 C 130.8 . 1 1401 117 PHE CE1 C 130.9 . 1 1402 117 PHE N N 119.6 . 1 1403 118 ALA H H 8.37 . 1 1404 118 ALA HA H 4.00 . 1 1405 118 ALA HB H 1.65 . 1 1406 118 ALA C C 179.4 . 1 1407 118 ALA CA C 55.4 . 1 1408 118 ALA CB C 19.1 . 1 1409 118 ALA N N 122.9 . 1 1410 119 VAL H H 8.84 . 1 1411 119 VAL HA H 3.51 . 1 1412 119 VAL HB H 2.07 . 1 1413 119 VAL HG1 H 0.91 . 2 1414 119 VAL HG2 H 0.98 . 2 1415 119 VAL C C 179.0 . 1 1416 119 VAL CA C 66.7 . 1 1417 119 VAL CB C 31.8 . 1 1418 119 VAL CG1 C 21.2 . 2 1419 119 VAL CG2 C 22.6 . 2 1420 119 VAL N N 119.4 . 1 1421 120 ASN H H 8.75 . 1 1422 120 ASN HA H 4.44 . 1 1423 120 ASN HB2 H 2.90 . 2 1424 120 ASN HB3 H 2.71 . 2 1425 120 ASN HD21 H 6.87 . 2 1426 120 ASN HD22 H 7.54 . 2 1427 120 ASN C C 177.9 . 1 1428 120 ASN CA C 55.6 . 1 1429 120 ASN CB C 38.0 . 1 1430 120 ASN N N 118.8 . 1 1431 120 ASN ND2 N 111.4 . 1 1432 121 SER H H 7.75 . 1 1433 121 SER HA H 4.13 . 1 1434 121 SER HB2 H 3.87 . 2 1435 121 SER HB3 H 3.77 . 2 1436 121 SER C C 175.5 . 1 1437 121 SER CA C 61.2 . 1 1438 121 SER CB C 62.9 . 1 1439 121 SER N N 115.9 . 1 1440 122 LEU H H 7.51 . 1 1441 122 LEU HA H 4.11 . 1 1442 122 LEU HB2 H 1.73 . 2 1443 122 LEU HB3 H 1.73 . 2 1444 122 LEU HG H 1.76 . 1 1445 122 LEU HD1 H 0.94 . 2 1446 122 LEU HD2 H 0.89 . 2 1447 122 LEU C C 178.6 . 1 1448 122 LEU CA C 57.0 . 1 1449 122 LEU CB C 42.2 . 1 1450 122 LEU CG C 26.8 . 1 1451 122 LEU CD1 C 25.0 . 2 1452 122 LEU CD2 C 24.4 . 2 1453 122 LEU N N 122.2 . 1 1454 123 GLU H H 7.91 . 1 1455 123 GLU HA H 4.09 . 1 1456 123 GLU HB2 H 1.98 . 2 1457 123 GLU HB3 H 1.98 . 2 1458 123 GLU HG2 H 2.26 . 2 1459 123 GLU HG3 H 2.36 . 2 1460 123 GLU C C 177.4 . 1 1461 123 GLU CA C 57.3 . 1 1462 123 GLU CB C 29.2 . 1 1463 123 GLU CG C 35.1 . 1 1464 123 GLU N N 117.9 . 1 1465 124 HIS H H 8.10 . 1 1466 124 HIS HA H 4.59 . 1 1467 124 HIS HB2 H 3.24 . 2 1468 124 HIS HB3 H 3.14 . 2 1469 124 HIS C C 174.8 . 1 1470 124 HIS CA C 55.8 . 1 1471 124 HIS CB C 28.5 . 1 1472 124 HIS N N 116.4 . 1 1473 125 HIS H H 8.13 . 1 1474 125 HIS HA H 4.61 . 1 1475 125 HIS HB2 H 3.26 . 2 1476 125 HIS HB3 H 3.16 . 2 1477 125 HIS C C 174.4 . 1 1478 125 HIS CA C 55.8 . 1 1479 125 HIS CB C 28.9 . 1 1480 125 HIS N N 117.4 . 1 1481 126 HIS H H 8.42 . 1 1482 126 HIS HA H 4.68 . 1 1483 126 HIS HB2 H 3.15 . 2 1484 126 HIS HB3 H 3.24 . 2 1485 126 HIS C C 174.2 . 1 1486 126 HIS CA C 55.3 . 1 1487 126 HIS CB C 28.8 . 1 1488 126 HIS N N 118.6 . 1 1489 127 HIS H H 8.54 . 1 1490 127 HIS HA H 4.67 . 1 1491 127 HIS HB2 H 3.24 . 2 1492 127 HIS HB3 H 3.15 . 2 1493 127 HIS C C 174.0 . 1 1494 127 HIS CA C 55.3 . 1 1495 127 HIS CB C 29.3 . 1 1496 127 HIS N N 119.6 . 1 1497 128 HIS H H 8.55 . 1 1498 128 HIS HA H 4.68 . 1 1499 128 HIS HB2 H 3.24 . 2 1500 128 HIS HB3 H 3.24 . 2 1501 128 HIS C C 173.5 . 1 1502 128 HIS CA C 55.5 . 1 1503 128 HIS CB C 29.4 . 1 1504 128 HIS N N 120.3 . 1 1505 129 HIS H H 8.39 . 1 1506 129 HIS HA H 4.67 . 1 1507 129 HIS HB2 H 3.24 . 2 1508 129 HIS HB3 H 3.24 . 2 1509 129 HIS CA C 57.0 . 1 1510 129 HIS CB C 29.6 . 1 1511 129 HIS N N 125.5 . 1 cwd: /data/PSVS/PSVS-v1.4-dev/results/SSR10_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/SSR10_R3_em_bcr3/rpf_calc/input/ctrl_file -o rpf_calc -q SSR10_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 n.peaks ...   Doing SimpleMatch for c_aro.peaks ...   Doing SimpleMatch for c_ali.peaks ...   Reading ComparePdbFile: SSR10_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SSR10_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SSR10_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SSR10_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SSR10_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SSR10_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SSR10_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SSR10_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SSR10_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SSR10_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SSR10_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SSR10_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SSR10_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SSR10_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SSR10_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SSR10_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SSR10_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SSR10_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SSR10_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: SSR10_R3_em_bcr3.pdb.iupac  quality-estimation for n.peaks ...   Doing Recall analysis for n.peaks ...  Doing Precision analysis for n.peaks ...  Doing Recall analysis for n.peaks ...  Doing Precision analysis for n.peaks ... prtSimleMatchPeakAtom for n.peaks ...   quality-estimation for c_aro.peaks ...   Doing Recall analysis for c_aro.peaks ...  Doing Precision analysis for c_aro.peaks ...  Doing Recall analysis for c_aro.peaks ...  Doing Precision analysis for c_aro.peaks ... prtSimleMatchPeakAtom for c_aro.peaks ...   quality-estimation for c_ali.peaks ...   Doing Recall analysis for c_ali.peaks ...  Doing Precision analysis for c_ali.peaks ...  Doing Recall analysis for c_ali.peaks ...  Doing Precision analysis for c_ali.peaks ... prtSimleMatchPeakAtom for c_ali.peaks ...