AS object created. control filepath is: /data/PSVS/PSVS-v1.4-dev/results/CCR55_R3_em_bcr3/rpf_calc/input/ctrl_file bmrb: chem_shift.bmrb sequence: CCR55_R3_em_bcr3_seq.bmrb parsing bmrb: /data/PSVS/PSVS-v1.4-dev/results/CCR55_R3_em_bcr3/rpf_calc/input/chem_shift.bmrb new residue 1 adding: *1* *1* *Met* *HB2* *H* *2.652* *.* *2* old residue 1 adding: *2* *1* *Met* *HB3* *H* *2.574* *.* *2* old residue 1 adding: *3* *1* *Met* *HG2* *H* *2.163* *.* *2* old residue 1 adding: *4* *1* *Met* *HG3* *H* *2.132* *.* *2* old residue 1 adding: *5* *1* *Met* *HE* *H* *2.062* *.* *1* old residue 1 adding: *6* *1* *Met* *CA* *C* *55.065* *.* *1* old residue 1 adding: *7* *1* *Met* *CB* *C* *31.572* *.* *1* old residue 1 adding: *8* *1* *Met* *CG* *C* *33.129* *.* *1* old residue 1 adding: *9* *1* *Met* *CE* *C* *17.175* *.* *1* new residue 2 adding: *10* *2* *Thr* *HA* *H* *3.833* *.* *1* old residue 2 adding: *11* *2* *Thr* *HB* *H* *4.294* *.* *1* old residue 2 adding: *12* *2* *Thr* *HG2* *H* *1.377* *.* *1* old residue 2 adding: *13* *2* *Thr* *C* *C* *170.665* *.* *1* old residue 2 adding: *14* *2* *Thr* *CA* *C* *62.154* *.* *1* old residue 2 adding: *15* *2* *Thr* *CB* *C* *69.580* *.* *1* old residue 2 adding: *16* *2* *Thr* *CG2* *C* *20.909* *.* *1* new residue 3 adding: *17* *3* *Leu* *H* *H* *9.068* *.* *1* old residue 3 adding: *18* *3* *Leu* *HA* *H* *4.887* *.* *1* old residue 3 adding: *19* *3* *Leu* *HB2* *H* *1.767* *.* *2* old residue 3 adding: *20* *3* *Leu* *HB3* *H* *0.762* *.* *2* old residue 3 adding: *21* *3* *Leu* *HG* *H* *1.619* *.* *1* old residue 3 adding: *22* *3* *Leu* *HD1* *H* *0.840* *.* *1* old residue 3 adding: *23* *3* *Leu* *HD2* *H* *0.619* *.* *1* old residue 3 adding: *24* *3* *Leu* *C* *C* *175.859* *.* *1* old residue 3 adding: *25* *3* *Leu* *CA* *C* *54.426* *.* *1* old residue 3 adding: *26* *3* *Leu* *CB* *C* *43.222* *.* *1* old residue 3 adding: *27* *3* *Leu* *CG* *C* *26.616* *.* *1* old residue 3 adding: *28* *3* *Leu* *CD1* *C* *25.928* *.* *1* old residue 3 adding: *29* *3* *Leu* *CD2* *C* *23.342* *.* *1* old residue 3 adding: *30* *3* *Leu* *N* *N* *129.030* *.* *1* new residue 4 adding: *31* *4* *Ile* *H* *H* *8.897* *.* *1* old residue 4 adding: *32* *4* *Ile* *HA* *H* *4.753* *.* *1* old residue 4 adding: *33* *4* *Ile* *HB* *H* *1.680* *.* *1* old residue 4 adding: *34* *4* *Ile* *HG12* *H* *1.090* *.* *2* old residue 4 adding: *35* *4* *Ile* *HG13* *H* *1.091* *.* *2* old residue 4 adding: *36* *4* *Ile* *HG2* *H* *0.927* *.* *1* old residue 4 adding: *37* *4* *Ile* *HD1* *H* *0.555* *.* *1* old residue 4 adding: *38* *4* *Ile* *C* *C* *174.211* *.* *1* old residue 4 adding: *39* *4* *Ile* *CA* *C* *59.998* *.* *1* old residue 4 adding: *40* *4* *Ile* *CB* *C* *41.129* *.* *1* old residue 4 adding: *41* *4* *Ile* *CG1* *C* *24.360* *.* *1* old residue 4 adding: *42* *4* *Ile* *CG2* *C* *18.723* *.* *1* old residue 4 adding: *43* *4* *Ile* *CD1* *C* *15.918* *.* *1* old residue 4 adding: *44* *4* *Ile* *N* *N* *115.702* *.* *1* new residue 5 adding: *45* *5* *Tyr* *H* *H* *9.050* *.* *1* old residue 5 adding: *46* *5* *Tyr* *HA* *H* *5.770* *.* *1* old residue 5 adding: *47* *5* *Tyr* *HB2* *H* *2.823* *.* *2* old residue 5 adding: *48* *5* *Tyr* *HB3* *H* *2.413* *.* *2* old residue 5 adding: *49* *5* *Tyr* *HD1* *H* *6.852* *.* *1* old residue 5 adding: *50* *5* *Tyr* *HD2* *H* *6.852* *.* *1* old residue 5 adding: *51* *5* *Tyr* *HE1* *H* *6.583* *.* *1* old residue 5 adding: *52* *5* *Tyr* *HE2* *H* *6.583* *.* *1* old residue 5 adding: *53* *5* *Tyr* *C* *C* *175.987* *.* *1* old residue 5 adding: *54* *5* *Tyr* *CA* *C* *57.923* *.* *1* old residue 5 adding: *55* *5* *Tyr* *CB* *C* *42.963* *.* *1* old residue 5 adding: *56* *5* *Tyr* *CD1* *C* *132.618* *.* *1* old residue 5 adding: *57* *5* *Tyr* *CD2* *C* *132.618* *.* *1* old residue 5 adding: *58* *5* *Tyr* *CE1* *C* *117.633* *.* *1* old residue 5 adding: *59* *5* *Tyr* *CE2* *C* *117.633* *.* *1* old residue 5 adding: *60* *5* *Tyr* *N* *N* *114.414* *.* *1* new residue 6 adding: *61* *6* *Lys* *H* *H* *8.858* *.* *1* old residue 6 adding: *62* *6* *Lys* *HA* *H* *4.813* *.* *1* old residue 6 adding: *63* *6* *Lys* *HB2* *H* *1.623* *.* *2* old residue 6 adding: *64* *6* *Lys* *HB3* *H* *1.463* *.* *2* old residue 6 adding: *65* *6* *Lys* *HG2* *H* *1.086* *.* *2* old residue 6 adding: *66* *6* *Lys* *HG3* *H* *1.014* *.* *2* old residue 6 adding: *67* *6* *Lys* *HD2* *H* *2.438* *.* *2* old residue 6 adding: *68* *6* *Lys* *HD3* *H* *1.743* *.* *2* old residue 6 adding: *69* *6* *Lys* *HE2* *H* *3.264* *.* *2* old residue 6 adding: *70* *6* *Lys* *HE3* *H* *3.095* *.* *2* old residue 6 adding: *71* *6* *Lys* *C* *C* *172.801* *.* *1* old residue 6 adding: *72* *6* *Lys* *CA* *C* *52.969* *.* *1* old residue 6 adding: *73* *6* *Lys* *CB* *C* *37.109* *.* *1* old residue 6 adding: *74* *6* *Lys* *CG* *C* *24.694* *.* *1* old residue 6 adding: *75* *6* *Lys* *CD* *C* *29.490* *.* *1* old residue 6 adding: *76* *6* *Lys* *CE* *C* *41.732* *.* *1* old residue 6 adding: *77* *6* *Lys* *N* *N* *121.597* *.* *1* new residue 7 adding: *78* *7* *Ile* *H* *H* *8.277* *.* *1* old residue 7 adding: *79* *7* *Ile* *HA* *H* *4.702* *.* *1* old residue 7 adding: *80* *7* *Ile* *HB* *H* *0.918* *.* *1* old residue 7 adding: *81* *7* *Ile* *HG12* *H* *1.379* *.* *2* old residue 7 adding: *82* *7* *Ile* *HG13* *H* *0.488* *.* *2* old residue 7 adding: *83* *7* *Ile* *HG2* *H* *-0.165* *.* *1* old residue 7 adding: *84* *7* *Ile* *HD1* *H* *0.619* *.* *1* old residue 7 adding: *85* *7* *Ile* *C* *C* *173.742* *.* *1* old residue 7 adding: *86* *7* *Ile* *CA* *C* *60.340* *.* *1* old residue 7 adding: *87* *7* *Ile* *CB* *C* *38.941* *.* *1* old residue 7 adding: *88* *7* *Ile* *CG1* *C* *28.802* *.* *1* old residue 7 adding: *89* *7* *Ile* *CG2* *C* *18.147* *.* *1* old residue 7 adding: *90* *7* *Ile* *CD1* *C* *14.670* *.* *1* old residue 7 adding: *91* *7* *Ile* *N* *N* *128.212* *.* *1* new residue 8 adding: *92* *8* *Leu* *H* *H* *8.627* *.* *1* old residue 8 adding: *93* *8* *Leu* *HA* *H* *4.757* *.* *1* old residue 8 adding: *94* *8* *Leu* *HB2* *H* *1.753* *.* *2* old residue 8 adding: *95* *8* *Leu* *HB3* *H* *1.324* *.* *2* old residue 8 adding: *96* *8* *Leu* *HG* *H* *1.681* *.* *1* old residue 8 adding: *97* *8* *Leu* *HD1* *H* *0.144* *.* *1* old residue 8 adding: *98* *8* *Leu* *HD2* *H* *0.241* *.* *1* old residue 8 adding: *99* *8* *Leu* *C* *C* *173.661* *.* *1* old residue 8 adding: *100* *8* *Leu* *CA* *C* *54.530* *.* *1* old residue 8 adding: *101* *8* *Leu* *CB* *C* *43.617* *.* *1* old residue 8 adding: *102* *8* *Leu* *CG* *C* *26.824* *.* *1* old residue 8 adding: *103* *8* *Leu* *CD1* *C* *26.781* *.* *1* old residue 8 adding: *104* *8* *Leu* *CD2* *C* *25.495* *.* *1* old residue 8 adding: *105* *8* *Leu* *N* *N* *126.590* *.* *1* new residue 9 adding: *106* *9* *Ser* *H* *H* *8.546* *.* *1* old residue 9 adding: *107* *9* *Ser* *HA* *H* *4.765* *.* *1* old residue 9 adding: *108* *9* *Ser* *HB2* *H* *4.503* *.* *2* old residue 9 adding: *109* *9* *Ser* *HB3* *H* *4.151* *.* *2* old residue 9 adding: *110* *9* *Ser* *C* *C* *175.160* *.* *1* old residue 9 adding: *111* *9* *Ser* *CA* *C* *58.520* *.* *1* old residue 9 adding: *112* *9* *Ser* *CB* *C* *65.227* *.* *1* old residue 9 adding: *113* *9* *Ser* *N* *N* *115.543* *.* *1* new residue 10 adding: *114* *10* *Arg* *H* *H* *9.080* *.* *1* old residue 10 adding: *115* *10* *Arg* *HA* *H* *4.037* *.* *1* old residue 10 adding: *116* *10* *Arg* *HB2* *H* *2.079* *.* *2* old residue 10 adding: *117* *10* *Arg* *HB3* *H* *1.932* *.* *2* old residue 10 adding: *118* *10* *Arg* *HG2* *H* *1.836* *.* *2* old residue 10 adding: *119* *10* *Arg* *HG3* *H* *1.655* *.* *2* old residue 10 adding: *120* *10* *Arg* *HD2* *H* *3.366* *.* *2* old residue 10 adding: *121* *10* *Arg* *HD3* *H* *3.265* *.* *2* old residue 10 adding: *122* *10* *Arg* *HE* *H* *7.334* *.* *1* old residue 10 adding: *123* *10* *Arg* *C* *C* *177.847* *.* *1* old residue 10 adding: *124* *10* *Arg* *CA* *C* *59.210* *.* *1* old residue 10 adding: *125* *10* *Arg* *CB* *C* *28.776* *.* *1* old residue 10 adding: *126* *10* *Arg* *CG* *C* *25.745* *.* *1* old residue 10 adding: *127* *10* *Arg* *CD* *C* *42.632* *.* *1* old residue 10 adding: *128* *10* *Arg* *N* *N* *123.688* *.* *1* old residue 10 adding: *129* *10* *Arg* *NE* *N* *83.512* *.* *1* new residue 11 adding: *130* *11* *Ala* *H* *H* *8.753* *.* *1* old residue 11 adding: *131* *11* *Ala* *HA* *H* *4.248* *.* *1* old residue 11 adding: *132* *11* *Ala* *HB* *H* *1.488* *.* *1* old residue 11 adding: *133* *11* *Ala* *C* *C* *181.848* *.* *1* old residue 11 adding: *134* *11* *Ala* *CA* *C* *55.483* *.* *1* old residue 11 adding: *135* *11* *Ala* *CB* *C* *18.209* *.* *1* old residue 11 adding: *136* *11* *Ala* *N* *N* *119.698* *.* *1* new residue 12 adding: *137* *12* *Glu* *H* *H* *7.957* *.* *1* old residue 12 adding: *138* *12* *Glu* *HA* *H* *4.183* *.* *1* old residue 12 adding: *139* *12* *Glu* *HB2* *H* *2.466* *.* *2* old residue 12 adding: *140* *12* *Glu* *HB3* *H* *2.173* *.* *2* old residue 12 adding: *141* *12* *Glu* *HG2* *H* *2.479* *.* *2* old residue 12 adding: *142* *12* *Glu* *HG3* *H* *2.434* *.* *2* old residue 12 adding: *143* *12* *Glu* *C* *C* *179.576* *.* *1* old residue 12 adding: *144* *12* *Glu* *CA* *C* *59.103* *.* *1* old residue 12 adding: *145* *12* *Glu* *CB* *C* *31.077* *.* *1* old residue 12 adding: *146* *12* *Glu* *CG* *C* *37.995* *.* *1* old residue 12 adding: *147* *12* *Glu* *N* *N* *118.210* *.* *1* new residue 13 adding: *148* *13* *Trp* *H* *H* *8.585* *.* *1* old residue 13 adding: *149* *13* *Trp* *HA* *H* *4.937* *.* *1* old residue 13 adding: *150* *13* *Trp* *HB2* *H* *3.195* *.* *2* old residue 13 adding: *151* *13* *Trp* *HB3* *H* *2.955* *.* *2* old residue 13 adding: *152* *13* *Trp* *HD1* *H* *7.029* *.* *1* old residue 13 adding: *153* *13* *Trp* *HE1* *H* *10.406* *.* *1* old residue 13 adding: *154* *13* *Trp* *HE3* *H* *7.137* *.* *1* old residue 13 adding: *155* *13* *Trp* *HZ2* *H* *7.336* *.* *1* old residue 13 adding: *156* *13* *Trp* *HZ3* *H* *6.474* *.* *1* old residue 13 adding: *157* *13* *Trp* *HH2* *H* *6.924* *.* *1* old residue 13 adding: *158* *13* *Trp* *C* *C* *176.827* *.* *1* old residue 13 adding: *159* *13* *Trp* *CA* *C* *57.845* *.* *1* old residue 13 adding: *160* *13* *Trp* *CB* *C* *31.010* *.* *1* old residue 13 adding: *161* *13* *Trp* *CD1* *C* *126.972* *.* *1* old residue 13 adding: *162* *13* *Trp* *CE3* *C* *122.786* *.* *1* old residue 13 adding: *163* *13* *Trp* *CZ2* *C* *114.514* *.* *1* old residue 13 adding: *164* *13* *Trp* *CZ3* *C* *119.949* *.* *1* old residue 13 adding: *165* *13* *Trp* *CH2* *C* *124.353* *.* *1* old residue 13 adding: *166* *13* *Trp* *N* *N* *123.646* *.* *1* old residue 13 adding: *167* *13* *Trp* *NE1* *N* *129.669* *.* *1* new residue 14 adding: *168* *14* *Asp* *H* *H* *9.260* *.* *1* old residue 14 adding: *169* *14* *Asp* *HA* *H* *4.048* *.* *1* old residue 14 adding: *170* *14* *Asp* *HB2* *H* *2.657* *.* *2* old residue 14 adding: *171* *14* *Asp* *HB3* *H* *2.479* *.* *2* old residue 14 adding: *172* *14* *Asp* *C* *C* *180.120* *.* *1* old residue 14 adding: *173* *14* *Asp* *CA* *C* *57.767* *.* *1* old residue 14 adding: *174* *14* *Asp* *CB* *C* *39.467* *.* *1* old residue 14 adding: *175* *14* *Asp* *N* *N* *120.253* *.* *1* new residue 15 adding: *176* *15* *Ala* *H* *H* *7.599* *.* *1* old residue 15 adding: *177* *15* *Ala* *HA* *H* *4.163* *.* *1* old residue 15 adding: *178* *15* *Ala* *HB* *H* *1.540* *.* *1* old residue 15 adding: *179* *15* *Ala* *C* *C* *180.115* *.* *1* old residue 15 adding: *180* *15* *Ala* *CA* *C* *55.016* *.* *1* old residue 15 adding: *181* *15* *Ala* *CB* *C* *17.871* *.* *1* old residue 15 adding: *182* *15* *Ala* *N* *N* *122.164* *.* *1* new residue 16 adding: *183* *16* *Ala* *H* *H* *7.944* *.* *1* old residue 16 adding: *184* *16* *Ala* *HA* *H* *4.334* *.* *1* old residue 16 adding: *185* *16* *Ala* *HB* *H* *1.585* *.* *1* old residue 16 adding: *186* *16* *Ala* *C* *C* *180.101* *.* *1* old residue 16 adding: *187* *16* *Ala* *CA* *C* *54.659* *.* *1* old residue 16 adding: *188* *16* *Ala* *CB* *C* *19.107* *.* *1* old residue 16 adding: *189* *16* *Ala* *N* *N* *122.526* *.* *1* new residue 17 adding: *190* *17* *Lys* *H* *H* *8.317* *.* *1* old residue 17 adding: *191* *17* *Lys* *HA* *H* *3.462* *.* *1* old residue 17 adding: *192* *17* *Lys* *HB2* *H* *1.387* *.* *2* old residue 17 adding: *193* *17* *Lys* *HB3* *H* *1.353* *.* *2* old residue 17 adding: *194* *17* *Lys* *HG2* *H* *0.439* *.* *2* old residue 17 adding: *195* *17* *Lys* *HG3* *H* *0.234* *.* *2* old residue 17 adding: *196* *17* *Lys* *HD2* *H* *1.233* *.* *2* old residue 17 adding: *197* *17* *Lys* *HD3* *H* *1.197* *.* *2* old residue 17 adding: *198* *17* *Lys* *HE2* *H* *2.515* *.* *2* old residue 17 adding: *199* *17* *Lys* *HE3* *H* *2.327* *.* *2* old residue 17 adding: *200* *17* *Lys* *C* *C* *179.126* *.* *1* old residue 17 adding: *201* *17* *Lys* *CA* *C* *60.077* *.* *1* old residue 17 adding: *202* *17* *Lys* *CB* *C* *31.431* *.* *1* old residue 17 adding: *203* *17* *Lys* *CG* *C* *25.304* *.* *1* old residue 17 adding: *204* *17* *Lys* *CD* *C* *29.171* *.* *1* old residue 17 adding: *205* *17* *Lys* *CE* *C* *41.493* *.* *1* old residue 17 adding: *206* *17* *Lys* *N* *N* *117.572* *.* *1* new residue 18 adding: *207* *18* *Ala* *H* *H* *7.296* *.* *1* old residue 18 adding: *208* *18* *Ala* *HA* *H* *4.100* *.* *1* old residue 18 adding: *209* *18* *Ala* *HB* *H* *1.474* *.* *1* old residue 18 adding: *210* *18* *Ala* *C* *C* *178.940* *.* *1* old residue 18 adding: *211* *18* *Ala* *CA* *C* *54.513* *.* *1* old residue 18 adding: *212* *18* *Ala* *CB* *C* *18.132* *.* *1* old residue 18 adding: *213* *18* *Ala* *N* *N* *119.644* *.* *1* new residue 19 adding: *214* *19* *Gln* *H* *H* *7.443* *.* *1* old residue 19 adding: *215* *19* *Gln* *HA* *H* *4.535* *.* *1* old residue 19 adding: *216* *19* *Gln* *HB2* *H* *2.256* *.* *2* old residue 19 adding: *217* *19* *Gln* *HB3* *H* *2.256* *.* *2* old residue 19 adding: *218* *19* *Gln* *HG2* *H* *2.670* *.* *2* old residue 19 adding: *219* *19* *Gln* *HG3* *H* *2.515* *.* *2* old residue 19 adding: *220* *19* *Gln* *HE21* *H* *7.411* *.* *1* old residue 19 adding: *221* *19* *Gln* *HE22* *H* *6.959* *.* *1* old residue 19 adding: *222* *19* *Gln* *C* *C* *176.607* *.* *1* old residue 19 adding: *223* *19* *Gln* *CA* *C* *55.755* *.* *1* old residue 19 adding: *224* *19* *Gln* *CB* *C* *30.075* *.* *1* old residue 19 adding: *225* *19* *Gln* *CG* *C* *33.449* *.* *1* old residue 19 adding: *226* *19* *Gln* *CD* *C* *179.803* *.* *1* old residue 19 adding: *227* *19* *Gln* *N* *N* *113.538* *.* *1* old residue 19 adding: *228* *19* *Gln* *NE2* *N* *111.095* *.* *1* new residue 20 adding: *229* *20* *Gly* *H* *H* *8.277* *.* *1* old residue 20 adding: *230* *20* *Gly* *HA2* *H* *4.450* *.* *2* old residue 20 adding: *231* *20* *Gly* *HA3* *H* *3.627* *.* *2* old residue 20 adding: *232* *20* *Gly* *C* *C* *174.006* *.* *1* old residue 20 adding: *233* *20* *Gly* *CA* *C* *45.567* *.* *1* old residue 20 adding: *234* *20* *Gly* *N* *N* *108.233* *.* *1* new residue 21 adding: *235* *21* *Arg* *H* *H* *7.786* *.* *1* old residue 21 adding: *236* *21* *Arg* *HA* *H* *5.123* *.* *1* old residue 21 adding: *237* *21* *Arg* *HB2* *H* *1.987* *.* *2* old residue 21 adding: *238* *21* *Arg* *HB3* *H* *1.397* *.* *2* old residue 21 adding: *239* *21* *Arg* *HG2* *H* *1.493* *.* *2* old residue 21 adding: *240* *21* *Arg* *HG3* *H* *1.222* *.* *2* old residue 21 adding: *241* *21* *Arg* *HD2* *H* *3.051* *.* *2* old residue 21 adding: *242* *21* *Arg* *HD3* *H* *2.901* *.* *2* old residue 21 adding: *243* *21* *Arg* *HE* *H* *7.607* *.* *1* old residue 21 adding: *244* *21* *Arg* *C* *C* *171.553* *.* *1* old residue 21 adding: *245* *21* *Arg* *CA* *C* *54.882* *.* *1* old residue 21 adding: *246* *21* *Arg* *CB* *C* *32.114* *.* *1* old residue 21 adding: *247* *21* *Arg* *CG* *C* *25.655* *.* *1* old residue 21 adding: *248* *21* *Arg* *CD* *C* *43.481* *.* *1* old residue 21 adding: *249* *21* *Arg* *N* *N* *116.837* *.* *1* old residue 21 adding: *250* *21* *Arg* *NE* *N* *84.131* *.* *1* new residue 22 adding: *251* *22* *Phe* *H* *H* *9.821* *.* *1* old residue 22 adding: *252* *22* *Phe* *HA* *H* *5.185* *.* *1* old residue 22 adding: *253* *22* *Phe* *HB2* *H* *3.033* *.* *2* old residue 22 adding: *254* *22* *Phe* *HB3* *H* *3.033* *.* *2* old residue 22 adding: *255* *22* *Phe* *HD1* *H* *7.292* *.* *1* old residue 22 adding: *256* *22* *Phe* *HD2* *H* *7.292* *.* *1* old residue 22 adding: *257* *22* *Phe* *C* *C* *173.825* *.* *1* old residue 22 adding: *258* *22* *Phe* *CA* *C* *54.913* *.* *1* old residue 22 adding: *259* *22* *Phe* *CB* *C* *41.568* *.* *1* old residue 22 adding: *260* *22* *Phe* *CD1* *C* *131.421* *.* *1* old residue 22 adding: *261* *22* *Phe* *CD2* *C* *131.421* *.* *1* old residue 22 adding: *262* *22* *Phe* *N* *N* *121.680* *.* *1* new residue 23 adding: *263* *23* *Glu* *H* *H* *9.053* *.* *1* old residue 23 adding: *264* *23* *Glu* *HA* *H* *3.893* *.* *1* old residue 23 adding: *265* *23* *Glu* *HB2* *H* *1.990* *.* *2* old residue 23 adding: *266* *23* *Glu* *HB3* *H* *1.812* *.* *2* old residue 23 adding: *267* *23* *Glu* *HG2* *H* *2.117* *.* *2* old residue 23 adding: *268* *23* *Glu* *HG3* *H* *1.904* *.* *2* old residue 23 adding: *269* *23* *Glu* *C* *C* *174.856* *.* *1* old residue 23 adding: *270* *23* *Glu* *CA* *C* *56.781* *.* *1* old residue 23 adding: *271* *23* *Glu* *CB* *C* *29.990* *.* *1* old residue 23 adding: *272* *23* *Glu* *CG* *C* *37.296* *.* *1* old residue 23 adding: *273* *23* *Glu* *N* *N* *125.059* *.* *1* new residue 24 adding: *274* *24* *Gly* *HA2* *H* *4.212* *.* *2* old residue 24 adding: *275* *24* *Gly* *HA3* *H* *3.112* *.* *2* old residue 24 adding: *276* *24* *Gly* *C* *C* *173.311* *.* *1* old residue 24 adding: *277* *24* *Gly* *CA* *C* *45.104* *.* *1* new residue 25 adding: *278* *25* *Ser* *H* *H* *9.877* *.* *1* old residue 25 adding: *279* *25* *Ser* *HA* *H* *4.884* *.* *1* old residue 25 adding: *280* *25* *Ser* *HB2* *H* *4.324* *.* *2* old residue 25 adding: *281* *25* *Ser* *HB3* *H* *4.324* *.* *2* old residue 25 adding: *282* *25* *Ser* *C* *C* *173.788* *.* *1* old residue 25 adding: *283* *25* *Ser* *CA* *C* *57.549* *.* *1* old residue 25 adding: *284* *25* *Ser* *CB* *C* *65.383* *.* *1* old residue 25 adding: *285* *25* *Ser* *N* *N* *121.073* *.* *1* new residue 26 adding: *286* *26* *Ala* *H* *H* *9.097* *.* *1* old residue 26 adding: *287* *26* *Ala* *HA* *H* *3.964* *.* *1* old residue 26 adding: *288* *26* *Ala* *HB* *H* *1.443* *.* *1* old residue 26 adding: *289* *26* *Ala* *C* *C* *181.102* *.* *1* old residue 26 adding: *290* *26* *Ala* *CA* *C* *56.670* *.* *1* old residue 26 adding: *291* *26* *Ala* *CB* *C* *17.927* *.* *1* old residue 26 adding: *292* *26* *Ala* *N* *N* *123.398* *.* *1* new residue 27 adding: *293* *27* *Val* *H* *H* *7.928* *.* *1* old residue 27 adding: *294* *27* *Val* *HA* *H* *3.593* *.* *1* old residue 27 adding: *295* *27* *Val* *HB* *H* *1.590* *.* *1* old residue 27 adding: *296* *27* *Val* *HG1* *H* *0.429* *.* *1* old residue 27 adding: *297* *27* *Val* *HG2* *H* *0.669* *.* *1* old residue 27 adding: *298* *27* *Val* *C* *C* *176.628* *.* *1* old residue 27 adding: *299* *27* *Val* *CA* *C* *65.257* *.* *1* old residue 27 adding: *300* *27* *Val* *CB* *C* *31.688* *.* *1* old residue 27 adding: *301* *27* *Val* *CG1* *C* *20.439* *.* *1* old residue 27 adding: *302* *27* *Val* *CG2* *C* *21.878* *.* *1* old residue 27 adding: *303* *27* *Val* *N* *N* *117.697* *.* *1* new residue 28 adding: *304* *28* *Asp* *H* *H* *6.927* *.* *1* old residue 28 adding: *305* *28* *Asp* *HA* *H* *4.512* *.* *1* old residue 28 adding: *306* *28* *Asp* *HB2* *H* *2.925* *.* *2* old residue 28 adding: *307* *28* *Asp* *HB3* *H* *2.658* *.* *2* old residue 28 adding: *308* *28* *Asp* *C* *C* *178.402* *.* *1* old residue 28 adding: *309* *28* *Asp* *CA* *C* *56.586* *.* *1* old residue 28 adding: *310* *28* *Asp* *CB* *C* *41.317* *.* *1* old residue 28 adding: *311* *28* *Asp* *N* *N* *121.516* *.* *1* new residue 29 adding: *312* *29* *Leu* *H* *H* *8.309* *.* *1* old residue 29 adding: *313* *29* *Leu* *HA* *H* *3.764* *.* *1* old residue 29 adding: *314* *29* *Leu* *HB2* *H* *1.597* *.* *2* old residue 29 adding: *315* *29* *Leu* *HB3* *H* *1.283* *.* *2* old residue 29 adding: *316* *29* *Leu* *HG* *H* *1.391* *.* *1* old residue 29 adding: *317* *29* *Leu* *HD1* *H* *0.627* *.* *2* old residue 29 adding: *318* *29* *Leu* *HD2* *H* *0.565* *.* *2* old residue 29 adding: *319* *29* *Leu* *C* *C* *180.093* *.* *1* old residue 29 adding: *320* *29* *Leu* *CA* *C* *57.091* *.* *1* old residue 29 adding: *321* *29* *Leu* *CB* *C* *41.418* *.* *1* old residue 29 adding: *322* *29* *Leu* *CG* *C* *26.923* *.* *1* old residue 29 adding: *323* *29* *Leu* *CD1* *C* *25.153* *.* *2* old residue 29 adding: *324* *29* *Leu* *CD2* *C* *22.333* *.* *2* old residue 29 adding: *325* *29* *Leu* *N* *N* *118.648* *.* *1* new residue 30 adding: *326* *30* *Ala* *H* *H* *7.458* *.* *1* old residue 30 adding: *327* *30* *Ala* *HA* *H* *4.000* *.* *1* old residue 30 adding: *328* *30* *Ala* *HB* *H* *1.356* *.* *1* old residue 30 adding: *329* *30* *Ala* *C* *C* *179.371* *.* *1* old residue 30 adding: *330* *30* *Ala* *CA* *C* *54.526* *.* *1* old residue 30 adding: *331* *30* *Ala* *CB* *C* *18.102* *.* *1* old residue 30 adding: *332* *30* *Ala* *N* *N* *120.814* *.* *1* new residue 31 adding: *333* *31* *Asp* *H* *H* *7.682* *.* *1* old residue 31 adding: *334* *31* *Asp* *HA* *H* *4.410* *.* *1* old residue 31 adding: *335* *31* *Asp* *HB2* *H* *1.854* *.* *2* old residue 31 adding: *336* *31* *Asp* *HB3* *H* *1.854* *.* *2* old residue 31 adding: *337* *31* *Asp* *C* *C* *176.610* *.* *1* old residue 31 adding: *338* *31* *Asp* *CA* *C* *55.271* *.* *1* old residue 31 adding: *339* *31* *Asp* *CB* *C* *40.083* *.* *1* old residue 31 adding: *340* *31* *Asp* *N* *N* *117.191* *.* *1* new residue 32 adding: *341* *32* *Gly* *H* *H* *7.909* *.* *1* old residue 32 adding: *342* *32* *Gly* *HA2* *H* *4.090* *.* *2* old residue 32 adding: *343* *32* *Gly* *HA3* *H* *3.597* *.* *2* old residue 32 adding: *344* *32* *Gly* *C* *C* *173.168* *.* *1* old residue 32 adding: *345* *32* *Gly* *CA* *C* *45.112* *.* *1* old residue 32 adding: *346* *32* *Gly* *N* *N* *106.983* *.* *1* new residue 33 adding: *347* *33* *Phe* *H* *H* *7.233* *.* *1* old residue 33 adding: *348* *33* *Phe* *HA* *H* *4.212* *.* *1* old residue 33 adding: *349* *33* *Phe* *HB2* *H* *1.837* *.* *2* old residue 33 adding: *350* *33* *Phe* *HB3* *H* *1.454* *.* *2* old residue 33 adding: *351* *33* *Phe* *HD1* *H* *5.987* *.* *1* old residue 33 adding: *352* *33* *Phe* *HD2* *H* *5.987* *.* *1* old residue 33 adding: *353* *33* *Phe* *HE1* *H* *5.587* *.* *1* old residue 33 adding: *354* *33* *Phe* *HE2* *H* *5.587* *.* *1* old residue 33 adding: *355* *33* *Phe* *HZ* *H* *6.544* *.* *1* old residue 33 adding: *356* *33* *Phe* *C* *C* *171.389* *.* *1* old residue 33 adding: *357* *33* *Phe* *CA* *C* *55.383* *.* *1* old residue 33 adding: *358* *33* *Phe* *CB* *C* *37.177* *.* *1* old residue 33 adding: *359* *33* *Phe* *CD1* *C* *132.280* *.* *1* old residue 33 adding: *360* *33* *Phe* *CD2* *C* *132.280* *.* *1* old residue 33 adding: *361* *33* *Phe* *CE1* *C* *128.773* *.* *1* old residue 33 adding: *362* *33* *Phe* *CE2* *C* *128.773* *.* *1* old residue 33 adding: *363* *33* *Phe* *CZ* *C* *127.426* *.* *1* old residue 33 adding: *364* *33* *Phe* *N* *N* *115.364* *.* *1* new residue 34 adding: *365* *34* *Ile* *H* *H* *8.637* *.* *1* old residue 34 adding: *366* *34* *Ile* *HA* *H* *3.817* *.* *1* old residue 34 adding: *367* *34* *Ile* *HB* *H* *1.874* *.* *1* old residue 34 adding: *368* *34* *Ile* *HG12* *H* *1.632* *.* *2* old residue 34 adding: *369* *34* *Ile* *HG13* *H* *0.582* *.* *2* old residue 34 adding: *370* *34* *Ile* *HG2* *H* *0.901* *.* *1* old residue 34 adding: *371* *34* *Ile* *HD1* *H* *0.818* *.* *1* old residue 34 adding: *372* *34* *Ile* *C* *C* *177.018* *.* *1* old residue 34 adding: *373* *34* *Ile* *CA* *C* *60.724* *.* *1* old residue 34 adding: *374* *34* *Ile* *CB* *C* *39.266* *.* *1* old residue 34 adding: *375* *34* *Ile* *CG1* *C* *28.859* *.* *1* old residue 34 adding: *376* *34* *Ile* *CG2* *C* *17.198* *.* *1* old residue 34 adding: *377* *34* *Ile* *CD1* *C* *14.167* *.* *1* old residue 34 adding: *378* *34* *Ile* *N* *N* *114.086* *.* *1* new residue 35 adding: *379* *35* *His* *H* *H* *9.203* *.* *1* old residue 35 adding: *380* *35* *His* *HA* *H* *4.448* *.* *1* old residue 35 adding: *381* *35* *His* *HB2* *H* *3.362* *.* *2* old residue 35 adding: *382* *35* *His* *HB3* *H* *3.163* *.* *2* old residue 35 adding: *383* *35* *His* *HD2* *H* *7.457* *.* *1* old residue 35 adding: *384* *35* *His* *C* *C* *175.740* *.* *1* old residue 35 adding: *385* *35* *His* *CA* *C* *57.757* *.* *1* old residue 35 adding: *386* *35* *His* *CB* *C* *29.758* *.* *1* old residue 35 adding: *387* *35* *His* *CD2* *C* *120.404* *.* *1* old residue 35 adding: *388* *35* *His* *N* *N* *127.988* *.* *1* new residue 36 adding: *389* *36* *Leu* *H* *H* *8.454* *.* *1* old residue 36 adding: *390* *36* *Leu* *HA* *H* *5.190* *.* *1* old residue 36 adding: *391* *36* *Leu* *HB2* *H* *1.645* *.* *2* old residue 36 adding: *392* *36* *Leu* *HB3* *H* *1.550* *.* *2* old residue 36 adding: *393* *36* *Leu* *HG* *H* *1.612* *.* *1* old residue 36 adding: *394* *36* *Leu* *HD1* *H* *0.726* *.* *1* old residue 36 adding: *395* *36* *Leu* *HD2* *H* *0.670* *.* *1* old residue 36 adding: *396* *36* *Leu* *C* *C* *174.813* *.* *1* old residue 36 adding: *397* *36* *Leu* *CA* *C* *56.019* *.* *1* old residue 36 adding: *398* *36* *Leu* *CB* *C* *44.541* *.* *1* old residue 36 adding: *399* *36* *Leu* *CG* *C* *28.502* *.* *1* old residue 36 adding: *400* *36* *Leu* *CD1* *C* *27.876* *.* *1* old residue 36 adding: *401* *36* *Leu* *CD2* *C* *26.016* *.* *1* old residue 36 adding: *402* *36* *Leu* *N* *N* *126.075* *.* *1* new residue 37 adding: *403* *37* *Ser* *H* *H* *9.128* *.* *1* old residue 37 adding: *404* *37* *Ser* *HA* *H* *5.277* *.* *1* old residue 37 adding: *405* *37* *Ser* *HB2* *H* *3.966* *.* *2* old residue 37 adding: *406* *37* *Ser* *HB3* *H* *3.640* *.* *2* old residue 37 adding: *407* *37* *Ser* *C* *C* *174.433* *.* *1* old residue 37 adding: *408* *37* *Ser* *CA* *C* *57.990* *.* *1* old residue 37 adding: *409* *37* *Ser* *CB* *C* *66.778* *.* *1* old residue 37 adding: *410* *37* *Ser* *N* *N* *112.795* *.* *1* new residue 38 adding: *411* *38* *Ala* *H* *H* *9.665* *.* *1* old residue 38 adding: *412* *38* *Ala* *HA* *H* *4.973* *.* *1* old residue 38 adding: *413* *38* *Ala* *HB* *H* *1.785* *.* *1* old residue 38 adding: *414* *38* *Ala* *C* *C* *179.640* *.* *1* old residue 38 adding: *415* *38* *Ala* *CA* *C* *52.303* *.* *1* old residue 38 adding: *416* *38* *Ala* *CB* *C* *19.350* *.* *1* old residue 38 adding: *417* *38* *Ala* *N* *N* *127.103* *.* *1* new residue 39 adding: *418* *39* *Gly* *H* *H* *10.159* *.* *1* old residue 39 adding: *419* *39* *Gly* *HA2* *H* *4.249* *.* *2* old residue 39 adding: *420* *39* *Gly* *HA3* *H* *3.720* *.* *2* old residue 39 adding: *421* *39* *Gly* *C* *C* *176.229* *.* *1* old residue 39 adding: *422* *39* *Gly* *CA* *C* *49.163* *.* *1* old residue 39 adding: *423* *39* *Gly* *N* *N* *112.007* *.* *1* new residue 40 adding: *424* *40* *Glu* *H* *H* *9.367* *.* *1* old residue 40 adding: *425* *40* *Glu* *HA* *H* *4.234* *.* *1* old residue 40 adding: *426* *40* *Glu* *HB2* *H* *2.118* *.* *2* old residue 40 adding: *427* *40* *Glu* *HB3* *H* *2.118* *.* *2* old residue 40 adding: *428* *40* *Glu* *HG2* *H* *2.347* *.* *2* old residue 40 adding: *429* *40* *Glu* *HG3* *H* *2.347* *.* *2* old residue 40 adding: *430* *40* *Glu* *C* *C* *176.417* *.* *1* old residue 40 adding: *431* *40* *Glu* *CA* *C* *58.622* *.* *1* old residue 40 adding: *432* *40* *Glu* *CB* *C* *28.796* *.* *1* old residue 40 adding: *433* *40* *Glu* *CG* *C* *36.464* *.* *1* old residue 40 adding: *434* *40* *Glu* *N* *N* *117.243* *.* *1* new residue 41 adding: *435* *41* *Gln* *H* *H* *7.503* *.* *1* old residue 41 adding: *436* *41* *Gln* *HA* *H* *4.752* *.* *1* old residue 41 adding: *437* *41* *Gln* *HB2* *H* *2.359* *.* *2* old residue 41 adding: *438* *41* *Gln* *HB3* *H* *2.359* *.* *2* old residue 41 adding: *439* *41* *Gln* *HG2* *H* *2.435* *.* *2* old residue 41 adding: *440* *41* *Gln* *HG3* *H* *2.209* *.* *2* old residue 41 adding: *441* *41* *Gln* *HE21* *H* *7.001* *.* *1* old residue 41 adding: *442* *41* *Gln* *HE22* *H* *6.282* *.* *1* old residue 41 adding: *443* *41* *Gln* *C* *C* *177.730* *.* *1* old residue 41 adding: *444* *41* *Gln* *CA* *C* *55.626* *.* *1* old residue 41 adding: *445* *41* *Gln* *CB* *C* *30.653* *.* *1* old residue 41 adding: *446* *41* *Gln* *CG* *C* *33.639* *.* *1* old residue 41 adding: *447* *41* *Gln* *CD* *C* *178.406* *.* *1* old residue 41 adding: *448* *41* *Gln* *N* *N* *115.837* *.* *1* old residue 41 adding: *449* *41* *Gln* *NE2* *N* *110.350* *.* *1* new residue 42 adding: *450* *42* *Ala* *H* *H* *7.519* *.* *1* old residue 42 adding: *451* *42* *Ala* *HA* *H* *3.927* *.* *1* old residue 42 adding: *452* *42* *Ala* *HB* *H* *1.152* *.* *1* old residue 42 adding: *453* *42* *Ala* *C* *C* *177.826* *.* *1* old residue 42 adding: *454* *42* *Ala* *CA* *C* *56.706* *.* *1* old residue 42 adding: *455* *42* *Ala* *CB* *C* *18.247* *.* *1* old residue 42 adding: *456* *42* *Ala* *N* *N* *123.105* *.* *1* new residue 43 adding: *457* *43* *Gln* *H* *H* *9.203* *.* *1* old residue 43 adding: *458* *43* *Gln* *HA* *H* *3.942* *.* *1* old residue 43 adding: *459* *43* *Gln* *HB2* *H* *2.057* *.* *2* old residue 43 adding: *460* *43* *Gln* *HB3* *H* *1.970* *.* *2* old residue 43 adding: *461* *43* *Gln* *HG2* *H* *2.398* *.* *2* old residue 43 adding: *462* *43* *Gln* *HG3* *H* *2.335* *.* *2* old residue 43 adding: *463* *43* *Gln* *HE21* *H* *6.800* *.* *1* old residue 43 adding: *464* *43* *Gln* *HE22* *H* *8.095* *.* *1* old residue 43 adding: *465* *43* *Gln* *C* *C* *177.913* *.* *1* old residue 43 adding: *466* *43* *Gln* *CA* *C* *58.678* *.* *1* old residue 43 adding: *467* *43* *Gln* *CB* *C* *28.815* *.* *1* old residue 43 adding: *468* *43* *Gln* *CG* *C* *33.976* *.* *1* old residue 43 adding: *469* *43* *Gln* *CD* *C* *179.894* *.* *1* old residue 43 adding: *470* *43* *Gln* *N* *N* *118.650* *.* *1* old residue 43 adding: *471* *43* *Gln* *NE2* *N* *115.888* *.* *1* new residue 44 adding: *472* *44* *Glu* *H* *H* *8.611* *.* *1* old residue 44 adding: *473* *44* *Glu* *HA* *H* *4.207* *.* *1* old residue 44 adding: *474* *44* *Glu* *HB2* *H* *2.142* *.* *2* old residue 44 adding: *475* *44* *Glu* *HB3* *H* *2.142* *.* *2* old residue 44 adding: *476* *44* *Glu* *HG2* *H* *2.350* *.* *2* old residue 44 adding: *477* *44* *Glu* *HG3* *H* *2.350* *.* *2* old residue 44 adding: *478* *44* *Glu* *C* *C* *179.090* *.* *1* old residue 44 adding: *479* *44* *Glu* *CA* *C* *59.246* *.* *1* old residue 44 adding: *480* *44* *Glu* *CB* *C* *28.850* *.* *1* old residue 44 adding: *481* *44* *Glu* *CG* *C* *36.457* *.* *1* old residue 44 adding: *482* *44* *Glu* *N* *N* *122.042* *.* *1* new residue 45 adding: *483* *45* *Thr* *H* *H* *8.292* *.* *1* old residue 45 adding: *484* *45* *Thr* *HA* *H* *4.123* *.* *1* old residue 45 adding: *485* *45* *Thr* *HB* *H* *4.505* *.* *1* old residue 45 adding: *486* *45* *Thr* *HG2* *H* *1.499* *.* *1* old residue 45 adding: *487* *45* *Thr* *C* *C* *176.228* *.* *1* old residue 45 adding: *488* *45* *Thr* *CA* *C* *66.902* *.* *1* old residue 45 adding: *489* *45* *Thr* *CB* *C* *68.949* *.* *1* old residue 45 adding: *490* *45* *Thr* *CG2* *C* *22.230* *.* *1* old residue 45 adding: *491* *45* *Thr* *N* *N* *117.583* *.* *1* new residue 46 adding: *492* *46* *Ala* *H* *H* *8.275* *.* *1* old residue 46 adding: *493* *46* *Ala* *HA* *H* *4.255* *.* *1* old residue 46 adding: *494* *46* *Ala* *HB* *H* *1.390* *.* *1* old residue 46 adding: *495* *46* *Ala* *C* *C* *178.630* *.* *1* old residue 46 adding: *496* *46* *Ala* *CA* *C* *55.406* *.* *1* old residue 46 adding: *497* *46* *Ala* *CB* *C* *18.482* *.* *1* old residue 46 adding: *498* *46* *Ala* *N* *N* *123.184* *.* *1* new residue 47 adding: *499* *47* *Ala* *H* *H* *8.066* *.* *1* old residue 47 adding: *500* *47* *Ala* *HA* *H* *3.953* *.* *1* old residue 47 adding: *501* *47* *Ala* *HB* *H* *1.522* *.* *1* old residue 47 adding: *502* *47* *Ala* *C* *C* *178.552* *.* *1* old residue 47 adding: *503* *47* *Ala* *CA* *C* *55.030* *.* *1* old residue 47 adding: *504* *47* *Ala* *CB* *C* *18.899* *.* *1* old residue 47 adding: *505* *47* *Ala* *N* *N* *117.129* *.* *1* new residue 48 adding: *506* *48* *Lys* *H* *H* *8.089* *.* *1* old residue 48 adding: *507* *48* *Lys* *HA* *H* *3.936* *.* *1* old residue 48 adding: *508* *48* *Lys* *HB2* *H* *1.542* *.* *2* old residue 48 adding: *509* *48* *Lys* *HB3* *H* *1.107* *.* *2* old residue 48 adding: *510* *48* *Lys* *HG2* *H* *0.879* *.* *2* old residue 48 adding: *511* *48* *Lys* *HG3* *H* *0.499* *.* *2* old residue 48 adding: *512* *48* *Lys* *HD2* *H* *1.382* *.* *2* old residue 48 adding: *513* *48* *Lys* *HD3* *H* *1.314* *.* *2* old residue 48 adding: *514* *48* *Lys* *HE2* *H* *2.670* *.* *2* old residue 48 adding: *515* *48* *Lys* *HE3* *H* *2.568* *.* *2* old residue 48 adding: *516* *48* *Lys* *C* *C* *179.130* *.* *1* old residue 48 adding: *517* *48* *Lys* *CA* *C* *58.560* *.* *1* old residue 48 adding: *518* *48* *Lys* *CB* *C* *33.122* *.* *1* old residue 48 adding: *519* *48* *Lys* *CG* *C* *24.793* *.* *1* old residue 48 adding: *520* *48* *Lys* *CD* *C* *28.949* *.* *1* old residue 48 adding: *521* *48* *Lys* *CE* *C* *42.070* *.* *1* old residue 48 adding: *522* *48* *Lys* *N* *N* *115.322* *.* *1* new residue 49 adding: *523* *49* *Trp* *H* *H* *7.978* *.* *1* old residue 49 adding: *524* *49* *Trp* *HA* *H* *4.807* *.* *1* old residue 49 adding: *525* *49* *Trp* *HB2* *H* *2.906* *.* *2* old residue 49 adding: *526* *49* *Trp* *HB3* *H* *2.763* *.* *2* old residue 49 adding: *527* *49* *Trp* *HD1* *H* *7.380* *.* *1* old residue 49 adding: *528* *49* *Trp* *HE1* *H* *10.234* *.* *1* old residue 49 adding: *529* *49* *Trp* *HE3* *H* *7.633* *.* *1* old residue 49 adding: *530* *49* *Trp* *HZ2* *H* *7.408* *.* *1* old residue 49 adding: *531* *49* *Trp* *HZ3* *H* *7.083* *.* *1* old residue 49 adding: *532* *49* *Trp* *HH2* *H* *7.117* *.* *1* old residue 49 adding: *533* *49* *Trp* *C* *C* *176.923* *.* *1* old residue 49 adding: *534* *49* *Trp* *CA* *C* *57.157* *.* *1* old residue 49 adding: *535* *49* *Trp* *CB* *C* *31.461* *.* *1* old residue 49 adding: *536* *49* *Trp* *CD1* *C* *127.545* *.* *1* old residue 49 adding: *537* *49* *Trp* *CE3* *C* *121.17* *.* *1* old residue 49 adding: *538* *49* *Trp* *CZ2* *C* *114.540* *.* *1* old residue 49 adding: *539* *49* *Trp* *CZ3* *C* *121.98* *.* *1* old residue 49 adding: *540* *49* *Trp* *CH2* *C* *124.694* *.* *1* old residue 49 adding: *541* *49* *Trp* *N* *N* *114.492* *.* *1* old residue 49 adding: *542* *49* *Trp* *NE1* *N* *128.679* *.* *1* new residue 50 adding: *543* *50* *Phe* *H* *H* *7.740* *.* *1* old residue 50 adding: *544* *50* *Phe* *HA* *H* *4.925* *.* *1* old residue 50 adding: *545* *50* *Phe* *HB2* *H* *3.676* *.* *2* old residue 50 adding: *546* *50* *Phe* *HB3* *H* *2.930* *.* *2* old residue 50 adding: *547* *50* *Phe* *HD1* *H* *7.286* *.* *1* old residue 50 adding: *548* *50* *Phe* *HD2* *H* *7.286* *.* *1* old residue 50 adding: *549* *50* *Phe* *HZ* *H* *7.345* *.* *1* old residue 50 adding: *550* *50* *Phe* *C* *C* *174.160* *.* *1* old residue 50 adding: *551* *50* *Phe* *CA* *C* *57.772* *.* *1* old residue 50 adding: *552* *50* *Phe* *CB* *C* *39.610* *.* *1* old residue 50 adding: *553* *50* *Phe* *CD1* *C* *132.511* *.* *1* old residue 50 adding: *554* *50* *Phe* *CD2* *C* *132.511* *.* *1* old residue 50 adding: *555* *50* *Phe* *CZ* *C* *130.44* *.* *1* old residue 50 adding: *556* *50* *Phe* *N* *N* *116.540* *.* *1* new residue 51 adding: *557* *51* *Arg* *H* *H* *7.389* *.* *1* old residue 51 adding: *558* *51* *Arg* *HA* *H* *4.198* *.* *1* old residue 51 adding: *559* *51* *Arg* *HB2* *H* *2.027* *.* *2* old residue 51 adding: *560* *51* *Arg* *HB3* *H* *1.771* *.* *2* old residue 51 adding: *561* *51* *Arg* *HG2* *H* *1.545* *.* *2* old residue 51 adding: *562* *51* *Arg* *HG3* *H* *1.545* *.* *2* old residue 51 adding: *563* *51* *Arg* *HD2* *H* *3.212* *.* *2* old residue 51 adding: *564* *51* *Arg* *HD3* *H* *3.212* *.* *2* old residue 51 adding: *565* *51* *Arg* *HE* *H* *7.237* *.* *1* old residue 51 adding: *566* *51* *Arg* *C* *C* *179.130* *.* *1* old residue 51 adding: *567* *51* *Arg* *CA* *C* *58.224* *.* *1* old residue 51 adding: *568* *51* *Arg* *CB* *C* *30.032* *.* *1* old residue 51 adding: *569* *51* *Arg* *CG* *C* *27.926* *.* *1* old residue 51 adding: *570* *51* *Arg* *CD* *C* *43.448* *.* *1* old residue 51 adding: *571* *51* *Arg* *N* *N* *119.136* *.* *1* old residue 51 adding: *572* *51* *Arg* *NE* *N* *83.671* *.* *1* new residue 52 adding: *573* *52* *Gly* *H* *H* *10.264* *.* *1* old residue 52 adding: *574* *52* *Gly* *HA2* *H* *4.180* *.* *2* old residue 52 adding: *575* *52* *Gly* *HA3* *H* *3.745* *.* *2* old residue 52 adding: *576* *52* *Gly* *C* *C* *173.980* *.* *1* old residue 52 adding: *577* *52* *Gly* *CA* *C* *45.517* *.* *1* old residue 52 adding: *578* *52* *Gly* *N* *N* *114.192* *.* *1* new residue 53 adding: *579* *53* *Gln* *H* *H* *7.597* *.* *1* old residue 53 adding: *580* *53* *Gln* *HA* *H* *4.437* *.* *1* old residue 53 adding: *581* *53* *Gln* *HB2* *H* *2.257* *.* *2* old residue 53 adding: *582* *53* *Gln* *HB3* *H* *2.185* *.* *2* old residue 53 adding: *583* *53* *Gln* *HG2* *H* *2.321* *.* *2* old residue 53 adding: *584* *53* *Gln* *HG3* *H* *2.321* *.* *2* old residue 53 adding: *585* *53* *Gln* *HE21* *H* *7.888* *.* *1* old residue 53 adding: *586* *53* *Gln* *HE22* *H* *6.650* *.* *1* old residue 53 adding: *587* *53* *Gln* *C* *C* *172.934* *.* *1* old residue 53 adding: *588* *53* *Gln* *CA* *C* *56.280* *.* *1* old residue 53 adding: *589* *53* *Gln* *CB* *C* *29.123* *.* *1* old residue 53 adding: *590* *53* *Gln* *CG* *C* *33.921* *.* *1* old residue 53 adding: *591* *53* *Gln* *CD* *C* *179.642* *.* *1* old residue 53 adding: *592* *53* *Gln* *N* *N* *120.438* *.* *1* old residue 53 adding: *593* *53* *Gln* *NE2* *N* *112.642* *.* *1* new residue 54 adding: *594* *54* *Ala* *H* *H* *8.190* *.* *1* old residue 54 adding: *595* *54* *Ala* *HA* *H* *4.344* *.* *1* old residue 54 adding: *596* *54* *Ala* *HB* *H* *1.426* *.* *1* old residue 54 adding: *597* *54* *Ala* *C* *C* *177.278* *.* *1* old residue 54 adding: *598* *54* *Ala* *CA* *C* *51.377* *.* *1* old residue 54 adding: *599* *54* *Ala* *CB* *C* *20.525* *.* *1* old residue 54 adding: *600* *54* *Ala* *N* *N* *124.528* *.* *1* new residue 55 adding: *601* *55* *Asn* *H* *H* *8.903* *.* *1* old residue 55 adding: *602* *55* *Asn* *HA* *H* *4.598* *.* *1* old residue 55 adding: *603* *55* *Asn* *HB2* *H* *3.022* *.* *2* old residue 55 adding: *604* *55* *Asn* *HB3* *H* *2.973* *.* *2* old residue 55 adding: *605* *55* *Asn* *HD21* *H* *7.781* *.* *1* old residue 55 adding: *606* *55* *Asn* *HD22* *H* *7.038* *.* *1* old residue 55 adding: *607* *55* *Asn* *C* *C* *174.075* *.* *1* old residue 55 adding: *608* *55* *Asn* *CA* *C* *53.986* *.* *1* old residue 55 adding: *609* *55* *Asn* *CB* *C* *37.654* *.* *1* old residue 55 adding: *610* *55* *Asn* *CG* *C* *178.754* *.* *1* old residue 55 adding: *611* *55* *Asn* *N* *N* *113.776* *.* *1* old residue 55 adding: *612* *55* *Asn* *ND2* *N* *114.312* *.* *1* new residue 56 adding: *613* *56* *Leu* *H* *H* *8.543* *.* *1* old residue 56 adding: *614* *56* *Leu* *HA* *H* *4.677* *.* *1* old residue 56 adding: *615* *56* *Leu* *HB2* *H* *1.848* *.* *2* old residue 56 adding: *616* *56* *Leu* *HB3* *H* *0.961* *.* *2* old residue 56 adding: *617* *56* *Leu* *HG* *H* *1.542* *.* *1* old residue 56 adding: *618* *56* *Leu* *HD1* *H* *0.865* *.* *1* old residue 56 adding: *619* *56* *Leu* *HD2* *H* *0.668* *.* *1* old residue 56 adding: *620* *56* *Leu* *C* *C* *176.806* *.* *1* old residue 56 adding: *621* *56* *Leu* *CA* *C* *54.383* *.* *1* old residue 56 adding: *622* *56* *Leu* *CB* *C* *45.328* *.* *1* old residue 56 adding: *623* *56* *Leu* *CG* *C* *25.890* *.* *1* old residue 56 adding: *624* *56* *Leu* *CD1* *C* *27.756* *.* *1* old residue 56 adding: *625* *56* *Leu* *CD2* *C* *21.881* *.* *1* old residue 56 adding: *626* *56* *Leu* *N* *N* *117.411* *.* *1* new residue 57 adding: *627* *57* *Val* *H* *H* *9.207* *.* *1* old residue 57 adding: *628* *57* *Val* *HA* *H* *4.633* *.* *1* old residue 57 adding: *629* *57* *Val* *HB* *H* *1.504* *.* *1* old residue 57 adding: *630* *57* *Val* *HG1* *H* *0.410* *.* *1* old residue 57 adding: *631* *57* *Val* *HG2* *H* *0.754* *.* *1* old residue 57 adding: *632* *57* *Val* *C* *C* *172.465* *.* *1* old residue 57 adding: *633* *57* *Val* *CA* *C* *59.970* *.* *1* old residue 57 adding: *634* *57* *Val* *CB* *C* *35.376* *.* *1* old residue 57 adding: *635* *57* *Val* *CG1* *C* *21.245* *.* *1* old residue 57 adding: *636* *57* *Val* *CG2* *C* *21.284* *.* *1* old residue 57 adding: *637* *57* *Val* *N* *N* *121.448* *.* *1* new residue 58 adding: *638* *58* *Leu* *H* *H* *8.855* *.* *1* old residue 58 adding: *639* *58* *Leu* *HA* *H* *4.763* *.* *1* old residue 58 adding: *640* *58* *Leu* *HB2* *H* *1.583* *.* *2* old residue 58 adding: *641* *58* *Leu* *HB3* *H* *0.990* *.* *2* old residue 58 adding: *642* *58* *Leu* *HG* *H* *1.306* *.* *1* old residue 58 adding: *643* *58* *Leu* *HD1* *H* *0.749* *.* *1* old residue 58 adding: *644* *58* *Leu* *HD2* *H* *0.589* *.* *1* old residue 58 adding: *645* *58* *Leu* *C* *C* *175.349* *.* *1* old residue 58 adding: *646* *58* *Leu* *CA* *C* *52.286* *.* *1* old residue 58 adding: *647* *58* *Leu* *CB* *C* *46.390* *.* *1* old residue 58 adding: *648* *58* *Leu* *CG* *C* *26.930* *.* *1* old residue 58 adding: *649* *58* *Leu* *CD1* *C* *24.750* *.* *1* old residue 58 adding: *650* *58* *Leu* *CD2* *C* *26.462* *.* *1* old residue 58 adding: *651* *58* *Leu* *N* *N* *124.476* *.* *1* new residue 59 adding: *652* *59* *Leu* *H* *H* *9.265* *.* *1* old residue 59 adding: *653* *59* *Leu* *HA* *H* *4.714* *.* *1* old residue 59 adding: *654* *59* *Leu* *HB2* *H* *1.444* *.* *2* old residue 59 adding: *655* *59* *Leu* *HB3* *H* *0.848* *.* *2* old residue 59 adding: *656* *59* *Leu* *HG* *H* *0.844* *.* *1* old residue 59 adding: *657* *59* *Leu* *HD1* *H* *-0.321* *.* *1* old residue 59 adding: *658* *59* *Leu* *HD2* *H* *-0.739* *.* *1* old residue 59 adding: *659* *59* *Leu* *C* *C* *175.262* *.* *1* old residue 59 adding: *660* *59* *Leu* *CA* *C* *52.753* *.* *1* old residue 59 adding: *661* *59* *Leu* *CB* *C* *42.431* *.* *1* old residue 59 adding: *662* *59* *Leu* *CG* *C* *24.912* *.* *1* old residue 59 adding: *663* *59* *Leu* *CD1* *C* *24.265* *.* *1* old residue 59 adding: *664* *59* *Leu* *CD2* *C* *20.074* *.* *1* old residue 59 adding: *665* *59* *Leu* *N* *N* *125.973* *.* *1* new residue 60 adding: *666* *60* *Ala* *H* *H* *8.331* *.* *1* old residue 60 adding: *667* *60* *Ala* *HA* *H* *4.739* *.* *1* old residue 60 adding: *668* *60* *Ala* *HB* *H* *1.235* *.* *1* old residue 60 adding: *669* *60* *Ala* *C* *C* *175.631* *.* *1* old residue 60 adding: *670* *60* *Ala* *CA* *C* *50.320* *.* *1* old residue 60 adding: *671* *60* *Ala* *CB* *C* *21.744* *.* *1* old residue 60 adding: *672* *60* *Ala* *N* *N* *124.617* *.* *1* new residue 61 adding: *673* *61* *Val* *H* *H* *8.944* *.* *1* old residue 61 adding: *674* *61* *Val* *HA* *H* *4.244* *.* *1* old residue 61 adding: *675* *61* *Val* *HB* *H* *1.648* *.* *1* old residue 61 adding: *676* *61* *Val* *HG1* *H* *0.836* *.* *1* old residue 61 adding: *677* *61* *Val* *HG2* *H* *0.649* *.* *1* old residue 61 adding: *678* *61* *Val* *C* *C* *174.674* *.* *1* old residue 61 adding: *679* *61* *Val* *CA* *C* *60.770* *.* *1* old residue 61 adding: *680* *61* *Val* *CB* *C* *36.636* *.* *1* old residue 61 adding: *681* *61* *Val* *CG1* *C* *21.326* *.* *1* old residue 61 adding: *682* *61* *Val* *CG2* *C* *21.164* *.* *1* old residue 61 adding: *683* *61* *Val* *N* *N* *124.079* *.* *1* new residue 62 adding: *684* *62* *Glu* *H* *H* *8.490* *.* *1* old residue 62 adding: *685* *62* *Glu* *HA* *H* *4.551* *.* *1* old residue 62 adding: *686* *62* *Glu* *HB2* *H* *1.909* *.* *2* old residue 62 adding: *687* *62* *Glu* *HB3* *H* *1.909* *.* *2* old residue 62 adding: *688* *62* *Glu* *HG2* *H* *2.327* *.* *2* old residue 62 adding: *689* *62* *Glu* *HG3* *H* *2.272* *.* *2* old residue 62 adding: *690* *62* *Glu* *C* *C* *177.700* *.* *1* old residue 62 adding: *691* *62* *Glu* *CA* *C* *56.879* *.* *1* old residue 62 adding: *692* *62* *Glu* *CB* *C* *29.372* *.* *1* old residue 62 adding: *693* *62* *Glu* *CG* *C* *35.511* *.* *1* old residue 62 adding: *694* *62* *Glu* *N* *N* *127.752* *.* *1* new residue 63 adding: *695* *63* *Ala* *H* *H* *9.173* *.* *1* old residue 63 adding: *696* *63* *Ala* *HA* *H* *3.991* *.* *1* old residue 63 adding: *697* *63* *Ala* *HB* *H* *1.474* *.* *1* old residue 63 adding: *698* *63* *Ala* *C* *C* *180.311* *.* *1* old residue 63 adding: *699* *63* *Ala* *CA* *C* *54.850* *.* *1* old residue 63 adding: *700* *63* *Ala* *CB* *C* *19.495* *.* *1* old residue 63 adding: *701* *63* *Ala* *N* *N* *127.466* *.* *1* new residue 64 adding: *702* *64* *Glu* *H* *H* *9.571* *.* *1* old residue 64 adding: *703* *64* *Glu* *HA* *H* *4.146* *.* *1* old residue 64 adding: *704* *64* *Glu* *HB2* *H* *2.338* *.* *2* old residue 64 adding: *705* *64* *Glu* *HB3* *H* *1.980* *.* *2* old residue 64 adding: *706* *64* *Glu* *HG2* *H* *2.750* *.* *2* old residue 64 adding: *707* *64* *Glu* *HG3* *H* *2.389* *.* *2* old residue 64 adding: *708* *64* *Glu* *C* *C* *177.102* *.* *1* old residue 64 adding: *709* *64* *Glu* *CA* *C* *63.532* *.* *1* old residue 64 adding: *710* *64* *Glu* *CB* *C* *25.742* *.* *1* old residue 64 adding: *711* *64* *Glu* *CG* *C* *38.226* *.* *1* old residue 64 adding: *712* *64* *Glu* *N* *N* *120.368* *.* *1* new residue 65 adding: *713* *65* *Pro* *HA* *H* *4.440* *.* *1* old residue 65 adding: *714* *65* *Pro* *HB2* *H* *2.405* *.* *2* old residue 65 adding: *715* *65* *Pro* *HB3* *H* *1.856* *.* *2* old residue 65 adding: *716* *65* *Pro* *HG2* *H* *1.976* *.* *2* old residue 65 adding: *717* *65* *Pro* *HG3* *H* *1.905* *.* *2* old residue 65 adding: *718* *65* *Pro* *HD2* *H* *3.822* *.* *2* old residue 65 adding: *719* *65* *Pro* *HD3* *H* *3.467* *.* *2* old residue 65 adding: *720* *65* *Pro* *C* *C* *177.332* *.* *1* old residue 65 adding: *721* *65* *Pro* *CA* *C* *64.973* *.* *1* old residue 65 adding: *722* *65* *Pro* *CB* *C* *31.341* *.* *1* old residue 65 adding: *723* *65* *Pro* *CG* *C* *27.934* *.* *1* old residue 65 adding: *724* *65* *Pro* *CD* *C* *51.152* *.* *1* new residue 66 adding: *725* *66* *Leu* *H* *H* *7.412* *.* *1* old residue 66 adding: *726* *66* *Leu* *HA* *H* *4.023* *.* *1* old residue 66 adding: *727* *66* *Leu* *HB2* *H* *2.034* *.* *2* old residue 66 adding: *728* *66* *Leu* *HB3* *H* *1.338* *.* *2* old residue 66 adding: *729* *66* *Leu* *HG* *H* *2.046* *.* *1* old residue 66 adding: *730* *66* *Leu* *HD1* *H* *0.908* *.* *1* old residue 66 adding: *731* *66* *Leu* *HD2* *H* *0.756* *.* *1* old residue 66 adding: *732* *66* *Leu* *C* *C* *178.533* *.* *1* old residue 66 adding: *733* *66* *Leu* *CA* *C* *55.861* *.* *1* old residue 66 adding: *734* *66* *Leu* *CB* *C* *41.349* *.* *1* old residue 66 adding: *735* *66* *Leu* *CG* *C* *26.349* *.* *1* old residue 66 adding: *736* *66* *Leu* *CD1* *C* *27.059* *.* *1* old residue 66 adding: *737* *66* *Leu* *CD2* *C* *21.923* *.* *1* old residue 66 adding: *738* *66* *Leu* *N* *N* *114.991* *.* *1* new residue 67 adding: *739* *67* *Gly* *H* *H* *7.733* *.* *1* old residue 67 adding: *740* *67* *Gly* *HA2* *H* *4.018* *.* *2* old residue 67 adding: *741* *67* *Gly* *HA3* *H* *3.909* *.* *2* old residue 67 adding: *742* *67* *Gly* *C* *C* *175.925* *.* *1* old residue 67 adding: *743* *67* *Gly* *CA* *C* *46.054* *.* *1* old residue 67 adding: *744* *67* *Gly* *N* *N* *104.242* *.* *1* new residue 68 adding: *745* *68* *Glu* *H* *H* *8.887* *.* *1* old residue 68 adding: *746* *68* *Glu* *HA* *H* *4.219* *.* *1* old residue 68 adding: *747* *68* *Glu* *HB2* *H* *2.160* *.* *2* old residue 68 adding: *748* *68* *Glu* *HB3* *H* *1.969* *.* *2* old residue 68 adding: *749* *68* *Glu* *HG2* *H* *2.331* *.* *2* old residue 68 adding: *750* *68* *Glu* *HG3* *H* *2.331* *.* *2* old residue 68 adding: *751* *68* *Glu* *C* *C* *176.314* *.* *1* old residue 68 adding: *752* *68* *Glu* *CA* *C* *57.652* *.* *1* old residue 68 adding: *753* *68* *Glu* *CB* *C* *29.306* *.* *1* old residue 68 adding: *754* *68* *Glu* *CG* *C* *36.431* *.* *1* old residue 68 adding: *755* *68* *Glu* *N* *N* *121.253* *.* *1* new residue 69 adding: *756* *69* *Asp* *H* *H* *7.630* *.* *1* old residue 69 adding: *757* *69* *Asp* *HA* *H* *4.587* *.* *1* old residue 69 adding: *758* *69* *Asp* *HB2* *H* *2.612* *.* *2* old residue 69 adding: *759* *69* *Asp* *HB3* *H* *2.575* *.* *2* old residue 69 adding: *760* *69* *Asp* *C* *C* *174.665* *.* *1* old residue 69 adding: *761* *69* *Asp* *CA* *C* *56.078* *.* *1* old residue 69 adding: *762* *69* *Asp* *CB* *C* *41.572* *.* *1* old residue 69 adding: *763* *69* *Asp* *N* *N* *116.486* *.* *1* new residue 70 adding: *764* *70* *Leu* *H* *H* *7.433* *.* *1* old residue 70 adding: *765* *70* *Leu* *HA* *H* *4.854* *.* *1* old residue 70 adding: *766* *70* *Leu* *HB2* *H* *2.118* *.* *2* old residue 70 adding: *767* *70* *Leu* *HB3* *H* *0.982* *.* *2* old residue 70 adding: *768* *70* *Leu* *HG* *H* *0.941* *.* *1* old residue 70 adding: *769* *70* *Leu* *HD1* *H* *0.387* *.* *1* old residue 70 adding: *770* *70* *Leu* *HD2* *H* *0.833* *.* *1* old residue 70 adding: *771* *70* *Leu* *C* *C* *174.259* *.* *1* old residue 70 adding: *772* *70* *Leu* *CA* *C* *53.281* *.* *1* old residue 70 adding: *773* *70* *Leu* *CB* *C* *43.024* *.* *1* old residue 70 adding: *774* *70* *Leu* *CG* *C* *27.067* *.* *1* old residue 70 adding: *775* *70* *Leu* *CD1* *C* *23.634* *.* *1* old residue 70 adding: *776* *70* *Leu* *CD2* *C* *26.657* *.* *1* old residue 70 adding: *777* *70* *Leu* *N* *N* *121.585* *.* *1* new residue 71 adding: *778* *71* *Lys* *H* *H* *9.114* *.* *1* old residue 71 adding: *779* *71* *Lys* *HA* *H* *4.724* *.* *1* old residue 71 adding: *780* *71* *Lys* *HB2* *H* *1.685* *.* *2* old residue 71 adding: *781* *71* *Lys* *HB3* *H* *1.614* *.* *2* old residue 71 adding: *782* *71* *Lys* *HG2* *H* *1.272* *.* *2* old residue 71 adding: *783* *71* *Lys* *HG3* *H* *1.272* *.* *2* old residue 71 adding: *784* *71* *Lys* *HD2* *H* *1.479* *.* *2* old residue 71 adding: *785* *71* *Lys* *HD3* *H* *1.221* *.* *2* old residue 71 adding: *786* *71* *Lys* *HE2* *H* *2.674* *.* *2* old residue 71 adding: *787* *71* *Lys* *HE3* *H* *2.563* *.* *2* old residue 71 adding: *788* *71* *Lys* *C* *C* *175.146* *.* *1* old residue 71 adding: *789* *71* *Lys* *CA* *C* *54.024* *.* *1* old residue 71 adding: *790* *71* *Lys* *CB* *C* *35.469* *.* *1* old residue 71 adding: *791* *71* *Lys* *CG* *C* *25.046* *.* *1* old residue 71 adding: *792* *71* *Lys* *CD* *C* *28.739* *.* *1* old residue 71 adding: *793* *71* *Lys* *CE* *C* *42.278* *.* *1* old residue 71 adding: *794* *71* *Lys* *N* *N* *126.179* *.* *1* new residue 72 adding: *795* *72* *Trp* *H* *H* *8.981* *.* *1* old residue 72 adding: *796* *72* *Trp* *HA* *H* *4.720* *.* *1* old residue 72 adding: *797* *72* *Trp* *HB2* *H* *3.009* *.* *2* old residue 72 adding: *798* *72* *Trp* *HB3* *H* *2.644* *.* *2* old residue 72 adding: *799* *72* *Trp* *HD1* *H* *7.191* *.* *1* old residue 72 adding: *800* *72* *Trp* *HE1* *H* *10.308* *.* *1* old residue 72 adding: *801* *72* *Trp* *HE3* *H* *6.919* *.* *1* old residue 72 adding: *802* *72* *Trp* *HZ2* *H* *7.130* *.* *1* old residue 72 adding: *803* *72* *Trp* *HZ3* *H* *6.963* *.* *1* old residue 72 adding: *804* *72* *Trp* *HH2* *H* *6.969* *.* *1* old residue 72 adding: *805* *72* *Trp* *C* *C* *176.394* *.* *1* old residue 72 adding: *806* *72* *Trp* *CA* *C* *55.876* *.* *1* old residue 72 adding: *807* *72* *Trp* *CB* *C* *27.789* *.* *1* old residue 72 adding: *808* *72* *Trp* *CD1* *C* *127.868* *.* *1* old residue 72 adding: *809* *72* *Trp* *CE3* *C* *119.57* *.* *1* old residue 72 adding: *810* *72* *Trp* *CZ2* *C* *113.986* *.* *1* old residue 72 adding: *811* *72* *Trp* *CZ3* *C* *121.30* *.* *1* old residue 72 adding: *812* *72* *Trp* *CH2* *C* *123.464* *.* *1* old residue 72 adding: *813* *72* *Trp* *N* *N* *125.904* *.* *1* old residue 72 adding: *814* *72* *Trp* *NE1* *N* *131.103* *.* *1* new residue 73 adding: *815* *73* *Glu* *H* *H* *8.558* *.* *1* old residue 73 adding: *816* *73* *Glu* *HA* *H* *4.762* *.* *1* old residue 73 adding: *817* *73* *Glu* *HB2* *H* *2.039* *.* *2* old residue 73 adding: *818* *73* *Glu* *HB3* *H* *1.614* *.* *2* old residue 73 adding: *819* *73* *Glu* *HG2* *H* *2.117* *.* *2* old residue 73 adding: *820* *73* *Glu* *HG3* *H* *1.948* *.* *2* old residue 73 adding: *821* *73* *Glu* *C* *C* *175.459* *.* *1* old residue 73 adding: *822* *73* *Glu* *CA* *C* *55.208* *.* *1* old residue 73 adding: *823* *73* *Glu* *CB* *C* *32.615* *.* *1* old residue 73 adding: *824* *73* *Glu* *CG* *C* *37.218* *.* *1* old residue 73 adding: *825* *73* *Glu* *N* *N* *123.290* *.* *1* new residue 74 adding: *826* *74* *Ala* *H* *H* *8.962* *.* *1* old residue 74 adding: *827* *74* *Ala* *HA* *H* *4.738* *.* *1* old residue 74 adding: *828* *74* *Ala* *HB* *H* *1.372* *.* *1* old residue 74 adding: *829* *74* *Ala* *C* *C* *177.803* *.* *1* old residue 74 adding: *830* *74* *Ala* *CA* *C* *52.246* *.* *1* old residue 74 adding: *831* *74* *Ala* *CB* *C* *20.070* *.* *1* old residue 74 adding: *832* *74* *Ala* *N* *N* *127.315* *.* *1* new residue 75 adding: *833* *75* *Ser* *H* *H* *8.762* *.* *1* old residue 75 adding: *834* *75* *Ser* *HA* *H* *4.850* *.* *1* old residue 75 adding: *835* *75* *Ser* *HB2* *H* *4.275* *.* *2* old residue 75 adding: *836* *75* *Ser* *HB3* *H* *4.125* *.* *2* old residue 75 adding: *837* *75* *Ser* *C* *C* *176.080* *.* *1* old residue 75 adding: *838* *75* *Ser* *CA* *C* *56.954* *.* *1* old residue 75 adding: *839* *75* *Ser* *CB* *C* *65.244* *.* *1* old residue 75 adding: *840* *75* *Ser* *N* *N* *117.745* *.* *1* new residue 76 adding: *841* *76* *Arg* *HA* *H* *4.193* *.* *1* old residue 76 adding: *842* *76* *Arg* *HB2* *H* *1.982* *.* *2* old residue 76 adding: *843* *76* *Arg* *HB3* *H* *1.982* *.* *2* old residue 76 adding: *844* *76* *Arg* *HG2* *H* *1.765* *.* *2* old residue 76 adding: *845* *76* *Arg* *HG3* *H* *1.765* *.* *2* old residue 76 adding: *846* *76* *Arg* *HD2* *H* *3.264* *.* *2* old residue 76 adding: *847* *76* *Arg* *HD3* *H* *3.264* *.* *2* old residue 76 adding: *848* *76* *Arg* *HE* *H* *7.246* *.* *1* old residue 76 adding: *849* *76* *Arg* *CA* *C* *58.895* *.* *1* old residue 76 adding: *850* *76* *Arg* *CB* *C* *29.877* *.* *1* old residue 76 adding: *851* *76* *Arg* *CG* *C* *27.326* *.* *1* old residue 76 adding: *852* *76* *Arg* *CD* *C* *43.296* *.* *1* new residue 77 adding: *853* *77* *Gly* *C* *C* *175.277* *.* *1* new residue 78 adding: *854* *78* *Gly* *H* *H* *8.045* *.* *1* old residue 78 adding: *855* *78* *Gly* *HA2* *H* *4.390* *.* *2* old residue 78 adding: *856* *78* *Gly* *HA3* *H* *3.786* *.* *2* old residue 78 adding: *857* *78* *Gly* *C* *C* *173.503* *.* *1* old residue 78 adding: *858* *78* *Gly* *CA* *C* *45.296* *.* *1* old residue 78 adding: *859* *78* *Gly* *N* *N* *110.323* *.* *1* new residue 79 adding: *860* *79* *Ala* *H* *H* *7.879* *.* *1* old residue 79 adding: *861* *79* *Ala* *HA* *H* *4.357* *.* *1* old residue 79 adding: *862* *79* *Ala* *HB* *H* *1.297* *.* *1* old residue 79 adding: *863* *79* *Ala* *C* *C* *176.674* *.* *1* old residue 79 adding: *864* *79* *Ala* *CA* *C* *52.151* *.* *1* old residue 79 adding: *865* *79* *Ala* *CB* *C* *20.171* *.* *1* old residue 79 adding: *866* *79* *Ala* *N* *N* *123.865* *.* *1* new residue 80 adding: *867* *80* *Arg* *H* *H* *8.375* *.* *1* old residue 80 adding: *868* *80* *Arg* *HA* *H* *4.629* *.* *1* old residue 80 adding: *869* *80* *Arg* *HB2* *H* *1.764* *.* *2* old residue 80 adding: *870* *80* *Arg* *HB3* *H* *1.529* *.* *2* old residue 80 adding: *871* *80* *Arg* *HG2* *H* *1.690* *.* *2* old residue 80 adding: *872* *80* *Arg* *HG3* *H* *1.370* *.* *2* old residue 80 adding: *873* *80* *Arg* *HD2* *H* *3.072* *.* *2* old residue 80 adding: *874* *80* *Arg* *HD3* *H* *3.072* *.* *2* old residue 80 adding: *875* *80* *Arg* *HE* *H* *7.596* *.* *1* old residue 80 adding: *876* *80* *Arg* *C* *C* *175.713* *.* *1* old residue 80 adding: *877* *80* *Arg* *CA* *C* *55.622* *.* *1* old residue 80 adding: *878* *80* *Arg* *CB* *C* *32.074* *.* *1* old residue 80 adding: *879* *80* *Arg* *CG* *C* *28.075* *.* *1* old residue 80 adding: *880* *80* *Arg* *CD* *C* *43.521* *.* *1* old residue 80 adding: *881* *80* *Arg* *N* *N* *119.145* *.* *1* old residue 80 adding: *882* *80* *Arg* *NE* *N* *83.632* *.* *1* new residue 81 adding: *883* *81* *Phe* *H* *H* *8.722* *.* *1* old residue 81 adding: *884* *81* *Phe* *HA* *H* *5.156* *.* *1* old residue 81 adding: *885* *81* *Phe* *HB2* *H* *3.198* *.* *2* old residue 81 adding: *886* *81* *Phe* *HB3* *H* *2.703* *.* *2* old residue 81 adding: *887* *81* *Phe* *HD1* *H* *7.550* *.* *1* old residue 81 adding: *888* *81* *Phe* *HD2* *H* *7.550* *.* *1* old residue 81 adding: *889* *81* *Phe* *HE1* *H* *7.370* *.* *1* old residue 81 adding: *890* *81* *Phe* *HE2* *H* *7.370* *.* *1* old residue 81 adding: *891* *81* *Phe* *HZ* *H* *7.411* *.* *1* old residue 81 adding: *892* *81* *Phe* *C* *C* *172.806* *.* *1* old residue 81 adding: *893* *81* *Phe* *CA* *C* *54.950* *.* *1* old residue 81 adding: *894* *81* *Phe* *CB* *C* *42.240* *.* *1* old residue 81 adding: *895* *81* *Phe* *CD1* *C* *132.441* *.* *1* old residue 81 adding: *896* *81* *Phe* *CD2* *C* *132.441* *.* *1* old residue 81 adding: *897* *81* *Phe* *CE1* *C* *131.496* *.* *1* old residue 81 adding: *898* *81* *Phe* *CE2* *C* *131.496* *.* *1* old residue 81 adding: *899* *81* *Phe* *CZ* *C* *130.04* *.* *1* old residue 81 adding: *900* *81* *Phe* *N* *N* *123.774* *.* *1* new residue 82 adding: *901* *82* *Pro* *HA* *H* *3.635* *.* *1* old residue 82 adding: *902* *82* *Pro* *HB2* *H* *1.025* *.* *2* old residue 82 adding: *903* *82* *Pro* *HB3* *H* *-0.394* *.* *2* old residue 82 adding: *904* *82* *Pro* *HG2* *H* *1.843* *.* *2* old residue 82 adding: *905* *82* *Pro* *HG3* *H* *1.337* *.* *2* old residue 82 adding: *906* *82* *Pro* *HD2* *H* *4.070* *.* *2* old residue 82 adding: *907* *82* *Pro* *HD3* *H* *3.719* *.* *2* old residue 82 adding: *908* *82* *Pro* *C* *C* *174.511* *.* *1* old residue 82 adding: *909* *82* *Pro* *CA* *C* *61.347* *.* *1* old residue 82 adding: *910* *82* *Pro* *CB* *C* *29.495* *.* *1* old residue 82 adding: *911* *82* *Pro* *CG* *C* *26.047* *.* *1* old residue 82 adding: *912* *82* *Pro* *CD* *C* *49.571* *.* *1* new residue 83 adding: *913* *83* *His* *H* *H* *8.831* *.* *1* old residue 83 adding: *914* *83* *His* *HA* *H* *5.330* *.* *1* old residue 83 adding: *915* *83* *His* *HB2* *H* *3.014* *.* *2* old residue 83 adding: *916* *83* *His* *HB3* *H* *1.841* *.* *2* old residue 83 adding: *917* *83* *His* *HD2* *H* *7.093* *.* *1* old residue 83 adding: *918* *83* *His* *C* *C* *172.952* *.* *1* old residue 83 adding: *919* *83* *His* *CA* *C* *50.700* *.* *1* old residue 83 adding: *920* *83* *His* *CB* *C* *33.238* *.* *1* old residue 83 adding: *921* *83* *His* *CD2* *C* *118.50* *.* *1* old residue 83 adding: *922* *83* *His* *N* *N* *124.483* *.* *1* new residue 84 adding: *923* *84* *Leu* *H* *H* *9.063* *.* *1* old residue 84 adding: *924* *84* *Leu* *HA* *H* *5.163* *.* *1* old residue 84 adding: *925* *84* *Leu* *HB2* *H* *2.042* *.* *2* old residue 84 adding: *926* *84* *Leu* *HB3* *H* *1.001* *.* *2* old residue 84 adding: *927* *84* *Leu* *HG* *H* *1.930* *.* *1* old residue 84 adding: *928* *84* *Leu* *HD1* *H* *0.849* *.* *2* old residue 84 adding: *929* *84* *Leu* *HD2* *H* *0.769* *.* *2* old residue 84 adding: *930* *84* *Leu* *C* *C* *176.699* *.* *1* old residue 84 adding: *931* *84* *Leu* *CA* *C* *53.829* *.* *1* old residue 84 adding: *932* *84* *Leu* *CB* *C* *45.366* *.* *1* old residue 84 adding: *933* *84* *Leu* *CG* *C* *27.035* *.* *1* old residue 84 adding: *934* *84* *Leu* *CD1* *C* *27.038* *.* *2* old residue 84 adding: *935* *84* *Leu* *CD2* *C* *23.390* *.* *2* old residue 84 adding: *936* *84* *Leu* *N* *N* *125.218* *.* *1* new residue 85 adding: *937* *85* *Tyr* *H* *H* *9.058* *.* *1* old residue 85 adding: *938* *85* *Tyr* *HA* *H* *4.508* *.* *1* old residue 85 adding: *939* *85* *Tyr* *HB2* *H* *3.572* *.* *2* old residue 85 adding: *940* *85* *Tyr* *HB3* *H* *2.877* *.* *2* old residue 85 adding: *941* *85* *Tyr* *HD1* *H* *7.213* *.* *1* old residue 85 adding: *942* *85* *Tyr* *HD2* *H* *7.213* *.* *1* old residue 85 adding: *943* *85* *Tyr* *HE1* *H* *6.526* *.* *1* old residue 85 adding: *944* *85* *Tyr* *HE2* *H* *6.526* *.* *1* old residue 85 adding: *945* *85* *Tyr* *C* *C* *173.624* *.* *1* old residue 85 adding: *946* *85* *Tyr* *CA* *C* *60.034* *.* *1* old residue 85 adding: *947* *85* *Tyr* *CB* *C* *36.073* *.* *1* old residue 85 adding: *948* *85* *Tyr* *CD1* *C* *133.090* *.* *1* old residue 85 adding: *949* *85* *Tyr* *CD2* *C* *133.090* *.* *1* old residue 85 adding: *950* *85* *Tyr* *CE1* *C* *117.770* *.* *1* old residue 85 adding: *951* *85* *Tyr* *CE2* *C* *117.770* *.* *1* old residue 85 adding: *952* *85* *Tyr* *N* *N* *131.339* *.* *1* new residue 86 adding: *953* *86* *Arg* *H* *H* *7.432* *.* *1* old residue 86 adding: *954* *86* *Arg* *HA* *H* *4.682* *.* *1* old residue 86 adding: *955* *86* *Arg* *HB2* *H* *2.287* *.* *2* old residue 86 adding: *956* *86* *Arg* *HB3* *H* *1.724* *.* *2* old residue 86 adding: *957* *86* *Arg* *HG2* *H* *1.415* *.* *2* old residue 86 adding: *958* *86* *Arg* *HG3* *H* *1.221* *.* *2* old residue 86 adding: *959* *86* *Arg* *HD2* *H* *3.111* *.* *2* old residue 86 adding: *960* *86* *Arg* *HD3* *H* *3.035* *.* *2* old residue 86 adding: *961* *86* *Arg* *HE* *H* *7.583* *.* *1* old residue 86 adding: *962* *86* *Arg* *C* *C* *171.917* *.* *1* old residue 86 adding: *963* *86* *Arg* *CA* *C* *54.953* *.* *1* old residue 86 adding: *964* *86* *Arg* *CB* *C* *28.209* *.* *1* old residue 86 adding: *965* *86* *Arg* *CG* *C* *25.124* *.* *1* old residue 86 adding: *966* *86* *Arg* *CD* *C* *43.652* *.* *1* old residue 86 adding: *967* *86* *Arg* *N* *N* *114.399* *.* *1* old residue 86 adding: *968* *86* *Arg* *NE* *N* *83.363* *.* *1* new residue 87 adding: *969* *87* *Pro* *HA* *H* *4.303* *.* *1* old residue 87 adding: *970* *87* *Pro* *HB2* *H* *1.747* *.* *2* old residue 87 adding: *971* *87* *Pro* *HB3* *H* *1.501* *.* *2* old residue 87 adding: *972* *87* *Pro* *HG2* *H* *1.988* *.* *2* old residue 87 adding: *973* *87* *Pro* *HG3* *H* *1.915* *.* *2* old residue 87 adding: *974* *87* *Pro* *HD2* *H* *3.742* *.* *2* old residue 87 adding: *975* *87* *Pro* *HD3* *H* *3.540* *.* *2* old residue 87 adding: *976* *87* *Pro* *C* *C* *175.771* *.* *1* old residue 87 adding: *977* *87* *Pro* *CA* *C* *63.497* *.* *1* old residue 87 adding: *978* *87* *Pro* *CB* *C* *32.253* *.* *1* old residue 87 adding: *979* *87* *Pro* *CG* *C* *27.829* *.* *1* old residue 87 adding: *980* *87* *Pro* *CD* *C* *50.636* *.* *1* new residue 88 adding: *981* *88* *Leu* *H* *H* *8.095* *.* *1* old residue 88 adding: *982* *88* *Leu* *HA* *H* *4.286* *.* *1* old residue 88 adding: *983* *88* *Leu* *HB2* *H* *2.087* *.* *2* old residue 88 adding: *984* *88* *Leu* *HB3* *H* *1.291* *.* *2* old residue 88 adding: *985* *88* *Leu* *HG* *H* *1.677* *.* *1* old residue 88 adding: *986* *88* *Leu* *HD1* *H* *0.900* *.* *1* old residue 88 adding: *987* *88* *Leu* *HD2* *H* *0.642* *.* *1* old residue 88 adding: *988* *88* *Leu* *C* *C* *175.946* *.* *1* old residue 88 adding: *989* *88* *Leu* *CA* *C* *53.675* *.* *1* old residue 88 adding: *990* *88* *Leu* *CB* *C* *45.548* *.* *1* old residue 88 adding: *991* *88* *Leu* *CG* *C* *26.272* *.* *1* old residue 88 adding: *992* *88* *Leu* *CD1* *C* *24.102* *.* *1* old residue 88 adding: *993* *88* *Leu* *CD2* *C* *26.185* *.* *1* old residue 88 adding: *994* *88* *Leu* *N* *N* *125.942* *.* *1* new residue 89 adding: *995* *89* *Leu* *H* *H* *9.224* *.* *1* old residue 89 adding: *996* *89* *Leu* *HA* *H* *4.561* *.* *1* old residue 89 adding: *997* *89* *Leu* *HB2* *H* *1.707* *.* *2* old residue 89 adding: *998* *89* *Leu* *HB3* *H* *1.707* *.* *2* old residue 89 adding: *999* *89* *Leu* *HG* *H* *1.712* *.* *1* old residue 89 adding: *1000* *89* *Leu* *HD1* *H* *0.864* *.* *1* old residue 89 adding: *1001* *89* *Leu* *HD2* *H* *0.850* *.* *1* old residue 89 adding: *1002* *89* *Leu* *C* *C* *179.295* *.* *1* old residue 89 adding: *1003* *89* *Leu* *CA* *C* *55.212* *.* *1* old residue 89 adding: *1004* *89* *Leu* *CB* *C* *41.460* *.* *1* old residue 89 adding: *1005* *89* *Leu* *CG* *C* *27.145* *.* *1* old residue 89 adding: *1006* *89* *Leu* *CD1* *C* *25.624* *.* *1* old residue 89 adding: *1007* *89* *Leu* *CD2* *C* *22.553* *.* *1* old residue 89 adding: *1008* *89* *Leu* *N* *N* *128.295* *.* *1* new residue 90 adding: *1009* *90* *Val* *H* *H* *7.665* *.* *1* old residue 90 adding: *1010* *90* *Val* *HA* *H* *3.785* *.* *1* old residue 90 adding: *1011* *90* *Val* *HB* *H* *1.948* *.* *1* old residue 90 adding: *1012* *90* *Val* *HG1* *H* *0.896* *.* *1* old residue 90 adding: *1013* *90* *Val* *HG2* *H* *0.715* *.* *1* old residue 90 adding: *1014* *90* *Val* *C* *C* *178.510* *.* *1* old residue 90 adding: *1015* *90* *Val* *CA* *C* *66.833* *.* *1* old residue 90 adding: *1016* *90* *Val* *CB* *C* *31.330* *.* *1* old residue 90 adding: *1017* *90* *Val* *CG1* *C* *21.165* *.* *1* old residue 90 adding: *1018* *90* *Val* *CG2* *C* *22.449* *.* *1* old residue 90 adding: *1019* *90* *Val* *N* *N* *122.696* *.* *1* new residue 91 adding: *1020* *91* *Ser* *H* *H* *8.134* *.* *1* old residue 91 adding: *1021* *91* *Ser* *HA* *H* *4.280* *.* *1* old residue 91 adding: *1022* *91* *Ser* *HB2* *H* *4.083* *.* *2* old residue 91 adding: *1023* *91* *Ser* *HB3* *H* *3.828* *.* *2* old residue 91 adding: *1024* *91* *Ser* *C* *C* *175.328* *.* *1* old residue 91 adding: *1025* *91* *Ser* *CA* *C* *59.822* *.* *1* old residue 91 adding: *1026* *91* *Ser* *CB* *C* *62.512* *.* *1* old residue 91 adding: *1027* *91* *Ser* *N* *N* *112.443* *.* *1* new residue 92 adding: *1028* *92* *Glu* *H* *H* *7.598* *.* *1* old residue 92 adding: *1029* *92* *Glu* *HA* *H* *4.221* *.* *1* old residue 92 adding: *1030* *92* *Glu* *HB2* *H* *2.549* *.* *2* old residue 92 adding: *1031* *92* *Glu* *HB3* *H* *2.081* *.* *2* old residue 92 adding: *1032* *92* *Glu* *HG2* *H* *2.258* *.* *2* old residue 92 adding: *1033* *92* *Glu* *HG3* *H* *2.258* *.* *2* old residue 92 adding: *1034* *92* *Glu* *C* *C* *175.722* *.* *1* old residue 92 adding: *1035* *92* *Glu* *CA* *C* *56.594* *.* *1* old residue 92 adding: *1036* *92* *Glu* *CB* *C* *29.511* *.* *1* old residue 92 adding: *1037* *92* *Glu* *CG* *C* *38.193* *.* *1* old residue 92 adding: *1038* *92* *Glu* *N* *N* *120.359* *.* *1* new residue 93 adding: *1039* *93* *Val* *H* *H* *7.486* *.* *1* old residue 93 adding: *1040* *93* *Val* *HA* *H* *4.046* *.* *1* old residue 93 adding: *1041* *93* *Val* *HB* *H* *2.455* *.* *1* old residue 93 adding: *1042* *93* *Val* *HG1* *H* *0.834* *.* *1* old residue 93 adding: *1043* *93* *Val* *HG2* *H* *0.975* *.* *1* old residue 93 adding: *1044* *93* *Val* *C* *C* *176.093* *.* *1* old residue 93 adding: *1045* *93* *Val* *CA* *C* *63.242* *.* *1* old residue 93 adding: *1046* *93* *Val* *CB* *C* *32.306* *.* *1* old residue 93 adding: *1047* *93* *Val* *CG1* *C* *22.491* *.* *1* old residue 93 adding: *1048* *93* *Val* *CG2* *C* *22.666* *.* *1* old residue 93 adding: *1049* *93* *Val* *N* *N* *121.222* *.* *1* new residue 94 adding: *1050* *94* *Thr* *H* *H* *9.003* *.* *1* old residue 94 adding: *1051* *94* *Thr* *HA* *H* *4.264* *.* *1* old residue 94 adding: *1052* *94* *Thr* *HB* *H* *3.969* *.* *1* old residue 94 adding: *1053* *94* *Thr* *HG2* *H* *1.212* *.* *1* old residue 94 adding: *1054* *94* *Thr* *C* *C* *174.664* *.* *1* old residue 94 adding: *1055* *94* *Thr* *CA* *C* *64.438* *.* *1* old residue 94 adding: *1056* *94* *Thr* *CB* *C* *69.317* *.* *1* old residue 94 adding: *1057* *94* *Thr* *CG2* *C* *22.005* *.* *1* old residue 94 adding: *1058* *94* *Thr* *N* *N* *124.794* *.* *1* new residue 95 adding: *1059* *95* *Arg* *H* *H* *7.514* *.* *1* old residue 95 adding: *1060* *95* *Arg* *HA* *H* *4.646* *.* *1* old residue 95 adding: *1061* *95* *Arg* *HB2* *H* *1.769* *.* *2* old residue 95 adding: *1062* *95* *Arg* *HB3* *H* *1.769* *.* *2* old residue 95 adding: *1063* *95* *Arg* *HG2* *H* *1.565* *.* *2* old residue 95 adding: *1064* *95* *Arg* *HG3* *H* *1.490* *.* *2* old residue 95 adding: *1065* *95* *Arg* *HD2* *H* *3.201* *.* *2* old residue 95 adding: *1066* *95* *Arg* *HD3* *H* *3.201* *.* *2* old residue 95 adding: *1067* *95* *Arg* *HE* *H* *7.409* *.* *1* old residue 95 adding: *1068* *95* *Arg* *C* *C* *172.989* *.* *1* old residue 95 adding: *1069* *95* *Arg* *CA* *C* *55.872* *.* *1* old residue 95 adding: *1070* *95* *Arg* *CB* *C* *33.789* *.* *1* old residue 95 adding: *1071* *95* *Arg* *CG* *C* *27.594* *.* *1* old residue 95 adding: *1072* *95* *Arg* *CD* *C* *43.369* *.* *1* old residue 95 adding: *1073* *95* *Arg* *N* *N* *118.660* *.* *1* old residue 95 adding: *1074* *95* *Arg* *NE* *N* *84.585* *.* *1* new residue 96 adding: *1075* *96* *Glu* *H* *H* *8.545* *.* *1* old residue 96 adding: *1076* *96* *Glu* *HA* *H* *5.329* *.* *1* old residue 96 adding: *1077* *96* *Glu* *HB2* *H* *1.690* *.* *2* old residue 96 adding: *1078* *96* *Glu* *HB3* *H* *1.650* *.* *2* old residue 96 adding: *1079* *96* *Glu* *HG2* *H* *2.183* *.* *2* old residue 96 adding: *1080* *96* *Glu* *HG3* *H* *2.028* *.* *2* old residue 96 adding: *1081* *96* *Glu* *C* *C* *174.480* *.* *1* old residue 96 adding: *1082* *96* *Glu* *CA* *C* *53.415* *.* *1* old residue 96 adding: *1083* *96* *Glu* *CB* *C* *33.592* *.* *1* old residue 96 adding: *1084* *96* *Glu* *CG* *C* *35.515* *.* *1* old residue 96 adding: *1085* *96* *Glu* *N* *N* *121.828* *.* *1* new residue 97 adding: *1086* *97* *Ala* *H* *H* *8.276* *.* *1* old residue 97 adding: *1087* *97* *Ala* *HA* *H* *4.537* *.* *1* old residue 97 adding: *1088* *97* *Ala* *HB* *H* *0.854* *.* *1* old residue 97 adding: *1089* *97* *Ala* *C* *C* *175.233* *.* *1* old residue 97 adding: *1090* *97* *Ala* *CA* *C* *51.368* *.* *1* old residue 97 adding: *1091* *97* *Ala* *CB* *C* *22.101* *.* *1* old residue 97 adding: *1092* *97* *Ala* *N* *N* *123.211* *.* *1* new residue 98 adding: *1093* *98* *Asp* *H* *H* *8.399* *.* *1* old residue 98 adding: *1094* *98* *Asp* *HA* *H* *4.850* *.* *1* old residue 98 adding: *1095* *98* *Asp* *HB2* *H* *2.725* *.* *2* old residue 98 adding: *1096* *98* *Asp* *HB3* *H* *2.461* *.* *2* old residue 98 adding: *1097* *98* *Asp* *C* *C* *176.085* *.* *1* old residue 98 adding: *1098* *98* *Asp* *CA* *C* *54.824* *.* *1* old residue 98 adding: *1099* *98* *Asp* *CB* *C* *41.694* *.* *1* old residue 98 adding: *1100* *98* *Asp* *N* *N* *122.093* *.* *1* new residue 99 adding: *1101* *99* *Leu* *H* *H* *7.854* *.* *1* old residue 99 adding: *1102* *99* *Leu* *HA* *H* *4.766* *.* *1* old residue 99 adding: *1103* *99* *Leu* *HB2* *H* *1.692* *.* *2* old residue 99 adding: *1104* *99* *Leu* *HB3* *H* *1.036* *.* *2* old residue 99 adding: *1105* *99* *Leu* *HG* *H* *1.376* *.* *1* old residue 99 adding: *1106* *99* *Leu* *HD1* *H* *0.521* *.* *1* old residue 99 adding: *1107* *99* *Leu* *HD2* *H* *0.622* *.* *1* old residue 99 adding: *1108* *99* *Leu* *C* *C* *176.250* *.* *1* old residue 99 adding: *1109* *99* *Leu* *CA* *C* *53.544* *.* *1* old residue 99 adding: *1110* *99* *Leu* *CB* *C* *44.229* *.* *1* old residue 99 adding: *1111* *99* *Leu* *CG* *C* *25.957* *.* *1* old residue 99 adding: *1112* *99* *Leu* *CD1* *C* *25.776* *.* *1* old residue 99 adding: *1113* *99* *Leu* *CD2* *C* *23.449* *.* *1* old residue 99 adding: *1114* *99* *Leu* *N* *N* *120.272* *.* *1* new residue 100 adding: *1115* *100* *Asp* *H* *H* *9.215* *.* *1* old residue 100 adding: *1116* *100* *Asp* *HA* *H* *4.935* *.* *1* old residue 100 adding: *1117* *100* *Asp* *HB2* *H* *2.709* *.* *2* old residue 100 adding: *1118* *100* *Asp* *HB3* *H* *2.582* *.* *2* old residue 100 adding: *1119* *100* *Asp* *C* *C* *174.956* *.* *1* old residue 100 adding: *1120* *100* *Asp* *CA* *C* *52.684* *.* *1* old residue 100 adding: *1121* *100* *Asp* *CB* *C* *43.362* *.* *1* old residue 100 adding: *1122* *100* *Asp* *N* *N* *123.325* *.* *1* new residue 101 adding: *1123* *101* *Leu* *H* *H* *8.526* *.* *1* old residue 101 adding: *1124* *101* *Leu* *HA* *H* *4.639* *.* *1* old residue 101 adding: *1125* *101* *Leu* *HB2* *H* *1.812* *.* *2* old residue 101 adding: *1126* *101* *Leu* *HB3* *H* *1.146* *.* *2* old residue 101 adding: *1127* *101* *Leu* *HG* *H* *1.655* *.* *1* old residue 101 adding: *1128* *101* *Leu* *HD1* *H* *0.719* *.* *1* old residue 101 adding: *1129* *101* *Leu* *HD2* *H* *0.653* *.* *1* old residue 101 adding: *1130* *101* *Leu* *C* *C* *178.204* *.* *1* old residue 101 adding: *1131* *101* *Leu* *CA* *C* *53.490* *.* *1* old residue 101 adding: *1132* *101* *Leu* *CB* *C* *44.374* *.* *1* old residue 101 adding: *1133* *101* *Leu* *CG* *C* *26.790* *.* *1* old residue 101 adding: *1134* *101* *Leu* *CD1* *C* *24.516* *.* *1* old residue 101 adding: *1135* *101* *Leu* *CD2* *C* *21.139* *.* *1* old residue 101 adding: *1136* *101* *Leu* *N* *N* *118.539* *.* *1* new residue 102 adding: *1137* *102* *Asp* *H* *H* *8.029* *.* *1* old residue 102 adding: *1138* *102* *Asp* *HA* *H* *4.615* *.* *1* old residue 102 adding: *1139* *102* *Asp* *HB2* *H* *3.348* *.* *2* old residue 102 adding: *1140* *102* *Asp* *HB3* *H* *2.611* *.* *2* old residue 102 adding: *1141* *102* *Asp* *C* *C* *178.176* *.* *1* old residue 102 adding: *1142* *102* *Asp* *CA* *C* *52.297* *.* *1* old residue 102 adding: *1143* *102* *Asp* *CB* *C* *41.108* *.* *1* old residue 102 adding: *1144* *102* *Asp* *N* *N* *121.008* *.* *1* new residue 103 adding: *1145* *103* *Ala* *H* *H* *8.384* *.* *1* old residue 103 adding: *1146* *103* *Ala* *HA* *H* *4.099* *.* *1* old residue 103 adding: *1147* *103* *Ala* *HB* *H* *1.417* *.* *1* old residue 103 adding: *1148* *103* *Ala* *C* *C* *178.527* *.* *1* old residue 103 adding: *1149* *103* *Ala* *CA* *C* *54.648* *.* *1* old residue 103 adding: *1150* *103* *Ala* *CB* *C* *18.604* *.* *1* old residue 103 adding: *1151* *103* *Ala* *N* *N* *120.139* *.* *1* new residue 104 adding: *1152* *104* *Asp* *H* *H* *8.033* *.* *1* old residue 104 adding: *1153* *104* *Asp* *HA* *H* *4.811* *.* *1* old residue 104 adding: *1154* *104* *Asp* *HB2* *H* *2.834* *.* *2* old residue 104 adding: *1155* *104* *Asp* *HB3* *H* *2.673* *.* *2* old residue 104 adding: *1156* *104* *Asp* *C* *C* *176.113* *.* *1* old residue 104 adding: *1157* *104* *Asp* *CA* *C* *54.077* *.* *1* old residue 104 adding: *1158* *104* *Asp* *CB* *C* *41.899* *.* *1* old residue 104 adding: *1159* *104* *Asp* *N* *N* *116.590* *.* *1* new residue 105 adding: *1160* *105* *Gly* *H* *H* *8.196* *.* *1* old residue 105 adding: *1161* *105* *Gly* *HA2* *H* *4.293* *.* *2* old residue 105 adding: *1162* *105* *Gly* *HA3* *H* *3.657* *.* *2* old residue 105 adding: *1163* *105* *Gly* *C* *C* *173.635* *.* *1* old residue 105 adding: *1164* *105* *Gly* *CA* *C* *45.741* *.* *1* old residue 105 adding: *1165* *105* *Gly* *N* *N* *107.882* *.* *1* new residue 106 adding: *1166* *106* *Val* *H* *H* *8.886* *.* *1* old residue 106 adding: *1167* *106* *Val* *HA* *H* *4.082* *.* *1* old residue 106 adding: *1168* *106* *Val* *HB* *H* *2.304* *.* *1* old residue 106 adding: *1169* *106* *Val* *HG1* *H* *0.849* *.* *1* old residue 106 adding: *1170* *106* *Val* *HG2* *H* *0.904* *.* *1* old residue 106 adding: *1171* *106* *Val* *C* *C* *175.529* *.* *1* old residue 106 adding: *1172* *106* *Val* *CA* *C* *61.360* *.* *1* old residue 106 adding: *1173* *106* *Val* *CB* *C* *32.373* *.* *1* old residue 106 adding: *1174* *106* *Val* *CG1* *C* *20.394* *.* *1* old residue 106 adding: *1175* *106* *Val* *CG2* *C* *22.470* *.* *1* old residue 106 adding: *1176* *106* *Val* *N* *N* *125.585* *.* *1* new residue 107 adding: *1177* *107* *Pro* *HA* *H* *4.737* *.* *1* old residue 107 adding: *1178* *107* *Pro* *HB2* *H* *1.963* *.* *2* old residue 107 adding: *1179* *107* *Pro* *HB3* *H* *1.576* *.* *2* old residue 107 adding: *1180* *107* *Pro* *HG2* *H* *1.890* *.* *2* old residue 107 adding: *1181* *107* *Pro* *HG3* *H* *1.753* *.* *2* old residue 107 adding: *1182* *107* *Pro* *HD2* *H* *4.206* *.* *2* old residue 107 adding: *1183* *107* *Pro* *HD3* *H* *3.179* *.* *2* old residue 107 adding: *1184* *107* *Pro* *C* *C* *176.029* *.* *1* old residue 107 adding: *1185* *107* *Pro* *CA* *C* *62.674* *.* *1* old residue 107 adding: *1186* *107* *Pro* *CB* *C* *31.789* *.* *1* old residue 107 adding: *1187* *107* *Pro* *CG* *C* *28.235* *.* *1* old residue 107 adding: *1188* *107* *Pro* *CD* *C* *51.318* *.* *1* new residue 108 adding: *1189* *108* *Gln* *H* *H* *8.563* *.* *1* old residue 108 adding: *1190* *108* *Gln* *HA* *H* *4.498* *.* *1* old residue 108 adding: *1191* *108* *Gln* *HB2* *H* *2.146* *.* *2* old residue 108 adding: *1192* *108* *Gln* *HB3* *H* *2.058* *.* *2* old residue 108 adding: *1193* *108* *Gln* *HG2* *H* *2.429* *.* *2* old residue 108 adding: *1194* *108* *Gln* *HG3* *H* *2.429* *.* *2* old residue 108 adding: *1195* *108* *Gln* *HE21* *H* *7.180* *.* *1* old residue 108 adding: *1196* *108* *Gln* *HE22* *H* *6.986* *.* *1* old residue 108 adding: *1197* *108* *Gln* *C* *C* *176.218* *.* *1* old residue 108 adding: *1198* *108* *Gln* *CA* *C* *54.901* *.* *1* old residue 108 adding: *1199* *108* *Gln* *CB* *C* *29.514* *.* *1* old residue 108 adding: *1200* *108* *Gln* *CG* *C* *33.990* *.* *1* old residue 108 adding: *1201* *108* *Gln* *CD* *C* *180.223* *.* *1* old residue 108 adding: *1202* *108* *Gln* *N* *N* *122.641* *.* *1* old residue 108 adding: *1203* *108* *Gln* *NE2* *N* *114.932* *.* *1* new residue 109 adding: *1204* *109* *Leu* *H* *H* *8.853* *.* *1* old residue 109 adding: *1205* *109* *Leu* *HA* *H* *4.330* *.* *1* old residue 109 adding: *1206* *109* *Leu* *HB2* *H* *1.574* *.* *2* old residue 109 adding: *1207* *109* *Leu* *HB3* *H* *1.491* *.* *2* old residue 109 adding: *1208* *109* *Leu* *HG* *H* *1.502* *.* *1* old residue 109 adding: *1209* *109* *Leu* *HD1* *H* *0.583* *.* *1* old residue 109 adding: *1210* *109* *Leu* *HD2* *H* *0.519* *.* *1* old residue 109 adding: *1211* *109* *Leu* *C* *C* *178.151* *.* *1* old residue 109 adding: *1212* *109* *Leu* *CA* *C* *56.522* *.* *1* old residue 109 adding: *1213* *109* *Leu* *CB* *C* *41.883* *.* *1* old residue 109 adding: *1214* *109* *Leu* *CG* *C* *29.942* *.* *1* old residue 109 adding: *1215* *109* *Leu* *CD1* *C* *26.160* *.* *1* old residue 109 adding: *1216* *109* *Leu* *CD2* *C* *26.725* *.* *1* old residue 109 adding: *1217* *109* *Leu* *N* *N* *125.974* *.* *1* new residue 110 adding: *1218* *110* *Gly* *H* *H* *8.809* *.* *1* old residue 110 adding: *1219* *110* *Gly* *HA2* *H* *3.952* *.* *2* old residue 110 adding: *1220* *110* *Gly* *HA3* *H* *3.551* *.* *2* old residue 110 adding: *1221* *110* *Gly* *C* *C* *176.002* *.* *1* old residue 110 adding: *1222* *110* *Gly* *CA* *C* *48.748* *.* *1* old residue 110 adding: *1223* *110* *Gly* *N* *N* *109.442* *.* *1* new residue 111 adding: *1224* *111* *Asp* *H* *H* *8.674* *.* *1* old residue 111 adding: *1225* *111* *Asp* *HA* *H* *4.317* *.* *1* old residue 111 adding: *1226* *111* *Asp* *HB2* *H* *2.336* *.* *2* old residue 111 adding: *1227* *111* *Asp* *HB3* *H* *1.946* *.* *2* old residue 111 adding: *1228* *111* *Asp* *C* *C* *177.159* *.* *1* old residue 111 adding: *1229* *111* *Asp* *CA* *C* *56.239* *.* *1* old residue 111 adding: *1230* *111* *Asp* *CB* *C* *39.791* *.* *1* old residue 111 adding: *1231* *111* *Asp* *N* *N* *119.503* *.* *1* new residue 112 adding: *1232* *112* *His* *H* *H* *7.471* *.* *1* old residue 112 adding: *1233* *112* *His* *HA* *H* *4.481* *.* *1* old residue 112 adding: *1234* *112* *His* *HB2* *H* *2.952* *.* *2* old residue 112 adding: *1235* *112* *His* *HB3* *H* *2.650* *.* *2* old residue 112 adding: *1236* *112* *His* *HD2* *H* *6.855* *.* *1* old residue 112 adding: *1237* *112* *His* *HE1* *H* *7.833* *.* *1* old residue 112 adding: *1238* *112* *His* *C* *C* *177.121* *.* *1* old residue 112 adding: *1239* *112* *His* *CA* *C* *56.692* *.* *1* old residue 112 adding: *1240* *112* *His* *CB* *C* *31.648* *.* *1* old residue 112 adding: *1241* *112* *His* *CD2* *C* *118.178* *.* *1* old residue 112 adding: *1242* *112* *His* *CE1* *C* *139.52* *.* *1* old residue 112 adding: *1243* *112* *His* *N* *N* *116.681* *.* *1* new residue 113 adding: *1244* *113* *Leu* *H* *H* *7.526* *.* *1* old residue 113 adding: *1245* *113* *Leu* *HA* *H* *4.148* *.* *1* old residue 113 adding: *1246* *113* *Leu* *HB2* *H* *1.594* *.* *2* old residue 113 adding: *1247* *113* *Leu* *HB3* *H* *1.357* *.* *2* old residue 113 adding: *1248* *113* *Leu* *HG* *H* *1.483* *.* *1* old residue 113 adding: *1249* *113* *Leu* *HD1* *H* *0.689* *.* *1* old residue 113 adding: *1250* *113* *Leu* *HD2* *H* *0.117* *.* *1* old residue 113 adding: *1251* *113* *Leu* *C* *C* *177.363* *.* *1* old residue 113 adding: *1252* *113* *Leu* *CA* *C* *55.509* *.* *1* old residue 113 adding: *1253* *113* *Leu* *CB* *C* *42.009* *.* *1* old residue 113 adding: *1254* *113* *Leu* *CG* *C* *26.065* *.* *1* old residue 113 adding: *1255* *113* *Leu* *CD1* *C* *25.942* *.* *1* old residue 113 adding: *1256* *113* *Leu* *CD2* *C* *21.531* *.* *1* old residue 113 adding: *1257* *113* *Leu* *N* *N* *118.976* *.* *1* new residue 114 adding: *1258* *114* *Ala* *H* *H* *7.648* *.* *1* old residue 114 adding: *1259* *114* *Ala* *HA* *H* *4.227* *.* *1* old residue 114 adding: *1260* *114* *Ala* *HB* *H* *1.373* *.* *1* old residue 114 adding: *1261* *114* *Ala* *C* *C* *177.692* *.* *1* old residue 114 adding: *1262* *114* *Ala* *CA* *C* *52.828* *.* *1* old residue 114 adding: *1263* *114* *Ala* *CB* *C* *18.497* *.* *1* old residue 114 adding: *1264* *114* *Ala* *N* *N* *121.893* *.* *1* new residue 115 adding: *1265* *115* *Leu* *H* *H* *7.764* *.* *1* old residue 115 adding: *1266* *115* *Leu* *HA* *H* *4.146* *.* *1* old residue 115 adding: *1267* *115* *Leu* *HB2* *H* *1.632* *.* *2* old residue 115 adding: *1268* *115* *Leu* *HB3* *H* *1.487* *.* *2* old residue 115 adding: *1269* *115* *Leu* *HG* *H* *1.644* *.* *1* old residue 115 adding: *1270* *115* *Leu* *HD1* *H* *0.895* *.* *1* old residue 115 adding: *1271* *115* *Leu* *HD2* *H* *0.809* *.* *1* old residue 115 adding: *1272* *115* *Leu* *C* *C* *177.819* *.* *1* old residue 115 adding: *1273* *115* *Leu* *CA* *C* *55.771* *.* *1* old residue 115 adding: *1274* *115* *Leu* *CB* *C* *42.000* *.* *1* old residue 115 adding: *1275* *115* *Leu* *CG* *C* *26.714* *.* *1* old residue 115 adding: *1276* *115* *Leu* *CD1* *C* *25.072* *.* *1* old residue 115 adding: *1277* *115* *Leu* *CD2* *C* *23.070* *.* *1* old residue 115 adding: *1278* *115* *Leu* *N* *N* *119.576* *.* *1* new residue 116 adding: *1279* *116* *Glu* *H* *H* *8.095* *.* *1* old residue 116 adding: *1280* *116* *Glu* *HA* *H* *4.145* *.* *1* old residue 116 adding: *1281* *116* *Glu* *HB2* *H* *1.904* *.* *2* old residue 116 adding: *1282* *116* *Glu* *HB3* *H* *1.904* *.* *2* old residue 116 adding: *1283* *116* *Glu* *HG2* *H* *2.235* *.* *2* old residue 116 adding: *1284* *116* *Glu* *HG3* *H* *2.116* *.* *2* old residue 116 adding: *1285* *116* *Glu* *C* *C* *176.361* *.* *1* old residue 116 adding: *1286* *116* *Glu* *CA* *C* *56.975* *.* *1* old residue 116 adding: *1287* *116* *Glu* *CB* *C* *30.137* *.* *1* old residue 116 adding: *1288* *116* *Glu* *CG* *C* *36.209* *.* *1* old residue 116 adding: *1289* *116* *Glu* *N* *N* *119.657* *.* *1* seqcode size is : 116 seqcode: 33 shift counts are : 18 seqcode: 32 shift counts are : 6 seqcode: 90 shift counts are : 11 seqcode: 63 shift counts are : 7 seqcode: 21 shift counts are : 16 seqcode: 71 shift counts are : 17 seqcode: 102 shift counts are : 8 seqcode: 7 shift counts are : 14 seqcode: 80 shift counts are : 16 seqcode: 26 shift counts are : 7 seqcode: 99 shift counts are : 14 seqcode: 18 shift counts are : 7 seqcode: 72 shift counts are : 20 seqcode: 16 shift counts are : 7 seqcode: 44 shift counts are : 11 seqcode: 55 shift counts are : 12 seqcode: 74 shift counts are : 7 seqcode: 27 shift counts are : 11 seqcode: 84 shift counts are : 14 seqcode: 95 shift counts are : 16 seqcode: 57 shift counts are : 11 seqcode: 61 shift counts are : 11 seqcode: 108 shift counts are : 15 seqcode: 115 shift counts are : 14 seqcode: 20 shift counts are : 6 seqcode: 109 shift counts are : 14 seqcode: 92 shift counts are : 11 seqcode: 103 shift counts are : 7 seqcode: 89 shift counts are : 14 seqcode: 10 shift counts are : 16 seqcode: 31 shift counts are : 8 seqcode: 113 shift counts are : 14 seqcode: 35 shift counts are : 10 seqcode: 11 shift counts are : 7 seqcode: 91 shift counts are : 8 seqcode: 78 shift counts are : 6 seqcode: 107 shift counts are : 12 seqcode: 48 shift counts are : 17 seqcode: 87 shift counts are : 12 seqcode: 93 shift counts are : 11 seqcode: 77 shift counts are : 1 seqcode: 106 shift counts are : 11 seqcode: 65 shift counts are : 12 seqcode: 29 shift counts are : 14 seqcode: 50 shift counts are : 14 seqcode: 39 shift counts are : 6 seqcode: 64 shift counts are : 11 seqcode: 97 shift counts are : 7 seqcode: 114 shift counts are : 7 seqcode: 58 shift counts are : 14 seqcode: 41 shift counts are : 15 seqcode: 12 shift counts are : 11 seqcode: 15 shift counts are : 7 seqcode: 81 shift counts are : 18 seqcode: 52 shift counts are : 6 seqcode: 60 shift counts are : 7 seqcode: 56 shift counts are : 14 seqcode: 101 shift counts are : 14 seqcode: 73 shift counts are : 11 seqcode: 66 shift counts are : 14 seqcode: 45 shift counts are : 9 seqcode: 86 shift counts are : 16 seqcode: 76 shift counts are : 12 seqcode: 19 shift counts are : 15 seqcode: 62 shift counts are : 11 seqcode: 54 shift counts are : 7 seqcode: 67 shift counts are : 6 seqcode: 70 shift counts are : 14 seqcode: 68 shift counts are : 11 seqcode: 2 shift counts are : 7 seqcode: 17 shift counts are : 17 seqcode: 1 shift counts are : 9 seqcode: 116 shift counts are : 11 seqcode: 88 shift counts are : 14 seqcode: 30 shift counts are : 7 seqcode: 100 shift counts are : 8 seqcode: 110 shift counts are : 6 seqcode: 82 shift counts are : 12 seqcode: 25 shift counts are : 8 seqcode: 28 shift counts are : 8 seqcode: 83 shift counts are : 10 seqcode: 75 shift counts are : 8 seqcode: 40 shift counts are : 11 seqcode: 14 shift counts are : 8 seqcode: 112 shift counts are : 12 seqcode: 69 shift counts are : 8 seqcode: 59 shift counts are : 14 seqcode: 49 shift counts are : 20 seqcode: 24 shift counts are : 4 seqcode: 104 shift counts are : 8 seqcode: 53 shift counts are : 15 seqcode: 79 shift counts are : 7 seqcode: 22 shift counts are : 12 seqcode: 42 shift counts are : 7 seqcode: 46 shift counts are : 7 seqcode: 23 shift counts are : 11 seqcode: 13 shift counts are : 20 seqcode: 105 shift counts are : 6 seqcode: 96 shift counts are : 11 seqcode: 6 shift counts are : 17 seqcode: 85 shift counts are : 16 seqcode: 3 shift counts are : 14 seqcode: 36 shift counts are : 14 seqcode: 94 shift counts are : 9 seqcode: 111 shift counts are : 8 seqcode: 9 shift counts are : 8 seqcode: 51 shift counts are : 16 seqcode: 47 shift counts are : 7 seqcode: 8 shift counts are : 14 seqcode: 38 shift counts are : 7 seqcode: 98 shift counts are : 8 seqcode: 4 shift counts are : 14 seqcode: 34 shift counts are : 14 seqcode: 37 shift counts are : 8 seqcode: 43 shift counts are : 15 seqcode: 5 shift counts are : 16 setting ambig code at 1018 for HG2 to 2 setting ambig code at 1017 for HG1 to 2 setting ambig code at 1113 for HD2 to 2 setting ambig code at 1112 for HD1 to 2 setting ambig code at 302 for HG2 to 2 setting ambig code at 301 for HG1 to 2 setting ambig code at 935 for HD2 to 2 setting ambig code at 934 for HD1 to 2 setting ambig code at 636 for HG2 to 2 setting ambig code at 635 for HG1 to 2 setting ambig code at 682 for HG2 to 2 setting ambig code at 681 for HG1 to 2 setting ambig code at 1277 for HD2 to 2 setting ambig code at 1276 for HD1 to 2 setting ambig code at 1216 for HD2 to 2 setting ambig code at 1215 for HD1 to 2 setting ambig code at 1007 for HD2 to 2 setting ambig code at 1006 for HD1 to 2 setting ambig code at 1256 for HD2 to 2 setting ambig code at 1255 for HD1 to 2 setting ambig code at 1048 for HG2 to 2 setting ambig code at 1047 for HG1 to 2 setting ambig code at 1175 for HG2 to 2 setting ambig code at 1174 for HG1 to 2 setting ambig code at 324 for HD2 to 2 setting ambig code at 323 for HD1 to 2 setting ambig code at 650 for HD2 to 2 setting ambig code at 649 for HD1 to 2 setting ambig code at 625 for HD2 to 2 setting ambig code at 624 for HD1 to 2 setting ambig code at 1135 for HD2 to 2 setting ambig code at 1134 for HD1 to 2 setting ambig code at 737 for HD2 to 2 setting ambig code at 736 for HD1 to 2 setting ambig code at 776 for HD2 to 2 setting ambig code at 775 for HD1 to 2 setting ambig code at 993 for HD2 to 2 setting ambig code at 992 for HD1 to 2 setting ambig code at 664 for HD2 to 2 setting ambig code at 663 for HD1 to 2 setting ambig code at 29 for HD2 to 2 setting ambig code at 28 for HD1 to 2 setting ambig code at 401 for HD2 to 2 setting ambig code at 400 for HD1 to 2 setting ambig code at 104 for HD2 to 2 setting ambig code at 103 for HD1 to 2 1 1 MET HB2 H 2.652 . 2 2 1 MET HB3 H 2.574 . 2 3 1 MET HG2 H 2.163 . 2 4 1 MET HG3 H 2.132 . 2 5 1 MET HE H 2.062 . 1 6 1 MET CA C 55.065 . 1 7 1 MET CB C 31.572 . 1 8 1 MET CG C 33.129 . 1 9 1 MET CE C 17.175 . 1 10 2 THR HA H 3.833 . 1 11 2 THR HB H 4.294 . 1 12 2 THR HG2 H 1.377 . 1 13 2 THR C C 170.665 . 1 14 2 THR CA C 62.154 . 1 15 2 THR CB C 69.580 . 1 16 2 THR CG2 C 20.909 . 1 17 3 LEU H H 9.068 . 1 18 3 LEU HA H 4.887 . 1 19 3 LEU HB2 H 1.767 . 2 20 3 LEU HB3 H 0.762 . 2 21 3 LEU HG H 1.619 . 1 22 3 LEU HD1 H 0.840 . 2 23 3 LEU HD2 H 0.619 . 2 24 3 LEU C C 175.859 . 1 25 3 LEU CA C 54.426 . 1 26 3 LEU CB C 43.222 . 1 27 3 LEU CG C 26.616 . 1 28 3 LEU CD1 C 25.928 . 2 29 3 LEU CD2 C 23.342 . 2 30 3 LEU N N 129.030 . 1 31 4 ILE H H 8.897 . 1 32 4 ILE HA H 4.753 . 1 33 4 ILE HB H 1.680 . 1 34 4 ILE HG12 H 1.090 . 2 35 4 ILE HG13 H 1.091 . 2 36 4 ILE HG2 H 0.927 . 1 37 4 ILE HD1 H 0.555 . 1 38 4 ILE C C 174.211 . 1 39 4 ILE CA C 59.998 . 1 40 4 ILE CB C 41.129 . 1 41 4 ILE CG1 C 24.360 . 1 42 4 ILE CG2 C 18.723 . 1 43 4 ILE CD1 C 15.918 . 1 44 4 ILE N N 115.702 . 1 45 5 TYR H H 9.050 . 1 46 5 TYR HA H 5.770 . 1 47 5 TYR HB2 H 2.823 . 2 48 5 TYR HB3 H 2.413 . 2 49 5 TYR HD1 H 6.852 . 1 50 5 TYR HD2 H 6.852 . 1 51 5 TYR HE1 H 6.583 . 1 52 5 TYR HE2 H 6.583 . 1 53 5 TYR C C 175.987 . 1 54 5 TYR CA C 57.923 . 1 55 5 TYR CB C 42.963 . 1 56 5 TYR CD1 C 132.618 . 1 57 5 TYR CD2 C 132.618 . 1 58 5 TYR CE1 C 117.633 . 1 59 5 TYR CE2 C 117.633 . 1 60 5 TYR N N 114.414 . 1 61 6 LYS H H 8.858 . 1 62 6 LYS HA H 4.813 . 1 63 6 LYS HB2 H 1.623 . 2 64 6 LYS HB3 H 1.463 . 2 65 6 LYS HG2 H 1.086 . 2 66 6 LYS HG3 H 1.014 . 2 67 6 LYS HD2 H 2.438 . 2 68 6 LYS HD3 H 1.743 . 2 69 6 LYS HE2 H 3.264 . 2 70 6 LYS HE3 H 3.095 . 2 71 6 LYS C C 172.801 . 1 72 6 LYS CA C 52.969 . 1 73 6 LYS CB C 37.109 . 1 74 6 LYS CG C 24.694 . 1 75 6 LYS CD C 29.490 . 1 76 6 LYS CE C 41.732 . 1 77 6 LYS N N 121.597 . 1 78 7 ILE H H 8.277 . 1 79 7 ILE HA H 4.702 . 1 80 7 ILE HB H 0.918 . 1 81 7 ILE HG12 H 1.379 . 2 82 7 ILE HG13 H 0.488 . 2 83 7 ILE HG2 H -0.165 . 1 84 7 ILE HD1 H 0.619 . 1 85 7 ILE C C 173.742 . 1 86 7 ILE CA C 60.340 . 1 87 7 ILE CB C 38.941 . 1 88 7 ILE CG1 C 28.802 . 1 89 7 ILE CG2 C 18.147 . 1 90 7 ILE CD1 C 14.670 . 1 91 7 ILE N N 128.212 . 1 92 8 LEU H H 8.627 . 1 93 8 LEU HA H 4.757 . 1 94 8 LEU HB2 H 1.753 . 2 95 8 LEU HB3 H 1.324 . 2 96 8 LEU HG H 1.681 . 1 97 8 LEU HD1 H 0.144 . 2 98 8 LEU HD2 H 0.241 . 2 99 8 LEU C C 173.661 . 1 100 8 LEU CA C 54.530 . 1 101 8 LEU CB C 43.617 . 1 102 8 LEU CG C 26.824 . 1 103 8 LEU CD1 C 26.781 . 2 104 8 LEU CD2 C 25.495 . 2 105 8 LEU N N 126.590 . 1 106 9 SER H H 8.546 . 1 107 9 SER HA H 4.765 . 1 108 9 SER HB2 H 4.503 . 2 109 9 SER HB3 H 4.151 . 2 110 9 SER C C 175.160 . 1 111 9 SER CA C 58.520 . 1 112 9 SER CB C 65.227 . 1 113 9 SER N N 115.543 . 1 114 10 ARG H H 9.080 . 1 115 10 ARG HA H 4.037 . 1 116 10 ARG HB2 H 2.079 . 2 117 10 ARG HB3 H 1.932 . 2 118 10 ARG HG2 H 1.836 . 2 119 10 ARG HG3 H 1.655 . 2 120 10 ARG HD2 H 3.366 . 2 121 10 ARG HD3 H 3.265 . 2 122 10 ARG HE H 7.334 . 1 123 10 ARG C C 177.847 . 1 124 10 ARG CA C 59.210 . 1 125 10 ARG CB C 28.776 . 1 126 10 ARG CG C 25.745 . 1 127 10 ARG CD C 42.632 . 1 128 10 ARG N N 123.688 . 1 129 10 ARG NE N 83.512 . 1 130 11 ALA H H 8.753 . 1 131 11 ALA HA H 4.248 . 1 132 11 ALA HB H 1.488 . 1 133 11 ALA C C 181.848 . 1 134 11 ALA CA C 55.483 . 1 135 11 ALA CB C 18.209 . 1 136 11 ALA N N 119.698 . 1 137 12 GLU H H 7.957 . 1 138 12 GLU HA H 4.183 . 1 139 12 GLU HB2 H 2.466 . 2 140 12 GLU HB3 H 2.173 . 2 141 12 GLU HG2 H 2.479 . 2 142 12 GLU HG3 H 2.434 . 2 143 12 GLU C C 179.576 . 1 144 12 GLU CA C 59.103 . 1 145 12 GLU CB C 31.077 . 1 146 12 GLU CG C 37.995 . 1 147 12 GLU N N 118.210 . 1 148 13 TRP H H 8.585 . 1 149 13 TRP HA H 4.937 . 1 150 13 TRP HB2 H 3.195 . 2 151 13 TRP HB3 H 2.955 . 2 152 13 TRP HD1 H 7.029 . 1 153 13 TRP HE1 H 10.406 . 1 154 13 TRP HE3 H 7.137 . 1 155 13 TRP HZ2 H 7.336 . 1 156 13 TRP HZ3 H 6.474 . 1 157 13 TRP HH2 H 6.924 . 1 158 13 TRP C C 176.827 . 1 159 13 TRP CA C 57.845 . 1 160 13 TRP CB C 31.010 . 1 161 13 TRP CD1 C 126.972 . 1 162 13 TRP CE3 C 122.786 . 1 163 13 TRP CZ2 C 114.514 . 1 164 13 TRP CZ3 C 119.949 . 1 165 13 TRP CH2 C 124.353 . 1 166 13 TRP N N 123.646 . 1 167 13 TRP NE1 N 129.669 . 1 168 14 ASP H H 9.260 . 1 169 14 ASP HA H 4.048 . 1 170 14 ASP HB2 H 2.657 . 2 171 14 ASP HB3 H 2.479 . 2 172 14 ASP C C 180.120 . 1 173 14 ASP CA C 57.767 . 1 174 14 ASP CB C 39.467 . 1 175 14 ASP N N 120.253 . 1 176 15 ALA H H 7.599 . 1 177 15 ALA HA H 4.163 . 1 178 15 ALA HB H 1.540 . 1 179 15 ALA C C 180.115 . 1 180 15 ALA CA C 55.016 . 1 181 15 ALA CB C 17.871 . 1 182 15 ALA N N 122.164 . 1 183 16 ALA H H 7.944 . 1 184 16 ALA HA H 4.334 . 1 185 16 ALA HB H 1.585 . 1 186 16 ALA C C 180.101 . 1 187 16 ALA CA C 54.659 . 1 188 16 ALA CB C 19.107 . 1 189 16 ALA N N 122.526 . 1 190 17 LYS H H 8.317 . 1 191 17 LYS HA H 3.462 . 1 192 17 LYS HB2 H 1.387 . 2 193 17 LYS HB3 H 1.353 . 2 194 17 LYS HG2 H 0.439 . 2 195 17 LYS HG3 H 0.234 . 2 196 17 LYS HD2 H 1.233 . 2 197 17 LYS HD3 H 1.197 . 2 198 17 LYS HE2 H 2.515 . 2 199 17 LYS HE3 H 2.327 . 2 200 17 LYS C C 179.126 . 1 201 17 LYS CA C 60.077 . 1 202 17 LYS CB C 31.431 . 1 203 17 LYS CG C 25.304 . 1 204 17 LYS CD C 29.171 . 1 205 17 LYS CE C 41.493 . 1 206 17 LYS N N 117.572 . 1 207 18 ALA H H 7.296 . 1 208 18 ALA HA H 4.100 . 1 209 18 ALA HB H 1.474 . 1 210 18 ALA C C 178.940 . 1 211 18 ALA CA C 54.513 . 1 212 18 ALA CB C 18.132 . 1 213 18 ALA N N 119.644 . 1 214 19 GLN H H 7.443 . 1 215 19 GLN HA H 4.535 . 1 216 19 GLN HB2 H 2.256 . 2 217 19 GLN HB3 H 2.256 . 2 218 19 GLN HG2 H 2.670 . 2 219 19 GLN HG3 H 2.515 . 2 220 19 GLN HE21 H 7.411 . 1 221 19 GLN HE22 H 6.959 . 1 222 19 GLN C C 176.607 . 1 223 19 GLN CA C 55.755 . 1 224 19 GLN CB C 30.075 . 1 225 19 GLN CG C 33.449 . 1 226 19 GLN CD C 179.803 . 1 227 19 GLN N N 113.538 . 1 228 19 GLN NE2 N 111.095 . 1 229 20 GLY H H 8.277 . 1 230 20 GLY HA2 H 4.450 . 2 231 20 GLY HA3 H 3.627 . 2 232 20 GLY C C 174.006 . 1 233 20 GLY CA C 45.567 . 1 234 20 GLY N N 108.233 . 1 235 21 ARG H H 7.786 . 1 236 21 ARG HA H 5.123 . 1 237 21 ARG HB2 H 1.987 . 2 238 21 ARG HB3 H 1.397 . 2 239 21 ARG HG2 H 1.493 . 2 240 21 ARG HG3 H 1.222 . 2 241 21 ARG HD2 H 3.051 . 2 242 21 ARG HD3 H 2.901 . 2 243 21 ARG HE H 7.607 . 1 244 21 ARG C C 171.553 . 1 245 21 ARG CA C 54.882 . 1 246 21 ARG CB C 32.114 . 1 247 21 ARG CG C 25.655 . 1 248 21 ARG CD C 43.481 . 1 249 21 ARG N N 116.837 . 1 250 21 ARG NE N 84.131 . 1 251 22 PHE H H 9.821 . 1 252 22 PHE HA H 5.185 . 1 253 22 PHE HB2 H 3.033 . 2 254 22 PHE HB3 H 3.033 . 2 255 22 PHE HD1 H 7.292 . 1 256 22 PHE HD2 H 7.292 . 1 257 22 PHE C C 173.825 . 1 258 22 PHE CA C 54.913 . 1 259 22 PHE CB C 41.568 . 1 260 22 PHE CD1 C 131.421 . 1 261 22 PHE CD2 C 131.421 . 1 262 22 PHE N N 121.680 . 1 263 23 GLU H H 9.053 . 1 264 23 GLU HA H 3.893 . 1 265 23 GLU HB2 H 1.990 . 2 266 23 GLU HB3 H 1.812 . 2 267 23 GLU HG2 H 2.117 . 2 268 23 GLU HG3 H 1.904 . 2 269 23 GLU C C 174.856 . 1 270 23 GLU CA C 56.781 . 1 271 23 GLU CB C 29.990 . 1 272 23 GLU CG C 37.296 . 1 273 23 GLU N N 125.059 . 1 274 24 GLY HA2 H 4.212 . 2 275 24 GLY HA3 H 3.112 . 2 276 24 GLY C C 173.311 . 1 277 24 GLY CA C 45.104 . 1 278 25 SER H H 9.877 . 1 279 25 SER HA H 4.884 . 1 280 25 SER HB2 H 4.324 . 2 281 25 SER HB3 H 4.324 . 2 282 25 SER C C 173.788 . 1 283 25 SER CA C 57.549 . 1 284 25 SER CB C 65.383 . 1 285 25 SER N N 121.073 . 1 286 26 ALA H H 9.097 . 1 287 26 ALA HA H 3.964 . 1 288 26 ALA HB H 1.443 . 1 289 26 ALA C C 181.102 . 1 290 26 ALA CA C 56.670 . 1 291 26 ALA CB C 17.927 . 1 292 26 ALA N N 123.398 . 1 293 27 VAL H H 7.928 . 1 294 27 VAL HA H 3.593 . 1 295 27 VAL HB H 1.590 . 1 296 27 VAL HG1 H 0.429 . 2 297 27 VAL HG2 H 0.669 . 2 298 27 VAL C C 176.628 . 1 299 27 VAL CA C 65.257 . 1 300 27 VAL CB C 31.688 . 1 301 27 VAL CG1 C 20.439 . 2 302 27 VAL CG2 C 21.878 . 2 303 27 VAL N N 117.697 . 1 304 28 ASP H H 6.927 . 1 305 28 ASP HA H 4.512 . 1 306 28 ASP HB2 H 2.925 . 2 307 28 ASP HB3 H 2.658 . 2 308 28 ASP C C 178.402 . 1 309 28 ASP CA C 56.586 . 1 310 28 ASP CB C 41.317 . 1 311 28 ASP N N 121.516 . 1 312 29 LEU H H 8.309 . 1 313 29 LEU HA H 3.764 . 1 314 29 LEU HB2 H 1.597 . 2 315 29 LEU HB3 H 1.283 . 2 316 29 LEU HG H 1.391 . 1 317 29 LEU HD1 H 0.627 . 2 318 29 LEU HD2 H 0.565 . 2 319 29 LEU C C 180.093 . 1 320 29 LEU CA C 57.091 . 1 321 29 LEU CB C 41.418 . 1 322 29 LEU CG C 26.923 . 1 323 29 LEU CD1 C 25.153 . 2 324 29 LEU CD2 C 22.333 . 2 325 29 LEU N N 118.648 . 1 326 30 ALA H H 7.458 . 1 327 30 ALA HA H 4.000 . 1 328 30 ALA HB H 1.356 . 1 329 30 ALA C C 179.371 . 1 330 30 ALA CA C 54.526 . 1 331 30 ALA CB C 18.102 . 1 332 30 ALA N N 120.814 . 1 333 31 ASP H H 7.682 . 1 334 31 ASP HA H 4.410 . 1 335 31 ASP HB2 H 1.854 . 2 336 31 ASP HB3 H 1.854 . 2 337 31 ASP C C 176.610 . 1 338 31 ASP CA C 55.271 . 1 339 31 ASP CB C 40.083 . 1 340 31 ASP N N 117.191 . 1 341 32 GLY H H 7.909 . 1 342 32 GLY HA2 H 4.090 . 2 343 32 GLY HA3 H 3.597 . 2 344 32 GLY C C 173.168 . 1 345 32 GLY CA C 45.112 . 1 346 32 GLY N N 106.983 . 1 347 33 PHE H H 7.233 . 1 348 33 PHE HA H 4.212 . 1 349 33 PHE HB2 H 1.837 . 2 350 33 PHE HB3 H 1.454 . 2 351 33 PHE HD1 H 5.987 . 1 352 33 PHE HD2 H 5.987 . 1 353 33 PHE HE1 H 5.587 . 1 354 33 PHE HE2 H 5.587 . 1 355 33 PHE HZ H 6.544 . 1 356 33 PHE C C 171.389 . 1 357 33 PHE CA C 55.383 . 1 358 33 PHE CB C 37.177 . 1 359 33 PHE CD1 C 132.280 . 1 360 33 PHE CD2 C 132.280 . 1 361 33 PHE CE1 C 128.773 . 1 362 33 PHE CE2 C 128.773 . 1 363 33 PHE CZ C 127.426 . 1 364 33 PHE N N 115.364 . 1 365 34 ILE H H 8.637 . 1 366 34 ILE HA H 3.817 . 1 367 34 ILE HB H 1.874 . 1 368 34 ILE HG12 H 1.632 . 2 369 34 ILE HG13 H 0.582 . 2 370 34 ILE HG2 H 0.901 . 1 371 34 ILE HD1 H 0.818 . 1 372 34 ILE C C 177.018 . 1 373 34 ILE CA C 60.724 . 1 374 34 ILE CB C 39.266 . 1 375 34 ILE CG1 C 28.859 . 1 376 34 ILE CG2 C 17.198 . 1 377 34 ILE CD1 C 14.167 . 1 378 34 ILE N N 114.086 . 1 379 35 HIS H H 9.203 . 1 380 35 HIS HA H 4.448 . 1 381 35 HIS HB2 H 3.362 . 2 382 35 HIS HB3 H 3.163 . 2 383 35 HIS HD2 H 7.457 . 1 384 35 HIS C C 175.740 . 1 385 35 HIS CA C 57.757 . 1 386 35 HIS CB C 29.758 . 1 387 35 HIS CD2 C 120.404 . 1 388 35 HIS N N 127.988 . 1 389 36 LEU H H 8.454 . 1 390 36 LEU HA H 5.190 . 1 391 36 LEU HB2 H 1.645 . 2 392 36 LEU HB3 H 1.550 . 2 393 36 LEU HG H 1.612 . 1 394 36 LEU HD1 H 0.726 . 2 395 36 LEU HD2 H 0.670 . 2 396 36 LEU C C 174.813 . 1 397 36 LEU CA C 56.019 . 1 398 36 LEU CB C 44.541 . 1 399 36 LEU CG C 28.502 . 1 400 36 LEU CD1 C 27.876 . 2 401 36 LEU CD2 C 26.016 . 2 402 36 LEU N N 126.075 . 1 403 37 SER H H 9.128 . 1 404 37 SER HA H 5.277 . 1 405 37 SER HB2 H 3.966 . 2 406 37 SER HB3 H 3.640 . 2 407 37 SER C C 174.433 . 1 408 37 SER CA C 57.990 . 1 409 37 SER CB C 66.778 . 1 410 37 SER N N 112.795 . 1 411 38 ALA H H 9.665 . 1 412 38 ALA HA H 4.973 . 1 413 38 ALA HB H 1.785 . 1 414 38 ALA C C 179.640 . 1 415 38 ALA CA C 52.303 . 1 416 38 ALA CB C 19.350 . 1 417 38 ALA N N 127.103 . 1 418 39 GLY H H 10.159 . 1 419 39 GLY HA2 H 4.249 . 2 420 39 GLY HA3 H 3.720 . 2 421 39 GLY C C 176.229 . 1 422 39 GLY CA C 49.163 . 1 423 39 GLY N N 112.007 . 1 424 40 GLU H H 9.367 . 1 425 40 GLU HA H 4.234 . 1 426 40 GLU HB2 H 2.118 . 2 427 40 GLU HB3 H 2.118 . 2 428 40 GLU HG2 H 2.347 . 2 429 40 GLU HG3 H 2.347 . 2 430 40 GLU C C 176.417 . 1 431 40 GLU CA C 58.622 . 1 432 40 GLU CB C 28.796 . 1 433 40 GLU CG C 36.464 . 1 434 40 GLU N N 117.243 . 1 435 41 GLN H H 7.503 . 1 436 41 GLN HA H 4.752 . 1 437 41 GLN HB2 H 2.359 . 2 438 41 GLN HB3 H 2.359 . 2 439 41 GLN HG2 H 2.435 . 2 440 41 GLN HG3 H 2.209 . 2 441 41 GLN HE21 H 7.001 . 1 442 41 GLN HE22 H 6.282 . 1 443 41 GLN C C 177.730 . 1 444 41 GLN CA C 55.626 . 1 445 41 GLN CB C 30.653 . 1 446 41 GLN CG C 33.639 . 1 447 41 GLN CD C 178.406 . 1 448 41 GLN N N 115.837 . 1 449 41 GLN NE2 N 110.350 . 1 450 42 ALA H H 7.519 . 1 451 42 ALA HA H 3.927 . 1 452 42 ALA HB H 1.152 . 1 453 42 ALA C C 177.826 . 1 454 42 ALA CA C 56.706 . 1 455 42 ALA CB C 18.247 . 1 456 42 ALA N N 123.105 . 1 457 43 GLN H H 9.203 . 1 458 43 GLN HA H 3.942 . 1 459 43 GLN HB2 H 2.057 . 2 460 43 GLN HB3 H 1.970 . 2 461 43 GLN HG2 H 2.398 . 2 462 43 GLN HG3 H 2.335 . 2 463 43 GLN HE21 H 6.800 . 1 464 43 GLN HE22 H 8.095 . 1 465 43 GLN C C 177.913 . 1 466 43 GLN CA C 58.678 . 1 467 43 GLN CB C 28.815 . 1 468 43 GLN CG C 33.976 . 1 469 43 GLN CD C 179.894 . 1 470 43 GLN N N 118.650 . 1 471 43 GLN NE2 N 115.888 . 1 472 44 GLU H H 8.611 . 1 473 44 GLU HA H 4.207 . 1 474 44 GLU HB2 H 2.142 . 2 475 44 GLU HB3 H 2.142 . 2 476 44 GLU HG2 H 2.350 . 2 477 44 GLU HG3 H 2.350 . 2 478 44 GLU C C 179.090 . 1 479 44 GLU CA C 59.246 . 1 480 44 GLU CB C 28.850 . 1 481 44 GLU CG C 36.457 . 1 482 44 GLU N N 122.042 . 1 483 45 THR H H 8.292 . 1 484 45 THR HA H 4.123 . 1 485 45 THR HB H 4.505 . 1 486 45 THR HG2 H 1.499 . 1 487 45 THR C C 176.228 . 1 488 45 THR CA C 66.902 . 1 489 45 THR CB C 68.949 . 1 490 45 THR CG2 C 22.230 . 1 491 45 THR N N 117.583 . 1 492 46 ALA H H 8.275 . 1 493 46 ALA HA H 4.255 . 1 494 46 ALA HB H 1.390 . 1 495 46 ALA C C 178.630 . 1 496 46 ALA CA C 55.406 . 1 497 46 ALA CB C 18.482 . 1 498 46 ALA N N 123.184 . 1 499 47 ALA H H 8.066 . 1 500 47 ALA HA H 3.953 . 1 501 47 ALA HB H 1.522 . 1 502 47 ALA C C 178.552 . 1 503 47 ALA CA C 55.030 . 1 504 47 ALA CB C 18.899 . 1 505 47 ALA N N 117.129 . 1 506 48 LYS H H 8.089 . 1 507 48 LYS HA H 3.936 . 1 508 48 LYS HB2 H 1.542 . 2 509 48 LYS HB3 H 1.107 . 2 510 48 LYS HG2 H 0.879 . 2 511 48 LYS HG3 H 0.499 . 2 512 48 LYS HD2 H 1.382 . 2 513 48 LYS HD3 H 1.314 . 2 514 48 LYS HE2 H 2.670 . 2 515 48 LYS HE3 H 2.568 . 2 516 48 LYS C C 179.130 . 1 517 48 LYS CA C 58.560 . 1 518 48 LYS CB C 33.122 . 1 519 48 LYS CG C 24.793 . 1 520 48 LYS CD C 28.949 . 1 521 48 LYS CE C 42.070 . 1 522 48 LYS N N 115.322 . 1 523 49 TRP H H 7.978 . 1 524 49 TRP HA H 4.807 . 1 525 49 TRP HB2 H 2.906 . 2 526 49 TRP HB3 H 2.763 . 2 527 49 TRP HD1 H 7.380 . 1 528 49 TRP HE1 H 10.234 . 1 529 49 TRP HE3 H 7.633 . 1 530 49 TRP HZ2 H 7.408 . 1 531 49 TRP HZ3 H 7.083 . 1 532 49 TRP HH2 H 7.117 . 1 533 49 TRP C C 176.923 . 1 534 49 TRP CA C 57.157 . 1 535 49 TRP CB C 31.461 . 1 536 49 TRP CD1 C 127.545 . 1 537 49 TRP CE3 C 121.17 . 1 538 49 TRP CZ2 C 114.540 . 1 539 49 TRP CZ3 C 121.98 . 1 540 49 TRP CH2 C 124.694 . 1 541 49 TRP N N 114.492 . 1 542 49 TRP NE1 N 128.679 . 1 543 50 PHE H H 7.740 . 1 544 50 PHE HA H 4.925 . 1 545 50 PHE HB2 H 3.676 . 2 546 50 PHE HB3 H 2.930 . 2 547 50 PHE HD1 H 7.286 . 1 548 50 PHE HD2 H 7.286 . 1 549 50 PHE HZ H 7.345 . 1 550 50 PHE C C 174.160 . 1 551 50 PHE CA C 57.772 . 1 552 50 PHE CB C 39.610 . 1 553 50 PHE CD1 C 132.511 . 1 554 50 PHE CD2 C 132.511 . 1 555 50 PHE CZ C 130.44 . 1 556 50 PHE N N 116.540 . 1 557 51 ARG H H 7.389 . 1 558 51 ARG HA H 4.198 . 1 559 51 ARG HB2 H 2.027 . 2 560 51 ARG HB3 H 1.771 . 2 561 51 ARG HG2 H 1.545 . 2 562 51 ARG HG3 H 1.545 . 2 563 51 ARG HD2 H 3.212 . 2 564 51 ARG HD3 H 3.212 . 2 565 51 ARG HE H 7.237 . 1 566 51 ARG C C 179.130 . 1 567 51 ARG CA C 58.224 . 1 568 51 ARG CB C 30.032 . 1 569 51 ARG CG C 27.926 . 1 570 51 ARG CD C 43.448 . 1 571 51 ARG N N 119.136 . 1 572 51 ARG NE N 83.671 . 1 573 52 GLY H H 10.264 . 1 574 52 GLY HA2 H 4.180 . 2 575 52 GLY HA3 H 3.745 . 2 576 52 GLY C C 173.980 . 1 577 52 GLY CA C 45.517 . 1 578 52 GLY N N 114.192 . 1 579 53 GLN H H 7.597 . 1 580 53 GLN HA H 4.437 . 1 581 53 GLN HB2 H 2.257 . 2 582 53 GLN HB3 H 2.185 . 2 583 53 GLN HG2 H 2.321 . 2 584 53 GLN HG3 H 2.321 . 2 585 53 GLN HE21 H 7.888 . 1 586 53 GLN HE22 H 6.650 . 1 587 53 GLN C C 172.934 . 1 588 53 GLN CA C 56.280 . 1 589 53 GLN CB C 29.123 . 1 590 53 GLN CG C 33.921 . 1 591 53 GLN CD C 179.642 . 1 592 53 GLN N N 120.438 . 1 593 53 GLN NE2 N 112.642 . 1 594 54 ALA H H 8.190 . 1 595 54 ALA HA H 4.344 . 1 596 54 ALA HB H 1.426 . 1 597 54 ALA C C 177.278 . 1 598 54 ALA CA C 51.377 . 1 599 54 ALA CB C 20.525 . 1 600 54 ALA N N 124.528 . 1 601 55 ASN H H 8.903 . 1 602 55 ASN HA H 4.598 . 1 603 55 ASN HB2 H 3.022 . 2 604 55 ASN HB3 H 2.973 . 2 605 55 ASN HD21 H 7.781 . 1 606 55 ASN HD22 H 7.038 . 1 607 55 ASN C C 174.075 . 1 608 55 ASN CA C 53.986 . 1 609 55 ASN CB C 37.654 . 1 610 55 ASN CG C 178.754 . 1 611 55 ASN N N 113.776 . 1 612 55 ASN ND2 N 114.312 . 1 613 56 LEU H H 8.543 . 1 614 56 LEU HA H 4.677 . 1 615 56 LEU HB2 H 1.848 . 2 616 56 LEU HB3 H 0.961 . 2 617 56 LEU HG H 1.542 . 1 618 56 LEU HD1 H 0.865 . 2 619 56 LEU HD2 H 0.668 . 2 620 56 LEU C C 176.806 . 1 621 56 LEU CA C 54.383 . 1 622 56 LEU CB C 45.328 . 1 623 56 LEU CG C 25.890 . 1 624 56 LEU CD1 C 27.756 . 2 625 56 LEU CD2 C 21.881 . 2 626 56 LEU N N 117.411 . 1 627 57 VAL H H 9.207 . 1 628 57 VAL HA H 4.633 . 1 629 57 VAL HB H 1.504 . 1 630 57 VAL HG1 H 0.410 . 2 631 57 VAL HG2 H 0.754 . 2 632 57 VAL C C 172.465 . 1 633 57 VAL CA C 59.970 . 1 634 57 VAL CB C 35.376 . 1 635 57 VAL CG1 C 21.245 . 2 636 57 VAL CG2 C 21.284 . 2 637 57 VAL N N 121.448 . 1 638 58 LEU H H 8.855 . 1 639 58 LEU HA H 4.763 . 1 640 58 LEU HB2 H 1.583 . 2 641 58 LEU HB3 H 0.990 . 2 642 58 LEU HG H 1.306 . 1 643 58 LEU HD1 H 0.749 . 2 644 58 LEU HD2 H 0.589 . 2 645 58 LEU C C 175.349 . 1 646 58 LEU CA C 52.286 . 1 647 58 LEU CB C 46.390 . 1 648 58 LEU CG C 26.930 . 1 649 58 LEU CD1 C 24.750 . 2 650 58 LEU CD2 C 26.462 . 2 651 58 LEU N N 124.476 . 1 652 59 LEU H H 9.265 . 1 653 59 LEU HA H 4.714 . 1 654 59 LEU HB2 H 1.444 . 2 655 59 LEU HB3 H 0.848 . 2 656 59 LEU HG H 0.844 . 1 657 59 LEU HD1 H -0.321 . 2 658 59 LEU HD2 H -0.739 . 2 659 59 LEU C C 175.262 . 1 660 59 LEU CA C 52.753 . 1 661 59 LEU CB C 42.431 . 1 662 59 LEU CG C 24.912 . 1 663 59 LEU CD1 C 24.265 . 2 664 59 LEU CD2 C 20.074 . 2 665 59 LEU N N 125.973 . 1 666 60 ALA H H 8.331 . 1 667 60 ALA HA H 4.739 . 1 668 60 ALA HB H 1.235 . 1 669 60 ALA C C 175.631 . 1 670 60 ALA CA C 50.320 . 1 671 60 ALA CB C 21.744 . 1 672 60 ALA N N 124.617 . 1 673 61 VAL H H 8.944 . 1 674 61 VAL HA H 4.244 . 1 675 61 VAL HB H 1.648 . 1 676 61 VAL HG1 H 0.836 . 2 677 61 VAL HG2 H 0.649 . 2 678 61 VAL C C 174.674 . 1 679 61 VAL CA C 60.770 . 1 680 61 VAL CB C 36.636 . 1 681 61 VAL CG1 C 21.326 . 2 682 61 VAL CG2 C 21.164 . 2 683 61 VAL N N 124.079 . 1 684 62 GLU H H 8.490 . 1 685 62 GLU HA H 4.551 . 1 686 62 GLU HB2 H 1.909 . 2 687 62 GLU HB3 H 1.909 . 2 688 62 GLU HG2 H 2.327 . 2 689 62 GLU HG3 H 2.272 . 2 690 62 GLU C C 177.700 . 1 691 62 GLU CA C 56.879 . 1 692 62 GLU CB C 29.372 . 1 693 62 GLU CG C 35.511 . 1 694 62 GLU N N 127.752 . 1 695 63 ALA H H 9.173 . 1 696 63 ALA HA H 3.991 . 1 697 63 ALA HB H 1.474 . 1 698 63 ALA C C 180.311 . 1 699 63 ALA CA C 54.850 . 1 700 63 ALA CB C 19.495 . 1 701 63 ALA N N 127.466 . 1 702 64 GLU H H 9.571 . 1 703 64 GLU HA H 4.146 . 1 704 64 GLU HB2 H 2.338 . 2 705 64 GLU HB3 H 1.980 . 2 706 64 GLU HG2 H 2.750 . 2 707 64 GLU HG3 H 2.389 . 2 708 64 GLU C C 177.102 . 1 709 64 GLU CA C 63.532 . 1 710 64 GLU CB C 25.742 . 1 711 64 GLU CG C 38.226 . 1 712 64 GLU N N 120.368 . 1 713 65 PRO HA H 4.440 . 1 714 65 PRO HB2 H 2.405 . 2 715 65 PRO HB3 H 1.856 . 2 716 65 PRO HG2 H 1.976 . 2 717 65 PRO HG3 H 1.905 . 2 718 65 PRO HD2 H 3.822 . 2 719 65 PRO HD3 H 3.467 . 2 720 65 PRO C C 177.332 . 1 721 65 PRO CA C 64.973 . 1 722 65 PRO CB C 31.341 . 1 723 65 PRO CG C 27.934 . 1 724 65 PRO CD C 51.152 . 1 725 66 LEU H H 7.412 . 1 726 66 LEU HA H 4.023 . 1 727 66 LEU HB2 H 2.034 . 2 728 66 LEU HB3 H 1.338 . 2 729 66 LEU HG H 2.046 . 1 730 66 LEU HD1 H 0.908 . 2 731 66 LEU HD2 H 0.756 . 2 732 66 LEU C C 178.533 . 1 733 66 LEU CA C 55.861 . 1 734 66 LEU CB C 41.349 . 1 735 66 LEU CG C 26.349 . 1 736 66 LEU CD1 C 27.059 . 2 737 66 LEU CD2 C 21.923 . 2 738 66 LEU N N 114.991 . 1 739 67 GLY H H 7.733 . 1 740 67 GLY HA2 H 4.018 . 2 741 67 GLY HA3 H 3.909 . 2 742 67 GLY C C 175.925 . 1 743 67 GLY CA C 46.054 . 1 744 67 GLY N N 104.242 . 1 745 68 GLU H H 8.887 . 1 746 68 GLU HA H 4.219 . 1 747 68 GLU HB2 H 2.160 . 2 748 68 GLU HB3 H 1.969 . 2 749 68 GLU HG2 H 2.331 . 2 750 68 GLU HG3 H 2.331 . 2 751 68 GLU C C 176.314 . 1 752 68 GLU CA C 57.652 . 1 753 68 GLU CB C 29.306 . 1 754 68 GLU CG C 36.431 . 1 755 68 GLU N N 121.253 . 1 756 69 ASP H H 7.630 . 1 757 69 ASP HA H 4.587 . 1 758 69 ASP HB2 H 2.612 . 2 759 69 ASP HB3 H 2.575 . 2 760 69 ASP C C 174.665 . 1 761 69 ASP CA C 56.078 . 1 762 69 ASP CB C 41.572 . 1 763 69 ASP N N 116.486 . 1 764 70 LEU H H 7.433 . 1 765 70 LEU HA H 4.854 . 1 766 70 LEU HB2 H 2.118 . 2 767 70 LEU HB3 H 0.982 . 2 768 70 LEU HG H 0.941 . 1 769 70 LEU HD1 H 0.387 . 2 770 70 LEU HD2 H 0.833 . 2 771 70 LEU C C 174.259 . 1 772 70 LEU CA C 53.281 . 1 773 70 LEU CB C 43.024 . 1 774 70 LEU CG C 27.067 . 1 775 70 LEU CD1 C 23.634 . 2 776 70 LEU CD2 C 26.657 . 2 777 70 LEU N N 121.585 . 1 778 71 LYS H H 9.114 . 1 779 71 LYS HA H 4.724 . 1 780 71 LYS HB2 H 1.685 . 2 781 71 LYS HB3 H 1.614 . 2 782 71 LYS HG2 H 1.272 . 2 783 71 LYS HG3 H 1.272 . 2 784 71 LYS HD2 H 1.479 . 2 785 71 LYS HD3 H 1.221 . 2 786 71 LYS HE2 H 2.674 . 2 787 71 LYS HE3 H 2.563 . 2 788 71 LYS C C 175.146 . 1 789 71 LYS CA C 54.024 . 1 790 71 LYS CB C 35.469 . 1 791 71 LYS CG C 25.046 . 1 792 71 LYS CD C 28.739 . 1 793 71 LYS CE C 42.278 . 1 794 71 LYS N N 126.179 . 1 795 72 TRP H H 8.981 . 1 796 72 TRP HA H 4.720 . 1 797 72 TRP HB2 H 3.009 . 2 798 72 TRP HB3 H 2.644 . 2 799 72 TRP HD1 H 7.191 . 1 800 72 TRP HE1 H 10.308 . 1 801 72 TRP HE3 H 6.919 . 1 802 72 TRP HZ2 H 7.130 . 1 803 72 TRP HZ3 H 6.963 . 1 804 72 TRP HH2 H 6.969 . 1 805 72 TRP C C 176.394 . 1 806 72 TRP CA C 55.876 . 1 807 72 TRP CB C 27.789 . 1 808 72 TRP CD1 C 127.868 . 1 809 72 TRP CE3 C 119.57 . 1 810 72 TRP CZ2 C 113.986 . 1 811 72 TRP CZ3 C 121.30 . 1 812 72 TRP CH2 C 123.464 . 1 813 72 TRP N N 125.904 . 1 814 72 TRP NE1 N 131.103 . 1 815 73 GLU H H 8.558 . 1 816 73 GLU HA H 4.762 . 1 817 73 GLU HB2 H 2.039 . 2 818 73 GLU HB3 H 1.614 . 2 819 73 GLU HG2 H 2.117 . 2 820 73 GLU HG3 H 1.948 . 2 821 73 GLU C C 175.459 . 1 822 73 GLU CA C 55.208 . 1 823 73 GLU CB C 32.615 . 1 824 73 GLU CG C 37.218 . 1 825 73 GLU N N 123.290 . 1 826 74 ALA H H 8.962 . 1 827 74 ALA HA H 4.738 . 1 828 74 ALA HB H 1.372 . 1 829 74 ALA C C 177.803 . 1 830 74 ALA CA C 52.246 . 1 831 74 ALA CB C 20.070 . 1 832 74 ALA N N 127.315 . 1 833 75 SER H H 8.762 . 1 834 75 SER HA H 4.850 . 1 835 75 SER HB2 H 4.275 . 2 836 75 SER HB3 H 4.125 . 2 837 75 SER C C 176.080 . 1 838 75 SER CA C 56.954 . 1 839 75 SER CB C 65.244 . 1 840 75 SER N N 117.745 . 1 841 76 ARG HA H 4.193 . 1 842 76 ARG HB2 H 1.982 . 2 843 76 ARG HB3 H 1.982 . 2 844 76 ARG HG2 H 1.765 . 2 845 76 ARG HG3 H 1.765 . 2 846 76 ARG HD2 H 3.264 . 2 847 76 ARG HD3 H 3.264 . 2 848 76 ARG HE H 7.246 . 1 849 76 ARG CA C 58.895 . 1 850 76 ARG CB C 29.877 . 1 851 76 ARG CG C 27.326 . 1 852 76 ARG CD C 43.296 . 1 853 77 GLY C C 175.277 . 1 854 78 GLY H H 8.045 . 1 855 78 GLY HA2 H 4.390 . 2 856 78 GLY HA3 H 3.786 . 2 857 78 GLY C C 173.503 . 1 858 78 GLY CA C 45.296 . 1 859 78 GLY N N 110.323 . 1 860 79 ALA H H 7.879 . 1 861 79 ALA HA H 4.357 . 1 862 79 ALA HB H 1.297 . 1 863 79 ALA C C 176.674 . 1 864 79 ALA CA C 52.151 . 1 865 79 ALA CB C 20.171 . 1 866 79 ALA N N 123.865 . 1 867 80 ARG H H 8.375 . 1 868 80 ARG HA H 4.629 . 1 869 80 ARG HB2 H 1.764 . 2 870 80 ARG HB3 H 1.529 . 2 871 80 ARG HG2 H 1.690 . 2 872 80 ARG HG3 H 1.370 . 2 873 80 ARG HD2 H 3.072 . 2 874 80 ARG HD3 H 3.072 . 2 875 80 ARG HE H 7.596 . 1 876 80 ARG C C 175.713 . 1 877 80 ARG CA C 55.622 . 1 878 80 ARG CB C 32.074 . 1 879 80 ARG CG C 28.075 . 1 880 80 ARG CD C 43.521 . 1 881 80 ARG N N 119.145 . 1 882 80 ARG NE N 83.632 . 1 883 81 PHE H H 8.722 . 1 884 81 PHE HA H 5.156 . 1 885 81 PHE HB2 H 3.198 . 2 886 81 PHE HB3 H 2.703 . 2 887 81 PHE HD1 H 7.550 . 1 888 81 PHE HD2 H 7.550 . 1 889 81 PHE HE1 H 7.370 . 1 890 81 PHE HE2 H 7.370 . 1 891 81 PHE HZ H 7.411 . 1 892 81 PHE C C 172.806 . 1 893 81 PHE CA C 54.950 . 1 894 81 PHE CB C 42.240 . 1 895 81 PHE CD1 C 132.441 . 1 896 81 PHE CD2 C 132.441 . 1 897 81 PHE CE1 C 131.496 . 1 898 81 PHE CE2 C 131.496 . 1 899 81 PHE CZ C 130.04 . 1 900 81 PHE N N 123.774 . 1 901 82 PRO HA H 3.635 . 1 902 82 PRO HB2 H 1.025 . 2 903 82 PRO HB3 H -0.394 . 2 904 82 PRO HG2 H 1.843 . 2 905 82 PRO HG3 H 1.337 . 2 906 82 PRO HD2 H 4.070 . 2 907 82 PRO HD3 H 3.719 . 2 908 82 PRO C C 174.511 . 1 909 82 PRO CA C 61.347 . 1 910 82 PRO CB C 29.495 . 1 911 82 PRO CG C 26.047 . 1 912 82 PRO CD C 49.571 . 1 913 83 HIS H H 8.831 . 1 914 83 HIS HA H 5.330 . 1 915 83 HIS HB2 H 3.014 . 2 916 83 HIS HB3 H 1.841 . 2 917 83 HIS HD2 H 7.093 . 1 918 83 HIS C C 172.952 . 1 919 83 HIS CA C 50.700 . 1 920 83 HIS CB C 33.238 . 1 921 83 HIS CD2 C 118.50 . 1 922 83 HIS N N 124.483 . 1 923 84 LEU H H 9.063 . 1 924 84 LEU HA H 5.163 . 1 925 84 LEU HB2 H 2.042 . 2 926 84 LEU HB3 H 1.001 . 2 927 84 LEU HG H 1.930 . 1 928 84 LEU HD1 H 0.849 . 2 929 84 LEU HD2 H 0.769 . 2 930 84 LEU C C 176.699 . 1 931 84 LEU CA C 53.829 . 1 932 84 LEU CB C 45.366 . 1 933 84 LEU CG C 27.035 . 1 934 84 LEU CD1 C 27.038 . 2 935 84 LEU CD2 C 23.390 . 2 936 84 LEU N N 125.218 . 1 937 85 TYR H H 9.058 . 1 938 85 TYR HA H 4.508 . 1 939 85 TYR HB2 H 3.572 . 2 940 85 TYR HB3 H 2.877 . 2 941 85 TYR HD1 H 7.213 . 1 942 85 TYR HD2 H 7.213 . 1 943 85 TYR HE1 H 6.526 . 1 944 85 TYR HE2 H 6.526 . 1 945 85 TYR C C 173.624 . 1 946 85 TYR CA C 60.034 . 1 947 85 TYR CB C 36.073 . 1 948 85 TYR CD1 C 133.090 . 1 949 85 TYR CD2 C 133.090 . 1 950 85 TYR CE1 C 117.770 . 1 951 85 TYR CE2 C 117.770 . 1 952 85 TYR N N 131.339 . 1 953 86 ARG H H 7.432 . 1 954 86 ARG HA H 4.682 . 1 955 86 ARG HB2 H 2.287 . 2 956 86 ARG HB3 H 1.724 . 2 957 86 ARG HG2 H 1.415 . 2 958 86 ARG HG3 H 1.221 . 2 959 86 ARG HD2 H 3.111 . 2 960 86 ARG HD3 H 3.035 . 2 961 86 ARG HE H 7.583 . 1 962 86 ARG C C 171.917 . 1 963 86 ARG CA C 54.953 . 1 964 86 ARG CB C 28.209 . 1 965 86 ARG CG C 25.124 . 1 966 86 ARG CD C 43.652 . 1 967 86 ARG N N 114.399 . 1 968 86 ARG NE N 83.363 . 1 969 87 PRO HA H 4.303 . 1 970 87 PRO HB2 H 1.747 . 2 971 87 PRO HB3 H 1.501 . 2 972 87 PRO HG2 H 1.988 . 2 973 87 PRO HG3 H 1.915 . 2 974 87 PRO HD2 H 3.742 . 2 975 87 PRO HD3 H 3.540 . 2 976 87 PRO C C 175.771 . 1 977 87 PRO CA C 63.497 . 1 978 87 PRO CB C 32.253 . 1 979 87 PRO CG C 27.829 . 1 980 87 PRO CD C 50.636 . 1 981 88 LEU H H 8.095 . 1 982 88 LEU HA H 4.286 . 1 983 88 LEU HB2 H 2.087 . 2 984 88 LEU HB3 H 1.291 . 2 985 88 LEU HG H 1.677 . 1 986 88 LEU HD1 H 0.900 . 2 987 88 LEU HD2 H 0.642 . 2 988 88 LEU C C 175.946 . 1 989 88 LEU CA C 53.675 . 1 990 88 LEU CB C 45.548 . 1 991 88 LEU CG C 26.272 . 1 992 88 LEU CD1 C 24.102 . 2 993 88 LEU CD2 C 26.185 . 2 994 88 LEU N N 125.942 . 1 995 89 LEU H H 9.224 . 1 996 89 LEU HA H 4.561 . 1 997 89 LEU HB2 H 1.707 . 2 998 89 LEU HB3 H 1.707 . 2 999 89 LEU HG H 1.712 . 1 1000 89 LEU HD1 H 0.864 . 2 1001 89 LEU HD2 H 0.850 . 2 1002 89 LEU C C 179.295 . 1 1003 89 LEU CA C 55.212 . 1 1004 89 LEU CB C 41.460 . 1 1005 89 LEU CG C 27.145 . 1 1006 89 LEU CD1 C 25.624 . 2 1007 89 LEU CD2 C 22.553 . 2 1008 89 LEU N N 128.295 . 1 1009 90 VAL H H 7.665 . 1 1010 90 VAL HA H 3.785 . 1 1011 90 VAL HB H 1.948 . 1 1012 90 VAL HG1 H 0.896 . 2 1013 90 VAL HG2 H 0.715 . 2 1014 90 VAL C C 178.510 . 1 1015 90 VAL CA C 66.833 . 1 1016 90 VAL CB C 31.330 . 1 1017 90 VAL CG1 C 21.165 . 2 1018 90 VAL CG2 C 22.449 . 2 1019 90 VAL N N 122.696 . 1 1020 91 SER H H 8.134 . 1 1021 91 SER HA H 4.280 . 1 1022 91 SER HB2 H 4.083 . 2 1023 91 SER HB3 H 3.828 . 2 1024 91 SER C C 175.328 . 1 1025 91 SER CA C 59.822 . 1 1026 91 SER CB C 62.512 . 1 1027 91 SER N N 112.443 . 1 1028 92 GLU H H 7.598 . 1 1029 92 GLU HA H 4.221 . 1 1030 92 GLU HB2 H 2.549 . 2 1031 92 GLU HB3 H 2.081 . 2 1032 92 GLU HG2 H 2.258 . 2 1033 92 GLU HG3 H 2.258 . 2 1034 92 GLU C C 175.722 . 1 1035 92 GLU CA C 56.594 . 1 1036 92 GLU CB C 29.511 . 1 1037 92 GLU CG C 38.193 . 1 1038 92 GLU N N 120.359 . 1 1039 93 VAL H H 7.486 . 1 1040 93 VAL HA H 4.046 . 1 1041 93 VAL HB H 2.455 . 1 1042 93 VAL HG1 H 0.834 . 2 1043 93 VAL HG2 H 0.975 . 2 1044 93 VAL C C 176.093 . 1 1045 93 VAL CA C 63.242 . 1 1046 93 VAL CB C 32.306 . 1 1047 93 VAL CG1 C 22.491 . 2 1048 93 VAL CG2 C 22.666 . 2 1049 93 VAL N N 121.222 . 1 1050 94 THR H H 9.003 . 1 1051 94 THR HA H 4.264 . 1 1052 94 THR HB H 3.969 . 1 1053 94 THR HG2 H 1.212 . 1 1054 94 THR C C 174.664 . 1 1055 94 THR CA C 64.438 . 1 1056 94 THR CB C 69.317 . 1 1057 94 THR CG2 C 22.005 . 1 1058 94 THR N N 124.794 . 1 1059 95 ARG H H 7.514 . 1 1060 95 ARG HA H 4.646 . 1 1061 95 ARG HB2 H 1.769 . 2 1062 95 ARG HB3 H 1.769 . 2 1063 95 ARG HG2 H 1.565 . 2 1064 95 ARG HG3 H 1.490 . 2 1065 95 ARG HD2 H 3.201 . 2 1066 95 ARG HD3 H 3.201 . 2 1067 95 ARG HE H 7.409 . 1 1068 95 ARG C C 172.989 . 1 1069 95 ARG CA C 55.872 . 1 1070 95 ARG CB C 33.789 . 1 1071 95 ARG CG C 27.594 . 1 1072 95 ARG CD C 43.369 . 1 1073 95 ARG N N 118.660 . 1 1074 95 ARG NE N 84.585 . 1 1075 96 GLU H H 8.545 . 1 1076 96 GLU HA H 5.329 . 1 1077 96 GLU HB2 H 1.690 . 2 1078 96 GLU HB3 H 1.650 . 2 1079 96 GLU HG2 H 2.183 . 2 1080 96 GLU HG3 H 2.028 . 2 1081 96 GLU C C 174.480 . 1 1082 96 GLU CA C 53.415 . 1 1083 96 GLU CB C 33.592 . 1 1084 96 GLU CG C 35.515 . 1 1085 96 GLU N N 121.828 . 1 1086 97 ALA H H 8.276 . 1 1087 97 ALA HA H 4.537 . 1 1088 97 ALA HB H 0.854 . 1 1089 97 ALA C C 175.233 . 1 1090 97 ALA CA C 51.368 . 1 1091 97 ALA CB C 22.101 . 1 1092 97 ALA N N 123.211 . 1 1093 98 ASP H H 8.399 . 1 1094 98 ASP HA H 4.850 . 1 1095 98 ASP HB2 H 2.725 . 2 1096 98 ASP HB3 H 2.461 . 2 1097 98 ASP C C 176.085 . 1 1098 98 ASP CA C 54.824 . 1 1099 98 ASP CB C 41.694 . 1 1100 98 ASP N N 122.093 . 1 1101 99 LEU H H 7.854 . 1 1102 99 LEU HA H 4.766 . 1 1103 99 LEU HB2 H 1.692 . 2 1104 99 LEU HB3 H 1.036 . 2 1105 99 LEU HG H 1.376 . 1 1106 99 LEU HD1 H 0.521 . 2 1107 99 LEU HD2 H 0.622 . 2 1108 99 LEU C C 176.250 . 1 1109 99 LEU CA C 53.544 . 1 1110 99 LEU CB C 44.229 . 1 1111 99 LEU CG C 25.957 . 1 1112 99 LEU CD1 C 25.776 . 2 1113 99 LEU CD2 C 23.449 . 2 1114 99 LEU N N 120.272 . 1 1115 100 ASP H H 9.215 . 1 1116 100 ASP HA H 4.935 . 1 1117 100 ASP HB2 H 2.709 . 2 1118 100 ASP HB3 H 2.582 . 2 1119 100 ASP C C 174.956 . 1 1120 100 ASP CA C 52.684 . 1 1121 100 ASP CB C 43.362 . 1 1122 100 ASP N N 123.325 . 1 1123 101 LEU H H 8.526 . 1 1124 101 LEU HA H 4.639 . 1 1125 101 LEU HB2 H 1.812 . 2 1126 101 LEU HB3 H 1.146 . 2 1127 101 LEU HG H 1.655 . 1 1128 101 LEU HD1 H 0.719 . 2 1129 101 LEU HD2 H 0.653 . 2 1130 101 LEU C C 178.204 . 1 1131 101 LEU CA C 53.490 . 1 1132 101 LEU CB C 44.374 . 1 1133 101 LEU CG C 26.790 . 1 1134 101 LEU CD1 C 24.516 . 2 1135 101 LEU CD2 C 21.139 . 2 1136 101 LEU N N 118.539 . 1 1137 102 ASP H H 8.029 . 1 1138 102 ASP HA H 4.615 . 1 1139 102 ASP HB2 H 3.348 . 2 1140 102 ASP HB3 H 2.611 . 2 1141 102 ASP C C 178.176 . 1 1142 102 ASP CA C 52.297 . 1 1143 102 ASP CB C 41.108 . 1 1144 102 ASP N N 121.008 . 1 1145 103 ALA H H 8.384 . 1 1146 103 ALA HA H 4.099 . 1 1147 103 ALA HB H 1.417 . 1 1148 103 ALA C C 178.527 . 1 1149 103 ALA CA C 54.648 . 1 1150 103 ALA CB C 18.604 . 1 1151 103 ALA N N 120.139 . 1 1152 104 ASP H H 8.033 . 1 1153 104 ASP HA H 4.811 . 1 1154 104 ASP HB2 H 2.834 . 2 1155 104 ASP HB3 H 2.673 . 2 1156 104 ASP C C 176.113 . 1 1157 104 ASP CA C 54.077 . 1 1158 104 ASP CB C 41.899 . 1 1159 104 ASP N N 116.590 . 1 1160 105 GLY H H 8.196 . 1 1161 105 GLY HA2 H 4.293 . 2 1162 105 GLY HA3 H 3.657 . 2 1163 105 GLY C C 173.635 . 1 1164 105 GLY CA C 45.741 . 1 1165 105 GLY N N 107.882 . 1 1166 106 VAL H H 8.886 . 1 1167 106 VAL HA H 4.082 . 1 1168 106 VAL HB H 2.304 . 1 1169 106 VAL HG1 H 0.849 . 2 1170 106 VAL HG2 H 0.904 . 2 1171 106 VAL C C 175.529 . 1 1172 106 VAL CA C 61.360 . 1 1173 106 VAL CB C 32.373 . 1 1174 106 VAL CG1 C 20.394 . 2 1175 106 VAL CG2 C 22.470 . 2 1176 106 VAL N N 125.585 . 1 1177 107 PRO HA H 4.737 . 1 1178 107 PRO HB2 H 1.963 . 2 1179 107 PRO HB3 H 1.576 . 2 1180 107 PRO HG2 H 1.890 . 2 1181 107 PRO HG3 H 1.753 . 2 1182 107 PRO HD2 H 4.206 . 2 1183 107 PRO HD3 H 3.179 . 2 1184 107 PRO C C 176.029 . 1 1185 107 PRO CA C 62.674 . 1 1186 107 PRO CB C 31.789 . 1 1187 107 PRO CG C 28.235 . 1 1188 107 PRO CD C 51.318 . 1 1189 108 GLN H H 8.563 . 1 1190 108 GLN HA H 4.498 . 1 1191 108 GLN HB2 H 2.146 . 2 1192 108 GLN HB3 H 2.058 . 2 1193 108 GLN HG2 H 2.429 . 2 1194 108 GLN HG3 H 2.429 . 2 1195 108 GLN HE21 H 7.180 . 1 1196 108 GLN HE22 H 6.986 . 1 1197 108 GLN C C 176.218 . 1 1198 108 GLN CA C 54.901 . 1 1199 108 GLN CB C 29.514 . 1 1200 108 GLN CG C 33.990 . 1 1201 108 GLN CD C 180.223 . 1 1202 108 GLN N N 122.641 . 1 1203 108 GLN NE2 N 114.932 . 1 1204 109 LEU H H 8.853 . 1 1205 109 LEU HA H 4.330 . 1 1206 109 LEU HB2 H 1.574 . 2 1207 109 LEU HB3 H 1.491 . 2 1208 109 LEU HG H 1.502 . 1 1209 109 LEU HD1 H 0.583 . 2 1210 109 LEU HD2 H 0.519 . 2 1211 109 LEU C C 178.151 . 1 1212 109 LEU CA C 56.522 . 1 1213 109 LEU CB C 41.883 . 1 1214 109 LEU CG C 29.942 . 1 1215 109 LEU CD1 C 26.160 . 2 1216 109 LEU CD2 C 26.725 . 2 1217 109 LEU N N 125.974 . 1 1218 110 GLY H H 8.809 . 1 1219 110 GLY HA2 H 3.952 . 2 1220 110 GLY HA3 H 3.551 . 2 1221 110 GLY C C 176.002 . 1 1222 110 GLY CA C 48.748 . 1 1223 110 GLY N N 109.442 . 1 1224 111 ASP H H 8.674 . 1 1225 111 ASP HA H 4.317 . 1 1226 111 ASP HB2 H 2.336 . 2 1227 111 ASP HB3 H 1.946 . 2 1228 111 ASP C C 177.159 . 1 1229 111 ASP CA C 56.239 . 1 1230 111 ASP CB C 39.791 . 1 1231 111 ASP N N 119.503 . 1 1232 112 HIS H H 7.471 . 1 1233 112 HIS HA H 4.481 . 1 1234 112 HIS HB2 H 2.952 . 2 1235 112 HIS HB3 H 2.650 . 2 1236 112 HIS HD2 H 6.855 . 1 1237 112 HIS HE1 H 7.833 . 1 1238 112 HIS C C 177.121 . 1 1239 112 HIS CA C 56.692 . 1 1240 112 HIS CB C 31.648 . 1 1241 112 HIS CD2 C 118.178 . 1 1242 112 HIS CE1 C 139.52 . 1 1243 112 HIS N N 116.681 . 1 1244 113 LEU H H 7.526 . 1 1245 113 LEU HA H 4.148 . 1 1246 113 LEU HB2 H 1.594 . 2 1247 113 LEU HB3 H 1.357 . 2 1248 113 LEU HG H 1.483 . 1 1249 113 LEU HD1 H 0.689 . 2 1250 113 LEU HD2 H 0.117 . 2 1251 113 LEU C C 177.363 . 1 1252 113 LEU CA C 55.509 . 1 1253 113 LEU CB C 42.009 . 1 1254 113 LEU CG C 26.065 . 1 1255 113 LEU CD1 C 25.942 . 2 1256 113 LEU CD2 C 21.531 . 2 1257 113 LEU N N 118.976 . 1 1258 114 ALA H H 7.648 . 1 1259 114 ALA HA H 4.227 . 1 1260 114 ALA HB H 1.373 . 1 1261 114 ALA C C 177.692 . 1 1262 114 ALA CA C 52.828 . 1 1263 114 ALA CB C 18.497 . 1 1264 114 ALA N N 121.893 . 1 1265 115 LEU H H 7.764 . 1 1266 115 LEU HA H 4.146 . 1 1267 115 LEU HB2 H 1.632 . 2 1268 115 LEU HB3 H 1.487 . 2 1269 115 LEU HG H 1.644 . 1 1270 115 LEU HD1 H 0.895 . 2 1271 115 LEU HD2 H 0.809 . 2 1272 115 LEU C C 177.819 . 1 1273 115 LEU CA C 55.771 . 1 1274 115 LEU CB C 42.000 . 1 1275 115 LEU CG C 26.714 . 1 1276 115 LEU CD1 C 25.072 . 2 1277 115 LEU CD2 C 23.070 . 2 1278 115 LEU N N 119.576 . 1 1279 116 GLU H H 8.095 . 1 1280 116 GLU HA H 4.145 . 1 1281 116 GLU HB2 H 1.904 . 2 1282 116 GLU HB3 H 1.904 . 2 1283 116 GLU HG2 H 2.235 . 2 1284 116 GLU HG3 H 2.116 . 2 1285 116 GLU C C 176.361 . 1 1286 116 GLU CA C 56.975 . 1 1287 116 GLU CB C 30.137 . 1 1288 116 GLU CG C 36.209 . 1 1289 116 GLU N N 119.657 . 1 cwd: /data/PSVS/PSVS-v1.4-dev/results/CCR55_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/CCR55_R3_em_bcr3/rpf_calc/input/ctrl_file -o rpf_calc -q CCR55_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 ali.peaks ...   Doing SimpleMatch for aro.peaks ...   Reading ComparePdbFile: CCR55_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: CCR55_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: CCR55_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: CCR55_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: CCR55_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: CCR55_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: CCR55_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: CCR55_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: CCR55_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: CCR55_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: CCR55_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: CCR55_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: CCR55_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: CCR55_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: CCR55_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: CCR55_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: CCR55_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: CCR55_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: CCR55_R3_em_bcr3.pdb.iupac  Reading ComparePdbFile: CCR55_R3_em_bcr3.pdb.iupac  quality-estimation for ali.peaks ...   quality-estimation for aro.peaks ...   Doing Recall analysis for aro.peaks ...  Doing Precision analysis for aro.peaks ...  Doing Recall analysis for aro.peaks ...  Doing Precision analysis for aro.peaks ... prtSimleMatchPeakAtom for aro.peaks ...