AS object created. control filepath is: /data/PSVS/PSVS-v1.4-dev/results/UUR17A_R3_em_bcr3/rpf_calc/input/ctrl_file bmrb: chem_shift.bmrb sequence: UUR17A_R3_em_bcr3_seq.bmrb parsing bmrb: /data/PSVS/PSVS-v1.4-dev/results/UUR17A_R3_em_bcr3/rpf_calc/input/chem_shift.bmrb new residue 2 adding: *8* *2* *Leu* *HA* *H* *4.388* *.* *1* old residue 2 adding: *9* *2* *Leu* *HB2* *H* *1.667* *.* *2* old residue 2 adding: *10* *2* *Leu* *HB3* *H* *1.667* *.* *2* old residue 2 adding: *11* *2* *Leu* *HG* *H* *1.654* *.* *1* old residue 2 adding: *12* *2* *Leu* *HD1* *H* *0.887* *.* *2* old residue 2 adding: *13* *2* *Leu* *HD2* *H* *0.887* *.* *2* old residue 2 adding: *14* *2* *Leu* *C* *C* *176.516* *.* *1* old residue 2 adding: *15* *2* *Leu* *CA* *C* *55.855* *.* *1* old residue 2 adding: *16* *2* *Leu* *CB* *C* *42.324* *.* *1* old residue 2 adding: *17* *2* *Leu* *CG* *C* *27.180* *.* *1* old residue 2 adding: *18* *2* *Leu* *CD1* *C* *24.129* *.* *2* old residue 2 adding: *19* *2* *Leu* *CD2* *C* *24.129* *.* *2* new residue 3 adding: *20* *3* *Ser* *H* *H* *8.479* *.* *1* old residue 3 adding: *21* *3* *Ser* *HA* *H* *4.39* *.* *1* old residue 3 adding: *22* *3* *Ser* *HB2* *H* *3.947* *.* *2* old residue 3 adding: *23* *3* *Ser* *HB3* *H* *3.894* *.* *2* old residue 3 adding: *24* *3* *Ser* *C* *C* *174.803* *.* *1* old residue 3 adding: *25* *3* *Ser* *CA* *C* *58.759* *.* *1* old residue 3 adding: *26* *3* *Ser* *CB* *C* *63.569* *.* *1* old residue 3 adding: *27* *3* *Ser* *N* *N* *116.589* *.* *1* new residue 4 adding: *28* *4* *Gln* *H* *H* *8.45* *.* *1* old residue 4 adding: *29* *4* *Gln* *HA* *H* *4.369* *.* *1* old residue 4 adding: *30* *4* *Gln* *HB2* *H* *2.194* *.* *2* old residue 4 adding: *31* *4* *Gln* *HB3* *H* *2.057* *.* *2* old residue 4 adding: *32* *4* *Gln* *HG2* *H* *2.397* *.* *2* old residue 4 adding: *33* *4* *Gln* *HG3* *H* *2.397* *.* *2* old residue 4 adding: *34* *4* *Gln* *C* *C* *175.893* *.* *1* old residue 4 adding: *35* *4* *Gln* *CA* *C* *55.873* *.* *1* old residue 4 adding: *36* *4* *Gln* *CB* *C* *29.416* *.* *1* old residue 4 adding: *37* *4* *Gln* *CG* *C* *33.98* *.* *1* old residue 4 adding: *38* *4* *Gln* *N* *N* *122.337* *.* *1* new residue 5 adding: *39* *5* *Ala* *H* *H* *8.258* *.* *1* old residue 5 adding: *40* *5* *Ala* *HA* *H* *4.303* *.* *1* old residue 5 adding: *41* *5* *Ala* *HB* *H* *1.380* *.* *1* old residue 5 adding: *42* *5* *Ala* *C* *C* *177.117* *.* *1* old residue 5 adding: *43* *5* *Ala* *CA* *C* *52.978* *.* *1* old residue 5 adding: *44* *5* *Ala* *CB* *C* *19.345* *.* *1* old residue 5 adding: *45* *5* *Ala* *N* *N* *124.044* *.* *1* new residue 6 adding: *46* *6* *Asn* *H* *H* *8.412* *.* *1* old residue 6 adding: *47* *6* *Asn* *HA* *H* *4.703* *.* *1* old residue 6 adding: *48* *6* *Asn* *HB2* *H* *2.91* *.* *2* old residue 6 adding: *49* *6* *Asn* *HB3* *H* *2.91* *.* *2* old residue 6 adding: *50* *6* *Asn* *C* *C* *176.078* *.* *1* old residue 6 adding: *51* *6* *Asn* *CA* *C* *53.770* *.* *1* old residue 6 adding: *52* *6* *Asn* *CB* *C* *39.022* *.* *1* old residue 6 adding: *2001* *6* *Asn* *HD21* *H* *7.83* *.* *2* old residue 6 adding: *2002* *6* *Asn* *HD22* *H* *7.12* *.* *2* old residue 6 adding: *2003* *6* *Asn* *ND2* *N* *113.5* *.* *1* old residue 6 adding: *53* *6* *Asn* *N* *N* *118.107* *.* *1* new residue 7 adding: *54* *7* *Glu* *H* *H* *8.587* *.* *1* old residue 7 adding: *55* *7* *Glu* *HA* *H* *4.067* *.* *1* old residue 7 adding: *56* *7* *Glu* *HB2* *H* *2.08* *.* *2* old residue 7 adding: *57* *7* *Glu* *HB3* *H* *2.08* *.* *2* old residue 7 adding: *58* *7* *Glu* *HG2* *H* *2.337* *.* *2* old residue 7 adding: *59* *7* *Glu* *HG3* *H* *2.337* *.* *2* old residue 7 adding: *60* *7* *Glu* *C* *C* *177.858* *.* *1* old residue 7 adding: *61* *7* *Glu* *CA* *C* *58.511* *.* *1* old residue 7 adding: *62* *7* *Glu* *CB* *C* *30.464* *.* *1* old residue 7 adding: *63* *7* *Glu* *CG* *C* *36.182* *.* *1* old residue 7 adding: *64* *7* *Glu* *N* *N* *121.910* *.* *1* new residue 8 adding: *65* *8* *Asp* *H* *H* *8.455* *.* *1* old residue 8 adding: *66* *8* *Asp* *HA* *H* *4.411* *.* *1* old residue 8 adding: *67* *8* *Asp* *HB2* *H* *2.744* *.* *2* old residue 8 adding: *68* *8* *Asp* *HB3* *H* *2.683* *.* *2* old residue 8 adding: *69* *8* *Asp* *C* *C* *178.135* *.* *1* old residue 8 adding: *70* *8* *Asp* *CA* *C* *56.369* *.* *1* old residue 8 adding: *71* *8* *Asp* *CB* *C* *40.273* *.* *1* old residue 8 adding: *72* *8* *Asp* *N* *N* *120.117* *.* *1* new residue 9 adding: *73* *9* *Phe* *H* *H* *8.255* *.* *1* old residue 9 adding: *74* *9* *Phe* *HA* *H* *4.003* *.* *1* old residue 9 adding: *75* *9* *Phe* *HB2* *H* *3.208* *.* *2* old residue 9 adding: *76* *9* *Phe* *HB3* *H* *2.806* *.* *2* old residue 9 adding: *77* *9* *Phe* *C* *C* *176.995* *.* *1* old residue 9 adding: *78* *9* *Phe* *CA* *C* *61.979* *.* *1* old residue 9 adding: *79* *9* *Phe* *CB* *C* *39.473* *.* *1* old residue 9 adding: *3058* *9* *Phe* *HD1* *H* *6.81* *.* *2* old residue 9 adding: *3059* *9* *Phe* *HE1* *H* *7.207* *.* *2* old residue 9 adding: *3061* *9* *Phe* *HE2* *H* *7.207* *.* *2* old residue 9 adding: *3062* *9* *Phe* *HD2* *H* *6.81* *.* *2* old residue 9 adding: *3064* *9* *Phe* *CD1* *C* *131.9* *.* *2* old residue 9 adding: *3065* *9* *Phe* *CE1* *C* *130.9* *.* *2* old residue 9 adding: *3067* *9* *Phe* *CE2* *C* *130.9* *.* *2* old residue 9 adding: *3068* *9* *Phe* *CD2* *C* *132.1* *.* *2* old residue 9 adding: *80* *9* *Phe* *N* *N* *123.288* *.* *1* new residue 10 adding: *81* *10* *Lys* *H* *H* *8.067* *.* *1* old residue 10 adding: *82* *10* *Lys* *HA* *H* *3.495* *.* *1* old residue 10 adding: *83* *10* *Lys* *HB2* *H* *1.818* *.* *2* old residue 10 adding: *84* *10* *Lys* *HB3* *H* *1.754* *.* *2* old residue 10 adding: *3020* *10* *Lys* *HG2* *H* *1.551* *.* *2* old residue 10 adding: *85* *10* *Lys* *HG3* *H* *1.323* *.* *2* old residue 10 adding: *86* *10* *Lys* *HD2* *H* *1.678* *.* *2* old residue 10 adding: *87* *10* *Lys* *HD3* *H* *1.678* *.* *2* old residue 10 adding: *88* *10* *Lys* *C* *C* *178.210* *.* *1* old residue 10 adding: *89* *10* *Lys* *CA* *C* *59.89* *.* *1* old residue 10 adding: *90* *10* *Lys* *CB* *C* *31.882* *.* *1* old residue 10 adding: *91* *10* *Lys* *CG* *C* *25.46* *.* *1* old residue 10 adding: *92* *10* *Lys* *CD* *C* *29.55* *.* *1* old residue 10 adding: *93* *10* *Lys* *CE* *C* *42.177* *.* *1* old residue 10 adding: *94* *10* *Lys* *N* *N* *117.587* *.* *1* new residue 11 adding: *95* *11* *Lys* *H* *H* *7.387* *.* *1* old residue 11 adding: *96* *11* *Lys* *HA* *H* *3.899* *.* *1* old residue 11 adding: *97* *11* *Lys* *HB2* *H* *1.83* *.* *2* old residue 11 adding: *98* *11* *Lys* *HB3* *H* *1.83* *.* *2* old residue 11 adding: *3021* *11* *Lys* *HG2* *H* *1.54* *.* *2* old residue 11 adding: *3022* *11* *Lys* *HG3* *H* *1.347* *.* *2* old residue 11 adding: *3023* *11* *Lys* *HD2* *H* *1.7* *.* *2* old residue 11 adding: *3024* *11* *Lys* *HD3* *H* *1.7* *.* *2* old residue 11 adding: *99* *11* *Lys* *C* *C* *178.820* *.* *1* old residue 11 adding: *100* *11* *Lys* *CA* *C* *59.35* *.* *1* old residue 11 adding: *101* *11* *Lys* *CB* *C* *32.224* *.* *1* old residue 11 adding: *102* *11* *Lys* *CG* *C* *25.394* *.* *1* old residue 11 adding: *103* *11* *Lys* *CD* *C* *29.455* *.* *1* old residue 11 adding: *104* *11* *Lys* *CE* *C* *42.134* *.* *1* old residue 11 adding: *105* *11* *Lys* *N* *N* *117.271* *.* *1* new residue 12 adding: *106* *12* *Ile* *H* *H* *6.970* *.* *1* old residue 12 adding: *107* *12* *Ile* *HA* *H* *3.166* *.* *1* old residue 12 adding: *108* *12* *Ile* *HB* *H* *1.277* *.* *1* old residue 12 adding: *3005* *12* *Ile* *HG12* *H* *1.304* *.* *2* old residue 12 adding: *109* *12* *Ile* *HG13* *H* *0.128* *.* *2* old residue 12 adding: *110* *12* *Ile* *HG2* *H* *-0.08* *.* *1* old residue 12 adding: *111* *12* *Ile* *HD1* *H* *0.455* *.* *1* old residue 12 adding: *112* *12* *Ile* *C* *C* *178.350* *.* *1* old residue 12 adding: *113* *12* *Ile* *CA* *C* *65.22* *.* *1* old residue 12 adding: *114* *12* *Ile* *CB* *C* *36.951* *.* *1* old residue 12 adding: *115* *12* *Ile* *CG1* *C* *27.82* *.* *1* old residue 12 adding: *116* *12* *Ile* *CG2* *C* *16.2* *.* *1* old residue 12 adding: *117* *12* *Ile* *CD1* *C* *13.357* *.* *1* old residue 12 adding: *118* *12* *Ile* *N* *N* *119.214* *.* *1* new residue 13 adding: *119* *13* *Val* *H* *H* *7.504* *.* *1* old residue 13 adding: *120* *13* *Val* *HA* *H* *3.072* *.* *1* old residue 13 adding: *121* *13* *Val* *HB* *H* *1.676* *.* *1* old residue 13 adding: *2045* *13* *Val* *HG1* *H* *0.231* *.* *2* old residue 13 adding: *122* *13* *Val* *HG2* *H* *0.583* *.* *2* old residue 13 adding: *123* *13* *Val* *C* *C* *177.926* *.* *1* old residue 13 adding: *124* *13* *Val* *CA* *C* *65.935* *.* *1* old residue 13 adding: *125* *13* *Val* *CB* *C* *31.131* *.* *1* old residue 13 adding: *126* *13* *Val* *CG1* *C* *23.019* *.* *2* old residue 13 adding: *127* *13* *Val* *CG2* *C* *21.624* *.* *2* old residue 13 adding: *128* *13* *Val* *N* *N* *117.420* *.* *1* new residue 14 adding: *129* *14* *Asn* *H* *H* *7.84* *.* *1* old residue 14 adding: *130* *14* *Asn* *HA* *H* *4.426* *.* *1* old residue 14 adding: *131* *14* *Asn* *HB2* *H* *2.819* *.* *2* old residue 14 adding: *132* *14* *Asn* *HB3* *H* *2.722* *.* *2* old residue 14 adding: *133* *14* *Asn* *C* *C* *175.757* *.* *1* old residue 14 adding: *134* *14* *Asn* *CA* *C* *54.893* *.* *1* old residue 14 adding: *135* *14* *Asn* *CB* *C* *38.457* *.* *1* old residue 14 adding: *2004* *14* *Asn* *HD21* *H* *7.52* *.* *2* old residue 14 adding: *2005* *14* *Asn* *HD22* *H* *6.88* *.* *2* old residue 14 adding: *2006* *14* *Asn* *ND2* *N* *112.5* *.* *1* old residue 14 adding: *36* *14* *Asn* *N* *N* *115.865* *.* *1* new residue 15 adding: *137* *15* *Asn* *H* *H* *7.613* *.* *1* old residue 15 adding: *138* *15* *Asn* *HA* *H* *4.873* *.* *1* old residue 15 adding: *139* *15* *Asn* *HB2* *H* *2.987* *.* *2* old residue 15 adding: *140* *15* *Asn* *HB3* *H* *2.689* *.* *2* old residue 15 adding: *141* *15* *Asn* *C* *C* *174.765* *.* *1* old residue 15 adding: *142* *15* *Asn* *CA* *C* *53.041* *.* *1* old residue 15 adding: *143* *15* *Asn* *CB* *C* *40.315* *.* *1* old residue 15 adding: *2007* *15* *Asn* *HD21* *H* *7.59* *.* *2* old residue 15 adding: *2008* *15* *Asn* *HD22* *H* *6.99* *.* *2* old residue 15 adding: *2009* *15* *Asn* *ND2* *N* *113.5* *.* *1* old residue 15 adding: *144* *15* *Asn* *N* *N* *117.294* *.* *1* new residue 16 adding: *145* *16* *Ile* *H* *H* *7.152* *.* *1* old residue 16 adding: *146* *16* *Ile* *HA* *H* *4.178* *.* *1* old residue 16 adding: *147* *16* *Ile* *HB* *H* *1.722* *.* *1* old residue 16 adding: *148* *16* *Ile* *HG12* *H* *1.991* *.* *2* old residue 16 adding: *3006* *16* *Ile* *HG13* *H* *1.005* *.* *2* old residue 16 adding: *149* *16* *Ile* *HG2* *H* *0.854* *.* *1* old residue 16 adding: *3007* *16* *Ile* *HD1* *H* *0.702* *.* *1* old residue 16 adding: *150* *16* *Ile* *C* *C* *175.531* *.* *1* old residue 16 adding: *151* *16* *Ile* *CA* *C* *62.731* *.* *1* old residue 16 adding: *152* *16* *Ile* *CB* *C* *38.129* *.* *1* old residue 16 adding: *153* *16* *Ile* *CG1* *C* *27.588* *.* *1* old residue 16 adding: *154* *16* *Ile* *CG2* *C* *17.534* *.* *1* old residue 16 adding: *155* *16* *Ile* *CD1* *C* *15.766* *.* *1* old residue 16 adding: *156* *16* *Ile* *N* *N* *120.310* *.* *1* new residue 17 adding: *157* *17* *Arg* *H* *H* *8.620* *.* *1* old residue 17 adding: *158* *17* *Arg* *HA* *H* *4.788* *.* *1* old residue 17 adding: *159* *17* *Arg* *HB2* *H* *2.043* *.* *2* old residue 17 adding: *160* *17* *Arg* *HB3* *H* *1.805* *.* *2* old residue 17 adding: *161* *17* *Arg* *HG2* *H* *1.762* *.* *2* old residue 17 adding: *2043* *17* *Arg* *HG3* *H* *1.711* *.* *2* old residue 17 adding: *162* *17* *Arg* *HD2* *H* *3.265* *.* *2* old residue 17 adding: *163* *17* *Arg* *HD3* *H* *3.398* *.* *2* old residue 17 adding: *164* *17* *Arg* *C* *C* *176.682* *.* *1* old residue 17 adding: *165* *17* *Arg* *CA* *C* *54.765* *.* *1* old residue 17 adding: *166* *17* *Arg* *CB* *C* *35.05* *.* *1* old residue 17 adding: *167* *17* *Arg* *CG* *C* *27.411* *.* *1* old residue 17 adding: *168* *17* *Arg* *CD* *C* *43.446* *.* *1* old residue 17 adding: *169* *17* *Arg* *N* *N* *125.075* *.* *1* new residue 18 adding: *170* *18* *Leu* *H* *H* *8.978* *.* *1* old residue 18 adding: *171* *18* *Leu* *HA* *H* *3.663* *.* *1* old residue 18 adding: *172* *18* *Leu* *HB2* *H* *1.714* *.* *2* old residue 18 adding: *173* *18* *Leu* *HB3* *H* *1.071* *.* *2* old residue 18 adding: *174* *18* *Leu* *HG* *H* *1.58* *.* *1* old residue 18 adding: *175* *18* *Leu* *HD1* *H* *0.423* *.* *2* old residue 18 adding: *2099* *18* *Leu* *HD2* *H* *0.572* *.* *2* old residue 18 adding: *176* *18* *Leu* *CA* *C* *55.735* *.* *1* old residue 18 adding: *177* *18* *Leu* *CB* *C* *42.275* *.* *1* old residue 18 adding: *178* *18* *Leu* *CG* *C* *27.049* *.* *1* old residue 18 adding: *179* *18* *Leu* *CD1* *C* *26.169* *.* *2* old residue 18 adding: *180* *18* *Leu* *CD2* *C* *24.731* *.* *2* old residue 18 adding: *181* *18* *Leu* *N* *N* *127.698* *.* *1* new residue 19 adding: *182* *19* *Lys* *H* *H* *8.452* *.* *1* old residue 19 adding: *183* *19* *Lys* *HA* *H* *4.405* *.* *1* old residue 19 adding: *184* *19* *Lys* *HB2* *H* *2.378* *.* *2* old residue 19 adding: *185* *19* *Lys* *HB3* *H* *2.065* *.* *2* old residue 19 adding: *186* *19* *Lys* *HG2* *H* *1.80* *.* *2* old residue 19 adding: *187* *19* *Lys* *HG3* *H* *1.289* *.* *2* old residue 19 adding: *3025* *19* *Lys* *HD2* *H* *1.77* *.* *2* old residue 19 adding: *188* *19* *Lys* *HD3* *H* *1.77* *.* *2* old residue 19 adding: *189* *19* *Lys* *C* *C* *176.739* *.* *1* old residue 19 adding: *190* *19* *Lys* *CA* *C* *60.471* *.* *1* old residue 19 adding: *191* *19* *Lys* *CB* *C* *30.938* *.* *1* old residue 19 adding: *192* *19* *Lys* *CG* *C* *26.156* *.* *1* old residue 19 adding: *193* *19* *Lys* *CD* *C* *29.741* *.* *1* old residue 19 adding: *194* *19* *Lys* *CE* *C* *42.335* *.* *1* old residue 19 adding: *195* *19* *Lys* *N* *N* *120.284* *.* *1* new residue 20 adding: *196* *20* *Asp* *H* *H* *7.608* *.* *1* old residue 20 adding: *197* *20* *Asp* *HA* *H* *4.645* *.* *1* old residue 20 adding: *198* *20* *Asp* *HB2* *H* *2.677* *.* *2* old residue 20 adding: *199* *20* *Asp* *HB3* *H* *2.677* *.* *2* old residue 20 adding: *200* *20* *Asp* *C* *C* *176.293* *.* *1* old residue 20 adding: *201* *20* *Asp* *CA* *C* *56.198* *.* *1* old residue 20 adding: *202* *20* *Asp* *CB* *C* *43.08* *.* *1* old residue 20 adding: *203* *20* *Asp* *N* *N* *117.462* *.* *1* new residue 21 adding: *204* *21* *Thr* *H* *H* *8.623* *.* *1* old residue 21 adding: *205* *21* *Thr* *HA* *H* *4.164* *.* *1* old residue 21 adding: *206* *21* *Thr* *HB* *H* *4.269* *.* *1* old residue 21 adding: *208* *21* *Thr* *C* *C* *175.015* *.* *1* old residue 21 adding: *209* *21* *Thr* *CA* *C* *65.596* *.* *1* old residue 21 adding: *210* *21* *Thr* *CB* *C* *68.46* *.* *1* old residue 21 adding: *212* *21* *Thr* *N* *N* *111.699* *.* *1* new residue 22 adding: *213* *22* *Phe* *H* *H* *7.606* *.* *1* old residue 22 adding: *214* *22* *Phe* *HA* *H* *5.11* *.* *1* old residue 22 adding: *215* *22* *Phe* *HB2* *H* *2.95* *.* *2* old residue 22 adding: *216* *22* *Phe* *HB3* *H* *2.95* *.* *2* old residue 22 adding: *217* *22* *Phe* *C* *C* *170.154* *.* *1* old residue 22 adding: *218* *22* *Phe* *CA* *C* *55.345* *.* *1* old residue 22 adding: *219* *22* *Phe* *CB* *C* *41.126* *.* *1* old residue 22 adding: *3069* *22* *Phe* *HD1* *H* *6.993* *.* *2* old residue 22 adding: *3073* *22* *Phe* *HD2* *H* *6.993* *.* *2* old residue 22 adding: *3075* *22* *Phe* *CD1* *C* *131.96* *.* *2* old residue 22 adding: *3079* *22* *Phe* *CD2* *C* *131.96* *.* *2* old residue 22 adding: *220* *22* *Phe* *N* *N* *113.721* *.* *1* new residue 23 adding: *221* *23* *Asp* *H* *H* *9.045* *.* *1* old residue 23 adding: *222* *23* *Asp* *HA* *H* *4.787* *.* *1* old residue 23 adding: *223* *23* *Asp* *HB2* *H* *2.961* *.* *2* old residue 23 adding: *224* *23* *Asp* *HB3* *H* *2.511* *.* *2* old residue 23 adding: *225* *23* *Asp* *C* *C* *175.785* *.* *1* old residue 23 adding: *226* *23* *Asp* *CA* *C* *53.871* *.* *1* old residue 23 adding: *227* *23* *Asp* *CB* *C* *47.85* *.* *1* old residue 23 adding: *228* *23* *Asp* *N* *N* *121.321* *.* *1* new residue 24 adding: *229* *24* *Phe* *H* *H* *8.944* *.* *1* old residue 24 adding: *230* *24* *Phe* *HA* *H* *6.087* *.* *1* old residue 24 adding: *231* *24* *Phe* *HB2* *H* *2.95* *.* *2* old residue 24 adding: *232* *24* *Phe* *HB3* *H* *2.95* *.* *2* old residue 24 adding: *233* *24* *Phe* *C* *C* *172.639* *.* *1* old residue 24 adding: *234* *24* *Phe* *CA* *C* *56.319* *.* *1* old residue 24 adding: *235* *24* *Phe* *CB* *C* *43.62* *.* *1* old residue 24 adding: *3080* *24* *Phe* *HD1* *H* *7.099* *.* *2* old residue 24 adding: *3081* *24* *Phe* *HE1* *H* *6.808* *.* *2* old residue 24 adding: *3083* *24* *Phe* *HE2* *H* *6.808* *.* *2* old residue 24 adding: *3084* *24* *Phe* *HD2* *H* *7.099* *.* *2* old residue 24 adding: *3086* *24* *Phe* *CD1* *C* *132.3* *.* *2* old residue 24 adding: *3087* *24* *Phe* *CE1* *C* *132.06* *.* *2* old residue 24 adding: *3089* *24* *Phe* *CE2* *C* *132.5* *.* *2* old residue 24 adding: *3090* *24* *Phe* *CD2* *C* *132.06* *.* *2* old residue 24 adding: *236* *24* *Phe* *N* *N* *114.948* *.* *1* new residue 25 adding: *237* *25* *Lys* *H* *H* *9.098* *.* *1* old residue 25 adding: *238* *25* *Lys* *HA* *H* *4.713* *.* *1* old residue 25 adding: *239* *25* *Lys* *HB2* *H* *1.853* *.* *2* old residue 25 adding: *240* *25* *Lys* *HB3* *H* *1.714* *.* *2* old residue 25 adding: *3026* *25* *Lys* *HG2* *H* *1.450* *.* *2* old residue 25 adding: *3027* *25* *Lys* *HG3* *H* *1.381* *.* *2* old residue 25 adding: *241* *25* *Lys* *C* *C* *175.516* *.* *1* old residue 25 adding: *242* *25* *Lys* *CA* *C* *54.610* *.* *1* old residue 25 adding: *243* *25* *Lys* *CB* *C* *37.004* *.* *1* old residue 25 adding: *244* *25* *Lys* *CG* *C* *24.514* *.* *1* old residue 25 adding: *246* *25* *Lys* *CE* *C* *42.142* *.* *1* old residue 25 adding: *247* *25* *Lys* *N* *N* *118.505* *.* *1* new residue 26 adding: *248* *26* *Leu* *H* *H* *9.930* *.* *1* old residue 26 adding: *249* *26* *Leu* *HA* *H* *5.019* *.* *1* old residue 26 adding: *250* *26* *Leu* *HB2* *H* *2.098* *.* *2* old residue 26 adding: *251* *26* *Leu* *HB3* *H* *1.887* *.* *2* old residue 26 adding: *252* *26* *Leu* *HG* *H* *1.212* *.* *1* old residue 26 adding: *253* *26* *Leu* *HD1* *H* *1.138* *.* *2* old residue 26 adding: *254* *26* *Leu* *HD2* *H* *1.138* *.* *2* old residue 26 adding: *255* *26* *Leu* *C* *C* *177.546* *.* *1* old residue 26 adding: *256* *26* *Leu* *CA* *C* *54.22* *.* *1* old residue 26 adding: *257* *26* *Leu* *CB* *C* *42.138* *.* *1* old residue 26 adding: *258* *26* *Leu* *CG* *C* *26.643* *.* *1* old residue 26 adding: *259* *26* *Leu* *CD1* *C* *25.832* *.* *2* old residue 26 adding: *260* *26* *Leu* *CD2* *C* *25.832* *.* *2* old residue 26 adding: *261* *26* *Leu* *N* *N* *125.25* *.* *1* new residue 27 adding: *262* *27* *Ala* *H* *H* *8.01* *.* *1* old residue 27 adding: *263* *27* *Ala* *HA* *H* *3.897* *.* *1* old residue 27 adding: *264* *27* *Ala* *HB* *H* *1.208* *.* *1* old residue 27 adding: *265* *27* *Ala* *C* *C* *179.107* *.* *1* old residue 27 adding: *266* *27* *Ala* *CA* *C* *54.465* *.* *1* old residue 27 adding: *267* *27* *Ala* *CB* *C* *17.9550* *.* *1* old residue 27 adding: *268* *27* *Ala* *N* *N* *128.008* *.* *1* new residue 28 adding: *269* *28* *Ala* *H* *H* *8.320* *.* *1* old residue 28 adding: *270* *28* *Ala* *HA* *H* *3.736* *.* *1* old residue 28 adding: *271* *28* *Ala* *HB* *H* *0.572* *.* *1* old residue 28 adding: *272* *28* *Ala* *C* *C* *176.745* *.* *1* old residue 28 adding: *273* *28* *Ala* *CA* *C* *53.417* *.* *1* old residue 28 adding: *274* *28* *Ala* *CB* *C* *19.771* *.* *1* old residue 28 adding: *275* *28* *Ala* *N* *N* *114.273* *.* *1* new residue 29 adding: *276* *29* *Phe* *H* *H* *7.043* *.* *1* old residue 29 adding: *277* *29* *Phe* *HA* *H* *5.242* *.* *1* old residue 29 adding: *278* *29* *Phe* *HB2* *H* *3.177* *.* *2* old residue 29 adding: *279* *29* *Phe* *HB3* *H* *2.812* *.* *2* old residue 29 adding: *280* *29* *Phe* *CA* *C* *53.623* *.* *1* old residue 29 adding: *281* *29* *Phe* *CB* *C* *41.253* *.* *1* old residue 29 adding: *3091* *29* *Phe* *HD1* *H* *7.12* *.* *2* old residue 29 adding: *3092* *29* *Phe* *HE1* *H* *7.11* *.* *2* old residue 29 adding: *3094* *29* *Phe* *HE2* *H* *7.11* *.* *1* old residue 29 adding: *3095* *29* *Phe* *HD2* *H* *7.12* *.* *2* old residue 29 adding: *3097* *29* *Phe* *CD1* *C* *133.2* *.* *2* old residue 29 adding: *3098* *29* *Phe* *CE1* *C* *130.2* *.* *2* old residue 29 adding: *3100* *29* *Phe* *CE2* *C* *130.2* *.* *2* old residue 29 adding: *3101* *29* *Phe* *CD2* *C* *133.2* *.* *2* old residue 29 adding: *282* *29* *Phe* *N* *N* *112.267* *.* *1* new residue 30 adding: *283* *30* *Pro* *HA* *H* *4.384* *.* *1* old residue 30 adding: *284* *30* *Pro* *HB2* *H* *2.218* *.* *2* old residue 30 adding: *285* *30* *Pro* *HB3* *H* *1.915* *.* *2* old residue 30 adding: *286* *30* *Pro* *HG2* *H* *1.989* *.* *2* old residue 30 adding: *287* *30* *Pro* *HG3* *H* *1.989* *.* *2* old residue 30 adding: *288* *30* *Pro* *HD2* *H* *3.574* *.* *2* old residue 30 adding: *2086* *30* *Pro* *HD3* *H* *3.477* *.* *2* old residue 30 adding: *289* *30* *Pro* *C* *C* *177.686* *.* *1* old residue 30 adding: *290* *30* *Pro* *CA* *C* *64.889* *.* *1* old residue 30 adding: *291* *30* *Pro* *CB* *C* *31.935* *.* *1* old residue 30 adding: *292* *30* *Pro* *CG* *C* *27.3* *.* *1* old residue 30 adding: *293* *30* *Pro* *CD* *C* *49.74* *.* *1* new residue 31 adding: *294* *31* *Asn* *H* *H* *8.699* *.* *1* old residue 31 adding: *295* *31* *Asn* *HA* *H* *4.785* *.* *1* old residue 31 adding: *296* *31* *Asn* *HB2* *H* *2.980* *.* *2* old residue 31 adding: *297* *31* *Asn* *HB3* *H* *2.791* *.* *2* old residue 31 adding: *298* *31* *Asn* *C* *C* *174.507* *.* *1* old residue 31 adding: *299* *31* *Asn* *CA* *C* *53.234* *.* *1* old residue 31 adding: *300* *31* *Asn* *CB* *C* *38.9* *.* *1* old residue 31 adding: *2010* *31* *Asn* *HD21* *H* *7.63* *.* *2* old residue 31 adding: *2011* *31* *Asn* *HD22* *H* *7.009* *.* *2* old residue 31 adding: *2012* *31* *Asn* *ND2* *N* *114.1* *.* *1* old residue 31 adding: *301* *31* *Asn* *N* *N* *115.305* *.* *1* new residue 32 adding: *302* *32* *Gln* *H* *H* *7.227* *.* *1* old residue 32 adding: *303* *32* *Gln* *HA* *H* *4.585* *.* *1* old residue 32 adding: *304* *32* *Gln* *HB2* *H* *1.9* *.* *2* old residue 32 adding: *305* *32* *Gln* *HB3* *H* *1.9* *.* *2* old residue 32 adding: *306* *32* *Gln* *HG2* *H* *2.25* *.* *2* old residue 32 adding: *2058* *32* *Gln* *HG3* *H* *2.25* *.* *2* old residue 32 adding: *307* *32* *Gln* *C* *C* *174.827* *.* *1* old residue 32 adding: *308* *32* *Gln* *CA* *C* *55.371* *.* *1* old residue 32 adding: *309* *32* *Gln* *CB* *C* *31.85* *.* *1* old residue 32 adding: *310* *32* *Gln* *CG* *C* *34.97* *.* *1* old residue 32 adding: *311* *32* *Gln* *N* *N* *117.758* *.* *1* new residue 33 adding: *312* *33* *Asn* *H* *H* *8.692* *.* *1* old residue 33 adding: *313* *33* *Asn* *HA* *H* *4.591* *.* *1* old residue 33 adding: *314* *33* *Asn* *HB2* *H* *2.801* *.* *2* old residue 33 adding: *315* *33* *Asn* *HB3* *H* *2.617* *.* *2* old residue 33 adding: *316* *33* *Asn* *C* *C* *176.830* *.* *1* old residue 33 adding: *317* *33* *Asn* *CA* *C* *51.572* *.* *1* old residue 33 adding: *318* *33* *Asn* *CB* *C* *40.280* *.* *1* old residue 33 adding: *2013* *33* *Asn* *HD21* *H* *7.77* *.* *2* old residue 33 adding: *2014* *33* *Asn* *HD22* *H* *6.86* *.* *2* old residue 33 adding: *2015* *33* *Asn* *ND2* *N* *113.8* *.* *1* old residue 33 adding: *319* *33* *Asn* *N* *N* *120.622* *.* *1* new residue 34 adding: *320* *34* *Tyr* *H* *H* *7.328* *.* *1* old residue 34 adding: *321* *34* *Tyr* *HA* *H* *4.225* *.* *1* old residue 34 adding: *322* *34* *Tyr* *HB2* *H* *2.756* *.* *2* old residue 34 adding: *323* *34* *Tyr* *HB3* *H* *2.580* *.* *2* old residue 34 adding: *324* *34* *Tyr* *C* *C* *177.022* *.* *1* old residue 34 adding: *325* *34* *Tyr* *CA* *C* *60.2* *.* *1* old residue 34 adding: *326* *34* *Tyr* *CB* *C* *37.54* *.* *1* old residue 34 adding: *3135* *34* *Tyr* *HD1* *H* *6.806* *.* *2* old residue 34 adding: *3136* *34* *Tyr* *HE1* *H* *6.124* *.* *2* old residue 34 adding: *3137* *34* *Tyr* *HD2* *H* *6.806* *.* *2* old residue 34 adding: *3138* *34* *Tyr* *HE2* *H* *6.124* *.* *2* old residue 34 adding: *3140* *34* *Tyr* *CD1* *C* *132.06* *.* *2* old residue 34 adding: *3141* *34* *Tyr* *CD2* *C* *132.06* *.* *2* old residue 34 adding: *3142* *34* *Tyr* *CE1* *C* *118.609* *.* *2* old residue 34 adding: *3143* *34* *Tyr* *CE2* *C* *118.609* *.* *2* old residue 34 adding: *327* *34* *Tyr* *N* *N* *117.43* *.* *1* new residue 35 adding: *328* *35* *Asp* *H* *H* *7.944* *.* *1* old residue 35 adding: *329* *35* *Asp* *HA* *H* *4.351* *.* *1* old residue 35 adding: *330* *35* *Asp* *HB2* *H* *2.863* *.* *2* old residue 35 adding: *331* *35* *Asp* *HB3* *H* *2.549* *.* *2* old residue 35 adding: *332* *35* *Asp* *C* *C* *176.343* *.* *1* old residue 35 adding: *333* *35* *Asp* *CA* *C* *54.950* *.* *1* old residue 35 adding: *334* *35* *Asp* *CB* *C* *39.48* *.* *1* old residue 35 adding: *335* *35* *Asp* *N* *N* *109.804* *.* *1* new residue 36 adding: *336* *36* *Gln* *H* *H* *7.83* *.* *1* old residue 36 adding: *337* *36* *Gln* *HA* *H* *4.419* *.* *1* old residue 36 adding: *338* *36* *Gln* *HB2* *H* *2.399* *.* *2* old residue 36 adding: *339* *36* *Gln* *HB3* *H* *2.148* *.* *2* old residue 36 adding: *340* *36* *Gln* *HG2* *H* *2.366* *.* *2* old residue 36 adding: *2059* *36* *Gln* *HG3* *H* *2.366* *.* *2* old residue 36 adding: *341* *36* *Gln* *C* *C* *175.491* *.* *1* old residue 36 adding: *342* *36* *Gln* *CA* *C* *54.91* *.* *1* old residue 36 adding: *343* *36* *Gln* *CB* *C* *31.008* *.* *1* old residue 36 adding: *344* *36* *Gln* *CG* *C* *34.871* *.* *1* old residue 36 adding: *345* *36* *Gln* *N* *N* *116.1* *.* *1* new residue 37 adding: *346* *37* *Leu* *H* *H* *7.766* *.* *1* old residue 37 adding: *347* *37* *Leu* *HA* *H* *4.567* *.* *1* old residue 37 adding: *348* *37* *Leu* *HB2* *H* *0.89* *.* *2* old residue 37 adding: *349* *37* *Leu* *HB3* *H* *0.89* *.* *2* old residue 37 adding: *350* *37* *Leu* *HG* *H* *0.71* *.* *1* old residue 37 adding: *351* *37* *Leu* *HD1* *H* *-0.044* *.* *2* old residue 37 adding: *352* *37* *Leu* *HD2* *H* *-0.044* *.* *2* old residue 37 adding: *353* *37* *Leu* *C* *C* *175.435* *.* *1* old residue 37 adding: *354* *37* *Leu* *CA* *C* *53.073* *.* *1* old residue 37 adding: *355* *37* *Leu* *CB* *C* *45.05* *.* *1* old residue 37 adding: *356* *37* *Leu* *CG* *C* *25.52* *.* *1* old residue 37 adding: *357* *37* *Leu* *CD1* *C* *22.35* *.* *2* old residue 37 adding: *358* *37* *Leu* *CD2* *C* *22.35* *.* *2* old residue 37 adding: *359* *37* *Leu* *N* *N* *122.471* *.* *1* new residue 38 adding: *360* *38* *Leu* *H* *H* *8.806* *.* *1* old residue 38 adding: *3001* *38* *Leu* *HA* *H* *4.576* *.* *1* old residue 38 adding: *361* *38* *Leu* *HB2* *H* *1.667* *.* *2* old residue 38 adding: *362* *38* *Leu* *HB3* *H* *1.667* *.* *2* old residue 38 adding: *363* *38* *Leu* *HG* *H* *0.880* *.* *1* old residue 38 adding: *366* *38* *Leu* *CA* *C* *53.340* *.* *1* old residue 38 adding: *367* *38* *Leu* *CB* *C* *42.4* *.* *1* old residue 38 adding: *368* *38* *Leu* *CG* *C* *25.94* *.* *1* old residue 38 adding: *371* *38* *Leu* *N* *N* *123.422* *.* *1* new residue 39 adding: *372* *39* *Pro* *HA* *H* *3.770* *.* *1* old residue 39 adding: *373* *39* *Pro* *HB2* *H* *2.39* *.* *2* old residue 39 adding: *374* *39* *Pro* *HB3* *H* *2.39* *.* *2* old residue 39 adding: *3228* *39* *Pro* *HG2* *H* *2.24* *.* *2* old residue 39 adding: *375* *39* *Pro* *HG3* *H* *1.72* *.* *2* old residue 39 adding: *2087* *39* *Pro* *CG* *C* *28.05* *.* *1* old residue 39 adding: *378* *39* *Pro* *CA* *C* *66.56* *.* *1* old residue 39 adding: *379* *39* *Pro* *CB* *C* *32.0* *.* *1* new residue 40 adding: *381* *40* *Ser* *H* *H* *9.189* *.* *1* old residue 40 adding: *382* *40* *Ser* *HA* *H* *5.043* *.* *1* old residue 40 adding: *383* *40* *Ser* *HB2* *H* *3.943* *.* *2* old residue 40 adding: *384* *40* *Ser* *HB3* *H* *3.943* *.* *2* old residue 40 adding: *385* *40* *Ser* *CA* *C* *61.72* *.* *1* old residue 40 adding: *387* *40* *Ser* *N* *N* *110.942* *.* *1* new residue 41 adding: *388* *41* *Gln* *H* *H* *7.45* *.* *1* old residue 41 adding: *389* *41* *Gln* *HA* *H* *4.285* *.* *1* old residue 41 adding: *390* *41* *Gln* *HB2* *H* *1.958* *.* *2* old residue 41 adding: *391* *41* *Gln* *HB3* *H* *2.458* *.* *2* old residue 41 adding: *392* *41* *Gln* *HG2* *H* *2.487* *.* *2* old residue 41 adding: *2066* *41* *Gln* *HG3* *H* *2.348* *.* *2* old residue 41 adding: *393* *41* *Gln* *C* *C* *179.564* *.* *1* old residue 41 adding: *394* *41* *Gln* *CA* *C* *59.0* *.* *1* old residue 41 adding: *395* *41* *Gln* *CB* *C* *29.976* *.* *1* old residue 41 adding: *396* *41* *Gln* *CG* *C* *36.2* *.* *1* old residue 41 adding: *397* *41* *Gln* *N* *N* *121.997* *.* *1* new residue 42 adding: *398* *42* *Ile* *H* *H* *7.416* *.* *1* old residue 42 adding: *399* *42* *Ile* *HA* *H* *3.517* *.* *1* old residue 42 adding: *400* *42* *Ile* *HB* *H* *1.613* *.* *1* old residue 42 adding: *401* *42* *Ile* *HG12* *H* *0.806* *.* *2* old residue 42 adding: *402* *42* *Ile* *HG13* *H* *0.806* *.* *2* old residue 42 adding: *403* *42* *Ile* *HG2* *H* *0.596* *.* *1* old residue 42 adding: *404* *42* *Ile* *HD1* *H* *-0.204* *.* *1* old residue 42 adding: *405* *42* *Ile* *CA* *C* *65.210* *.* *1* old residue 42 adding: *406* *42* *Ile* *CB* *C* *37.448* *.* *1* old residue 42 adding: *407* *42* *Ile* *CG1* *C* *29.324* *.* *1* old residue 42 adding: *408* *42* *Ile* *CG2* *C* *14.738* *.* *1* old residue 42 adding: *409* *42* *Ile* *CD1* *C* *15.555* *.* *1* old residue 42 adding: *410* *42* *Ile* *N* *N* *120.598* *.* *1* new residue 43 adding: *411* *43* *Tyr* *H* *H* *8.803* *.* *1* old residue 43 adding: *412* *43* *Tyr* *HA* *H* *3.833* *.* *1* old residue 43 adding: *413* *43* *Tyr* *HB2* *H* *3.251* *.* *2* old residue 43 adding: *414* *43* *Tyr* *HB3* *H* *3.251* *.* *2* old residue 43 adding: *415* *43* *Tyr* *C* *C* *177.348* *.* *1* old residue 43 adding: *416* *43* *Tyr* *CA* *C* *62.545* *.* *1* old residue 43 adding: *417* *43* *Tyr* *CB* *C* *39.973* *.* *1* old residue 43 adding: *3145* *43* *Tyr* *HD1* *H* *6.552* *.* *2* old residue 43 adding: *3147* *43* *Tyr* *HD2* *H* *6.552* *.* *2* old residue 43 adding: *3150* *43* *Tyr* *CD1* *C* *132.71* *.* *2* old residue 43 adding: *3151* *43* *Tyr* *CD2* *C* *132.71* *.* *2* old residue 43 adding: *418* *43* *Tyr* *N* *N* *120.164* *.* *1* new residue 44 adding: *419* *44* *Lys* *H* *H* *8.010* *.* *1* old residue 44 adding: *420* *44* *Lys* *HA* *H* *4.255* *.* *1* old residue 44 adding: *421* *44* *Lys* *HB2* *H* *2.05* *.* *2* old residue 44 adding: *422* *44* *Lys* *HB3* *H* *2.009* *.* *2* old residue 44 adding: *3030* *44* *Lys* *HG2* *H* *1.99* *.* *2* old residue 44 adding: *3031* *44* *Lys* *HG3* *H* *1.693* *.* *2* old residue 44 adding: *3032* *44* *Lys* *HD2* *H* *1.767* *.* *2* old residue 44 adding: *3033* *44* *Lys* *HD3* *H* *1.767* *.* *2* old residue 44 adding: *423* *44* *Lys* *C* *C* *177.959* *.* *1* old residue 44 adding: *424* *44* *Lys* *CA* *C* *58.292* *.* *1* old residue 44 adding: *425* *44* *Lys* *CB* *C* *34.018* *.* *1* old residue 44 adding: *426* *44* *Lys* *CG* *C* *26.68* *.* *1* old residue 44 adding: *427* *44* *Lys* *CD* *C* *29.328* *.* *1* old residue 44 adding: *428* *44* *Lys* *CE* *C* *42.298* *.* *1* old residue 44 adding: *429* *44* *Lys* *N* *N* *112.505* *.* *1* new residue 45 adding: *430* *45* *Asn* *H* *H* *7.343* *.* *1* old residue 45 adding: *431* *45* *Asn* *HA* *H* *5.344* *.* *1* old residue 45 adding: *432* *45* *Asn* *HB2* *H* *2.82* *.* *2* old residue 45 adding: *433* *45* *Asn* *HB3* *H* *2.444* *.* *2* old residue 45 adding: *434* *45* *Asn* *C* *C* *177.526* *.* *1* old residue 45 adding: *435* *45* *Asn* *CA* *C* *54.405* *.* *1* old residue 45 adding: *436* *45* *Asn* *CB* *C* *42.1* *.* *1* old residue 45 adding: *2018* *45* *Asn* *ND2* *N* *110.67* *.* *1* old residue 45 adding: *437* *45* *Asn* *N* *N* *110.975* *.* *1* new residue 46 adding: *438* *46* *Tyr* *H* *H* *8.367* *.* *1* old residue 46 adding: *439* *46* *Tyr* *HA* *H* *5.35* *.* *1* old residue 46 adding: *440* *46* *Tyr* *HB2* *H* *2.980* *.* *2* old residue 46 adding: *441* *46* *Tyr* *HB3* *H* *3.140* *.* *2* old residue 46 adding: *442* *46* *Tyr* *C* *C* *177.348* *.* *1* old residue 46 adding: *443* *46* *Tyr* *CA* *C* *61.422* *.* *1* old residue 46 adding: *444* *46* *Tyr* *CB* *C* *36.26* *.* *1* old residue 46 adding: *3163* *46* *Tyr* *CE1* *C* *118.11* *.* *2* old residue 46 adding: *3164* *46* *Tyr* *CE2* *C* *118.11* *.* *2* old residue 46 adding: *445* *46* *Tyr* *N* *N* *123.444* *.* *1* new residue 47 adding: *447* *47* *Tyr* *HA* *H* *4.079* *.* *1* old residue 47 adding: *448* *47* *Tyr* *HB2* *H* *2.899* *.* *2* old residue 47 adding: *449* *47* *Tyr* *HB3* *H* *2.745* *.* *2* old residue 47 adding: *450* *47* *Tyr* *C* *C* *175.748* *.* *1* old residue 47 adding: *451* *47* *Tyr* *CA* *C* *59.325* *.* *1* old residue 47 adding: *452* *47* *Tyr* *CB* *C* *36.434* *.* *1* new residue 48 adding: *454* *48* *Gln* *H* *H* *6.629* *.* *1* old residue 48 adding: *455* *48* *Gln* *HA* *H* *3.858* *.* *1* old residue 48 adding: *456* *48* *Gln* *HB2* *H* *2.051* *.* *2* old residue 48 adding: *457* *48* *Gln* *HB3* *H* *1.820* *.* *2* old residue 48 adding: *458* *48* *Gln* *HG2* *H* *1.791* *.* *2* old residue 48 adding: *459* *48* *Gln* *HG3* *H* *1.48* *.* *2* old residue 48 adding: *460* *48* *Gln* *C* *C* *176.070* *.* *1* old residue 48 adding: *461* *48* *Gln* *CA* *C* *57.37* *.* *1* old residue 48 adding: *462* *48* *Gln* *CB* *C* *28.192* *.* *1* old residue 48 adding: *463* *48* *Gln* *CG* *C* *34.22* *.* *1* old residue 48 adding: *464* *48* *Gln* *N* *N* *117.6* *.* *1* new residue 49 adding: *465* *49* *Gly* *H* *H* *7.729* *.* *1* old residue 49 adding: *466* *49* *Gly* *HA2* *H* *4.656* *.* *2* old residue 49 adding: *467* *49* *Gly* *HA3* *H* *3.868* *.* *2* old residue 49 adding: *468* *49* *Gly* *CA* *C* *45.292* *.* *1* old residue 49 adding: *469* *49* *Gly* *N* *N* *106.971* *.* *1* new residue 50 adding: *470* *50* *Ile* *H* *H* *8.845* *.* *1* old residue 50 adding: *471* *50* *Ile* *HA* *H* *5.022* *.* *1* old residue 50 adding: *472* *50* *Ile* *HB* *H* *1.90* *.* *1* old residue 50 adding: *473* *50* *Ile* *HG12* *H* *1.978* *.* *2* old residue 50 adding: *474* *50* *Ile* *HG13* *H* *1.14* *.* *2* old residue 50 adding: *475* *50* *Ile* *HG2* *H* *1.07* *.* *1* old residue 50 adding: *476* *50* *Ile* *HD1* *H* *0.924* *.* *1* old residue 50 adding: *477* *50* *Ile* *C* *C* *174.448* *.* *1* old residue 50 adding: *478* *50* *Ile* *CA* *C* *60.736* *.* *1* old residue 50 adding: *479* *50* *Ile* *CB* *C* *42.550* *.* *1* old residue 50 adding: *480* *50* *Ile* *CG1* *C* *27.6* *.* *1* old residue 50 adding: *481* *50* *Ile* *CG2* *C* *18.52* *.* *1* old residue 50 adding: *482* *50* *Ile* *CD1* *C* *15.466* *.* *1* old residue 50 adding: *483* *50* *Ile* *N* *N* *125.81* *.* *1* new residue 51 adding: *484* *51* *Glu* *H* *H* *9.280* *.* *1* old residue 51 adding: *485* *51* *Glu* *HA* *H* *4.865* *.* *1* old residue 51 adding: *486* *51* *Glu* *HB2* *H* *2.039* *.* *2* old residue 51 adding: *487* *51* *Glu* *HB3* *H* *1.930* *.* *2* old residue 51 adding: *488* *51* *Glu* *HG2* *H* *2.307* *.* *2* old residue 51 adding: *489* *51* *Glu* *HG3* *H* *2.307* *.* *2* old residue 51 adding: *490* *51* *Glu* *C* *C* *175.340* *.* *1* old residue 51 adding: *491* *51* *Glu* *CA* *C* *54.882* *.* *1* old residue 51 adding: *492* *51* *Glu* *CB* *C* *32.703* *.* *1* old residue 51 adding: *493* *51* *Glu* *CG* *C* *36.198* *.* *1* old residue 51 adding: *494* *51* *Glu* *N* *N* *127.617* *.* *1* new residue 52 adding: *495* *52* *Ile* *H* *H* *9.061* *.* *1* old residue 52 adding: *496* *52* *Ile* *HA* *H* *4.852* *.* *1* old residue 52 adding: *497* *52* *Ile* *HB* *H* *2.15* *.* *1* old residue 52 adding: *498* *52* *Ile* *HG12* *H* *1.708* *.* *2* old residue 52 adding: *3009* *52* *Ile* *HG13* *H* *1.538* *.* *2* old residue 52 adding: *499* *52* *Ile* *HG2* *H* *0.978* *.* *1* old residue 52 adding: *500* *52* *Ile* *HD1* *H* *0.822* *.* *1* old residue 52 adding: *501* *52* *Ile* *C* *C* *175.798* *.* *1* old residue 52 adding: *502* *52* *Ile* *CA* *C* *59.055* *.* *1* old residue 52 adding: *503* *52* *Ile* *CB* *C* *38.804* *.* *1* old residue 52 adding: *505* *52* *Ile* *CG1* *C* *27.518* *.* *1* old residue 52 adding: *506* *52* *Ile* *CG2* *C* *16.798* *.* *1* old residue 52 adding: *507* *52* *Ile* *CD1* *C* *11.594* *.* *1* old residue 52 adding: *508* *52* *Ile* *N* *N* *126.210* *.* *1* new residue 53 adding: *509* *53* *Gln* *H* *H* *8.755* *.* *1* old residue 53 adding: *510* *53* *Gln* *HA* *H* *4.656* *.* *1* old residue 53 adding: *511* *53* *Gln* *HB2* *H* *1.942* *.* *2* old residue 53 adding: *512* *53* *Gln* *HB3* *H* *1.860* *.* *2* old residue 53 adding: *513* *53* *Gln* *HG2* *H* *2.265* *.* *2* old residue 53 adding: *2070* *53* *Gln* *HG3* *H* *2.265* *.* *2* old residue 53 adding: *514* *53* *Gln* *C* *C* *173.594* *.* *1* old residue 53 adding: *515* *53* *Gln* *CA* *C* *54.703* *.* *1* old residue 53 adding: *516* *53* *Gln* *CB* *C* *29.173* *.* *1* old residue 53 adding: *517* *53* *Gln* *CG* *C* *33.455* *.* *1* old residue 53 adding: *518* *53* *Gln* *N* *N* *127.724* *.* *1* new residue 54 adding: *519* *54* *Gln* *H* *H* *9.235* *.* *1* old residue 54 adding: *520* *54* *Gln* *HA* *H* *4.3* *.* *1* old residue 54 adding: *521* *54* *Gln* *HB2* *H* *2.194* *.* *2* old residue 54 adding: *522* *54* *Gln* *HB3* *H* *2.06* *.* *2* old residue 54 adding: *523* *54* *Gln* *HG2* *H* *2.4* *.* *2* old residue 54 adding: *524* *54* *Gln* *HG3* *H* *2.4* *.* *2* old residue 54 adding: *525* *54* *Gln* *C* *C* *174.810* *.* *1* old residue 54 adding: *526* *54* *Gln* *CA* *C* *56.0* *.* *1* old residue 54 adding: *527* *54* *Gln* *CB* *C* *29.22* *.* *1* old residue 54 adding: *528* *54* *Gln* *CG* *C* *34.0* *.* *1* old residue 54 adding: *529* *54* *Gln* *N* *N* *127.228* *.* *1* new residue 55 adding: *530* *55* *His* *H* *H* *8.501* *.* *1* old residue 55 adding: *531* *55* *His* *HA* *H* *4.963* *.* *1* old residue 55 adding: *532* *55* *His* *HB2* *H* *3.329* *.* *2* old residue 55 adding: *533* *55* *His* *HB3* *H* *3.107* *.* *2* old residue 55 adding: *2048* *55* *His* *HD2* *H* *6.53* *.* *1* old residue 55 adding: *534* *55* *His* *C* *C* *175.148* *.* *1* old residue 55 adding: *535* *55* *His* *CA* *C* *55.524* *.* *1* old residue 55 adding: *536* *55* *His* *CB* *C* *31.7* *.* *1* old residue 55 adding: *2050* *55* *His* *CD2* *C* *118.6* *.* *1* old residue 55 adding: *537* *55* *His* *N* *N* *123.757* *.* *1* new residue 56 adding: *538* *56* *Lys* *H* *H* *7.444* *.* *1* old residue 56 adding: *539* *56* *Lys* *HA* *H* *4.671* *.* *1* old residue 56 adding: *540* *56* *Lys* *HB2* *H* *1.346* *.* *2* old residue 56 adding: *541* *56* *Lys* *HB3* *H* *1.266* *.* *2* old residue 56 adding: *3034* *56* *Lys* *HG2* *H* *1.342* *.* *2* old residue 56 adding: *542* *56* *Lys* *HG3* *H* *1.215* *.* *2* old residue 56 adding: *3035* *56* *Lys* *HD2* *H* *1.52* *.* *2* old residue 56 adding: *543* *56* *Lys* *HD3* *H* *1.52* *.* *2* old residue 56 adding: *544* *56* *Lys* *C* *C* *174.915* *.* *1* old residue 56 adding: *545* *56* *Lys* *CA* *C* *54.735* *.* *1* old residue 56 adding: *546* *56* *Lys* *CB* *C* *38.503* *.* *1* old residue 56 adding: *547* *56* *Lys* *CG* *C* *25.599* *.* *1* old residue 56 adding: *548* *56* *Lys* *CD* *C* *29.554* *.* *1* old residue 56 adding: *3036* *56* *Lys* *CE* *C* *42.15* *.* *1* old residue 56 adding: *549* *56* *Lys* *N* *N* *115.021* *.* *1* new residue 57 adding: *550* *57* *Tyr* *H* *H* *8.881* *.* *1* old residue 57 adding: *551* *57* *Tyr* *HA* *H* *4.750* *.* *1* old residue 57 adding: *552* *57* *Tyr* *HB2* *H* *3.357* *.* *2* old residue 57 adding: *553* *57* *Tyr* *HB3* *H* *3.067* *.* *2* old residue 57 adding: *554* *57* *Tyr* *C* *C* *177.055* *.* *1* old residue 57 adding: *555* *57* *Tyr* *CA* *C* *58.251* *.* *1* old residue 57 adding: *556* *57* *Tyr* *CB* *C* *36.303* *.* *1* old residue 57 adding: *3176* *57* *Tyr* *HD1* *H* *6.93* *.* *2* old residue 57 adding: *3177* *57* *Tyr* *HE1* *H* *6.53* *.* *2* old residue 57 adding: *3178* *57* *Tyr* *HD2* *H* *6.93* *.* *2* old residue 57 adding: *3179* *57* *Tyr* *HE2* *H* *6.53* *.* *2* old residue 57 adding: *3181* *57* *Tyr* *CD1* *C* *132.76* *.* *2* old residue 57 adding: *3182* *57* *Tyr* *CD2* *C* *132.76* *.* *2* old residue 57 adding: *3183* *57* *Tyr* *CE1* *C* *118.66* *.* *2* old residue 57 adding: *3184* *57* *Tyr* *CE2* *C* *118.66* *.* *2* old residue 57 adding: *557* *57* *Tyr* *N* *N* *113.634* *.* *1* new residue 58 adding: *558* *58* *Gln* *H* *H* *9.344* *.* *1* old residue 58 adding: *559* *58* *Gln* *HA* *H* *4.060* *.* *1* old residue 58 adding: *560* *58* *Gln* *HB2* *H* *2.089* *.* *2* old residue 58 adding: *561* *58* *Gln* *HB3* *H* *1.943* *.* *2* old residue 58 adding: *562* *58* *Gln* *HG2* *H* *2.554* *.* *2* old residue 58 adding: *2077* *58* *Gln* *HG3* *H* *2.04* *.* *2* old residue 58 adding: *2078* *58* *Gln* *HE21* *H* *7.66* *.* *2* old residue 58 adding: *2079* *58* *Gln* *HE22* *H* *7.35* *.* *2* old residue 58 adding: *563* *58* *Gln* *C* *C* *177.751* *.* *1* old residue 58 adding: *564* *58* *Gln* *CA* *C* *60.835* *.* *1* old residue 58 adding: *565* *58* *Gln* *CB* *C* *28.275* *.* *1* old residue 58 adding: *566* *58* *Gln* *CG* *C* *34.585* *.* *1* old residue 58 adding: *2080* *58* *Gln* *NE2* *N* *109.5* *.* *1* old residue 58 adding: *567* *58* *Gln* *N* *N* *119.012* *.* *1* new residue 59 adding: *568* *59* *Asn* *H* *H* *8.717* *.* *1* old residue 59 adding: *569* *59* *Asn* *HA* *H* *4.636* *.* *1* old residue 59 adding: *570* *59* *Asn* *HB2* *H* *2.791* *.* *2* old residue 59 adding: *571* *59* *Asn* *HB3* *H* *2.792* *.* *2* old residue 59 adding: *572* *59* *Asn* *C* *C* *175.860* *.* *1* old residue 59 adding: *573* *59* *Asn* *CA* *C* *54.717* *.* *1* old residue 59 adding: *574* *59* *Asn* *CB* *C* *38.638* *.* *1* old residue 59 adding: *2019* *59* *Asn* *HD21* *H* *7.77* *.* *2* old residue 59 adding: *2020* *59* *Asn* *HD22* *H* *7.02* *.* *2* old residue 59 adding: *2021* *59* *Asn* *ND2* *N* *113.9* *.* *1* old residue 59 adding: *575* *59* *Asn* *N* *N* *113.155* *.* *1* new residue 60 adding: *576* *60* *Glu* *H* *H* *8.153* *.* *1* old residue 60 adding: *577* *60* *Glu* *HA* *H* *4.347* *.* *1* old residue 60 adding: *578* *60* *Glu* *HB2* *H* *2.166* *.* *2* old residue 60 adding: *579* *60* *Glu* *HB3* *H* *2.053* *.* *2* old residue 60 adding: *580* *60* *Glu* *HG2* *H* *2.52* *.* *2* old residue 60 adding: *581* *60* *Glu* *HG3* *H* *2.52* *.* *2* old residue 60 adding: *582* *60* *Glu* *C* *C* *176.792* *.* *1* old residue 60 adding: *583* *60* *Glu* *CA* *C* *59.212* *.* *1* old residue 60 adding: *584* *60* *Glu* *CB* *C* *32.136* *.* *1* old residue 60 adding: *585* *60* *Glu* *CG* *C* *36.480* *.* *1* old residue 60 adding: *586* *60* *Glu* *N* *N* *117.194* *.* *1* new residue 61 adding: *587* *61* *Leu* *H* *H* *8.638* *.* *1* old residue 61 adding: *588* *61* *Leu* *HA* *H* *5.635* *.* *1* old residue 61 adding: *589* *61* *Leu* *HB2* *H* *2.14* *.* *2* old residue 61 adding: *590* *61* *Leu* *HB3* *H* *1.31* *.* *2* old residue 61 adding: *591* *61* *Leu* *HG* *H* *0.65* *.* *1* old residue 61 adding: *592* *61* *Leu* *HD1* *H* *0.89* *.* *2* old residue 61 adding: *593* *61* *Leu* *HD2* *H* *0.89* *.* *2* old residue 61 adding: *594* *61* *Leu* *C* *C* *174.291* *.* *1* old residue 61 adding: *595* *61* *Leu* *CA* *C* *54.202* *.* *1* old residue 61 adding: *596* *61* *Leu* *CB* *C* *46.5* *.* *1* old residue 61 adding: *597* *61* *Leu* *CG* *C* *26.637* *.* *1* old residue 61 adding: *598* *61* *Leu* *CD1* *C* *24.99* *.* *2* old residue 61 adding: *599* *61* *Leu* *CD2* *C* *24.99* *.* *2* old residue 61 adding: *600* *61* *Leu* *N* *N* *123.189* *.* *1* new residue 62 adding: *601* *62* *Asp* *H* *H* *8.801* *.* *1* old residue 62 adding: *602* *62* *Asp* *HA* *H* *5.33* *.* *1* old residue 62 adding: *603* *62* *Asp* *HB2* *H* *2.667* *.* *2* old residue 62 adding: *604* *62* *Asp* *HB3* *H* *2.431* *.* *2* old residue 62 adding: *605* *62* *Asp* *C* *C* *174.580* *.* *1* old residue 62 adding: *606* *62* *Asp* *CA* *C* *53.151* *.* *1* old residue 62 adding: *607* *62* *Asp* *CB* *C* *45.273* *.* *1* old residue 62 adding: *608* *62* *Asp* *N* *N* *125.578* *.* *1* new residue 63 adding: *609* *63* *Ile* *H* *H* *7.864* *.* *1* old residue 63 adding: *610* *63* *Ile* *HA* *H* *4.289* *.* *1* old residue 63 adding: *611* *63* *Ile* *HB* *H* *1.203* *.* *1* old residue 63 adding: *612* *63* *Ile* *HG12* *H* *1.32* *.* *2* old residue 63 adding: *3010* *63* *Ile* *HG13* *H* *1.32* *.* *2* old residue 63 adding: *3011* *63* *Ile* *HG2* *H* *-0.076* *.* *1* old residue 63 adding: *613* *63* *Ile* *HD1* *H* *0.404* *.* *1* old residue 63 adding: *614* *63* *Ile* *C* *C* *173.538* *.* *1* old residue 63 adding: *615* *63* *Ile* *CA* *C* *60.967* *.* *1* old residue 63 adding: *616* *63* *Ile* *CB* *C* *41.301* *.* *1* old residue 63 adding: *617* *63* *Ile* *CG1* *C* *27.4* *.* *1* old residue 63 adding: *618* *63* *Ile* *CG2* *C* *15.98* *.* *1* old residue 63 adding: *619* *63* *Ile* *CD1* *C* *14.72* *.* *1* old residue 63 adding: *620* *63* *Ile* *N* *N* *122.782* *.* *1* new residue 64 adding: *621* *64* *Lys* *H* *H* *8.170* *.* *1* old residue 64 adding: *622* *64* *Lys* *HA* *H* *4.476* *.* *1* old residue 64 adding: *623* *64* *Lys* *HB2* *H* *1.65* *.* *2* old residue 64 adding: *624* *64* *Lys* *HB3* *H* *1.65* *.* *2* old residue 64 adding: *3037* *64* *Lys* *HG2* *H* *1.461* *.* *2* old residue 64 adding: *3038* *64* *Lys* *HG3* *H* *1.308* *.* *2* old residue 64 adding: *625* *64* *Lys* *HD2* *H* *1.65* *.* *2* old residue 64 adding: *626* *64* *Lys* *HD3* *H* *1.65* *.* *2* old residue 64 adding: *627* *64* *Lys* *C* *C* *175.569* *.* *1* old residue 64 adding: *628* *64* *Lys* *CA* *C* *54.537* *.* *1* old residue 64 adding: *629* *64* *Lys* *CB* *C* *36.45* *.* *1* old residue 64 adding: *630* *64* *Lys* *CG* *C* *25.004* *.* *1* old residue 64 adding: *631* *64* *Lys* *CD* *C* *29.01* *.* *1* old residue 64 adding: *632* *64* *Lys* *CE* *C* *42.586* *.* *1* old residue 64 adding: *633* *64* *Lys* *N* *N* *124.657* *.* *1* new residue 65 adding: *634* *65* *Ile* *H* *H* *8.6* *.* *1* old residue 65 adding: *3015* *65* *Ile* *HA* *H* *4.06* *.* *1* old residue 65 adding: *3012* *65* *Ile* *HB* *H* *1.345* *.* *1* old residue 65 adding: *637* *65* *Ile* *HG2* *H* *-0.269* *.* *1* old residue 65 adding: *638* *65* *Ile* *HD1* *H* *0.428* *.* *1* old residue 65 adding: *639* *65* *Ile* *CA* *C* *60.9* *.* *1* old residue 65 adding: *3014* *65* *Ile* *CB* *C* *38.68* *.* *1* old residue 65 adding: *640* *65* *Ile* *CG1* *C* *27.47* *.* *1* old residue 65 adding: *641* *65* *Ile* *CG2* *C* *17.25* *.* *1* old residue 65 adding: *642* *65* *Ile* *CD1* *C* *15.07* *.* *1* old residue 65 adding: *643* *65* *Ile* *N* *N* *123.131* *.* *1* new residue 66 adding: *644* *66* *Ile* *HA* *H* *4.07* *.* *1* old residue 66 adding: *645* *66* *Ile* *HB* *H* *1.849* *.* *1* old residue 66 adding: *3016* *66* *Ile* *HG12* *H* *1.339* *.* *2* old residue 66 adding: *3017* *66* *Ile* *HG13* *H* *0.97* *.* *2* old residue 66 adding: *646* *66* *Ile* *HG2* *H* *0.85* *.* *1* old residue 66 adding: *647* *66* *Ile* *HD1* *H* *0.85* *.* *1* old residue 66 adding: *648* *66* *Ile* *C* *C* *175.719* *.* *1* old residue 66 adding: *649* *66* *Ile* *CA* *C* *61.3* *.* *1* old residue 66 adding: *650* *66* *Ile* *CB* *C* *38.196* *.* *1* old residue 66 adding: *651* *66* *Ile* *CG1* *C* *26.7* *.* *1* old residue 66 adding: *652* *66* *Ile* *CG2* *C* *17.6* *.* *1* old residue 66 adding: *653* *66* *Ile* *CD1* *C* *12.9* *.* *1* new residue 67 adding: *654* *67* *Asn* *H* *H* *7.141* *.* *1* old residue 67 adding: *655* *67* *Asn* *HA* *H* *4.27* *.* *1* old residue 67 adding: *656* *67* *Asn* *HB2* *H* *2.796* *.* *2* old residue 67 adding: *657* *67* *Asn* *HB3* *H* *2.796* *.* *2* old residue 67 adding: *658* *67* *Asn* *C* *C* *171.998* *.* *1* old residue 67 adding: *659* *67* *Asn* *CA* *C* *52.874* *.* *1* old residue 67 adding: *660* *67* *Asn* *CB* *C* *41.891* *.* *1* old residue 67 adding: *661* *67* *Asn* *N* *N* *112.344* *.* *1* new residue 68 adding: *662* *68* *Phe* *H* *H* *6.40* *.* *1* old residue 68 adding: *663* *68* *Phe* *HA* *H* *4.940* *.* *1* old residue 68 adding: *664* *68* *Phe* *HB2* *H* *2.611* *.* *2* old residue 68 adding: *665* *68* *Phe* *HB3* *H* *2.337* *.* *2* old residue 68 adding: *666* *68* *Phe* *C* *C* *173.523* *.* *1* old residue 68 adding: *667* *68* *Phe* *CA* *C* *56.79* *.* *1* old residue 68 adding: *668* *68* *Phe* *CB* *C* *42.357* *.* *1* old residue 68 adding: *3102* *68* *Phe* *HD1* *H* *6.212* *.* *2* old residue 68 adding: *3103* *68* *Phe* *HE1* *H* *6.52* *.* *2* old residue 68 adding: *3105* *68* *Phe* *HE2* *H* *6.52* *.* *1* old residue 68 adding: *3106* *68* *Phe* *HD2* *H* *6.212* *.* *2* old residue 68 adding: *3108* *68* *Phe* *CD1* *C* *131.8* *.* *2* old residue 68 adding: *3109* *68* *Phe* *CE1* *C* *130.3* *.* *2* old residue 68 adding: *3111* *68* *Phe* *CE2* *C* *130.3* *.* *2* old residue 68 adding: *3112* *68* *Phe* *CD2* *C* *131.8* *.* *2* old residue 68 adding: *669* *68* *Phe* *N* *N* *114.298* *.* *1* new residue 69 adding: *670* *69* *Leu* *H* *H* *9.15* *.* *1* old residue 69 adding: *671* *69* *Leu* *HA* *H* *4.815* *.* *2* old residue 69 adding: *672* *69* *Leu* *HB2* *H* *1.612* *.* *2* old residue 69 adding: *673* *69* *Leu* *HB3* *H* *1.364* *.* *1* old residue 69 adding: *674* *69* *Leu* *HG* *H* *1.448* *.* *2* old residue 69 adding: *3057* *69* *Leu* *HD1* *H* *0.85* *.* *2* old residue 69 adding: *675* *69* *Leu* *HD2* *H* *0.85* *.* *2* old residue 69 adding: *676* *69* *Leu* *C* *C* *176.112* *.* *1* old residue 69 adding: *677* *69* *Leu* *CA* *C* *53.542* *.* *1* old residue 69 adding: *678* *69* *Leu* *CB* *C* *45.689* *.* *1* old residue 69 adding: *679* *69* *Leu* *CG* *C* *27.0* *.* *1* old residue 69 adding: *680* *69* *Leu* *CD1* *C* *25.85* *.* *2* old residue 69 adding: *681* *69* *Leu* *CD2* *C* *25.85* *.* *2* old residue 69 adding: *682* *69* *Leu* *N* *N* *119.32* *.* *1* new residue 70 adding: *683* *70* *Tyr* *H* *H* *8.79* *.* *1* old residue 70 adding: *684* *70* *Tyr* *HA* *H* *5.01* *.* *1* old residue 70 adding: *685* *70* *Tyr* *HB2* *H* *2.96* *.* *2* old residue 70 adding: *686* *70* *Tyr* *HB3* *H* *2.327* *.* *2* old residue 70 adding: *687* *70* *Tyr* *CA* *C* *54.420* *.* *1* old residue 70 adding: *688* *70* *Tyr* *CB* *C* *37.2* *.* *1* old residue 70 adding: *3186* *70* *Tyr* *HD1* *H* *6.619* *.* *2* old residue 70 adding: *3187* *70* *Tyr* *HE1* *H* *6.069* *.* *2* old residue 70 adding: *3188* *70* *Tyr* *HD2* *H* *6.619* *.* *2* old residue 70 adding: *3189* *70* *Tyr* *HE2* *H* *6.069* *.* *2* old residue 70 adding: *3191* *70* *Tyr* *CD1* *C* *131.32* *.* *2* old residue 70 adding: *3192* *70* *Tyr* *CD2* *C* *131.32* *.* *2* old residue 70 adding: *3193* *70* *Tyr* *CE1* *C* *117* *.* *2* old residue 70 adding: *3194* *70* *Tyr* *CE2* *C* *117* *.* *2* old residue 70 adding: *689* *70* *Tyr* *N* *N* *121.9* *.* *1* new residue 72 adding: *696* *72* *Asp* *HA* *H* *4.756* *.* *1* old residue 72 adding: *697* *72* *Asp* *HB2* *H* *2.8* *.* *2* old residue 72 adding: *698* *72* *Asp* *HB3* *H* *2.8* *.* *2* old residue 72 adding: *699* *72* *Asp* *C* *C* *176.532* *.* *1* old residue 72 adding: *700* *72* *Asp* *CA* *C* *54.141* *.* *1* old residue 72 adding: *701* *72* *Asp* *CB* *C* *41.19* *.* *1* new residue 73 adding: *703* *73* *Gly* *H* *H* *7.812* *.* *1* old residue 73 adding: *704* *73* *Gly* *HA2* *H* *4.296* *.* *2* old residue 73 adding: *705* *73* *Gly* *HA3* *H* *3.92* *.* *2* old residue 73 adding: *706* *73* *Gly* *C* *C* *173.284* *.* *1* old residue 73 adding: *707* *73* *Gly* *CA* *C* *46.12* *.* *1* old residue 73 adding: *708* *73* *Gly* *N* *N* *106.396* *.* *1* new residue 74 adding: *9* *74* *Asp* *H* *H* *7.689* *.* *1* old residue 74 adding: *710* *74* *Asp* *HA* *H* *4.849* *.* *1* old residue 74 adding: *711* *74* *Asp* *HB2* *H* *2.786* *.* *2* old residue 74 adding: *712* *74* *Asp* *HB3* *H* *2.434* *.* *2* old residue 74 adding: *713* *74* *Asp* *C* *C* *175.359* *.* *1* old residue 74 adding: *714* *74* *Asp* *CA* *C* *52.880* *.* *1* old residue 74 adding: *715* *74* *Asp* *CB* *C* *43.442* *.* *1* old residue 74 adding: *716* *74* *Asp* *N* *N* *119.728* *.* *1* new residue 75 adding: *717* *75* *Phe* *H* *H* *8.343* *.* *1* old residue 75 adding: *718* *75* *Phe* *HB2* *H* *2.550* *.* *2* old residue 75 adding: *719* *75* *Phe* *HB3* *H* *2.04* *.* *2* old residue 75 adding: *720* *75* *Phe* *CA* *C* *59.267* *.* *1* old residue 75 adding: *721* *75* *Phe* *CB* *C* *34.7* *.* *1* old residue 75 adding: *3113* *75* *Phe* *HD1* *H* *6.6* *.* *2* old residue 75 adding: *3114* *75* *Phe* *HE1* *H* *7.09* *.* *2* old residue 75 adding: *3116* *75* *Phe* *HE2* *H* *7.09* *.* *1* old residue 75 adding: *3117* *75* *Phe* *HD2* *H* *6.6* *.* *2* old residue 75 adding: *3119* *75* *Phe* *CD1* *C* *132.9* *.* *2* old residue 75 adding: *3120* *75* *Phe* *CE1* *C* *131.8* *.* *2* old residue 75 adding: *3122* *75* *Phe* *CE2* *C* *131.8* *.* *2* old residue 75 adding: *3123* *75* *Phe* *CD2* *C* *132.9* *.* *2* old residue 75 adding: *722* *75* *Phe* *N* *N* *125.786* *.* *1* new residue 76 adding: *723* *76* *Gly* *H* *H* *7.439* *.* *1* old residue 76 adding: *724* *76* *Gly* *HA2* *H* *3.371* *.* *2* old residue 76 adding: *725* *76* *Gly* *HA3* *H* *3.22* *.* *2* old residue 76 adding: *726* *76* *Gly* *C* *C* *176.492* *.* *1* old residue 76 adding: *727* *76* *Gly* *CA* *C* *46.674* *.* *1* old residue 76 adding: *728* *76* *Gly* *N* *N* *110.87* *.* *1* new residue 77 adding: *729* *77* *Ser* *H* *H* *7.893* *.* *1* old residue 77 adding: *730* *77* *Ser* *HA* *H* *4.050* *.* *1* old residue 77 adding: *731* *77* *Ser* *HB2* *H* *3.876* *.* *2* old residue 77 adding: *732* *77* *Ser* *HB3* *H* *3.876* *.* *2* old residue 77 adding: *733* *77* *Ser* *C* *C* *176.482* *.* *1* old residue 77 adding: *734* *77* *Ser* *CA* *C* *60.766* *.* *1* old residue 77 adding: *735* *77* *Ser* *CB* *C* *62.53* *.* *1* old residue 77 adding: *736* *77* *Ser* *N* *N* *117.851* *.* *1* new residue 78 adding: *737* *78* *Ala* *H* *H* *7.38* *.* *1* old residue 78 adding: *738* *78* *Ala* *HA* *H* *4.33* *.* *1* old residue 78 adding: *739* *78* *Ala* *HB* *H* *1.682* *.* *1* old residue 78 adding: *740* *78* *Ala* *CA* *C* *55.141* *.* *1* old residue 78 adding: *741* *78* *Ala* *CB* *C* *19.771* *.* *1* old residue 78 adding: *2000* *78* *Ala* *C* *C* *180.172* *.* *1* old residue 78 adding: *742* *78* *Ala* *N* *N* *124.8* *.* *1* new residue 79 adding: *743* *79* *Asn* *H* *H* *8.471* *.* *1* old residue 79 adding: *744* *79* *Asn* *HA* *H* *4.63* *.* *1* old residue 79 adding: *746* *79* *Asn* *HB2* *H* *2.775* *.* *2* old residue 79 adding: *747* *79* *Asn* *HB3* *H* *2.775* *.* *2* old residue 79 adding: *748* *79* *Asn* *C* *C* *177.640* *.* *1* old residue 79 adding: *749* *79* *Asn* *CA* *C* *55.078* *.* *1* old residue 79 adding: *750* *79* *Asn* *CB* *C* *38.271* *.* *1* old residue 79 adding: *751* *79* *Asn* *N* *N* *116.675* *.* *1* new residue 80 adding: *752* *80* *Lys* *H* *H* *8.042* *.* *1* old residue 80 adding: *753* *80* *Lys* *HA* *H* *4.184* *.* *1* old residue 80 adding: *754* *80* *Lys* *HB2* *H* *1.86* *.* *2* old residue 80 adding: *755* *80* *Lys* *HB3* *H* *1.86* *.* *2* old residue 80 adding: *3039* *80* *Lys* *HG2* *H* *1.449* *.* *2* old residue 80 adding: *3040* *80* *Lys* *HG3* *H* *1.364* *.* *2* old residue 80 adding: *3041* *80* *Lys* *HD2* *H* *1.6* *.* *2* old residue 80 adding: *3042* *80* *Lys* *HD3* *H* *1.6* *.* *2* old residue 80 adding: *3043* *80* *Lys* *C* *C* *177.367* *.* *1* old residue 80 adding: *756* *80* *Lys* *CA* *C* *59.07* *.* *1* old residue 80 adding: *757* *80* *Lys* *CB* *C* *32.65* *.* *1* old residue 80 adding: *758* *80* *Lys* *CG* *C* *25.0* *.* *1* old residue 80 adding: *759* *80* *Lys* *CD* *C* *29.5* *.* *1* old residue 80 adding: *760* *80* *Lys* *CE* *C* *42.145* *.* *1* old residue 80 adding: *761* *80* *Lys* *N* *N* *120.911* *.* *1* new residue 81 adding: *762* *81* *Asn* *H* *H* *7.640* *.* *1* old residue 81 adding: *763* *81* *Asn* *HA* *H* *4.850* *.* *1* old residue 81 adding: *764* *81* *Asn* *HB2* *H* *2.9* *.* *2* old residue 81 adding: *765* *81* *Asn* *HB3* *H* *2.9* *.* *2* old residue 81 adding: *766* *81* *Asn* *C* *C* *176.702* *.* *1* old residue 81 adding: *767* *81* *Asn* *CA* *C* *53.275* *.* *1* old residue 81 adding: *768* *81* *Asn* *CB* *C* *40.2* *.* *1* old residue 81 adding: *769* *81* *Asn* *N* *N* *112.6* *.* *1* new residue 82 adding: *770* *82* *Gly* *H* *H* *8.551* *.* *1* old residue 82 adding: *771* *82* *Gly* *HA2* *H* *3.89* *.* *2* old residue 82 adding: *772* *82* *Gly* *HA3* *H* *3.70* *.* *2* old residue 82 adding: *773* *82* *Gly* *C* *C* *173.372* *.* *1* old residue 82 adding: *774* *82* *Gly* *CA* *C* *48.35* *.* *1* old residue 82 adding: *775* *82* *Gly* *N* *N* *113.307* *.* *1* new residue 83 adding: *776* *83* *Thr* *H* *H* *7.963* *.* *1* old residue 83 adding: *777* *83* *Thr* *HA* *H* *5.564* *.* *1* old residue 83 adding: *778* *83* *Thr* *HB* *H* *4.028* *.* *1* old residue 83 adding: *779* *83* *Thr* *HG2* *H* *1.162* *.* *1* old residue 83 adding: *780* *83* *Thr* *CA* *C* *60.303* *.* *1* old residue 83 adding: *781* *83* *Thr* *CB* *C* *72.127* *.* *1* old residue 83 adding: *782* *83* *Thr* *CG2* *C* *22.276* *.* *1* old residue 83 adding: *783* *83* *Thr* *N* *N* *111.624* *.* *1* new residue 84 adding: *784* *84* *Leu* *H* *H* *8.6* *.* *1* old residue 84 adding: *785* *84* *Leu* *HA* *H* *4.774* *.* *1* old residue 84 adding: *786* *84* *Leu* *HB2* *H* *1.47* *.* *2* old residue 84 adding: *787* *84* *Leu* *HB3* *H* *1.47* *.* *2* old residue 84 adding: *789* *84* *Leu* *HD1* *H* *0.863* *.* *2* old residue 84 adding: *790* *84* *Leu* *HD2* *H* *0.365* *.* *2* old residue 84 adding: *791* *84* *Leu* *C* *C* *175.300* *.* *1* old residue 84 adding: *792* *84* *Leu* *CA* *C* *53.876* *.* *1* old residue 84 adding: *793* *84* *Leu* *CB* *C* *49.9* *.* *1* old residue 84 adding: *795* *84* *Leu* *CD1* *C* *25.5* *.* *2* old residue 84 adding: *796* *84* *Leu* *CD2* *C* *25.5* *.* *2* old residue 84 adding: *797* *84* *Leu* *N* *N* *118.084* *.* *1* new residue 85 adding: *798* *85* *Lys* *H* *H* *8.893* *.* *1* old residue 85 adding: *799* *85* *Lys* *HA* *H* *5.287* *.* *1* old residue 85 adding: *800* *85* *Lys* *HB2* *H* *1.615* *.* *2* old residue 85 adding: *801* *85* *Lys* *HB3* *H* *1.543* *.* *2* old residue 85 adding: *802* *85* *Lys* *HG2* *H* *1.3* *.* *2* old residue 85 adding: *803* *85* *Lys* *HG3* *H* *1.3* *.* *2* old residue 85 adding: *804* *85* *Lys* *HD2* *H* *1.66* *.* *2* old residue 85 adding: *805* *85* *Lys* *HD3* *H* *1.66* *.* *2* old residue 85 adding: *806* *85* *Lys* *C* *C* *174.616* *.* *1* old residue 85 adding: *807* *85* *Lys* *CA* *C* *55.324* *.* *1* old residue 85 adding: *808* *85* *Lys* *CB* *C* *34.906* *.* *1* old residue 85 adding: *809* *85* *Lys* *CG* *C* *26.279* *.* *1* old residue 85 adding: *810* *85* *Lys* *CD* *C* *30.134* *.* *1* old residue 85 adding: *811* *85* *Lys* *CE* *C* *42.060* *.* *1* old residue 85 adding: *812* *85* *Lys* *N* *N* *117.951* *.* *1* new residue 86 adding: *813* *86* *Leu* *H* *H* *9.397* *.* *1* old residue 86 adding: *814* *86* *Leu* *HA* *H* *4.348* *.* *1* old residue 86 adding: *815* *86* *Leu* *HB2* *H* *1.67* *.* *2* old residue 86 adding: *816* *86* *Leu* *HB3* *H* *1.29* *.* *2* old residue 86 adding: *817* *86* *Leu* *HG* *H* *0.84* *.* *1* old residue 86 adding: *818* *86* *Leu* *HD1* *H* *1.021* *.* *2* old residue 86 adding: *3227* *86* *Leu* *HD2* *H* *1.021* *.* *2* old residue 86 adding: *819* *86* *Leu* *C* *C* *175.209* *.* *1* old residue 86 adding: *820* *86* *Leu* *CA* *C* *54.659* *.* *1* old residue 86 adding: *821* *86* *Leu* *CB* *C* *43.640* *.* *1* old residue 86 adding: *822* *86* *Leu* *CG* *C* *26.7* *.* *1* old residue 86 adding: *823* *86* *Leu* *CD1* *C* *24.75* *.* *2* old residue 86 adding: *3229* *86* *Leu* *CD2* *C* *24.75* *.* *2* old residue 86 adding: *824* *86* *Leu* *N* *N* *125.172* *.* *1* new residue 87 adding: *825* *87* *Ser* *H* *H* *7.899* *.* *1* old residue 87 adding: *826* *87* *Ser* *HA* *H* *4.795* *.* *1* old residue 87 adding: *827* *87* *Ser* *HB2* *H* *3.7* *.* *2* old residue 87 adding: *828* *87* *Ser* *HB3* *H* *3.32* *.* *2* old residue 87 adding: *829* *87* *Ser* *C* *C* *173.321* *.* *1* old residue 87 adding: *830* *87* *Ser* *CA* *C* *56.856* *.* *1* old residue 87 adding: *831* *87* *Ser* *CB* *C* *62.763* *.* *1* old residue 87 adding: *832* *87* *Ser* *N* *N* *117.129* *.* *1* new residue 88 adding: *833* *88* *Leu* *H* *H* *9.163* *.* *1* old residue 88 adding: *834* *88* *Leu* *HA* *H* *5.102* *.* *1* old residue 88 adding: *835* *88* *Leu* *HB2* *H* *1.95* *.* *2* old residue 88 adding: *836* *88* *Leu* *HB3* *H* *1.062* *.* *2* old residue 88 adding: *837* *88* *Leu* *HG* *H* *1.66* *.* *1* old residue 88 adding: *838* *88* *Leu* *HD1* *H* *0.482* *.* *2* old residue 88 adding: *839* *88* *Leu* *HD2* *H* *0.482* *.* *2* old residue 88 adding: *840* *88* *Leu* *C* *C* *176.161* *.* *1* old residue 88 adding: *841* *88* *Leu* *CA* *C* *53.199* *.* *1* old residue 88 adding: *842* *88* *Leu* *CB* *C* *44.140* *.* *1* old residue 88 adding: *843* *88* *Leu* *CG* *C* *26.640* *.* *1* old residue 88 adding: *844* *88* *Leu* *CD1* *C* *24.99* *.* *2* old residue 88 adding: *845* *88* *Leu* *CD2* *C* *24.99* *.* *2* old residue 88 adding: *846* *88* *Leu* *N* *N* *125.681* *.* *1* new residue 89 adding: *847* *89* *Met* *H* *H* *8.987* *.* *1* old residue 89 adding: *848* *89* *Met* *HA* *H* *4.573* *.* *1* old residue 89 adding: *849* *89* *Met* *HB2* *H* *1.91* *.* *2* old residue 89 adding: *850* *89* *Met* *HB3* *H* *1.64* *.* *2* old residue 89 adding: *852* *89* *Met* *C* *C* *174.325* *.* *1* old residue 89 adding: *853* *89* *Met* *CA* *C* *55.175* *.* *1* old residue 89 adding: *854* *89* *Met* *CB* *C* *35.95* *.* *1* old residue 89 adding: *855* *89* *Met* *CG* *C* *31.899* *.* *1* old residue 89 adding: *856* *89* *Met* *N* *N* *123.211* *.* *1* new residue 90 adding: *857* *90* *Leu* *H* *H* *9.377* *.* *1* old residue 90 adding: *858* *90* *Leu* *HA* *H* *5.332* *.* *1* old residue 90 adding: *859* *90* *Leu* *HB2* *H* *1.92* *.* *2* old residue 90 adding: *860* *90* *Leu* *HB3* *H* *1.92* *.* *2* old residue 90 adding: *861* *90* *Leu* *HG* *H* *0.745* *.* *1* old residue 90 adding: *862* *90* *Leu* *HD1* *H* *0.78* *.* *2* old residue 90 adding: *863* *90* *Leu* *HD2* *H* *0.78* *.* *2* old residue 90 adding: *864* *90* *Leu* *C* *C* *175.073* *.* *1* old residue 90 adding: *865* *90* *Leu* *CA* *C* *52.282* *.* *1* old residue 90 adding: *866* *90* *Leu* *CB* *C* *42.525* *.* *1* old residue 90 adding: *867* *90* *Leu* *CG* *C* *27.24* *.* *1* old residue 90 adding: *868* *90* *Leu* *CD1* *C* *26.0* *.* *2* old residue 90 adding: *869* *90* *Leu* *CD2* *C* *26.0* *.* *2* old residue 90 adding: *870* *90* *Leu* *N* *N* *129.861* *.* *1* new residue 91 adding: *871* *91* *Thr* *H* *H* *8.862* *.* *1* old residue 91 adding: *872* *91* *Thr* *HA* *H* *4.902* *.* *1* old residue 91 adding: *873* *91* *Thr* *HB* *H* *3.884* *.* *1* old residue 91 adding: *2044* *91* *Thr* *HG2* *H* *0.864* *.* *1* old residue 91 adding: *874* *91* *Thr* *C* *C* *173.788* *.* *1* old residue 91 adding: *875* *91* *Thr* *CA* *C* *62.358* *.* *1* old residue 91 adding: *876* *91* *Thr* *CB* *C* *70.071* *.* *1* old residue 91 adding: *877* *91* *Thr* *CG2* *C* *20.401* *.* *1* old residue 91 adding: *878* *91* *Thr* *N* *N* *119.062* *.* *1* new residue 92 adding: *879* *92* *Asp* *H* *H* *8.762* *.* *1* old residue 92 adding: *880* *92* *Asp* *HA* *H* *4.380* *.* *1* old residue 92 adding: *881* *92* *Asp* *HB2* *H* *2.774* *.* *2* old residue 92 adding: *882* *92* *Asp* *HB3* *H* *1.025* *.* *2* old residue 92 adding: *883* *92* *Asp* *C* *C* *176.864* *.* *1* old residue 92 adding: *884* *92* *Asp* *CA* *C* *53.264* *.* *1* old residue 92 adding: *885* *92* *Asp* *CB* *C* *40.00* *.* *1* old residue 92 adding: *886* *92* *Asp* *N* *N* *126.719* *.* *1* new residue 93 adding: *887* *93* *Lys* *H* *H* *7.785* *.* *1* old residue 93 adding: *888* *93* *Lys* *HA* *H* *3.942* *.* *1* old residue 93 adding: *889* *93* *Lys* *HB2* *H* *1.920* *.* *2* old residue 93 adding: *890* *93* *Lys* *HB3* *H* *1.439* *.* *2* old residue 93 adding: *891* *93* *Lys* *HG2* *H* *1.31* *.* *2* old residue 93 adding: *892* *93* *Lys* *HG3* *H* *1.31* *.* *2* old residue 93 adding: *3044* *93* *Lys* *HD2* *H* *1.56* *.* *2* old residue 93 adding: *3045* *93* *Lys* *HD3* *H* *1.56* *.* *2* old residue 93 adding: *3046* *93* *Lys* *C* *C* *177.77* *.* *1* old residue 93 adding: *893* *93* *Lys* *CA* *C* *58.889* *.* *1* old residue 93 adding: *894* *93* *Lys* *CB* *C* *32.179* *.* *1* old residue 93 adding: *895* *93* *Lys* *CG* *C* *25.99* *.* *1* old residue 93 adding: *896* *93* *Lys* *CD* *C* *29.300* *.* *1* old residue 93 adding: *897* *93* *Lys* *CE* *C* *41.879* *.* *1* old residue 93 adding: *898* *93* *Lys* *N* *N* *125.071* *.* *1* new residue 94 adding: *899* *94* *Lys* *H* *H* *8.571* *.* *1* old residue 94 adding: *900* *94* *Lys* *HA* *H* *4.190* *.* *1* old residue 94 adding: *901* *94* *Lys* *HB2* *H* *1.948* *.* *2* old residue 94 adding: *902* *94* *Lys* *HB3* *H* *1.805* *.* *2* old residue 94 adding: *3047* *94* *Lys* *HG2* *H* *1.549* *.* *2* old residue 94 adding: *3048* *94* *Lys* *HG3* *H* *1.428* *.* *2* old residue 94 adding: *903* *94* *Lys* *HD2* *H* *1.724* *.* *2* old residue 94 adding: *3049* *94* *Lys* *HD3* *H* *1.724* *.* *2* old residue 94 adding: *904* *94* *Lys* *C* *C* *177.809* *.* *1* old residue 94 adding: *905* *94* *Lys* *CA* *C* *58.452* *.* *1* old residue 94 adding: *906* *94* *Lys* *CB* *C* *32.2* *.* *1* old residue 94 adding: *907* *94* *Lys* *CG* *C* *25.386* *.* *1* old residue 94 adding: *908* *94* *Lys* *CD* *C* *28.914* *.* *1* old residue 94 adding: *909* *94* *Lys* *CE* *C* *42.142* *.* *1* old residue 94 adding: *910* *94* *Lys* *N* *N* *118.112* *.* *1* new residue 95 adding: *911* *95* *Asn* *H* *H* *7.18* *.* *1* old residue 95 adding: *912* *95* *Asn* *HA* *H* *4.774* *.* *1* old residue 95 adding: *913* *95* *Asn* *HB2* *H* *2.655* *.* *2* old residue 95 adding: *914* *95* *Asn* *HB3* *H* *2.655* *.* *2* old residue 95 adding: *915* *95* *Asn* *C* *C* *174.838* *.* *1* old residue 95 adding: *916* *95* *Asn* *CA* *C* *52.545* *.* *1* old residue 95 adding: *917* *95* *Asn* *CB* *C* *39.515* *.* *1* old residue 95 adding: *2031* *95* *Asn* *HD21* *H* *8.08* *.* *2* old residue 95 adding: *2032* *95* *Asn* *HD22* *H* *6.76* *.* *2* old residue 95 adding: *2033* *95* *Asn* *ND2* *N* *114.5* *.* *1* old residue 95 adding: *918* *95* *Asn* *N* *N* *113.292* *.* *1* new residue 96 adding: *919* *96* *Asn* *H* *H* *8.297* *.* *1* old residue 96 adding: *920* *96* *Asn* *HA* *H* *4.15* *.* *1* old residue 96 adding: *921* *96* *Asn* *HB2* *H* *3.0* *.* *2* old residue 96 adding: *922* *96* *Asn* *HB3* *H* *2.711* *.* *2* old residue 96 adding: *923* *96* *Asn* *C* *C* *173.719* *.* *1* old residue 96 adding: *924* *96* *Asn* *CA* *C* *54.560* *.* *1* old residue 96 adding: *925* *96* *Asn* *CB* *C* *37.273* *.* *1* old residue 96 adding: *2034* *96* *Asn* *HD21* *H* *7.48* *.* *2* old residue 96 adding: *2035* *96* *Asn* *HD22* *H* *6.72* *.* *2* old residue 96 adding: *2036* *96* *Asn* *ND2* *N* *112.4* *.* *1* old residue 96 adding: *926* *96* *Asn* *N* *N* *117.305* *.* *1* new residue 97 adding: *927* *97* *Gln* *H* *H* *7.514* *.* *1* old residue 97 adding: *928* *97* *Gln* *HA* *H* *4.353* *.* *1* old residue 97 adding: *929* *97* *Gln* *HB2* *H* *1.787* *.* *2* old residue 97 adding: *930* *97* *Gln* *HB3* *H* *1.787* *.* *2* old residue 97 adding: *2085* *97* *Gln* *HG2* *H* *2.114* *.* *2* old residue 97 adding: *2081* *97* *Gln* *HG3* *H* *2.114* *.* *2* old residue 97 adding: *2082* *97* *Gln* *HE21* *H* *7.29* *.* *2* old residue 97 adding: *2083* *97* *Gln* *HE22* *H* *6.81* *.* *2* old residue 97 adding: *931* *97* *Gln* *C* *C* *173.811* *.* *1* old residue 97 adding: *932* *97* *Gln* *CA* *C* *55.249* *.* *1* old residue 97 adding: *933* *97* *Gln* *CB* *C* *31.069* *.* *1* old residue 97 adding: *934* *97* *Gln* *CG* *C* *33.750* *.* *1* old residue 97 adding: *2084* *97* *Gln* *NE2* *N* *112.5* *.* *1* old residue 97 adding: *935* *97* *Gln* *N* *N* *117.381* *.* *1* new residue 98 adding: *936* *98* *Val* *H* *H* *8.001* *.* *1* old residue 98 adding: *2046* *98* *Val* *HA* *H* *4.66* *.* *1* old residue 98 adding: *937* *98* *Val* *HB* *H* *1.606* *.* *1* old residue 98 adding: *938* *98* *Val* *HG1* *H* *0.783* *.* *2* old residue 98 adding: *939* *98* *Val* *HG2* *H* *0.522* *.* *2* old residue 98 adding: *940* *98* *Val* *C* *C* *174.717* *.* *1* old residue 98 adding: *941* *98* *Val* *CA* *C* *61.473* *.* *1* old residue 98 adding: *942* *98* *Val* *CB* *C* *33.921* *.* *1* old residue 98 adding: *943* *98* *Val* *CG1* *C* *21.387* *.* *2* old residue 98 adding: *944* *98* *Val* *CG2* *C* *21.387* *.* *2* old residue 98 adding: *945* *98* *Val* *N* *N* *122.101* *.* *1* new residue 99 adding: *946* *99* *Tyr* *H* *H* *9.187* *.* *1* old residue 99 adding: *947* *99* *Tyr* *HA* *H* *4.659* *.* *1* old residue 99 adding: *948* *99* *Tyr* *HB2* *H* *3.083* *.* *2* old residue 99 adding: *949* *99* *Tyr* *HB3* *H* *2.65* *.* *2* old residue 99 adding: *950* *99* *Tyr* *C* *C* *173.193* *.* *1* old residue 99 adding: *951* *99* *Tyr* *CA* *C* *56.279* *.* *1* old residue 99 adding: *952* *99* *Tyr* *CB* *C* *42.427* *.* *1* old residue 99 adding: *3196* *99* *Tyr* *HD1* *H* *7.099* *.* *2* old residue 99 adding: *3198* *99* *Tyr* *HD2* *H* *7.099* *.* *2* old residue 99 adding: *3201* *99* *Tyr* *CD1* *C* *133.64* *.* *2* old residue 99 adding: *3202* *99* *Tyr* *CD2* *C* *133.64* *.* *2* old residue 99 adding: *953* *99* *Tyr* *N* *N* *125.768* *.* *1* new residue 100 adding: *954* *100* *Tyr* *H* *H* *8.741* *.* *1* old residue 100 adding: *955* *100* *Tyr* *HA* *H* *5.384* *.* *1* old residue 100 adding: *956* *100* *Tyr* *HB2* *H* *3.089* *.* *2* old residue 100 adding: *957* *100* *Tyr* *HB3* *H* *2.659* *.* *2* old residue 100 adding: *958* *100* *Tyr* *CA* *C* *57.331* *.* *1* old residue 100 adding: *959* *100* *Tyr* *CB* *C* *40.810* *.* *1* old residue 100 adding: *3206* *100* *Tyr* *HD1* *H* *7.09* *.* *2* old residue 100 adding: *3207* *100* *Tyr* *HE1* *H* *6.61* *.* *2* old residue 100 adding: *3208* *100* *Tyr* *HD2* *H* *7.09* *.* *2* old residue 100 adding: *3209* *100* *Tyr* *HE2* *H* *6.61* *.* *2* old residue 100 adding: *3211* *100* *Tyr* *CD1* *C* *133.43* *.* *2* old residue 100 adding: *3212* *100* *Tyr* *CD2* *C* *133.43* *.* *2* old residue 100 adding: *3213* *100* *Tyr* *CE1* *C* *117.6* *.* *2* old residue 100 adding: *3214* *100* *Tyr* *CE2* *C* *117.6* *.* *2* old residue 100 adding: *960* *100* *Tyr* *N* *N* *119.952* *.* *1* new residue 101 adding: *961* *101* *Lys* *H* *H* *8.284* *.* *1* old residue 101 adding: *962* *101* *Lys* *HA* *H* *4.629* *.* *1* old residue 101 adding: *963* *101* *Lys* *HB2* *H* *1.645* *.* *2* old residue 101 adding: *964* *101* *Lys* *HB3* *H* *1.527* *.* *2* old residue 101 adding: *3051* *101* *Lys* *HG2* *H* *1.403* *.* *2* old residue 101 adding: *3052* *101* *Lys* *HG3* *H* *1.213* *.* *2* old residue 101 adding: *3050* *101* *Lys* *HD2* *H* *1.48* *.* *2* old residue 101 adding: *965* *101* *Lys* *HD3* *H* *1.48* *.* *2* old residue 101 adding: *966* *101* *Lys* *C* *C* *172.991* *.* *1* old residue 101 adding: *967* *101* *Lys* *CA* *C* *55.252* *.* *1* old residue 101 adding: *968* *101* *Lys* *CB* *C* *38.041* *.* *1* old residue 101 adding: *969* *101* *Lys* *CG* *C* *25.210* *.* *1* old residue 101 adding: *970* *101* *Lys* *CD* *C* *29.6* *.* *1* old residue 101 adding: *971* *101* *Lys* *CE* *C* *42.447* *.* *1* old residue 101 adding: *972* *101* *Lys* *N* *N* *122.148* *.* *1* new residue 102 adding: *973* *102* *Leu* *H* *H* *8.698* *.* *1* old residue 102 adding: *974* *102* *Leu* *HA* *H* *5.282* *.* *1* old residue 102 adding: *975* *102* *Leu* *HB2* *H* *1.724* *.* *2* old residue 102 adding: *976* *102* *Leu* *HB3* *H* *1.393* *.* *2* old residue 102 adding: *977* *102* *Leu* *HG* *H* *1.667* *.* *1* old residue 102 adding: *978* *102* *Leu* *HD1* *H* *0.848* *.* *2* old residue 102 adding: *3003* *102* *Leu* *HD2* *H* *0.848* *.* *2* old residue 102 adding: *979* *102* *Leu* *C* *C* *176.024* *.* *1* old residue 102 adding: *980* *102* *Leu* *CA* *C* *54.025* *.* *1* old residue 102 adding: *981* *102* *Leu* *CB* *C* *43.601* *.* *1* old residue 102 adding: *982* *102* *Leu* *CG* *C* *27.287* *.* *1* old residue 102 adding: *983* *102* *Leu* *CD1* *C* *24.98* *.* *2* old residue 102 adding: *984* *102* *Leu* *CD2* *C* *24.98* *.* *2* old residue 102 adding: *985* *102* *Leu* *N* *N* *127.349* *.* *1* new residue 103 adding: *986* *103* *Leu* *H* *H* *9.120* *.* *1* old residue 103 adding: *987* *103* *Leu* *HA* *H* *4.831* *.* *1* old residue 103 adding: *988* *103* *Leu* *HB2* *H* *1.923* *.* *2* old residue 103 adding: *989* *103* *Leu* *HB3* *H* *1.258* *.* *2* old residue 103 adding: *3004* *103* *Leu* *HG* *H* *1.65* *.* *1* old residue 103 adding: *991* *103* *Leu* *HD2* *H* *1.092* *.* *2* old residue 103 adding: *992* *103* *Leu* *C* *C* *175.163* *.* *1* old residue 103 adding: *993* *103* *Leu* *CA* *C* *53.664* *.* *1* old residue 103 adding: *994* *103* *Leu* *CB* *C* *46.915* *.* *1* old residue 103 adding: *995* *103* *Leu* *CG* *C* *27.189* *.* *1* old residue 103 adding: *996* *103* *Leu* *CD1* *C* *25.802* *.* *2* old residue 103 adding: *997* *103* *Leu* *CD2* *C* *24.38* *.* *2* old residue 103 adding: *998* *103* *Leu* *N* *N* *126.377* *.* *1* new residue 104 adding: *999* *104* *Glu* *H* *H* *9.190* *.* *1* old residue 104 adding: *1000* *104* *Glu* *HA* *H* *4.818* *.* *1* old residue 104 adding: *1001* *104* *Glu* *HB2* *H* *2.154* *.* *2* old residue 104 adding: *1002* *104* *Glu* *HB3* *H* *1.934* *.* *2* old residue 104 adding: *2040* *104* *Glu* *HG2* *H* *2.198* *.* *2* old residue 104 adding: *1003* *104* *Glu* *HG3* *H* *2.144* *.* *2* old residue 104 adding: *1004* *104* *Glu* *C* *C* *175.348* *.* *1* old residue 104 adding: *1005* *104* *Glu* *CA* *C* *56.889* *.* *1* old residue 104 adding: *1006* *104* *Glu* *CB* *C* *30.830* *.* *1* old residue 104 adding: *1007* *104* *Glu* *CG* *C* *36.1* *.* *1* old residue 104 adding: *1008* *104* *Glu* *N* *N* *129.120* *.* *1* new residue 105 adding: *1009* *105* *Val* *H* *H* *9.155* *.* *1* old residue 105 adding: *1010* *105* *Val* *HA* *H* *4.661* *.* *1* old residue 105 adding: *1011* *105* *Val* *HB* *H* *2.270* *.* *1* old residue 105 adding: *1012* *105* *Val* *HG1* *H* *1.040* *.* *2* old residue 105 adding: *1013* *105* *Val* *HG2* *H* *1.098* *.* *2* old residue 105 adding: *1014* *105* *Val* *C* *C* *173.666* *.* *1* old residue 105 adding: *1015* *105* *Val* *CA* *C* *61.2* *.* *1* old residue 105 adding: *1016* *105* *Val* *CB* *C* *35.188* *.* *1* old residue 105 adding: *1017* *105* *Val* *CG1* *C* *23.089* *.* *2* old residue 105 adding: *1018* *105* *Val* *CG2* *C* *22.024* *.* *2* old residue 105 adding: *1019* *105* *Val* *N* *N* *125.360* *.* *1* new residue 106 adding: *1020* *106* *Ser* *H* *H* *8.329* *.* *1* old residue 106 adding: *1021* *106* *Ser* *HA* *H* *5.485* *.* *1* old residue 106 adding: *1022* *106* *Ser* *HB2* *H* *4.024* *.* *2* old residue 106 adding: *1023* *106* *Ser* *HB3* *H* *3.921* *.* *2* old residue 106 adding: *1024* *106* *Ser* *C* *C* *173.761* *.* *1* old residue 106 adding: *1025* *106* *Ser* *CA* *C* *56.202* *.* *1* old residue 106 adding: *1026* *106* *Ser* *CB* *C* *65.074* *.* *1* old residue 106 adding: *1027* *106* *Ser* *N* *N* *119.446* *.* *1* new residue 107 adding: *1028* *107* *Gly* *H* *H* *8.570* *.* *1* old residue 107 adding: *1029* *107* *Gly* *HA2* *H* *4.074* *.* *2* old residue 107 adding: *1030* *107* *Gly* *HA3* *H* *3.661* *.* *2* old residue 107 adding: *1031* *107* *Gly* *C* *C* *175.736* *.* *1* old residue 107 adding: *1032* *107* *Gly* *CA* *C* *45.048* *.* *1* old residue 107 adding: *1033* *107* *Gly* *N* *N* *106.829* *.* *1* new residue 108 adding: *1034* *108* *Phe* *H* *H* *7.936* *.* *1* old residue 108 adding: *1035* *108* *Phe* *HA* *H* *4.735* *.* *1* old residue 108 adding: *1036* *108* *Phe* *HB2* *H* *2.33* *.* *2* old residue 108 adding: *1037* *108* *Phe* *HB3* *H* *2.33* *.* *2* old residue 108 adding: *1038* *108* *Phe* *C* *C* *174.304* *.* *1* old residue 108 adding: *1039* *108* *Phe* *CA* *C* *57.93* *.* *1* old residue 108 adding: *1040* *108* *Phe* *CB* *C* *38.1* *.* *1* old residue 108 adding: *3124* *108* *Phe* *HD1* *H* *7.52* *.* *2* old residue 108 adding: *3125* *108* *Phe* *HE1* *H* *7.20* *.* *2* old residue 108 adding: *3127* *108* *Phe* *HE2* *H* *7.20* *.* *2* old residue 108 adding: *3128* *108* *Phe* *HD2* *H* *7.52* *.* *2* old residue 108 adding: *3130* *108* *Phe* *CD1* *C* *132.5* *.* *2* old residue 108 adding: *3131* *108* *Phe* *CE1* *C* *131* *.* *2* old residue 108 adding: *3133* *108* *Phe* *CE2* *C* *131* *.* *2* old residue 108 adding: *3134* *108* *Phe* *CD2* *C* *132.5* *.* *2* old residue 108 adding: *1041* *108* *Phe* *N* *N* *119.405* *.* *1* new residue 109 adding: *1042* *109* *Lys* *H* *H* *8.085* *.* *1* old residue 109 adding: *1043* *109* *Lys* *HA* *H* *3.942* *.* *1* old residue 109 adding: *1044* *109* *Lys* *HB2* *H* *1.378* *.* *2* old residue 109 adding: *1045* *109* *Lys* *HB3* *H* *1.227* *.* *2* old residue 109 adding: *3053* *109* *Lys* *HG2* *H* *1.54* *.* *2* old residue 109 adding: *3054* *109* *Lys* *HG3* *H* *1.35* *.* *2* old residue 109 adding: *3055* *109* *Lys* *HD2* *H* *1.58* *.* *2* old residue 109 adding: *3056* *109* *Lys* *HD3* *H* *1.495* *.* *2* old residue 109 adding: *1046* *109* *Lys* *C* *C* *173.732* *.* *1* old residue 109 adding: *1047* *109* *Lys* *CA* *C* *58.476* *.* *1* old residue 109 adding: *1048* *109* *Lys* *CB* *C* *32.82* *.* *1* old residue 109 adding: *1049* *109* *Lys* *CG* *C* *25.5* *.* *1* old residue 109 adding: *1050* *109* *Lys* *CD* *C* *30.107* *.* *1* old residue 109 adding: *1051* *109* *Lys* *CE* *C* *42.466* *.* *1* old residue 109 adding: *1052* *109* *Lys* *N* *N* *123.188* *.* *1* new residue 110 adding: *1053* *110* *Ser* *H* *H* *7.785* *.* *1* old residue 110 adding: *1054* *110* *Ser* *HA* *H* *5.328* *.* *1* old residue 110 adding: *1055* *110* *Ser* *HB2* *H* *3.825* *.* *2* old residue 110 adding: *1056* *110* *Ser* *HB3* *H* *3.414* *.* *2* old residue 110 adding: *1057* *110* *Ser* *C* *C* *174.890* *.* *1* old residue 110 adding: *1058* *110* *Ser* *CA* *C* *55.63* *.* *1* old residue 110 adding: *1059* *110* *Ser* *CB* *C* *66.584* *.* *1* old residue 110 adding: *1060* *110* *Ser* *N* *N* *114.467* *.* *1* new residue 111 adding: *1061* *111* *Asn* *H* *H* *8.217* *.* *1* old residue 111 adding: *1062* *111* *Asn* *HA* *H* *5.102* *.* *1* old residue 111 adding: *1063* *111* *Asn* *HB2* *H* *2.763* *.* *2* old residue 111 adding: *1064* *111* *Asn* *HB3* *H* *2.572* *.* *2* old residue 111 adding: *1065* *111* *Asn* *CA* *C* *50.26* *.* *1* old residue 111 adding: *1066* *111* *Asn* *CB* *C* *39.6* *.* *1* old residue 111 adding: *2037* *111* *Asn* *HD21* *H* *7.66* *.* *2* old residue 111 adding: *2038* *111* *Asn* *HD22* *H* *7.006* *.* *2* old residue 111 adding: *2039* *111* *Asn* *ND2* *N* *111.7* *.* *1* old residue 111 adding: *1067* *111* *Asn* *N* *N* *118.303* *.* *1* new residue 112 adding: *1068* *112* *Pro* *HA* *H* *4.416* *.* *1* old residue 112 adding: *1069* *112* *Pro* *HB2* *H* *2.197* *.* *2* old residue 112 adding: *1070* *112* *Pro* *HB3* *H* *1.688* *.* *2* old residue 112 adding: *2095* *112* *Pro* *HG2* *H* *1.938* *.* *2* old residue 112 adding: *2096* *112* *Pro* *HG3* *H* *1.639* *.* *2* old residue 112 adding: *1071* *112* *Pro* *HD2* *H* *3.7* *.* *2* old residue 112 adding: *1072* *112* *Pro* *HD3* *H* *3.7* *.* *2* old residue 112 adding: *1073* *112* *Pro* *C* *C* *176.425* *.* *1* old residue 112 adding: *1074* *112* *Pro* *CA* *C* *63.49* *.* *1* old residue 112 adding: *1075* *112* *Pro* *CB* *C* *32.042* *.* *1* old residue 112 adding: *1076* *112* *Pro* *CG* *C* *26.7* *.* *1* old residue 112 adding: *1077* *112* *Pro* *CD* *C* *50.7* *.* *1* new residue 113 adding: *1078* *113* *Tyr* *H* *H* *7.92* *.* *1* old residue 113 adding: *1079* *113* *Tyr* *HA* *H* *4.57* *.* *1* old residue 113 adding: *1080* *113* *Tyr* *HB2* *H* *3.098* *.* *2* old residue 113 adding: *1081* *113* *Tyr* *HB3* *H* *2.912* *.* *2* old residue 113 adding: *1082* *113* *Tyr* *C* *C* *175.468* *.* *1* old residue 113 adding: *1083* *113* *Tyr* *CA* *C* *57.56* *.* *1* old residue 113 adding: *1084* *113* *Tyr* *CB* *C* *38.416* *.* *1* old residue 113 adding: *3216* *113* *Tyr* *HD1* *H* *7.104* *.* *2* old residue 113 adding: *3217* *113* *Tyr* *HE1* *H* *6.81* *.* *2* old residue 113 adding: *3218* *113* *Tyr* *HD2* *H* *7.104* *.* *2* old residue 113 adding: *3219* *113* *Tyr* *HE2* *H* *6.81* *.* *2* old residue 113 adding: *3221* *113* *Tyr* *CD1* *C* *133.1* *.* *2* old residue 113 adding: *3222* *113* *Tyr* *CD2* *C* *133.1* *.* *2* old residue 113 adding: *3223* *113* *Tyr* *CE1* *C* *118.1* *.* *2* old residue 113 adding: *3224* *113* *Tyr* *CE2* *C* *118.1* *.* *2* old residue 113 adding: *1085* *113* *Tyr* *N* *N* *119.04* *.* *1* new residue 114 adding: *1086* *114* *Leu* *H* *H* *7.874* *.* *1* old residue 114 adding: *1087* *114* *Leu* *HA* *H* *4.245* *.* *1* old residue 114 adding: *1088* *114* *Leu* *HB2* *H* *1.494* *.* *2* old residue 114 adding: *1089* *114* *Leu* *HB3* *H* *1.494* *.* *2* old residue 114 adding: *1090* *114* *Leu* *HG* *H* *1.492* *.* *1* old residue 114 adding: *1091* *114* *Leu* *HD1* *H* *0.89* *.* *2* old residue 114 adding: *1092* *114* *Leu* *HD2* *H* *0.83* *.* *2* old residue 114 adding: *1093* *114* *Leu* *C* *C* *176.586* *.* *1* old residue 114 adding: *1094* *114* *Leu* *CA* *C* *55.206* *.* *1* old residue 114 adding: *1095* *114* *Leu* *CB* *C* *42.537* *.* *1* old residue 114 adding: *1096* *114* *Leu* *CG* *C* *26.85* *.* *1* old residue 114 adding: *1097* *114* *Leu* *CD1* *C* *25.0* *.* *2* old residue 114 adding: *1098* *114* *Leu* *CD2* *C* *23.85* *.* *2* old residue 114 adding: *1099* *114* *Leu* *N* *N* *123.619* *.* *1* new residue 115 adding: *1100* *115* *Glu* *H* *H* *8.281* *.* *1* old residue 115 adding: *1101* *115* *Glu* *HA* *H* *4.171* *.* *1* old residue 115 adding: *1102* *115* *Glu* *HB2* *H* *1.907* *.* *2* old residue 115 adding: *1103* *115* *Glu* *HB3* *H* *1.845* *.* *2* old residue 115 adding: *1104* *115* *Glu* *HG2* *H* *2.197* *.* *2* old residue 115 adding: *2041* *115* *Glu* *HG3* *H* *2.141* *.* *2* old residue 115 adding: *1105* *115* *Glu* *C* *C* *176.023* *.* *1* old residue 115 adding: *1106* *115* *Glu* *CA* *C* *56.495* *.* *1* old residue 115 adding: *1107* *115* *Glu* *CB* *C* *30.46* *.* *1* old residue 115 adding: *1108* *115* *Glu* *CG* *C* *36.133* *.* *1* old residue 115 adding: *1109* *115* *Glu* *N* *N* *122.028* *.* *1* new residue 116 adding: *1110* *116* *His* *H* *H* *8.3* *.* *1* old residue 116 adding: *1111* *116* *His* *HA* *H* *4.602* *.* *1* old residue 116 adding: *1112* *116* *His* *HB2* *H* *3.0* *.* *2* old residue 116 adding: *1113* *116* *His* *HB3* *H* *3.0* *.* *2* old residue 116 adding: *1115* *116* *His* *CA* *C* *55.98* *.* *1* old residue 116 adding: *1116* *116* *His* *CB* *C* *30.24* *.* *1* old residue 116 adding: *1117* *116* *His* *N* *N* *120.05* *.* *1* new residue 117 adding: *1118* *117* *His* *H* *H* *8.13* *.* *1* old residue 117 adding: *1120* *117* *His* *HB2* *H* *3.189* *.* *2* old residue 117 adding: *1121* *117* *His* *HB3* *H* *3.06* *.* *2* old residue 117 adding: *1122* *117* *His* *CA* *C* *57.74* *.* *1* old residue 117 adding: *1123* *117* *His* *CB* *C* *30.36* *.* *1* old residue 117 adding: *1124* *117* *His* *N* *N* *125.4* *.* *1* seqcode size is : 115 seqcode: 33 shift counts are : 11 seqcode: 32 shift counts are : 11 seqcode: 90 shift counts are : 14 seqcode: 63 shift counts are : 14 seqcode: 21 shift counts are : 7 seqcode: 102 shift counts are : 14 seqcode: 7 shift counts are : 11 seqcode: 80 shift counts are : 15 seqcode: 26 shift counts are : 14 seqcode: 99 shift counts are : 12 seqcode: 18 shift counts are : 13 seqcode: 72 shift counts are : 6 seqcode: 16 shift counts are : 14 seqcode: 44 shift counts are : 15 seqcode: 55 shift counts are : 10 seqcode: 74 shift counts are : 8 seqcode: 27 shift counts are : 7 seqcode: 84 shift counts are : 12 seqcode: 95 shift counts are : 11 seqcode: 57 shift counts are : 16 seqcode: 61 shift counts are : 14 seqcode: 108 shift counts are : 16 seqcode: 115 shift counts are : 11 seqcode: 20 shift counts are : 8 seqcode: 109 shift counts are : 15 seqcode: 92 shift counts are : 8 seqcode: 103 shift counts are : 13 seqcode: 89 shift counts are : 9 seqcode: 10 shift counts are : 15 seqcode: 31 shift counts are : 11 seqcode: 113 shift counts are : 16 seqcode: 35 shift counts are : 8 seqcode: 11 shift counts are : 15 seqcode: 91 shift counts are : 9 seqcode: 78 shift counts are : 7 seqcode: 107 shift counts are : 6 seqcode: 48 shift counts are : 11 seqcode: 87 shift counts are : 8 seqcode: 93 shift counts are : 15 seqcode: 77 shift counts are : 8 seqcode: 106 shift counts are : 8 seqcode: 65 shift counts are : 11 seqcode: 29 shift counts are : 15 seqcode: 50 shift counts are : 14 seqcode: 39 shift counts are : 8 seqcode: 64 shift counts are : 15 seqcode: 97 shift counts are : 14 seqcode: 114 shift counts are : 14 seqcode: 58 shift counts are : 14 seqcode: 41 shift counts are : 11 seqcode: 12 shift counts are : 14 seqcode: 15 shift counts are : 11 seqcode: 81 shift counts are : 8 seqcode: 52 shift counts are : 14 seqcode: 60 shift counts are : 11 seqcode: 56 shift counts are : 15 seqcode: 101 shift counts are : 15 seqcode: 73 shift counts are : 6 seqcode: 66 shift counts are : 12 seqcode: 45 shift counts are : 9 seqcode: 86 shift counts are : 14 seqcode: 76 shift counts are : 6 seqcode: 19 shift counts are : 15 seqcode: 62 shift counts are : 8 seqcode: 54 shift counts are : 11 seqcode: 67 shift counts are : 8 seqcode: 70 shift counts are : 15 seqcode: 68 shift counts are : 16 seqcode: 2 shift counts are : 12 seqcode: 17 shift counts are : 14 seqcode: 116 shift counts are : 7 seqcode: 88 shift counts are : 14 seqcode: 30 shift counts are : 12 seqcode: 100 shift counts are : 15 seqcode: 110 shift counts are : 8 seqcode: 82 shift counts are : 6 seqcode: 25 shift counts are : 12 seqcode: 28 shift counts are : 7 seqcode: 83 shift counts are : 8 seqcode: 75 shift counts are : 14 seqcode: 40 shift counts are : 6 seqcode: 14 shift counts are : 11 seqcode: 112 shift counts are : 12 seqcode: 69 shift counts are : 14 seqcode: 59 shift counts are : 11 seqcode: 49 shift counts are : 5 seqcode: 24 shift counts are : 16 seqcode: 104 shift counts are : 11 seqcode: 53 shift counts are : 11 seqcode: 79 shift counts are : 8 seqcode: 22 shift counts are : 12 seqcode: 42 shift counts are : 13 seqcode: 46 shift counts are : 10 seqcode: 23 shift counts are : 8 seqcode: 13 shift counts are : 11 seqcode: 105 shift counts are : 11 seqcode: 96 shift counts are : 11 seqcode: 6 shift counts are : 11 seqcode: 85 shift counts are : 15 seqcode: 3 shift counts are : 8 seqcode: 36 shift counts are : 11 seqcode: 94 shift counts are : 15 seqcode: 111 shift counts are : 10 seqcode: 9 shift counts are : 16 seqcode: 51 shift counts are : 11 seqcode: 47 shift counts are : 6 seqcode: 8 shift counts are : 8 seqcode: 38 shift counts are : 9 seqcode: 98 shift counts are : 11 seqcode: 4 shift counts are : 11 seqcode: 34 shift counts are : 16 seqcode: 37 shift counts are : 14 seqcode: 117 shift counts are : 6 seqcode: 43 shift counts are : 12 seqcode: 5 shift counts are : 7 setting ambig code at 869 for HD2 to 2 setting ambig code at 868 for HD1 to 2 setting ambig code at 984 for HD2 to 2 setting ambig code at 983 for HD1 to 2 setting ambig code at 260 for HD2 to 2 setting ambig code at 259 for HD1 to 2 setting ambig code at 180 for HD2 to 2 setting ambig code at 179 for HD1 to 2 setting ambig code at 796 for HD2 to 2 setting ambig code at 795 for HD1 to 2 setting ambig code at 599 for HD2 to 2 setting ambig code at 598 for HD1 to 2 setting ambig code at 997 for HD2 to 2 setting ambig code at 1098 for HD2 to 2 setting ambig code at 1097 for HD1 to 2 setting ambig code at 3229 for HD2 to 2 setting ambig code at 823 for HD1 to 2 setting ambig code at 19 for HD2 to 2 setting ambig code at 18 for HD1 to 2 setting ambig code at 845 for HD2 to 2 setting ambig code at 844 for HD1 to 2 setting ambig code at 681 for HD2 to 2 setting ambig code at 680 for HD1 to 2 setting ambig code at 127 for HG2 to 2 setting ambig code at 126 for HG1 to 2 setting ambig code at 1018 for HG2 to 2 setting ambig code at 1017 for HG1 to 2 setting ambig code at 944 for HG2 to 2 setting ambig code at 943 for HG1 to 2 setting ambig code at 358 for HD2 to 2 setting ambig code at 357 for HD1 to 2 8 2 LEU HA H 4.388 . 1 9 2 LEU HB2 H 1.667 . 2 10 2 LEU HB3 H 1.667 . 2 11 2 LEU HG H 1.654 . 1 12 2 LEU HD1 H 0.887 . 2 13 2 LEU HD2 H 0.887 . 2 14 2 LEU C C 176.516 . 1 15 2 LEU CA C 55.855 . 1 16 2 LEU CB C 42.324 . 1 17 2 LEU CG C 27.180 . 1 18 2 LEU CD1 C 24.129 . 2 19 2 LEU CD2 C 24.129 . 2 20 3 SER H H 8.479 . 1 21 3 SER HA H 4.39 . 1 22 3 SER HB2 H 3.947 . 2 23 3 SER HB3 H 3.894 . 2 24 3 SER C C 174.803 . 1 25 3 SER CA C 58.759 . 1 26 3 SER CB C 63.569 . 1 27 3 SER N N 116.589 . 1 28 4 GLN H H 8.45 . 1 29 4 GLN HA H 4.369 . 1 30 4 GLN HB2 H 2.194 . 2 31 4 GLN HB3 H 2.057 . 2 32 4 GLN HG2 H 2.397 . 2 33 4 GLN HG3 H 2.397 . 2 34 4 GLN C C 175.893 . 1 35 4 GLN CA C 55.873 . 1 36 4 GLN CB C 29.416 . 1 37 4 GLN CG C 33.98 . 1 38 4 GLN N N 122.337 . 1 39 5 ALA H H 8.258 . 1 40 5 ALA HA H 4.303 . 1 41 5 ALA HB H 1.380 . 1 42 5 ALA C C 177.117 . 1 43 5 ALA CA C 52.978 . 1 44 5 ALA CB C 19.345 . 1 45 5 ALA N N 124.044 . 1 46 6 ASN H H 8.412 . 1 47 6 ASN HA H 4.703 . 1 48 6 ASN HB2 H 2.91 . 2 49 6 ASN HB3 H 2.91 . 2 50 6 ASN C C 176.078 . 1 51 6 ASN CA C 53.770 . 1 52 6 ASN CB C 39.022 . 1 53 6 ASN N N 118.107 . 1 2001 6 ASN HD21 H 7.83 . 2 2002 6 ASN HD22 H 7.12 . 2 2003 6 ASN ND2 N 113.5 . 1 54 7 GLU H H 8.587 . 1 55 7 GLU HA H 4.067 . 1 56 7 GLU HB2 H 2.08 . 2 57 7 GLU HB3 H 2.08 . 2 58 7 GLU HG2 H 2.337 . 2 59 7 GLU HG3 H 2.337 . 2 60 7 GLU C C 177.858 . 1 61 7 GLU CA C 58.511 . 1 62 7 GLU CB C 30.464 . 1 63 7 GLU CG C 36.182 . 1 64 7 GLU N N 121.910 . 1 65 8 ASP H H 8.455 . 1 66 8 ASP HA H 4.411 . 1 67 8 ASP HB2 H 2.744 . 2 68 8 ASP HB3 H 2.683 . 2 69 8 ASP C C 178.135 . 1 70 8 ASP CA C 56.369 . 1 71 8 ASP CB C 40.273 . 1 72 8 ASP N N 120.117 . 1 73 9 PHE H H 8.255 . 1 74 9 PHE HA H 4.003 . 1 75 9 PHE HB2 H 3.208 . 2 76 9 PHE HB3 H 2.806 . 2 77 9 PHE C C 176.995 . 1 78 9 PHE CA C 61.979 . 1 79 9 PHE CB C 39.473 . 1 80 9 PHE N N 123.288 . 1 3058 9 PHE HD1 H 6.81 . 2 3059 9 PHE HE1 H 7.207 . 2 3061 9 PHE HE2 H 7.207 . 2 3062 9 PHE HD2 H 6.81 . 2 3064 9 PHE CD1 C 131.9 . 2 3065 9 PHE CE1 C 130.9 . 2 3067 9 PHE CE2 C 130.9 . 2 3068 9 PHE CD2 C 132.1 . 2 81 10 LYS H H 8.067 . 1 82 10 LYS HA H 3.495 . 1 83 10 LYS HB2 H 1.818 . 2 84 10 LYS HB3 H 1.754 . 2 85 10 LYS HG3 H 1.323 . 2 86 10 LYS HD2 H 1.678 . 2 87 10 LYS HD3 H 1.678 . 2 88 10 LYS C C 178.210 . 1 89 10 LYS CA C 59.89 . 1 90 10 LYS CB C 31.882 . 1 91 10 LYS CG C 25.46 . 1 92 10 LYS CD C 29.55 . 1 93 10 LYS CE C 42.177 . 1 94 10 LYS N N 117.587 . 1 3020 10 LYS HG2 H 1.551 . 2 95 11 LYS H H 7.387 . 1 96 11 LYS HA H 3.899 . 1 97 11 LYS HB2 H 1.83 . 2 98 11 LYS HB3 H 1.83 . 2 99 11 LYS C C 178.820 . 1 100 11 LYS CA C 59.35 . 1 101 11 LYS CB C 32.224 . 1 102 11 LYS CG C 25.394 . 1 103 11 LYS CD C 29.455 . 1 104 11 LYS CE C 42.134 . 1 105 11 LYS N N 117.271 . 1 3021 11 LYS HG2 H 1.54 . 2 3022 11 LYS HG3 H 1.347 . 2 3023 11 LYS HD2 H 1.7 . 2 3024 11 LYS HD3 H 1.7 . 2 106 12 ILE H H 6.970 . 1 107 12 ILE HA H 3.166 . 1 108 12 ILE HB H 1.277 . 1 109 12 ILE HG13 H 0.128 . 2 110 12 ILE HG2 H -0.08 . 1 111 12 ILE HD1 H 0.455 . 1 112 12 ILE C C 178.350 . 1 113 12 ILE CA C 65.22 . 1 114 12 ILE CB C 36.951 . 1 115 12 ILE CG1 C 27.82 . 1 116 12 ILE CG2 C 16.2 . 1 117 12 ILE CD1 C 13.357 . 1 118 12 ILE N N 119.214 . 1 3005 12 ILE HG12 H 1.304 . 2 119 13 VAL H H 7.504 . 1 120 13 VAL HA H 3.072 . 1 121 13 VAL HB H 1.676 . 1 122 13 VAL HG2 H 0.583 . 2 123 13 VAL C C 177.926 . 1 124 13 VAL CA C 65.935 . 1 125 13 VAL CB C 31.131 . 1 126 13 VAL CG1 C 23.019 . 2 127 13 VAL CG2 C 21.624 . 2 128 13 VAL N N 117.420 . 1 2045 13 VAL HG1 H 0.231 . 2 36 14 ASN N N 115.865 . 1 129 14 ASN H H 7.84 . 1 130 14 ASN HA H 4.426 . 1 131 14 ASN HB2 H 2.819 . 2 132 14 ASN HB3 H 2.722 . 2 133 14 ASN C C 175.757 . 1 134 14 ASN CA C 54.893 . 1 135 14 ASN CB C 38.457 . 1 2004 14 ASN HD21 H 7.52 . 2 2005 14 ASN HD22 H 6.88 . 2 2006 14 ASN ND2 N 112.5 . 1 137 15 ASN H H 7.613 . 1 138 15 ASN HA H 4.873 . 1 139 15 ASN HB2 H 2.987 . 2 140 15 ASN HB3 H 2.689 . 2 141 15 ASN C C 174.765 . 1 142 15 ASN CA C 53.041 . 1 143 15 ASN CB C 40.315 . 1 144 15 ASN N N 117.294 . 1 2007 15 ASN HD21 H 7.59 . 2 2008 15 ASN HD22 H 6.99 . 2 2009 15 ASN ND2 N 113.5 . 1 145 16 ILE H H 7.152 . 1 146 16 ILE HA H 4.178 . 1 147 16 ILE HB H 1.722 . 1 148 16 ILE HG12 H 1.991 . 2 149 16 ILE HG2 H 0.854 . 1 150 16 ILE C C 175.531 . 1 151 16 ILE CA C 62.731 . 1 152 16 ILE CB C 38.129 . 1 153 16 ILE CG1 C 27.588 . 1 154 16 ILE CG2 C 17.534 . 1 155 16 ILE CD1 C 15.766 . 1 156 16 ILE N N 120.310 . 1 3006 16 ILE HG13 H 1.005 . 2 3007 16 ILE HD1 H 0.702 . 1 157 17 ARG H H 8.620 . 1 158 17 ARG HA H 4.788 . 1 159 17 ARG HB2 H 2.043 . 2 160 17 ARG HB3 H 1.805 . 2 161 17 ARG HG2 H 1.762 . 2 162 17 ARG HD2 H 3.265 . 2 163 17 ARG HD3 H 3.398 . 2 164 17 ARG C C 176.682 . 1 165 17 ARG CA C 54.765 . 1 166 17 ARG CB C 35.05 . 1 167 17 ARG CG C 27.411 . 1 168 17 ARG CD C 43.446 . 1 169 17 ARG N N 125.075 . 1 2043 17 ARG HG3 H 1.711 . 2 170 18 LEU H H 8.978 . 1 171 18 LEU HA H 3.663 . 1 172 18 LEU HB2 H 1.714 . 2 173 18 LEU HB3 H 1.071 . 2 174 18 LEU HG H 1.58 . 1 175 18 LEU HD1 H 0.423 . 2 176 18 LEU CA C 55.735 . 1 177 18 LEU CB C 42.275 . 1 178 18 LEU CG C 27.049 . 1 179 18 LEU CD1 C 26.169 . 2 180 18 LEU CD2 C 24.731 . 2 181 18 LEU N N 127.698 . 1 2099 18 LEU HD2 H 0.572 . 2 182 19 LYS H H 8.452 . 1 183 19 LYS HA H 4.405 . 1 184 19 LYS HB2 H 2.378 . 2 185 19 LYS HB3 H 2.065 . 2 186 19 LYS HG2 H 1.80 . 2 187 19 LYS HG3 H 1.289 . 2 188 19 LYS HD3 H 1.77 . 2 189 19 LYS C C 176.739 . 1 190 19 LYS CA C 60.471 . 1 191 19 LYS CB C 30.938 . 1 192 19 LYS CG C 26.156 . 1 193 19 LYS CD C 29.741 . 1 194 19 LYS CE C 42.335 . 1 195 19 LYS N N 120.284 . 1 3025 19 LYS HD2 H 1.77 . 2 196 20 ASP H H 7.608 . 1 197 20 ASP HA H 4.645 . 1 198 20 ASP HB2 H 2.677 . 2 199 20 ASP HB3 H 2.677 . 2 200 20 ASP C C 176.293 . 1 201 20 ASP CA C 56.198 . 1 202 20 ASP CB C 43.08 . 1 203 20 ASP N N 117.462 . 1 204 21 THR H H 8.623 . 1 205 21 THR HA H 4.164 . 1 206 21 THR HB H 4.269 . 1 208 21 THR C C 175.015 . 1 209 21 THR CA C 65.596 . 1 210 21 THR CB C 68.46 . 1 212 21 THR N N 111.699 . 1 213 22 PHE H H 7.606 . 1 214 22 PHE HA H 5.11 . 1 215 22 PHE HB2 H 2.95 . 2 216 22 PHE HB3 H 2.95 . 2 217 22 PHE C C 170.154 . 1 218 22 PHE CA C 55.345 . 1 219 22 PHE CB C 41.126 . 1 220 22 PHE N N 113.721 . 1 3069 22 PHE HD1 H 6.993 . 2 3073 22 PHE HD2 H 6.993 . 2 3075 22 PHE CD1 C 131.96 . 2 3079 22 PHE CD2 C 131.96 . 2 221 23 ASP H H 9.045 . 1 222 23 ASP HA H 4.787 . 1 223 23 ASP HB2 H 2.961 . 2 224 23 ASP HB3 H 2.511 . 2 225 23 ASP C C 175.785 . 1 226 23 ASP CA C 53.871 . 1 227 23 ASP CB C 47.85 . 1 228 23 ASP N N 121.321 . 1 229 24 PHE H H 8.944 . 1 230 24 PHE HA H 6.087 . 1 231 24 PHE HB2 H 2.95 . 2 232 24 PHE HB3 H 2.95 . 2 233 24 PHE C C 172.639 . 1 234 24 PHE CA C 56.319 . 1 235 24 PHE CB C 43.62 . 1 236 24 PHE N N 114.948 . 1 3080 24 PHE HD1 H 7.099 . 2 3081 24 PHE HE1 H 6.808 . 2 3083 24 PHE HE2 H 6.808 . 2 3084 24 PHE HD2 H 7.099 . 2 3086 24 PHE CD1 C 132.3 . 2 3087 24 PHE CE1 C 132.06 . 2 3089 24 PHE CE2 C 132.5 . 2 3090 24 PHE CD2 C 132.06 . 2 237 25 LYS H H 9.098 . 1 238 25 LYS HA H 4.713 . 1 239 25 LYS HB2 H 1.853 . 2 240 25 LYS HB3 H 1.714 . 2 241 25 LYS C C 175.516 . 1 242 25 LYS CA C 54.610 . 1 243 25 LYS CB C 37.004 . 1 244 25 LYS CG C 24.514 . 1 246 25 LYS CE C 42.142 . 1 247 25 LYS N N 118.505 . 1 3026 25 LYS HG2 H 1.450 . 2 3027 25 LYS HG3 H 1.381 . 2 248 26 LEU H H 9.930 . 1 249 26 LEU HA H 5.019 . 1 250 26 LEU HB2 H 2.098 . 2 251 26 LEU HB3 H 1.887 . 2 252 26 LEU HG H 1.212 . 1 253 26 LEU HD1 H 1.138 . 2 254 26 LEU HD2 H 1.138 . 2 255 26 LEU C C 177.546 . 1 256 26 LEU CA C 54.22 . 1 257 26 LEU CB C 42.138 . 1 258 26 LEU CG C 26.643 . 1 259 26 LEU CD1 C 25.832 . 2 260 26 LEU CD2 C 25.832 . 2 261 26 LEU N N 125.25 . 1 262 27 ALA H H 8.01 . 1 263 27 ALA HA H 3.897 . 1 264 27 ALA HB H 1.208 . 1 265 27 ALA C C 179.107 . 1 266 27 ALA CA C 54.465 . 1 267 27 ALA CB C 17.9550 . 1 268 27 ALA N N 128.008 . 1 269 28 ALA H H 8.320 . 1 270 28 ALA HA H 3.736 . 1 271 28 ALA HB H 0.572 . 1 272 28 ALA C C 176.745 . 1 273 28 ALA CA C 53.417 . 1 274 28 ALA CB C 19.771 . 1 275 28 ALA N N 114.273 . 1 276 29 PHE H H 7.043 . 1 277 29 PHE HA H 5.242 . 1 278 29 PHE HB2 H 3.177 . 2 279 29 PHE HB3 H 2.812 . 2 280 29 PHE CA C 53.623 . 1 281 29 PHE CB C 41.253 . 1 282 29 PHE N N 112.267 . 1 3091 29 PHE HD1 H 7.12 . 2 3092 29 PHE HE1 H 7.11 . 2 3094 29 PHE HE2 H 7.11 . 1 3095 29 PHE HD2 H 7.12 . 2 3097 29 PHE CD1 C 133.2 . 2 3098 29 PHE CE1 C 130.2 . 2 3100 29 PHE CE2 C 130.2 . 2 3101 29 PHE CD2 C 133.2 . 2 283 30 PRO HA H 4.384 . 1 284 30 PRO HB2 H 2.218 . 2 285 30 PRO HB3 H 1.915 . 2 286 30 PRO HG2 H 1.989 . 2 287 30 PRO HG3 H 1.989 . 2 288 30 PRO HD2 H 3.574 . 2 289 30 PRO C C 177.686 . 1 290 30 PRO CA C 64.889 . 1 291 30 PRO CB C 31.935 . 1 292 30 PRO CG C 27.3 . 1 293 30 PRO CD C 49.74 . 1 2086 30 PRO HD3 H 3.477 . 2 294 31 ASN H H 8.699 . 1 295 31 ASN HA H 4.785 . 1 296 31 ASN HB2 H 2.980 . 2 297 31 ASN HB3 H 2.791 . 2 298 31 ASN C C 174.507 . 1 299 31 ASN CA C 53.234 . 1 300 31 ASN CB C 38.9 . 1 301 31 ASN N N 115.305 . 1 2010 31 ASN HD21 H 7.63 . 2 2011 31 ASN HD22 H 7.009 . 2 2012 31 ASN ND2 N 114.1 . 1 302 32 GLN H H 7.227 . 1 303 32 GLN HA H 4.585 . 1 304 32 GLN HB2 H 1.9 . 2 305 32 GLN HB3 H 1.9 . 2 306 32 GLN HG2 H 2.25 . 2 307 32 GLN C C 174.827 . 1 308 32 GLN CA C 55.371 . 1 309 32 GLN CB C 31.85 . 1 310 32 GLN CG C 34.97 . 1 311 32 GLN N N 117.758 . 1 2058 32 GLN HG3 H 2.25 . 2 312 33 ASN H H 8.692 . 1 313 33 ASN HA H 4.591 . 1 314 33 ASN HB2 H 2.801 . 2 315 33 ASN HB3 H 2.617 . 2 316 33 ASN C C 176.830 . 1 317 33 ASN CA C 51.572 . 1 318 33 ASN CB C 40.280 . 1 319 33 ASN N N 120.622 . 1 2013 33 ASN HD21 H 7.77 . 2 2014 33 ASN HD22 H 6.86 . 2 2015 33 ASN ND2 N 113.8 . 1 320 34 TYR H H 7.328 . 1 321 34 TYR HA H 4.225 . 1 322 34 TYR HB2 H 2.756 . 2 323 34 TYR HB3 H 2.580 . 2 324 34 TYR C C 177.022 . 1 325 34 TYR CA C 60.2 . 1 326 34 TYR CB C 37.54 . 1 327 34 TYR N N 117.43 . 1 3135 34 TYR HD1 H 6.806 . 2 3136 34 TYR HE1 H 6.124 . 2 3137 34 TYR HD2 H 6.806 . 2 3138 34 TYR HE2 H 6.124 . 2 3140 34 TYR CD1 C 132.06 . 2 3141 34 TYR CD2 C 132.06 . 2 3142 34 TYR CE1 C 118.609 . 2 3143 34 TYR CE2 C 118.609 . 2 328 35 ASP H H 7.944 . 1 329 35 ASP HA H 4.351 . 1 330 35 ASP HB2 H 2.863 . 2 331 35 ASP HB3 H 2.549 . 2 332 35 ASP C C 176.343 . 1 333 35 ASP CA C 54.950 . 1 334 35 ASP CB C 39.48 . 1 335 35 ASP N N 109.804 . 1 336 36 GLN H H 7.83 . 1 337 36 GLN HA H 4.419 . 1 338 36 GLN HB2 H 2.399 . 2 339 36 GLN HB3 H 2.148 . 2 340 36 GLN HG2 H 2.366 . 2 341 36 GLN C C 175.491 . 1 342 36 GLN CA C 54.91 . 1 343 36 GLN CB C 31.008 . 1 344 36 GLN CG C 34.871 . 1 345 36 GLN N N 116.1 . 1 2059 36 GLN HG3 H 2.366 . 2 346 37 LEU H H 7.766 . 1 347 37 LEU HA H 4.567 . 1 348 37 LEU HB2 H 0.89 . 2 349 37 LEU HB3 H 0.89 . 2 350 37 LEU HG H 0.71 . 1 351 37 LEU HD1 H -0.044 . 2 352 37 LEU HD2 H -0.044 . 2 353 37 LEU C C 175.435 . 1 354 37 LEU CA C 53.073 . 1 355 37 LEU CB C 45.05 . 1 356 37 LEU CG C 25.52 . 1 357 37 LEU CD1 C 22.35 . 2 358 37 LEU CD2 C 22.35 . 2 359 37 LEU N N 122.471 . 1 360 38 LEU H H 8.806 . 1 361 38 LEU HB2 H 1.667 . 2 362 38 LEU HB3 H 1.667 . 2 363 38 LEU HG H 0.880 . 1 366 38 LEU CA C 53.340 . 1 367 38 LEU CB C 42.4 . 1 368 38 LEU CG C 25.94 . 1 371 38 LEU N N 123.422 . 1 3001 38 LEU HA H 4.576 . 1 372 39 PRO HA H 3.770 . 1 373 39 PRO HB2 H 2.39 . 2 374 39 PRO HB3 H 2.39 . 2 375 39 PRO HG3 H 1.72 . 2 378 39 PRO CA C 66.56 . 1 379 39 PRO CB C 32.0 . 1 2087 39 PRO CG C 28.05 . 1 3228 39 PRO HG2 H 2.24 . 2 381 40 SER H H 9.189 . 1 382 40 SER HA H 5.043 . 1 383 40 SER HB2 H 3.943 . 2 384 40 SER HB3 H 3.943 . 2 385 40 SER CA C 61.72 . 1 387 40 SER N N 110.942 . 1 388 41 GLN H H 7.45 . 1 389 41 GLN HA H 4.285 . 1 390 41 GLN HB2 H 1.958 . 2 391 41 GLN HB3 H 2.458 . 2 392 41 GLN HG2 H 2.487 . 2 393 41 GLN C C 179.564 . 1 394 41 GLN CA C 59.0 . 1 395 41 GLN CB C 29.976 . 1 396 41 GLN CG C 36.2 . 1 397 41 GLN N N 121.997 . 1 2066 41 GLN HG3 H 2.348 . 2 398 42 ILE H H 7.416 . 1 399 42 ILE HA H 3.517 . 1 400 42 ILE HB H 1.613 . 1 401 42 ILE HG12 H 0.806 . 2 402 42 ILE HG13 H 0.806 . 2 403 42 ILE HG2 H 0.596 . 1 404 42 ILE HD1 H -0.204 . 1 405 42 ILE CA C 65.210 . 1 406 42 ILE CB C 37.448 . 1 407 42 ILE CG1 C 29.324 . 1 408 42 ILE CG2 C 14.738 . 1 409 42 ILE CD1 C 15.555 . 1 410 42 ILE N N 120.598 . 1 411 43 TYR H H 8.803 . 1 412 43 TYR HA H 3.833 . 1 413 43 TYR HB2 H 3.251 . 2 414 43 TYR HB3 H 3.251 . 2 415 43 TYR C C 177.348 . 1 416 43 TYR CA C 62.545 . 1 417 43 TYR CB C 39.973 . 1 418 43 TYR N N 120.164 . 1 3145 43 TYR HD1 H 6.552 . 2 3147 43 TYR HD2 H 6.552 . 2 3150 43 TYR CD1 C 132.71 . 2 3151 43 TYR CD2 C 132.71 . 2 419 44 LYS H H 8.010 . 1 420 44 LYS HA H 4.255 . 1 421 44 LYS HB2 H 2.05 . 2 422 44 LYS HB3 H 2.009 . 2 423 44 LYS C C 177.959 . 1 424 44 LYS CA C 58.292 . 1 425 44 LYS CB C 34.018 . 1 426 44 LYS CG C 26.68 . 1 427 44 LYS CD C 29.328 . 1 428 44 LYS CE C 42.298 . 1 429 44 LYS N N 112.505 . 1 3030 44 LYS HG2 H 1.99 . 2 3031 44 LYS HG3 H 1.693 . 2 3032 44 LYS HD2 H 1.767 . 2 3033 44 LYS HD3 H 1.767 . 2 430 45 ASN H H 7.343 . 1 431 45 ASN HA H 5.344 . 1 432 45 ASN HB2 H 2.82 . 2 433 45 ASN HB3 H 2.444 . 2 434 45 ASN C C 177.526 . 1 435 45 ASN CA C 54.405 . 1 436 45 ASN CB C 42.1 . 1 437 45 ASN N N 110.975 . 1 2018 45 ASN ND2 N 110.67 . 1 438 46 TYR H H 8.367 . 1 439 46 TYR HA H 5.35 . 1 440 46 TYR HB2 H 2.980 . 2 441 46 TYR HB3 H 3.140 . 2 442 46 TYR C C 177.348 . 1 443 46 TYR CA C 61.422 . 1 444 46 TYR CB C 36.26 . 1 445 46 TYR N N 123.444 . 1 3163 46 TYR CE1 C 118.11 . 2 3164 46 TYR CE2 C 118.11 . 2 447 47 TYR HA H 4.079 . 1 448 47 TYR HB2 H 2.899 . 2 449 47 TYR HB3 H 2.745 . 2 450 47 TYR C C 175.748 . 1 451 47 TYR CA C 59.325 . 1 452 47 TYR CB C 36.434 . 1 454 48 GLN H H 6.629 . 1 455 48 GLN HA H 3.858 . 1 456 48 GLN HB2 H 2.051 . 2 457 48 GLN HB3 H 1.820 . 2 458 48 GLN HG2 H 1.791 . 2 459 48 GLN HG3 H 1.48 . 2 460 48 GLN C C 176.070 . 1 461 48 GLN CA C 57.37 . 1 462 48 GLN CB C 28.192 . 1 463 48 GLN CG C 34.22 . 1 464 48 GLN N N 117.6 . 1 465 49 GLY H H 7.729 . 1 466 49 GLY HA2 H 4.656 . 2 467 49 GLY HA3 H 3.868 . 2 468 49 GLY CA C 45.292 . 1 469 49 GLY N N 106.971 . 1 470 50 ILE H H 8.845 . 1 471 50 ILE HA H 5.022 . 1 472 50 ILE HB H 1.90 . 1 473 50 ILE HG12 H 1.978 . 2 474 50 ILE HG13 H 1.14 . 2 475 50 ILE HG2 H 1.07 . 1 476 50 ILE HD1 H 0.924 . 1 477 50 ILE C C 174.448 . 1 478 50 ILE CA C 60.736 . 1 479 50 ILE CB C 42.550 . 1 480 50 ILE CG1 C 27.6 . 1 481 50 ILE CG2 C 18.52 . 1 482 50 ILE CD1 C 15.466 . 1 483 50 ILE N N 125.81 . 1 484 51 GLU H H 9.280 . 1 485 51 GLU HA H 4.865 . 1 486 51 GLU HB2 H 2.039 . 2 487 51 GLU HB3 H 1.930 . 2 488 51 GLU HG2 H 2.307 . 2 489 51 GLU HG3 H 2.307 . 2 490 51 GLU C C 175.340 . 1 491 51 GLU CA C 54.882 . 1 492 51 GLU CB C 32.703 . 1 493 51 GLU CG C 36.198 . 1 494 51 GLU N N 127.617 . 1 495 52 ILE H H 9.061 . 1 496 52 ILE HA H 4.852 . 1 497 52 ILE HB H 2.15 . 1 498 52 ILE HG12 H 1.708 . 2 499 52 ILE HG2 H 0.978 . 1 500 52 ILE HD1 H 0.822 . 1 501 52 ILE C C 175.798 . 1 502 52 ILE CA C 59.055 . 1 503 52 ILE CB C 38.804 . 1 505 52 ILE CG1 C 27.518 . 1 506 52 ILE CG2 C 16.798 . 1 507 52 ILE CD1 C 11.594 . 1 508 52 ILE N N 126.210 . 1 3009 52 ILE HG13 H 1.538 . 2 509 53 GLN H H 8.755 . 1 510 53 GLN HA H 4.656 . 1 511 53 GLN HB2 H 1.942 . 2 512 53 GLN HB3 H 1.860 . 2 513 53 GLN HG2 H 2.265 . 2 514 53 GLN C C 173.594 . 1 515 53 GLN CA C 54.703 . 1 516 53 GLN CB C 29.173 . 1 517 53 GLN CG C 33.455 . 1 518 53 GLN N N 127.724 . 1 2070 53 GLN HG3 H 2.265 . 2 519 54 GLN H H 9.235 . 1 520 54 GLN HA H 4.3 . 1 521 54 GLN HB2 H 2.194 . 2 522 54 GLN HB3 H 2.06 . 2 523 54 GLN HG2 H 2.4 . 2 524 54 GLN HG3 H 2.4 . 2 525 54 GLN C C 174.810 . 1 526 54 GLN CA C 56.0 . 1 527 54 GLN CB C 29.22 . 1 528 54 GLN CG C 34.0 . 1 529 54 GLN N N 127.228 . 1 530 55 HIS H H 8.501 . 1 531 55 HIS HA H 4.963 . 1 532 55 HIS HB2 H 3.329 . 2 533 55 HIS HB3 H 3.107 . 2 534 55 HIS C C 175.148 . 1 535 55 HIS CA C 55.524 . 1 536 55 HIS CB C 31.7 . 1 537 55 HIS N N 123.757 . 1 2048 55 HIS HD2 H 6.53 . 1 2050 55 HIS CD2 C 118.6 . 1 538 56 LYS H H 7.444 . 1 539 56 LYS HA H 4.671 . 1 540 56 LYS HB2 H 1.346 . 2 541 56 LYS HB3 H 1.266 . 2 542 56 LYS HG3 H 1.215 . 2 543 56 LYS HD3 H 1.52 . 2 544 56 LYS C C 174.915 . 1 545 56 LYS CA C 54.735 . 1 546 56 LYS CB C 38.503 . 1 547 56 LYS CG C 25.599 . 1 548 56 LYS CD C 29.554 . 1 549 56 LYS N N 115.021 . 1 3034 56 LYS HG2 H 1.342 . 2 3035 56 LYS HD2 H 1.52 . 2 3036 56 LYS CE C 42.15 . 1 550 57 TYR H H 8.881 . 1 551 57 TYR HA H 4.750 . 1 552 57 TYR HB2 H 3.357 . 2 553 57 TYR HB3 H 3.067 . 2 554 57 TYR C C 177.055 . 1 555 57 TYR CA C 58.251 . 1 556 57 TYR CB C 36.303 . 1 557 57 TYR N N 113.634 . 1 3176 57 TYR HD1 H 6.93 . 2 3177 57 TYR HE1 H 6.53 . 2 3178 57 TYR HD2 H 6.93 . 2 3179 57 TYR HE2 H 6.53 . 2 3181 57 TYR CD1 C 132.76 . 2 3182 57 TYR CD2 C 132.76 . 2 3183 57 TYR CE1 C 118.66 . 2 3184 57 TYR CE2 C 118.66 . 2 558 58 GLN H H 9.344 . 1 559 58 GLN HA H 4.060 . 1 560 58 GLN HB2 H 2.089 . 2 561 58 GLN HB3 H 1.943 . 2 562 58 GLN HG2 H 2.554 . 2 563 58 GLN C C 177.751 . 1 564 58 GLN CA C 60.835 . 1 565 58 GLN CB C 28.275 . 1 566 58 GLN CG C 34.585 . 1 567 58 GLN N N 119.012 . 1 2077 58 GLN HG3 H 2.04 . 2 2078 58 GLN HE21 H 7.66 . 2 2079 58 GLN HE22 H 7.35 . 2 2080 58 GLN NE2 N 109.5 . 1 568 59 ASN H H 8.717 . 1 569 59 ASN HA H 4.636 . 1 570 59 ASN HB2 H 2.791 . 2 571 59 ASN HB3 H 2.792 . 2 572 59 ASN C C 175.860 . 1 573 59 ASN CA C 54.717 . 1 574 59 ASN CB C 38.638 . 1 575 59 ASN N N 113.155 . 1 2019 59 ASN HD21 H 7.77 . 2 2020 59 ASN HD22 H 7.02 . 2 2021 59 ASN ND2 N 113.9 . 1 576 60 GLU H H 8.153 . 1 577 60 GLU HA H 4.347 . 1 578 60 GLU HB2 H 2.166 . 2 579 60 GLU HB3 H 2.053 . 2 580 60 GLU HG2 H 2.52 . 2 581 60 GLU HG3 H 2.52 . 2 582 60 GLU C C 176.792 . 1 583 60 GLU CA C 59.212 . 1 584 60 GLU CB C 32.136 . 1 585 60 GLU CG C 36.480 . 1 586 60 GLU N N 117.194 . 1 587 61 LEU H H 8.638 . 1 588 61 LEU HA H 5.635 . 1 589 61 LEU HB2 H 2.14 . 2 590 61 LEU HB3 H 1.31 . 2 591 61 LEU HG H 0.65 . 1 592 61 LEU HD1 H 0.89 . 2 593 61 LEU HD2 H 0.89 . 2 594 61 LEU C C 174.291 . 1 595 61 LEU CA C 54.202 . 1 596 61 LEU CB C 46.5 . 1 597 61 LEU CG C 26.637 . 1 598 61 LEU CD1 C 24.99 . 2 599 61 LEU CD2 C 24.99 . 2 600 61 LEU N N 123.189 . 1 601 62 ASP H H 8.801 . 1 602 62 ASP HA H 5.33 . 1 603 62 ASP HB2 H 2.667 . 2 604 62 ASP HB3 H 2.431 . 2 605 62 ASP C C 174.580 . 1 606 62 ASP CA C 53.151 . 1 607 62 ASP CB C 45.273 . 1 608 62 ASP N N 125.578 . 1 609 63 ILE H H 7.864 . 1 610 63 ILE HA H 4.289 . 1 611 63 ILE HB H 1.203 . 1 612 63 ILE HG12 H 1.32 . 2 613 63 ILE HD1 H 0.404 . 1 614 63 ILE C C 173.538 . 1 615 63 ILE CA C 60.967 . 1 616 63 ILE CB C 41.301 . 1 617 63 ILE CG1 C 27.4 . 1 618 63 ILE CG2 C 15.98 . 1 619 63 ILE CD1 C 14.72 . 1 620 63 ILE N N 122.782 . 1 3010 63 ILE HG13 H 1.32 . 2 3011 63 ILE HG2 H -0.076 . 1 621 64 LYS H H 8.170 . 1 622 64 LYS HA H 4.476 . 1 623 64 LYS HB2 H 1.65 . 2 624 64 LYS HB3 H 1.65 . 2 625 64 LYS HD2 H 1.65 . 2 626 64 LYS HD3 H 1.65 . 2 627 64 LYS C C 175.569 . 1 628 64 LYS CA C 54.537 . 1 629 64 LYS CB C 36.45 . 1 630 64 LYS CG C 25.004 . 1 631 64 LYS CD C 29.01 . 1 632 64 LYS CE C 42.586 . 1 633 64 LYS N N 124.657 . 1 3037 64 LYS HG2 H 1.461 . 2 3038 64 LYS HG3 H 1.308 . 2 634 65 ILE H H 8.6 . 1 637 65 ILE HG2 H -0.269 . 1 638 65 ILE HD1 H 0.428 . 1 639 65 ILE CA C 60.9 . 1 640 65 ILE CG1 C 27.47 . 1 641 65 ILE CG2 C 17.25 . 1 642 65 ILE CD1 C 15.07 . 1 643 65 ILE N N 123.131 . 1 3012 65 ILE HB H 1.345 . 1 3014 65 ILE CB C 38.68 . 1 3015 65 ILE HA H 4.06 . 1 644 66 ILE HA H 4.07 . 1 645 66 ILE HB H 1.849 . 1 646 66 ILE HG2 H 0.85 . 1 647 66 ILE HD1 H 0.85 . 1 648 66 ILE C C 175.719 . 1 649 66 ILE CA C 61.3 . 1 650 66 ILE CB C 38.196 . 1 651 66 ILE CG1 C 26.7 . 1 652 66 ILE CG2 C 17.6 . 1 653 66 ILE CD1 C 12.9 . 1 3016 66 ILE HG12 H 1.339 . 2 3017 66 ILE HG13 H 0.97 . 2 654 67 ASN H H 7.141 . 1 655 67 ASN HA H 4.27 . 1 656 67 ASN HB2 H 2.796 . 2 657 67 ASN HB3 H 2.796 . 2 658 67 ASN C C 171.998 . 1 659 67 ASN CA C 52.874 . 1 660 67 ASN CB C 41.891 . 1 661 67 ASN N N 112.344 . 1 662 68 PHE H H 6.40 . 1 663 68 PHE HA H 4.940 . 1 664 68 PHE HB2 H 2.611 . 2 665 68 PHE HB3 H 2.337 . 2 666 68 PHE C C 173.523 . 1 667 68 PHE CA C 56.79 . 1 668 68 PHE CB C 42.357 . 1 669 68 PHE N N 114.298 . 1 3102 68 PHE HD1 H 6.212 . 2 3103 68 PHE HE1 H 6.52 . 2 3105 68 PHE HE2 H 6.52 . 1 3106 68 PHE HD2 H 6.212 . 2 3108 68 PHE CD1 C 131.8 . 2 3109 68 PHE CE1 C 130.3 . 2 3111 68 PHE CE2 C 130.3 . 2 3112 68 PHE CD2 C 131.8 . 2 670 69 LEU H H 9.15 . 1 671 69 LEU HA H 4.815 . 2 672 69 LEU HB2 H 1.612 . 2 673 69 LEU HB3 H 1.364 . 1 674 69 LEU HG H 1.448 . 2 675 69 LEU HD2 H 0.85 . 2 676 69 LEU C C 176.112 . 1 677 69 LEU CA C 53.542 . 1 678 69 LEU CB C 45.689 . 1 679 69 LEU CG C 27.0 . 1 680 69 LEU CD1 C 25.85 . 2 681 69 LEU CD2 C 25.85 . 2 682 69 LEU N N 119.32 . 1 3057 69 LEU HD1 H 0.85 . 2 683 70 TYR H H 8.79 . 1 684 70 TYR HA H 5.01 . 1 685 70 TYR HB2 H 2.96 . 2 686 70 TYR HB3 H 2.327 . 2 687 70 TYR CA C 54.420 . 1 688 70 TYR CB C 37.2 . 1 689 70 TYR N N 121.9 . 1 3186 70 TYR HD1 H 6.619 . 2 3187 70 TYR HE1 H 6.069 . 2 3188 70 TYR HD2 H 6.619 . 2 3189 70 TYR HE2 H 6.069 . 2 3191 70 TYR CD1 C 131.32 . 2 3192 70 TYR CD2 C 131.32 . 2 3193 70 TYR CE1 C 117 . 2 3194 70 TYR CE2 C 117 . 2 696 72 ASP HA H 4.756 . 1 697 72 ASP HB2 H 2.8 . 2 698 72 ASP HB3 H 2.8 . 2 699 72 ASP C C 176.532 . 1 700 72 ASP CA C 54.141 . 1 701 72 ASP CB C 41.19 . 1 703 73 GLY H H 7.812 . 1 704 73 GLY HA2 H 4.296 . 2 705 73 GLY HA3 H 3.92 . 2 706 73 GLY C C 173.284 . 1 707 73 GLY CA C 46.12 . 1 708 73 GLY N N 106.396 . 1 9 74 ASP H H 7.689 . 1 710 74 ASP HA H 4.849 . 1 711 74 ASP HB2 H 2.786 . 2 712 74 ASP HB3 H 2.434 . 2 713 74 ASP C C 175.359 . 1 714 74 ASP CA C 52.880 . 1 715 74 ASP CB C 43.442 . 1 716 74 ASP N N 119.728 . 1 717 75 PHE H H 8.343 . 1 718 75 PHE HB2 H 2.550 . 2 719 75 PHE HB3 H 2.04 . 2 720 75 PHE CA C 59.267 . 1 721 75 PHE CB C 34.7 . 1 722 75 PHE N N 125.786 . 1 3113 75 PHE HD1 H 6.6 . 2 3114 75 PHE HE1 H 7.09 . 2 3116 75 PHE HE2 H 7.09 . 1 3117 75 PHE HD2 H 6.6 . 2 3119 75 PHE CD1 C 132.9 . 2 3120 75 PHE CE1 C 131.8 . 2 3122 75 PHE CE2 C 131.8 . 2 3123 75 PHE CD2 C 132.9 . 2 723 76 GLY H H 7.439 . 1 724 76 GLY HA2 H 3.371 . 2 725 76 GLY HA3 H 3.22 . 2 726 76 GLY C C 176.492 . 1 727 76 GLY CA C 46.674 . 1 728 76 GLY N N 110.87 . 1 729 77 SER H H 7.893 . 1 730 77 SER HA H 4.050 . 1 731 77 SER HB2 H 3.876 . 2 732 77 SER HB3 H 3.876 . 2 733 77 SER C C 176.482 . 1 734 77 SER CA C 60.766 . 1 735 77 SER CB C 62.53 . 1 736 77 SER N N 117.851 . 1 737 78 ALA H H 7.38 . 1 738 78 ALA HA H 4.33 . 1 739 78 ALA HB H 1.682 . 1 740 78 ALA CA C 55.141 . 1 741 78 ALA CB C 19.771 . 1 742 78 ALA N N 124.8 . 1 2000 78 ALA C C 180.172 . 1 743 79 ASN H H 8.471 . 1 744 79 ASN HA H 4.63 . 1 746 79 ASN HB2 H 2.775 . 2 747 79 ASN HB3 H 2.775 . 2 748 79 ASN C C 177.640 . 1 749 79 ASN CA C 55.078 . 1 750 79 ASN CB C 38.271 . 1 751 79 ASN N N 116.675 . 1 752 80 LYS H H 8.042 . 1 753 80 LYS HA H 4.184 . 1 754 80 LYS HB2 H 1.86 . 2 755 80 LYS HB3 H 1.86 . 2 756 80 LYS CA C 59.07 . 1 757 80 LYS CB C 32.65 . 1 758 80 LYS CG C 25.0 . 1 759 80 LYS CD C 29.5 . 1 760 80 LYS CE C 42.145 . 1 761 80 LYS N N 120.911 . 1 3039 80 LYS HG2 H 1.449 . 2 3040 80 LYS HG3 H 1.364 . 2 3041 80 LYS HD2 H 1.6 . 2 3042 80 LYS HD3 H 1.6 . 2 3043 80 LYS C C 177.367 . 1 762 81 ASN H H 7.640 . 1 763 81 ASN HA H 4.850 . 1 764 81 ASN HB2 H 2.9 . 2 765 81 ASN HB3 H 2.9 . 2 766 81 ASN C C 176.702 . 1 767 81 ASN CA C 53.275 . 1 768 81 ASN CB C 40.2 . 1 769 81 ASN N N 112.6 . 1 770 82 GLY H H 8.551 . 1 771 82 GLY HA2 H 3.89 . 2 772 82 GLY HA3 H 3.70 . 2 773 82 GLY C C 173.372 . 1 774 82 GLY CA C 48.35 . 1 775 82 GLY N N 113.307 . 1 776 83 THR H H 7.963 . 1 777 83 THR HA H 5.564 . 1 778 83 THR HB H 4.028 . 1 779 83 THR HG2 H 1.162 . 1 780 83 THR CA C 60.303 . 1 781 83 THR CB C 72.127 . 1 782 83 THR CG2 C 22.276 . 1 783 83 THR N N 111.624 . 1 784 84 LEU H H 8.6 . 1 785 84 LEU HA H 4.774 . 1 786 84 LEU HB2 H 1.47 . 2 787 84 LEU HB3 H 1.47 . 2 789 84 LEU HD1 H 0.863 . 2 790 84 LEU HD2 H 0.365 . 2 791 84 LEU C C 175.300 . 1 792 84 LEU CA C 53.876 . 1 793 84 LEU CB C 49.9 . 1 795 84 LEU CD1 C 25.5 . 2 796 84 LEU CD2 C 25.5 . 2 797 84 LEU N N 118.084 . 1 798 85 LYS H H 8.893 . 1 799 85 LYS HA H 5.287 . 1 800 85 LYS HB2 H 1.615 . 2 801 85 LYS HB3 H 1.543 . 2 802 85 LYS HG2 H 1.3 . 2 803 85 LYS HG3 H 1.3 . 2 804 85 LYS HD2 H 1.66 . 2 805 85 LYS HD3 H 1.66 . 2 806 85 LYS C C 174.616 . 1 807 85 LYS CA C 55.324 . 1 808 85 LYS CB C 34.906 . 1 809 85 LYS CG C 26.279 . 1 810 85 LYS CD C 30.134 . 1 811 85 LYS CE C 42.060 . 1 812 85 LYS N N 117.951 . 1 813 86 LEU H H 9.397 . 1 814 86 LEU HA H 4.348 . 1 815 86 LEU HB2 H 1.67 . 2 816 86 LEU HB3 H 1.29 . 2 817 86 LEU HG H 0.84 . 1 818 86 LEU HD1 H 1.021 . 2 819 86 LEU C C 175.209 . 1 820 86 LEU CA C 54.659 . 1 821 86 LEU CB C 43.640 . 1 822 86 LEU CG C 26.7 . 1 823 86 LEU CD1 C 24.75 . 2 824 86 LEU N N 125.172 . 1 3227 86 LEU HD2 H 1.021 . 2 3229 86 LEU CD2 C 24.75 . 2 825 87 SER H H 7.899 . 1 826 87 SER HA H 4.795 . 1 827 87 SER HB2 H 3.7 . 2 828 87 SER HB3 H 3.32 . 2 829 87 SER C C 173.321 . 1 830 87 SER CA C 56.856 . 1 831 87 SER CB C 62.763 . 1 832 87 SER N N 117.129 . 1 833 88 LEU H H 9.163 . 1 834 88 LEU HA H 5.102 . 1 835 88 LEU HB2 H 1.95 . 2 836 88 LEU HB3 H 1.062 . 2 837 88 LEU HG H 1.66 . 1 838 88 LEU HD1 H 0.482 . 2 839 88 LEU HD2 H 0.482 . 2 840 88 LEU C C 176.161 . 1 841 88 LEU CA C 53.199 . 1 842 88 LEU CB C 44.140 . 1 843 88 LEU CG C 26.640 . 1 844 88 LEU CD1 C 24.99 . 2 845 88 LEU CD2 C 24.99 . 2 846 88 LEU N N 125.681 . 1 847 89 MET H H 8.987 . 1 848 89 MET HA H 4.573 . 1 849 89 MET HB2 H 1.91 . 2 850 89 MET HB3 H 1.64 . 2 852 89 MET C C 174.325 . 1 853 89 MET CA C 55.175 . 1 854 89 MET CB C 35.95 . 1 855 89 MET CG C 31.899 . 1 856 89 MET N N 123.211 . 1 857 90 LEU H H 9.377 . 1 858 90 LEU HA H 5.332 . 1 859 90 LEU HB2 H 1.92 . 2 860 90 LEU HB3 H 1.92 . 2 861 90 LEU HG H 0.745 . 1 862 90 LEU HD1 H 0.78 . 2 863 90 LEU HD2 H 0.78 . 2 864 90 LEU C C 175.073 . 1 865 90 LEU CA C 52.282 . 1 866 90 LEU CB C 42.525 . 1 867 90 LEU CG C 27.24 . 1 868 90 LEU CD1 C 26.0 . 2 869 90 LEU CD2 C 26.0 . 2 870 90 LEU N N 129.861 . 1 871 91 THR H H 8.862 . 1 872 91 THR HA H 4.902 . 1 873 91 THR HB H 3.884 . 1 874 91 THR C C 173.788 . 1 875 91 THR CA C 62.358 . 1 876 91 THR CB C 70.071 . 1 877 91 THR CG2 C 20.401 . 1 878 91 THR N N 119.062 . 1 2044 91 THR HG2 H 0.864 . 1 879 92 ASP H H 8.762 . 1 880 92 ASP HA H 4.380 . 1 881 92 ASP HB2 H 2.774 . 2 882 92 ASP HB3 H 1.025 . 2 883 92 ASP C C 176.864 . 1 884 92 ASP CA C 53.264 . 1 885 92 ASP CB C 40.00 . 1 886 92 ASP N N 126.719 . 1 887 93 LYS H H 7.785 . 1 888 93 LYS HA H 3.942 . 1 889 93 LYS HB2 H 1.920 . 2 890 93 LYS HB3 H 1.439 . 2 891 93 LYS HG2 H 1.31 . 2 892 93 LYS HG3 H 1.31 . 2 893 93 LYS CA C 58.889 . 1 894 93 LYS CB C 32.179 . 1 895 93 LYS CG C 25.99 . 1 896 93 LYS CD C 29.300 . 1 897 93 LYS CE C 41.879 . 1 898 93 LYS N N 125.071 . 1 3044 93 LYS HD2 H 1.56 . 2 3045 93 LYS HD3 H 1.56 . 2 3046 93 LYS C C 177.77 . 1 899 94 LYS H H 8.571 . 1 900 94 LYS HA H 4.190 . 1 901 94 LYS HB2 H 1.948 . 2 902 94 LYS HB3 H 1.805 . 2 903 94 LYS HD2 H 1.724 . 2 904 94 LYS C C 177.809 . 1 905 94 LYS CA C 58.452 . 1 906 94 LYS CB C 32.2 . 1 907 94 LYS CG C 25.386 . 1 908 94 LYS CD C 28.914 . 1 909 94 LYS CE C 42.142 . 1 910 94 LYS N N 118.112 . 1 3047 94 LYS HG2 H 1.549 . 2 3048 94 LYS HG3 H 1.428 . 2 3049 94 LYS HD3 H 1.724 . 2 911 95 ASN H H 7.18 . 1 912 95 ASN HA H 4.774 . 1 913 95 ASN HB2 H 2.655 . 2 914 95 ASN HB3 H 2.655 . 2 915 95 ASN C C 174.838 . 1 916 95 ASN CA C 52.545 . 1 917 95 ASN CB C 39.515 . 1 918 95 ASN N N 113.292 . 1 2031 95 ASN HD21 H 8.08 . 2 2032 95 ASN HD22 H 6.76 . 2 2033 95 ASN ND2 N 114.5 . 1 919 96 ASN H H 8.297 . 1 920 96 ASN HA H 4.15 . 1 921 96 ASN HB2 H 3.0 . 2 922 96 ASN HB3 H 2.711 . 2 923 96 ASN C C 173.719 . 1 924 96 ASN CA C 54.560 . 1 925 96 ASN CB C 37.273 . 1 926 96 ASN N N 117.305 . 1 2034 96 ASN HD21 H 7.48 . 2 2035 96 ASN HD22 H 6.72 . 2 2036 96 ASN ND2 N 112.4 . 1 927 97 GLN H H 7.514 . 1 928 97 GLN HA H 4.353 . 1 929 97 GLN HB2 H 1.787 . 2 930 97 GLN HB3 H 1.787 . 2 931 97 GLN C C 173.811 . 1 932 97 GLN CA C 55.249 . 1 933 97 GLN CB C 31.069 . 1 934 97 GLN CG C 33.750 . 1 935 97 GLN N N 117.381 . 1 2081 97 GLN HG3 H 2.114 . 2 2082 97 GLN HE21 H 7.29 . 2 2083 97 GLN HE22 H 6.81 . 2 2084 97 GLN NE2 N 112.5 . 1 2085 97 GLN HG2 H 2.114 . 2 936 98 VAL H H 8.001 . 1 937 98 VAL HB H 1.606 . 1 938 98 VAL HG1 H 0.783 . 2 939 98 VAL HG2 H 0.522 . 2 940 98 VAL C C 174.717 . 1 941 98 VAL CA C 61.473 . 1 942 98 VAL CB C 33.921 . 1 943 98 VAL CG1 C 21.387 . 2 944 98 VAL CG2 C 21.387 . 2 945 98 VAL N N 122.101 . 1 2046 98 VAL HA H 4.66 . 1 946 99 TYR H H 9.187 . 1 947 99 TYR HA H 4.659 . 1 948 99 TYR HB2 H 3.083 . 2 949 99 TYR HB3 H 2.65 . 2 950 99 TYR C C 173.193 . 1 951 99 TYR CA C 56.279 . 1 952 99 TYR CB C 42.427 . 1 953 99 TYR N N 125.768 . 1 3196 99 TYR HD1 H 7.099 . 2 3198 99 TYR HD2 H 7.099 . 2 3201 99 TYR CD1 C 133.64 . 2 3202 99 TYR CD2 C 133.64 . 2 954 100 TYR H H 8.741 . 1 955 100 TYR HA H 5.384 . 1 956 100 TYR HB2 H 3.089 . 2 957 100 TYR HB3 H 2.659 . 2 958 100 TYR CA C 57.331 . 1 959 100 TYR CB C 40.810 . 1 960 100 TYR N N 119.952 . 1 3206 100 TYR HD1 H 7.09 . 2 3207 100 TYR HE1 H 6.61 . 2 3208 100 TYR HD2 H 7.09 . 2 3209 100 TYR HE2 H 6.61 . 2 3211 100 TYR CD1 C 133.43 . 2 3212 100 TYR CD2 C 133.43 . 2 3213 100 TYR CE1 C 117.6 . 2 3214 100 TYR CE2 C 117.6 . 2 961 101 LYS H H 8.284 . 1 962 101 LYS HA H 4.629 . 1 963 101 LYS HB2 H 1.645 . 2 964 101 LYS HB3 H 1.527 . 2 965 101 LYS HD3 H 1.48 . 2 966 101 LYS C C 172.991 . 1 967 101 LYS CA C 55.252 . 1 968 101 LYS CB C 38.041 . 1 969 101 LYS CG C 25.210 . 1 970 101 LYS CD C 29.6 . 1 971 101 LYS CE C 42.447 . 1 972 101 LYS N N 122.148 . 1 3050 101 LYS HD2 H 1.48 . 2 3051 101 LYS HG2 H 1.403 . 2 3052 101 LYS HG3 H 1.213 . 2 973 102 LEU H H 8.698 . 1 974 102 LEU HA H 5.282 . 1 975 102 LEU HB2 H 1.724 . 2 976 102 LEU HB3 H 1.393 . 2 977 102 LEU HG H 1.667 . 1 978 102 LEU HD1 H 0.848 . 2 979 102 LEU C C 176.024 . 1 980 102 LEU CA C 54.025 . 1 981 102 LEU CB C 43.601 . 1 982 102 LEU CG C 27.287 . 1 983 102 LEU CD1 C 24.98 . 2 984 102 LEU CD2 C 24.98 . 2 985 102 LEU N N 127.349 . 1 3003 102 LEU HD2 H 0.848 . 2 986 103 LEU H H 9.120 . 1 987 103 LEU HA H 4.831 . 1 988 103 LEU HB2 H 1.923 . 2 989 103 LEU HB3 H 1.258 . 2 991 103 LEU HD2 H 1.092 . 2 992 103 LEU C C 175.163 . 1 993 103 LEU CA C 53.664 . 1 994 103 LEU CB C 46.915 . 1 995 103 LEU CG C 27.189 . 1 996 103 LEU CD1 C 25.802 . 2 997 103 LEU CD2 C 24.38 . 2 998 103 LEU N N 126.377 . 1 3004 103 LEU HG H 1.65 . 1 999 104 GLU H H 9.190 . 1 1000 104 GLU HA H 4.818 . 1 1001 104 GLU HB2 H 2.154 . 2 1002 104 GLU HB3 H 1.934 . 2 1003 104 GLU HG3 H 2.144 . 2 1004 104 GLU C C 175.348 . 1 1005 104 GLU CA C 56.889 . 1 1006 104 GLU CB C 30.830 . 1 1007 104 GLU CG C 36.1 . 1 1008 104 GLU N N 129.120 . 1 2040 104 GLU HG2 H 2.198 . 2 1009 105 VAL H H 9.155 . 1 1010 105 VAL HA H 4.661 . 1 1011 105 VAL HB H 2.270 . 1 1012 105 VAL HG1 H 1.040 . 2 1013 105 VAL HG2 H 1.098 . 2 1014 105 VAL C C 173.666 . 1 1015 105 VAL CA C 61.2 . 1 1016 105 VAL CB C 35.188 . 1 1017 105 VAL CG1 C 23.089 . 2 1018 105 VAL CG2 C 22.024 . 2 1019 105 VAL N N 125.360 . 1 1020 106 SER H H 8.329 . 1 1021 106 SER HA H 5.485 . 1 1022 106 SER HB2 H 4.024 . 2 1023 106 SER HB3 H 3.921 . 2 1024 106 SER C C 173.761 . 1 1025 106 SER CA C 56.202 . 1 1026 106 SER CB C 65.074 . 1 1027 106 SER N N 119.446 . 1 1028 107 GLY H H 8.570 . 1 1029 107 GLY HA2 H 4.074 . 2 1030 107 GLY HA3 H 3.661 . 2 1031 107 GLY C C 175.736 . 1 1032 107 GLY CA C 45.048 . 1 1033 107 GLY N N 106.829 . 1 1034 108 PHE H H 7.936 . 1 1035 108 PHE HA H 4.735 . 1 1036 108 PHE HB2 H 2.33 . 2 1037 108 PHE HB3 H 2.33 . 2 1038 108 PHE C C 174.304 . 1 1039 108 PHE CA C 57.93 . 1 1040 108 PHE CB C 38.1 . 1 1041 108 PHE N N 119.405 . 1 3124 108 PHE HD1 H 7.52 . 2 3125 108 PHE HE1 H 7.20 . 2 3127 108 PHE HE2 H 7.20 . 2 3128 108 PHE HD2 H 7.52 . 2 3130 108 PHE CD1 C 132.5 . 2 3131 108 PHE CE1 C 131 . 2 3133 108 PHE CE2 C 131 . 2 3134 108 PHE CD2 C 132.5 . 2 1042 109 LYS H H 8.085 . 1 1043 109 LYS HA H 3.942 . 1 1044 109 LYS HB2 H 1.378 . 2 1045 109 LYS HB3 H 1.227 . 2 1046 109 LYS C C 173.732 . 1 1047 109 LYS CA C 58.476 . 1 1048 109 LYS CB C 32.82 . 1 1049 109 LYS CG C 25.5 . 1 1050 109 LYS CD C 30.107 . 1 1051 109 LYS CE C 42.466 . 1 1052 109 LYS N N 123.188 . 1 3053 109 LYS HG2 H 1.54 . 2 3054 109 LYS HG3 H 1.35 . 2 3055 109 LYS HD2 H 1.58 . 2 3056 109 LYS HD3 H 1.495 . 2 1053 110 SER H H 7.785 . 1 1054 110 SER HA H 5.328 . 1 1055 110 SER HB2 H 3.825 . 2 1056 110 SER HB3 H 3.414 . 2 1057 110 SER C C 174.890 . 1 1058 110 SER CA C 55.63 . 1 1059 110 SER CB C 66.584 . 1 1060 110 SER N N 114.467 . 1 1061 111 ASN H H 8.217 . 1 1062 111 ASN HA H 5.102 . 1 1063 111 ASN HB2 H 2.763 . 2 1064 111 ASN HB3 H 2.572 . 2 1065 111 ASN CA C 50.26 . 1 1066 111 ASN CB C 39.6 . 1 1067 111 ASN N N 118.303 . 1 2037 111 ASN HD21 H 7.66 . 2 2038 111 ASN HD22 H 7.006 . 2 2039 111 ASN ND2 N 111.7 . 1 1068 112 PRO HA H 4.416 . 1 1069 112 PRO HB2 H 2.197 . 2 1070 112 PRO HB3 H 1.688 . 2 1071 112 PRO HD2 H 3.7 . 2 1072 112 PRO HD3 H 3.7 . 2 1073 112 PRO C C 176.425 . 1 1074 112 PRO CA C 63.49 . 1 1075 112 PRO CB C 32.042 . 1 1076 112 PRO CG C 26.7 . 1 1077 112 PRO CD C 50.7 . 1 2095 112 PRO HG2 H 1.938 . 2 2096 112 PRO HG3 H 1.639 . 2 1078 113 TYR H H 7.92 . 1 1079 113 TYR HA H 4.57 . 1 1080 113 TYR HB2 H 3.098 . 2 1081 113 TYR HB3 H 2.912 . 2 1082 113 TYR C C 175.468 . 1 1083 113 TYR CA C 57.56 . 1 1084 113 TYR CB C 38.416 . 1 1085 113 TYR N N 119.04 . 1 3216 113 TYR HD1 H 7.104 . 2 3217 113 TYR HE1 H 6.81 . 2 3218 113 TYR HD2 H 7.104 . 2 3219 113 TYR HE2 H 6.81 . 2 3221 113 TYR CD1 C 133.1 . 2 3222 113 TYR CD2 C 133.1 . 2 3223 113 TYR CE1 C 118.1 . 2 3224 113 TYR CE2 C 118.1 . 2 1086 114 LEU H H 7.874 . 1 1087 114 LEU HA H 4.245 . 1 1088 114 LEU HB2 H 1.494 . 2 1089 114 LEU HB3 H 1.494 . 2 1090 114 LEU HG H 1.492 . 1 1091 114 LEU HD1 H 0.89 . 2 1092 114 LEU HD2 H 0.83 . 2 1093 114 LEU C C 176.586 . 1 1094 114 LEU CA C 55.206 . 1 1095 114 LEU CB C 42.537 . 1 1096 114 LEU CG C 26.85 . 1 1097 114 LEU CD1 C 25.0 . 2 1098 114 LEU CD2 C 23.85 . 2 1099 114 LEU N N 123.619 . 1 1100 115 GLU H H 8.281 . 1 1101 115 GLU HA H 4.171 . 1 1102 115 GLU HB2 H 1.907 . 2 1103 115 GLU HB3 H 1.845 . 2 1104 115 GLU HG2 H 2.197 . 2 1105 115 GLU C C 176.023 . 1 1106 115 GLU CA C 56.495 . 1 1107 115 GLU CB C 30.46 . 1 1108 115 GLU CG C 36.133 . 1 1109 115 GLU N N 122.028 . 1 2041 115 GLU HG3 H 2.141 . 2 1110 116 HIS H H 8.3 . 1 1111 116 HIS HA H 4.602 . 1 1112 116 HIS HB2 H 3.0 . 2 1113 116 HIS HB3 H 3.0 . 2 1115 116 HIS CA C 55.98 . 1 1116 116 HIS CB C 30.24 . 1 1117 116 HIS N N 120.05 . 1 1118 117 HIS H H 8.13 . 1 1120 117 HIS HB2 H 3.189 . 2 1121 117 HIS HB3 H 3.06 . 2 1122 117 HIS CA C 57.74 . 1 1123 117 HIS CB C 30.36 . 1 1124 117 HIS N N 125.4 . 1 cwd: /data/PSVS/PSVS-v1.4-dev/results/UUR17A_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/UUR17A_R3_em_bcr3/rpf_calc/input/ctrl_file -o rpf_calc -q UUR17A_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: UUR17A_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: UUR17A_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: UUR17A_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: UUR17A_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: UUR17A_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: UUR17A_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: UUR17A_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: UUR17A_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: UUR17A_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: UUR17A_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: UUR17A_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: UUR17A_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: UUR17A_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: UUR17A_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: UUR17A_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: UUR17A_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: UUR17A_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: UUR17A_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: UUR17A_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: UUR17A_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 ...