USER MOD reduce.3.24.130724 H: found=0, std=0, add=1090, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1090 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 114 THR OG1 : rot -88:sc= 0.212 USER MOD Set 1.2: A 117 GLN : amide:sc= 1.63 K(o=1.8,f=-0.77!) USER MOD Set 2.1: A 97 GLN : amide:sc= 0.226 K(o=0.47,f=-0.34) USER MOD Set 2.2: A 110 LYS NZ :NH3+ -105:sc= 0.244 (180deg=0) USER MOD Set 3.1: A 88 MET CE :methyl 140:sc= -0.458 (180deg=-2.48) USER MOD Set 3.2: A 118 MET CE :methyl -170:sc= 0 (180deg=0) USER MOD Set 3.3: A 122 MET CE :methyl -120:sc= 0 (180deg=-0.487) USER MOD Set 4.1: A 74 THR OG1 : rot -111:sc= 0.739 USER MOD Set 4.2: A 83 ASN : amide:sc= 1.64 K(o=2.4,f=-0.45) USER MOD Set 5.1: A 38 LYS NZ :NH3+ 158:sc= 1.12 (180deg=0.936) USER MOD Set 5.2: A 40 GLN : amide:sc= 0.365 K(o=1.5,f=-1.8!) USER MOD Set 6.1: A 33 GLN : amide:sc= -0.891 K(o=-1.1,f=-2.4!) USER MOD Set 6.2: A 35 SER OG : rot -126:sc= -0.203 USER MOD Set 7.1: A 9 LYS NZ :NH3+ 153:sc= 1.09 (180deg=0) USER MOD Set 7.2: A 22 THR OG1 : rot 131:sc= 0.948 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -170:sc= 0.423 (180deg=-0.238) USER MOD Single : A 4 LYS NZ :NH3+ -171:sc= -0.0031 (180deg=-0.115) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 176:sc= 1.24 (180deg=1.18) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -0.0505 K(o=-0.051,f=-3.6) USER MOD Single : A 15 ASN : amide:sc=-0.00161 X(o=-0.0016,f=0) USER MOD Single : A 17 THR OG1 : rot 80:sc= 0.0289 USER MOD Single : A 23 TYR OH : rot -83:sc= 1.5 USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ -163:sc= -0.0542 (180deg=-0.37) USER MOD Single : A 32 LYS NZ :NH3+ 166:sc= 0.862 (180deg=0.189) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot -79:sc= -1.93! USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ -154:sc= 0.509 (180deg=-1.4!) USER MOD Single : A 54 LYS NZ :NH3+ 169:sc= -0.0276 (180deg=-0.185) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 99:sc= 0.745 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 150:sc= 1.18 (180deg=0.738) USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 LYS NZ :NH3+ -114:sc= 0.07 (180deg=-0.454) USER MOD Single : A 75 TYR OH : rot 35:sc= -0.308 USER MOD Single : A 76 THR OG1 : rot -66:sc= 1.42 USER MOD Single : A 78 THR OG1 : rot 63:sc= 1.22 USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 GLN :FLIP amide:sc= -0.636 F(o=-1.5!,f=-0.64) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ -135:sc= -0.0333 (180deg=-0.705) USER MOD Single : A 94 LYS NZ :NH3+ -170:sc= -0.0157 (180deg=-0.17) USER MOD Single : A 100 SER OG : rot 51:sc= 1.27 USER MOD Single : A 103 ASN : amide:sc= -0.027 K(o=-0.027,f=-1.7!) USER MOD Single : A 105 SER OG : rot 180:sc= 0.0268 USER MOD Single : A 111 LYS NZ :NH3+ 168:sc= -0.0197 (180deg=-0.165) USER MOD Single : A 115 MET CE :methyl -159:sc= 0 (180deg=-0.191) USER MOD Single : A 123 LYS NZ :NH3+ 140:sc= 0.699 (180deg=0.0921) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 LYS NZ :NH3+ 147:sc= 1.23 (180deg=0.771) USER MOD Single : A 134 HIS : no HD1:sc= -0.31 X(o=-0.31,f=-0.022) USER MOD Single : A 135 HIS : no HE2:sc= -0.465 K(o=-0.47,f=-2.9) USER MOD Single : A 136 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 137 HIS : no HD1:sc= -0.0157 X(o=-0.016,f=0) USER MOD Single : A 138 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 139 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 16.865 8.334 8.154 1.00 0.00 N ATOM 2 CA MET A 1 15.750 7.493 7.663 1.00 0.00 C ATOM 3 C MET A 1 15.134 6.709 8.817 1.00 0.00 C ATOM 4 O MET A 1 14.090 7.091 9.348 1.00 0.00 O ATOM 5 CB MET A 1 16.241 6.532 6.574 1.00 0.00 C ATOM 6 CG MET A 1 16.954 7.226 5.424 1.00 0.00 C ATOM 7 SD MET A 1 15.929 8.470 4.615 1.00 0.00 S ATOM 8 CE MET A 1 17.098 9.148 3.437 1.00 0.00 C ATOM 0 H1 MET A 1 17.165 8.986 7.402 1.00 0.00 H new ATOM 0 H2 MET A 1 16.550 8.881 8.980 1.00 0.00 H new ATOM 0 H3 MET A 1 17.664 7.727 8.425 1.00 0.00 H new ATOM 0 HA MET A 1 14.989 8.144 7.233 1.00 0.00 H new ATOM 0 HB2 MET A 1 16.917 5.803 7.022 1.00 0.00 H new ATOM 0 HB3 MET A 1 15.389 5.977 6.180 1.00 0.00 H new ATOM 0 HG2 MET A 1 17.863 7.698 5.798 1.00 0.00 H new ATOM 0 HG3 MET A 1 17.260 6.481 4.690 1.00 0.00 H new ATOM 0 HE1 MET A 1 16.615 9.934 2.856 1.00 0.00 H new ATOM 0 HE2 MET A 1 17.952 9.565 3.971 1.00 0.00 H new ATOM 0 HE3 MET A 1 17.439 8.359 2.767 1.00 0.00 H new ATOM 20 N GLY A 2 15.797 5.631 9.218 1.00 0.00 N ATOM 21 CA GLY A 2 15.324 4.830 10.329 1.00 0.00 C ATOM 22 C GLY A 2 16.463 4.371 11.216 1.00 0.00 C ATOM 23 O GLY A 2 17.505 5.027 11.277 1.00 0.00 O ATOM 0 H GLY A 2 16.660 5.296 8.789 1.00 0.00 H new ATOM 0 HA2 GLY A 2 14.615 5.410 10.919 1.00 0.00 H new ATOM 0 HA3 GLY A 2 14.787 3.961 9.948 1.00 0.00 H new ATOM 27 N ASP A 3 16.279 3.241 11.891 1.00 0.00 N ATOM 28 CA ASP A 3 17.293 2.723 12.804 1.00 0.00 C ATOM 29 C ASP A 3 17.185 1.205 12.948 1.00 0.00 C ATOM 30 O ASP A 3 18.032 0.464 12.448 1.00 0.00 O ATOM 31 CB ASP A 3 17.157 3.398 14.171 1.00 0.00 C ATOM 32 CG ASP A 3 18.146 2.868 15.189 1.00 0.00 C ATOM 33 OD1 ASP A 3 19.364 3.062 15.005 1.00 0.00 O ATOM 34 OD2 ASP A 3 17.703 2.280 16.196 1.00 0.00 O ATOM 0 H ASP A 3 15.439 2.667 11.824 1.00 0.00 H new ATOM 0 HA ASP A 3 18.275 2.950 12.388 1.00 0.00 H new ATOM 0 HB2 ASP A 3 17.301 4.472 14.056 1.00 0.00 H new ATOM 0 HB3 ASP A 3 16.144 3.250 14.545 1.00 0.00 H new ATOM 39 N LYS A 4 16.133 0.745 13.616 1.00 0.00 N ATOM 40 CA LYS A 4 15.931 -0.683 13.840 1.00 0.00 C ATOM 41 C LYS A 4 14.975 -1.236 12.795 1.00 0.00 C ATOM 42 O LYS A 4 15.384 -1.880 11.829 1.00 0.00 O ATOM 43 CB LYS A 4 15.371 -0.932 15.245 1.00 0.00 C ATOM 44 CG LYS A 4 16.259 -0.411 16.359 1.00 0.00 C ATOM 45 CD LYS A 4 15.616 -0.594 17.723 1.00 0.00 C ATOM 46 CE LYS A 4 16.481 -0.005 18.827 1.00 0.00 C ATOM 47 NZ LYS A 4 17.794 -0.690 18.935 1.00 0.00 N ATOM 0 H LYS A 4 15.406 1.340 14.012 1.00 0.00 H new ATOM 0 HA LYS A 4 16.892 -1.191 13.755 1.00 0.00 H new ATOM 0 HB2 LYS A 4 14.391 -0.461 15.324 1.00 0.00 H new ATOM 0 HB3 LYS A 4 15.222 -2.003 15.382 1.00 0.00 H new ATOM 0 HG2 LYS A 4 17.216 -0.932 16.335 1.00 0.00 H new ATOM 0 HG3 LYS A 4 16.467 0.646 16.194 1.00 0.00 H new ATOM 0 HD2 LYS A 4 14.636 -0.116 17.732 1.00 0.00 H new ATOM 0 HD3 LYS A 4 15.455 -1.655 17.912 1.00 0.00 H new ATOM 0 HE2 LYS A 4 16.641 1.056 18.634 1.00 0.00 H new ATOM 0 HE3 LYS A 4 15.954 -0.080 19.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 18.287 -0.363 19.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 17.646 -1.718 18.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 18.370 -0.470 18.098 1.00 0.00 H new ATOM 61 N GLU A 5 13.701 -0.975 13.002 1.00 0.00 N ATOM 62 CA GLU A 5 12.689 -1.250 12.008 1.00 0.00 C ATOM 63 C GLU A 5 12.301 0.073 11.372 1.00 0.00 C ATOM 64 O GLU A 5 11.729 0.946 12.028 1.00 0.00 O ATOM 65 CB GLU A 5 11.494 -1.949 12.654 1.00 0.00 C ATOM 66 CG GLU A 5 11.852 -3.317 13.211 1.00 0.00 C ATOM 67 CD GLU A 5 10.807 -3.869 14.150 1.00 0.00 C ATOM 68 OE1 GLU A 5 9.751 -4.327 13.671 1.00 0.00 O ATOM 69 OE2 GLU A 5 11.053 -3.866 15.376 1.00 0.00 O ATOM 0 H GLU A 5 13.340 -0.567 13.864 1.00 0.00 H new ATOM 0 HA GLU A 5 13.065 -1.923 11.237 1.00 0.00 H new ATOM 0 HB2 GLU A 5 11.102 -1.324 13.457 1.00 0.00 H new ATOM 0 HB3 GLU A 5 10.698 -2.057 11.917 1.00 0.00 H new ATOM 0 HG2 GLU A 5 11.992 -4.013 12.384 1.00 0.00 H new ATOM 0 HG3 GLU A 5 12.805 -3.250 13.737 1.00 0.00 H new ATOM 76 N GLU A 6 12.648 0.230 10.110 1.00 0.00 N ATOM 77 CA GLU A 6 12.653 1.538 9.483 1.00 0.00 C ATOM 78 C GLU A 6 11.399 1.759 8.660 1.00 0.00 C ATOM 79 O GLU A 6 10.909 0.847 7.997 1.00 0.00 O ATOM 80 CB GLU A 6 13.897 1.688 8.607 1.00 0.00 C ATOM 81 CG GLU A 6 15.199 1.460 9.361 1.00 0.00 C ATOM 82 CD GLU A 6 16.427 1.651 8.495 1.00 0.00 C ATOM 83 OE1 GLU A 6 16.733 2.804 8.128 1.00 0.00 O ATOM 84 OE2 GLU A 6 17.104 0.649 8.184 1.00 0.00 O ATOM 0 H GLU A 6 12.931 -0.534 9.496 1.00 0.00 H new ATOM 0 HA GLU A 6 12.672 2.294 10.268 1.00 0.00 H new ATOM 0 HB2 GLU A 6 13.837 0.981 7.779 1.00 0.00 H new ATOM 0 HB3 GLU A 6 13.908 2.688 8.172 1.00 0.00 H new ATOM 0 HG2 GLU A 6 15.247 2.146 10.207 1.00 0.00 H new ATOM 0 HG3 GLU A 6 15.203 0.450 9.770 1.00 0.00 H new ATOM 91 N SER A 7 10.882 2.973 8.720 1.00 0.00 N ATOM 92 CA SER A 7 9.702 3.336 7.964 1.00 0.00 C ATOM 93 C SER A 7 10.090 4.155 6.741 1.00 0.00 C ATOM 94 O SER A 7 11.014 4.967 6.792 1.00 0.00 O ATOM 95 CB SER A 7 8.740 4.122 8.852 1.00 0.00 C ATOM 96 OG SER A 7 8.406 3.375 10.011 1.00 0.00 O ATOM 0 H SER A 7 11.266 3.727 9.289 1.00 0.00 H new ATOM 0 HA SER A 7 9.204 2.428 7.624 1.00 0.00 H new ATOM 0 HB2 SER A 7 9.196 5.069 9.142 1.00 0.00 H new ATOM 0 HB3 SER A 7 7.835 4.362 8.294 1.00 0.00 H new ATOM 0 HG SER A 7 7.790 3.895 10.569 1.00 0.00 H new ATOM 102 N LYS A 8 9.395 3.923 5.639 1.00 0.00 N ATOM 103 CA LYS A 8 9.632 4.670 4.417 1.00 0.00 C ATOM 104 C LYS A 8 8.317 4.892 3.684 1.00 0.00 C ATOM 105 O LYS A 8 7.528 3.965 3.525 1.00 0.00 O ATOM 106 CB LYS A 8 10.632 3.930 3.527 1.00 0.00 C ATOM 107 CG LYS A 8 10.990 4.667 2.255 1.00 0.00 C ATOM 108 CD LYS A 8 12.102 3.961 1.504 1.00 0.00 C ATOM 109 CE LYS A 8 12.586 4.806 0.347 1.00 0.00 C ATOM 110 NZ LYS A 8 13.690 4.161 -0.403 1.00 0.00 N ATOM 0 H LYS A 8 8.659 3.220 5.567 1.00 0.00 H new ATOM 0 HA LYS A 8 10.058 5.641 4.670 1.00 0.00 H new ATOM 0 HB2 LYS A 8 11.543 3.747 4.097 1.00 0.00 H new ATOM 0 HB3 LYS A 8 10.218 2.956 3.266 1.00 0.00 H new ATOM 0 HG2 LYS A 8 10.110 4.745 1.617 1.00 0.00 H new ATOM 0 HG3 LYS A 8 11.300 5.684 2.496 1.00 0.00 H new ATOM 0 HD2 LYS A 8 12.931 3.754 2.181 1.00 0.00 H new ATOM 0 HD3 LYS A 8 11.745 3.000 1.134 1.00 0.00 H new ATOM 0 HE2 LYS A 8 11.754 4.999 -0.331 1.00 0.00 H new ATOM 0 HE3 LYS A 8 12.922 5.773 0.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 13.940 4.747 -1.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 14.519 4.062 0.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 13.386 3.221 -0.728 1.00 0.00 H new ATOM 124 N LYS A 9 8.080 6.120 3.257 1.00 0.00 N ATOM 125 CA LYS A 9 6.820 6.487 2.634 1.00 0.00 C ATOM 126 C LYS A 9 6.992 6.729 1.140 1.00 0.00 C ATOM 127 O LYS A 9 7.877 7.472 0.714 1.00 0.00 O ATOM 128 CB LYS A 9 6.266 7.760 3.290 1.00 0.00 C ATOM 129 CG LYS A 9 4.881 8.162 2.803 1.00 0.00 C ATOM 130 CD LYS A 9 3.789 7.529 3.648 1.00 0.00 C ATOM 131 CE LYS A 9 3.828 8.056 5.075 1.00 0.00 C ATOM 132 NZ LYS A 9 2.820 7.401 5.947 1.00 0.00 N ATOM 0 H LYS A 9 8.750 6.886 3.331 1.00 0.00 H new ATOM 0 HA LYS A 9 6.124 5.660 2.774 1.00 0.00 H new ATOM 0 HB2 LYS A 9 6.231 7.613 4.369 1.00 0.00 H new ATOM 0 HB3 LYS A 9 6.957 8.582 3.103 1.00 0.00 H new ATOM 0 HG2 LYS A 9 4.784 9.247 2.834 1.00 0.00 H new ATOM 0 HG3 LYS A 9 4.758 7.861 1.763 1.00 0.00 H new ATOM 0 HD2 LYS A 9 2.815 7.738 3.206 1.00 0.00 H new ATOM 0 HD3 LYS A 9 3.910 6.446 3.653 1.00 0.00 H new ATOM 0 HE2 LYS A 9 4.823 7.897 5.491 1.00 0.00 H new ATOM 0 HE3 LYS A 9 3.654 9.132 5.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 3.149 7.420 6.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 1.915 7.909 5.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 2.688 6.415 5.645 1.00 0.00 H new ATOM 146 N PHE A 10 6.156 6.087 0.346 1.00 0.00 N ATOM 147 CA PHE A 10 6.010 6.451 -1.048 1.00 0.00 C ATOM 148 C PHE A 10 4.531 6.672 -1.313 1.00 0.00 C ATOM 149 O PHE A 10 3.683 6.026 -0.689 1.00 0.00 O ATOM 150 CB PHE A 10 6.606 5.388 -1.991 1.00 0.00 C ATOM 151 CG PHE A 10 5.648 4.323 -2.458 1.00 0.00 C ATOM 152 CD1 PHE A 10 4.843 4.535 -3.569 1.00 0.00 C ATOM 153 CD2 PHE A 10 5.566 3.107 -1.805 1.00 0.00 C ATOM 154 CE1 PHE A 10 3.976 3.558 -4.012 1.00 0.00 C ATOM 155 CE2 PHE A 10 4.703 2.124 -2.247 1.00 0.00 C ATOM 156 CZ PHE A 10 3.906 2.351 -3.352 1.00 0.00 C ATOM 0 H PHE A 10 5.567 5.309 0.645 1.00 0.00 H new ATOM 0 HA PHE A 10 6.568 7.365 -1.250 1.00 0.00 H new ATOM 0 HB2 PHE A 10 7.015 5.893 -2.866 1.00 0.00 H new ATOM 0 HB3 PHE A 10 7.440 4.904 -1.483 1.00 0.00 H new ATOM 0 HD1 PHE A 10 4.896 5.478 -4.093 1.00 0.00 H new ATOM 0 HD2 PHE A 10 6.184 2.924 -0.939 1.00 0.00 H new ATOM 0 HE1 PHE A 10 3.353 3.739 -4.875 1.00 0.00 H new ATOM 0 HE2 PHE A 10 4.651 1.178 -1.729 1.00 0.00 H new ATOM 0 HZ PHE A 10 3.229 1.584 -3.698 1.00 0.00 H new ATOM 166 N SER A 11 4.210 7.583 -2.206 1.00 0.00 N ATOM 167 CA SER A 11 2.828 7.938 -2.442 1.00 0.00 C ATOM 168 C SER A 11 2.600 8.206 -3.918 1.00 0.00 C ATOM 169 O SER A 11 3.031 9.229 -4.445 1.00 0.00 O ATOM 170 CB SER A 11 2.454 9.163 -1.601 1.00 0.00 C ATOM 171 OG SER A 11 1.067 9.445 -1.674 1.00 0.00 O ATOM 0 H SER A 11 4.885 8.090 -2.779 1.00 0.00 H new ATOM 0 HA SER A 11 2.189 7.106 -2.145 1.00 0.00 H new ATOM 0 HB2 SER A 11 2.736 8.991 -0.562 1.00 0.00 H new ATOM 0 HB3 SER A 11 3.020 10.028 -1.946 1.00 0.00 H new ATOM 0 HG SER A 11 0.864 10.231 -1.125 1.00 0.00 H new ATOM 177 N ALA A 12 1.937 7.279 -4.581 1.00 0.00 N ATOM 178 CA ALA A 12 1.674 7.408 -5.995 1.00 0.00 C ATOM 179 C ALA A 12 0.196 7.650 -6.234 1.00 0.00 C ATOM 180 O ALA A 12 -0.648 6.856 -5.814 1.00 0.00 O ATOM 181 CB ALA A 12 2.142 6.166 -6.738 1.00 0.00 C ATOM 0 H ALA A 12 1.571 6.426 -4.158 1.00 0.00 H new ATOM 0 HA ALA A 12 2.230 8.264 -6.377 1.00 0.00 H new ATOM 0 HB1 ALA A 12 1.936 6.280 -7.802 1.00 0.00 H new ATOM 0 HB2 ALA A 12 3.213 6.034 -6.587 1.00 0.00 H new ATOM 0 HB3 ALA A 12 1.612 5.293 -6.357 1.00 0.00 H new ATOM 187 N ASN A 13 -0.116 8.757 -6.883 1.00 0.00 N ATOM 188 CA ASN A 13 -1.491 9.075 -7.218 1.00 0.00 C ATOM 189 C ASN A 13 -1.801 8.564 -8.615 1.00 0.00 C ATOM 190 O ASN A 13 -1.484 9.212 -9.614 1.00 0.00 O ATOM 191 CB ASN A 13 -1.748 10.581 -7.132 1.00 0.00 C ATOM 192 CG ASN A 13 -3.170 10.947 -7.511 1.00 0.00 C ATOM 193 OD1 ASN A 13 -4.098 10.170 -7.314 1.00 0.00 O ATOM 194 ND2 ASN A 13 -3.351 12.138 -8.056 1.00 0.00 N ATOM 0 H ASN A 13 0.566 9.451 -7.189 1.00 0.00 H new ATOM 0 HA ASN A 13 -2.147 8.587 -6.498 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -1.545 10.924 -6.117 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -1.054 11.104 -7.790 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -4.287 12.437 -8.328 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -2.554 12.757 -8.204 1.00 0.00 H new ATOM 201 N LEU A 14 -2.385 7.380 -8.676 1.00 0.00 N ATOM 202 CA LEU A 14 -2.695 6.741 -9.947 1.00 0.00 C ATOM 203 C LEU A 14 -4.027 7.253 -10.485 1.00 0.00 C ATOM 204 O LEU A 14 -5.093 6.786 -10.069 1.00 0.00 O ATOM 205 CB LEU A 14 -2.723 5.214 -9.783 1.00 0.00 C ATOM 206 CG LEU A 14 -1.361 4.494 -9.835 1.00 0.00 C ATOM 207 CD1 LEU A 14 -0.200 5.463 -9.660 1.00 0.00 C ATOM 208 CD2 LEU A 14 -1.296 3.412 -8.768 1.00 0.00 C ATOM 0 H LEU A 14 -2.656 6.837 -7.856 1.00 0.00 H new ATOM 0 HA LEU A 14 -1.916 6.993 -10.667 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -3.196 4.981 -8.829 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -3.359 4.798 -10.564 1.00 0.00 H new ATOM 0 HG LEU A 14 -1.270 4.039 -10.821 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.741 4.915 -9.703 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -0.223 6.207 -10.457 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -0.285 5.962 -8.695 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.329 2.911 -8.816 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -1.423 3.863 -7.784 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -2.090 2.685 -8.938 1.00 0.00 H new ATOM 220 N ASN A 15 -3.943 8.249 -11.375 1.00 0.00 N ATOM 221 CA ASN A 15 -5.109 8.888 -12.006 1.00 0.00 C ATOM 222 C ASN A 15 -5.884 9.747 -11.011 1.00 0.00 C ATOM 223 O ASN A 15 -6.130 10.932 -11.242 1.00 0.00 O ATOM 224 CB ASN A 15 -6.028 7.842 -12.649 1.00 0.00 C ATOM 225 CG ASN A 15 -7.271 8.456 -13.266 1.00 0.00 C ATOM 226 OD1 ASN A 15 -7.239 8.940 -14.396 1.00 0.00 O ATOM 227 ND2 ASN A 15 -8.381 8.418 -12.543 1.00 0.00 N ATOM 0 H ASN A 15 -3.053 8.640 -11.683 1.00 0.00 H new ATOM 0 HA ASN A 15 -4.735 9.545 -12.791 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -5.475 7.301 -13.417 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -6.324 7.112 -11.896 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -9.249 8.799 -12.920 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -8.368 8.008 -11.609 1.00 0.00 H new ATOM 234 N GLY A 16 -6.261 9.133 -9.914 1.00 0.00 N ATOM 235 CA GLY A 16 -6.986 9.817 -8.866 1.00 0.00 C ATOM 236 C GLY A 16 -7.068 8.963 -7.624 1.00 0.00 C ATOM 237 O GLY A 16 -7.999 9.087 -6.824 1.00 0.00 O ATOM 0 H GLY A 16 -6.075 8.149 -9.722 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -6.492 10.760 -8.632 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -7.991 10.061 -9.212 1.00 0.00 H new ATOM 241 N THR A 17 -6.088 8.088 -7.480 1.00 0.00 N ATOM 242 CA THR A 17 -6.016 7.177 -6.361 1.00 0.00 C ATOM 243 C THR A 17 -4.691 7.383 -5.640 1.00 0.00 C ATOM 244 O THR A 17 -3.651 6.900 -6.089 1.00 0.00 O ATOM 245 CB THR A 17 -6.123 5.715 -6.836 1.00 0.00 C ATOM 246 OG1 THR A 17 -7.122 5.610 -7.861 1.00 0.00 O ATOM 247 CG2 THR A 17 -6.480 4.790 -5.685 1.00 0.00 C ATOM 0 H THR A 17 -5.318 7.992 -8.142 1.00 0.00 H new ATOM 0 HA THR A 17 -6.848 7.380 -5.686 1.00 0.00 H new ATOM 0 HB THR A 17 -5.153 5.415 -7.232 1.00 0.00 H new ATOM 0 HG1 THR A 17 -6.748 5.912 -8.715 1.00 0.00 H new ATOM 0 HG21 THR A 17 -6.549 3.765 -6.050 1.00 0.00 H new ATOM 0 HG22 THR A 17 -5.709 4.851 -4.917 1.00 0.00 H new ATOM 0 HG23 THR A 17 -7.439 5.089 -5.262 1.00 0.00 H new ATOM 255 N GLU A 18 -4.730 8.127 -4.548 1.00 0.00 N ATOM 256 CA GLU A 18 -3.519 8.503 -3.834 1.00 0.00 C ATOM 257 C GLU A 18 -3.095 7.378 -2.899 1.00 0.00 C ATOM 258 O GLU A 18 -3.566 7.284 -1.767 1.00 0.00 O ATOM 259 CB GLU A 18 -3.754 9.792 -3.043 1.00 0.00 C ATOM 260 CG GLU A 18 -4.793 10.706 -3.679 1.00 0.00 C ATOM 261 CD GLU A 18 -5.013 11.991 -2.906 1.00 0.00 C ATOM 262 OE1 GLU A 18 -4.131 12.877 -2.939 1.00 0.00 O ATOM 263 OE2 GLU A 18 -6.082 12.131 -2.275 1.00 0.00 O ATOM 0 H GLU A 18 -5.591 8.485 -4.134 1.00 0.00 H new ATOM 0 HA GLU A 18 -2.721 8.678 -4.556 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -4.074 9.537 -2.033 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -2.811 10.332 -2.953 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -4.480 10.950 -4.694 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -5.739 10.170 -3.757 1.00 0.00 H new ATOM 270 N ILE A 19 -2.227 6.507 -3.386 1.00 0.00 N ATOM 271 CA ILE A 19 -1.795 5.360 -2.608 1.00 0.00 C ATOM 272 C ILE A 19 -0.541 5.692 -1.807 1.00 0.00 C ATOM 273 O ILE A 19 0.546 5.865 -2.362 1.00 0.00 O ATOM 274 CB ILE A 19 -1.535 4.128 -3.511 1.00 0.00 C ATOM 275 CG1 ILE A 19 -2.825 3.754 -4.247 1.00 0.00 C ATOM 276 CG2 ILE A 19 -1.023 2.956 -2.684 1.00 0.00 C ATOM 277 CD1 ILE A 19 -2.725 2.479 -5.059 1.00 0.00 C ATOM 0 H ILE A 19 -1.809 6.573 -4.314 1.00 0.00 H new ATOM 0 HA ILE A 19 -2.601 5.112 -1.918 1.00 0.00 H new ATOM 0 HB ILE A 19 -0.768 4.377 -4.245 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -3.628 3.646 -3.518 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -3.103 4.573 -4.910 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -0.846 2.100 -3.336 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -0.091 3.237 -2.193 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -1.765 2.691 -1.930 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -3.679 2.284 -5.549 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -1.945 2.588 -5.813 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -2.479 1.646 -4.400 1.00 0.00 H new ATOM 289 N ALA A 20 -0.714 5.806 -0.498 1.00 0.00 N ATOM 290 CA ALA A 20 0.385 6.108 0.398 1.00 0.00 C ATOM 291 C ALA A 20 0.818 4.861 1.147 1.00 0.00 C ATOM 292 O ALA A 20 0.122 4.395 2.048 1.00 0.00 O ATOM 293 CB ALA A 20 -0.021 7.195 1.378 1.00 0.00 C ATOM 0 H ALA A 20 -1.615 5.692 -0.033 1.00 0.00 H new ATOM 0 HA ALA A 20 1.227 6.466 -0.195 1.00 0.00 H new ATOM 0 HB1 ALA A 20 0.813 7.413 2.046 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -0.292 8.097 0.829 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -0.876 6.856 1.964 1.00 0.00 H new ATOM 299 N ILE A 21 1.955 4.313 0.771 1.00 0.00 N ATOM 300 CA ILE A 21 2.443 3.096 1.388 1.00 0.00 C ATOM 301 C ILE A 21 3.678 3.370 2.235 1.00 0.00 C ATOM 302 O ILE A 21 4.633 4.002 1.783 1.00 0.00 O ATOM 303 CB ILE A 21 2.752 2.011 0.336 1.00 0.00 C ATOM 304 CG1 ILE A 21 1.464 1.590 -0.380 1.00 0.00 C ATOM 305 CG2 ILE A 21 3.429 0.810 0.981 1.00 0.00 C ATOM 306 CD1 ILE A 21 1.660 0.504 -1.417 1.00 0.00 C ATOM 0 H ILE A 21 2.559 4.691 0.041 1.00 0.00 H new ATOM 0 HA ILE A 21 1.650 2.724 2.036 1.00 0.00 H new ATOM 0 HB ILE A 21 3.439 2.427 -0.401 1.00 0.00 H new ATOM 0 HG12 ILE A 21 0.745 1.243 0.362 1.00 0.00 H new ATOM 0 HG13 ILE A 21 1.027 2.464 -0.863 1.00 0.00 H new ATOM 0 HG21 ILE A 21 3.637 0.058 0.220 1.00 0.00 H new ATOM 0 HG22 ILE A 21 4.363 1.125 1.445 1.00 0.00 H new ATOM 0 HG23 ILE A 21 2.772 0.386 1.740 1.00 0.00 H new ATOM 0 HD11 ILE A 21 0.702 0.263 -1.877 1.00 0.00 H new ATOM 0 HD12 ILE A 21 2.353 0.853 -2.183 1.00 0.00 H new ATOM 0 HD13 ILE A 21 2.067 -0.387 -0.938 1.00 0.00 H new ATOM 318 N THR A 22 3.633 2.909 3.472 1.00 0.00 N ATOM 319 CA THR A 22 4.738 3.059 4.392 1.00 0.00 C ATOM 320 C THR A 22 5.353 1.695 4.689 1.00 0.00 C ATOM 321 O THR A 22 4.687 0.810 5.228 1.00 0.00 O ATOM 322 CB THR A 22 4.266 3.698 5.710 1.00 0.00 C ATOM 323 OG1 THR A 22 3.351 4.765 5.423 1.00 0.00 O ATOM 324 CG2 THR A 22 5.446 4.239 6.508 1.00 0.00 C ATOM 0 H THR A 22 2.828 2.421 3.864 1.00 0.00 H new ATOM 0 HA THR A 22 5.482 3.708 3.930 1.00 0.00 H new ATOM 0 HB THR A 22 3.770 2.933 6.307 1.00 0.00 H new ATOM 0 HG1 THR A 22 2.549 4.666 5.977 1.00 0.00 H new ATOM 0 HG21 THR A 22 5.085 4.685 7.435 1.00 0.00 H new ATOM 0 HG22 THR A 22 6.132 3.424 6.741 1.00 0.00 H new ATOM 0 HG23 THR A 22 5.967 4.995 5.920 1.00 0.00 H new ATOM 332 N TYR A 23 6.609 1.522 4.316 1.00 0.00 N ATOM 333 CA TYR A 23 7.301 0.271 4.570 1.00 0.00 C ATOM 334 C TYR A 23 7.809 0.240 6.001 1.00 0.00 C ATOM 335 O TYR A 23 8.152 1.276 6.565 1.00 0.00 O ATOM 336 CB TYR A 23 8.520 0.091 3.662 1.00 0.00 C ATOM 337 CG TYR A 23 8.314 0.390 2.196 1.00 0.00 C ATOM 338 CD1 TYR A 23 8.511 1.671 1.713 1.00 0.00 C ATOM 339 CD2 TYR A 23 7.996 -0.611 1.289 1.00 0.00 C ATOM 340 CE1 TYR A 23 8.394 1.961 0.379 1.00 0.00 C ATOM 341 CE2 TYR A 23 7.864 -0.330 -0.058 1.00 0.00 C ATOM 342 CZ TYR A 23 8.066 0.957 -0.510 1.00 0.00 C ATOM 343 OH TYR A 23 7.955 1.235 -1.852 1.00 0.00 O ATOM 0 H TYR A 23 7.168 2.229 3.838 1.00 0.00 H new ATOM 0 HA TYR A 23 6.581 -0.525 4.379 1.00 0.00 H new ATOM 0 HB2 TYR A 23 9.320 0.732 4.033 1.00 0.00 H new ATOM 0 HB3 TYR A 23 8.867 -0.938 3.756 1.00 0.00 H new ATOM 0 HD1 TYR A 23 8.763 2.462 2.404 1.00 0.00 H new ATOM 0 HD2 TYR A 23 7.850 -1.622 1.640 1.00 0.00 H new ATOM 0 HE1 TYR A 23 8.557 2.968 0.025 1.00 0.00 H new ATOM 0 HE2 TYR A 23 7.604 -1.115 -0.753 1.00 0.00 H new ATOM 0 HH TYR A 23 7.063 1.597 -2.039 1.00 0.00 H new ATOM 353 N VAL A 24 7.829 -0.943 6.574 1.00 0.00 N ATOM 354 CA VAL A 24 8.589 -1.202 7.781 1.00 0.00 C ATOM 355 C VAL A 24 9.599 -2.286 7.468 1.00 0.00 C ATOM 356 O VAL A 24 9.280 -3.481 7.462 1.00 0.00 O ATOM 357 CB VAL A 24 7.700 -1.610 8.977 1.00 0.00 C ATOM 358 CG1 VAL A 24 8.544 -2.142 10.133 1.00 0.00 C ATOM 359 CG2 VAL A 24 6.888 -0.415 9.442 1.00 0.00 C ATOM 0 H VAL A 24 7.320 -1.753 6.219 1.00 0.00 H new ATOM 0 HA VAL A 24 9.086 -0.281 8.086 1.00 0.00 H new ATOM 0 HB VAL A 24 7.030 -2.405 8.650 1.00 0.00 H new ATOM 0 HG11 VAL A 24 7.892 -2.421 10.961 1.00 0.00 H new ATOM 0 HG12 VAL A 24 9.105 -3.016 9.802 1.00 0.00 H new ATOM 0 HG13 VAL A 24 9.238 -1.369 10.463 1.00 0.00 H new ATOM 0 HG21 VAL A 24 6.262 -0.706 10.286 1.00 0.00 H new ATOM 0 HG22 VAL A 24 7.561 0.385 9.749 1.00 0.00 H new ATOM 0 HG23 VAL A 24 6.256 -0.064 8.626 1.00 0.00 H new ATOM 369 N TYR A 25 10.801 -1.861 7.140 1.00 0.00 N ATOM 370 CA TYR A 25 11.829 -2.784 6.723 1.00 0.00 C ATOM 371 C TYR A 25 12.912 -2.902 7.777 1.00 0.00 C ATOM 372 O TYR A 25 13.318 -1.919 8.401 1.00 0.00 O ATOM 373 CB TYR A 25 12.419 -2.385 5.362 1.00 0.00 C ATOM 374 CG TYR A 25 13.032 -1.001 5.308 1.00 0.00 C ATOM 375 CD1 TYR A 25 12.255 0.112 5.011 1.00 0.00 C ATOM 376 CD2 TYR A 25 14.389 -0.813 5.533 1.00 0.00 C ATOM 377 CE1 TYR A 25 12.815 1.374 4.945 1.00 0.00 C ATOM 378 CE2 TYR A 25 14.954 0.444 5.466 1.00 0.00 C ATOM 379 CZ TYR A 25 14.165 1.535 5.175 1.00 0.00 C ATOM 380 OH TYR A 25 14.729 2.789 5.102 1.00 0.00 O ATOM 0 H TYR A 25 11.088 -0.882 7.155 1.00 0.00 H new ATOM 0 HA TYR A 25 11.368 -3.765 6.606 1.00 0.00 H new ATOM 0 HB2 TYR A 25 13.181 -3.114 5.086 1.00 0.00 H new ATOM 0 HB3 TYR A 25 11.632 -2.446 4.610 1.00 0.00 H new ATOM 0 HD1 TYR A 25 11.198 -0.011 4.829 1.00 0.00 H new ATOM 0 HD2 TYR A 25 15.012 -1.664 5.764 1.00 0.00 H new ATOM 0 HE1 TYR A 25 12.198 2.230 4.714 1.00 0.00 H new ATOM 0 HE2 TYR A 25 16.012 0.572 5.641 1.00 0.00 H new ATOM 0 HH TYR A 25 15.689 2.728 5.292 1.00 0.00 H new ATOM 390 N LYS A 26 13.348 -4.124 7.981 1.00 0.00 N ATOM 391 CA LYS A 26 14.371 -4.434 8.950 1.00 0.00 C ATOM 392 C LYS A 26 15.606 -4.919 8.205 1.00 0.00 C ATOM 393 O LYS A 26 15.663 -6.068 7.761 1.00 0.00 O ATOM 394 CB LYS A 26 13.844 -5.505 9.905 1.00 0.00 C ATOM 395 CG LYS A 26 14.487 -5.504 11.278 1.00 0.00 C ATOM 396 CD LYS A 26 13.777 -6.484 12.197 1.00 0.00 C ATOM 397 CE LYS A 26 14.283 -6.393 13.624 1.00 0.00 C ATOM 398 NZ LYS A 26 13.594 -7.361 14.515 1.00 0.00 N ATOM 0 H LYS A 26 12.999 -4.937 7.474 1.00 0.00 H new ATOM 0 HA LYS A 26 14.636 -3.554 9.537 1.00 0.00 H new ATOM 0 HB2 LYS A 26 12.769 -5.370 10.023 1.00 0.00 H new ATOM 0 HB3 LYS A 26 13.994 -6.484 9.450 1.00 0.00 H new ATOM 0 HG2 LYS A 26 15.540 -5.773 11.193 1.00 0.00 H new ATOM 0 HG3 LYS A 26 14.447 -4.502 11.704 1.00 0.00 H new ATOM 0 HD2 LYS A 26 12.705 -6.287 12.179 1.00 0.00 H new ATOM 0 HD3 LYS A 26 13.920 -7.499 11.825 1.00 0.00 H new ATOM 0 HE2 LYS A 26 15.356 -6.582 13.642 1.00 0.00 H new ATOM 0 HE3 LYS A 26 14.131 -5.381 14.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 13.967 -7.269 15.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 12.573 -7.165 14.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 13.760 -8.328 14.171 1.00 0.00 H new ATOM 412 N GLY A 27 16.567 -4.026 8.020 1.00 0.00 N ATOM 413 CA GLY A 27 17.702 -4.337 7.179 1.00 0.00 C ATOM 414 C GLY A 27 17.314 -4.281 5.716 1.00 0.00 C ATOM 415 O GLY A 27 16.928 -3.227 5.214 1.00 0.00 O ATOM 0 H GLY A 27 16.581 -3.095 8.436 1.00 0.00 H new ATOM 0 HA2 GLY A 27 18.510 -3.631 7.374 1.00 0.00 H new ATOM 0 HA3 GLY A 27 18.080 -5.330 7.422 1.00 0.00 H new ATOM 419 N ASP A 28 17.386 -5.414 5.034 1.00 0.00 N ATOM 420 CA ASP A 28 16.951 -5.484 3.643 1.00 0.00 C ATOM 421 C ASP A 28 15.693 -6.342 3.540 1.00 0.00 C ATOM 422 O ASP A 28 15.444 -6.999 2.535 1.00 0.00 O ATOM 423 CB ASP A 28 18.064 -6.048 2.748 1.00 0.00 C ATOM 424 CG ASP A 28 17.833 -5.742 1.274 1.00 0.00 C ATOM 425 OD1 ASP A 28 18.073 -4.589 0.862 1.00 0.00 O ATOM 426 OD2 ASP A 28 17.412 -6.650 0.526 1.00 0.00 O ATOM 0 H ASP A 28 17.738 -6.292 5.415 1.00 0.00 H new ATOM 0 HA ASP A 28 16.724 -4.476 3.296 1.00 0.00 H new ATOM 0 HB2 ASP A 28 19.022 -5.631 3.057 1.00 0.00 H new ATOM 0 HB3 ASP A 28 18.127 -7.127 2.887 1.00 0.00 H new ATOM 431 N LYS A 29 14.893 -6.329 4.594 1.00 0.00 N ATOM 432 CA LYS A 29 13.646 -7.083 4.618 1.00 0.00 C ATOM 433 C LYS A 29 12.473 -6.194 4.989 1.00 0.00 C ATOM 434 O LYS A 29 12.368 -5.751 6.129 1.00 0.00 O ATOM 435 CB LYS A 29 13.726 -8.229 5.624 1.00 0.00 C ATOM 436 CG LYS A 29 14.293 -9.518 5.065 1.00 0.00 C ATOM 437 CD LYS A 29 14.412 -10.572 6.152 1.00 0.00 C ATOM 438 CE LYS A 29 15.497 -10.209 7.155 1.00 0.00 C ATOM 439 NZ LYS A 29 16.846 -10.165 6.527 1.00 0.00 N ATOM 0 H LYS A 29 15.084 -5.804 5.447 1.00 0.00 H new ATOM 0 HA LYS A 29 13.493 -7.482 3.615 1.00 0.00 H new ATOM 0 HB2 LYS A 29 14.340 -7.913 6.468 1.00 0.00 H new ATOM 0 HB3 LYS A 29 12.727 -8.425 6.012 1.00 0.00 H new ATOM 0 HG2 LYS A 29 13.651 -9.886 4.265 1.00 0.00 H new ATOM 0 HG3 LYS A 29 15.273 -9.329 4.626 1.00 0.00 H new ATOM 0 HD2 LYS A 29 13.457 -10.676 6.667 1.00 0.00 H new ATOM 0 HD3 LYS A 29 14.638 -11.539 5.702 1.00 0.00 H new ATOM 0 HE2 LYS A 29 15.271 -9.239 7.598 1.00 0.00 H new ATOM 0 HE3 LYS A 29 15.499 -10.937 7.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 17.575 -10.202 7.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 16.959 -10.978 5.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 16.948 -9.283 5.985 1.00 0.00 H new ATOM 453 N VAL A 30 11.595 -5.930 4.036 1.00 0.00 N ATOM 454 CA VAL A 30 10.361 -5.224 4.340 1.00 0.00 C ATOM 455 C VAL A 30 9.367 -6.211 4.931 1.00 0.00 C ATOM 456 O VAL A 30 8.678 -6.923 4.205 1.00 0.00 O ATOM 457 CB VAL A 30 9.741 -4.546 3.104 1.00 0.00 C ATOM 458 CG1 VAL A 30 8.611 -3.622 3.527 1.00 0.00 C ATOM 459 CG2 VAL A 30 10.793 -3.783 2.315 1.00 0.00 C ATOM 0 H VAL A 30 11.711 -6.190 3.056 1.00 0.00 H new ATOM 0 HA VAL A 30 10.598 -4.432 5.050 1.00 0.00 H new ATOM 0 HB VAL A 30 9.335 -5.321 2.454 1.00 0.00 H new ATOM 0 HG11 VAL A 30 8.180 -3.148 2.646 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.842 -4.199 4.041 1.00 0.00 H new ATOM 0 HG13 VAL A 30 8.999 -2.856 4.198 1.00 0.00 H new ATOM 0 HG21 VAL A 30 10.328 -3.314 1.448 1.00 0.00 H new ATOM 0 HG22 VAL A 30 11.237 -3.015 2.948 1.00 0.00 H new ATOM 0 HG23 VAL A 30 11.569 -4.472 1.982 1.00 0.00 H new ATOM 469 N LEU A 31 9.324 -6.266 6.251 1.00 0.00 N ATOM 470 CA LEU A 31 8.576 -7.302 6.947 1.00 0.00 C ATOM 471 C LEU A 31 7.146 -6.860 7.239 1.00 0.00 C ATOM 472 O LEU A 31 6.319 -7.662 7.668 1.00 0.00 O ATOM 473 CB LEU A 31 9.295 -7.684 8.244 1.00 0.00 C ATOM 474 CG LEU A 31 10.721 -8.207 8.067 1.00 0.00 C ATOM 475 CD1 LEU A 31 11.357 -8.488 9.420 1.00 0.00 C ATOM 476 CD2 LEU A 31 10.725 -9.461 7.203 1.00 0.00 C ATOM 0 H LEU A 31 9.799 -5.604 6.865 1.00 0.00 H new ATOM 0 HA LEU A 31 8.523 -8.175 6.297 1.00 0.00 H new ATOM 0 HB2 LEU A 31 9.323 -6.811 8.896 1.00 0.00 H new ATOM 0 HB3 LEU A 31 8.707 -8.445 8.756 1.00 0.00 H new ATOM 0 HG LEU A 31 11.310 -7.440 7.563 1.00 0.00 H new ATOM 0 HD11 LEU A 31 12.371 -8.859 9.275 1.00 0.00 H new ATOM 0 HD12 LEU A 31 11.387 -7.569 10.006 1.00 0.00 H new ATOM 0 HD13 LEU A 31 10.769 -9.237 9.950 1.00 0.00 H new ATOM 0 HD21 LEU A 31 11.748 -9.820 7.087 1.00 0.00 H new ATOM 0 HD22 LEU A 31 10.121 -10.233 7.680 1.00 0.00 H new ATOM 0 HD23 LEU A 31 10.309 -9.229 6.223 1.00 0.00 H new ATOM 488 N LYS A 32 6.856 -5.587 7.004 1.00 0.00 N ATOM 489 CA LYS A 32 5.513 -5.050 7.206 1.00 0.00 C ATOM 490 C LYS A 32 5.265 -3.873 6.272 1.00 0.00 C ATOM 491 O LYS A 32 6.133 -3.024 6.090 1.00 0.00 O ATOM 492 CB LYS A 32 5.312 -4.627 8.668 1.00 0.00 C ATOM 493 CG LYS A 32 5.028 -5.790 9.609 1.00 0.00 C ATOM 494 CD LYS A 32 5.218 -5.402 11.065 1.00 0.00 C ATOM 495 CE LYS A 32 4.847 -6.543 12.006 1.00 0.00 C ATOM 496 NZ LYS A 32 5.510 -7.823 11.636 1.00 0.00 N ATOM 0 H LYS A 32 7.535 -4.903 6.672 1.00 0.00 H new ATOM 0 HA LYS A 32 4.792 -5.834 6.975 1.00 0.00 H new ATOM 0 HB2 LYS A 32 6.204 -4.103 9.011 1.00 0.00 H new ATOM 0 HB3 LYS A 32 4.486 -3.918 8.721 1.00 0.00 H new ATOM 0 HG2 LYS A 32 4.007 -6.139 9.457 1.00 0.00 H new ATOM 0 HG3 LYS A 32 5.688 -6.623 9.366 1.00 0.00 H new ATOM 0 HD2 LYS A 32 6.256 -5.115 11.233 1.00 0.00 H new ATOM 0 HD3 LYS A 32 4.605 -4.529 11.292 1.00 0.00 H new ATOM 0 HE2 LYS A 32 5.125 -6.275 13.025 1.00 0.00 H new ATOM 0 HE3 LYS A 32 3.766 -6.681 11.996 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 5.423 -8.499 12.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 5.055 -8.217 10.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 6.516 -7.649 11.439 1.00 0.00 H new ATOM 510 N GLN A 33 4.088 -3.844 5.668 1.00 0.00 N ATOM 511 CA GLN A 33 3.715 -2.780 4.747 1.00 0.00 C ATOM 512 C GLN A 33 2.394 -2.138 5.170 1.00 0.00 C ATOM 513 O GLN A 33 1.368 -2.809 5.255 1.00 0.00 O ATOM 514 CB GLN A 33 3.588 -3.352 3.336 1.00 0.00 C ATOM 515 CG GLN A 33 3.299 -2.316 2.266 1.00 0.00 C ATOM 516 CD GLN A 33 3.166 -2.931 0.885 1.00 0.00 C ATOM 517 OE1 GLN A 33 2.439 -2.422 0.034 1.00 0.00 O ATOM 518 NE2 GLN A 33 3.868 -4.029 0.651 1.00 0.00 N ATOM 0 H GLN A 33 3.367 -4.553 5.801 1.00 0.00 H new ATOM 0 HA GLN A 33 4.489 -2.013 4.763 1.00 0.00 H new ATOM 0 HB2 GLN A 33 4.512 -3.871 3.082 1.00 0.00 H new ATOM 0 HB3 GLN A 33 2.792 -4.097 3.329 1.00 0.00 H new ATOM 0 HG2 GLN A 33 2.379 -1.787 2.515 1.00 0.00 H new ATOM 0 HG3 GLN A 33 4.099 -1.576 2.255 1.00 0.00 H new ATOM 0 HE21 GLN A 33 4.460 -4.421 1.383 1.00 0.00 H new ATOM 0 HE22 GLN A 33 3.817 -4.482 -0.261 1.00 0.00 H new ATOM 527 N SER A 34 2.421 -0.847 5.453 1.00 0.00 N ATOM 528 CA SER A 34 1.206 -0.119 5.786 1.00 0.00 C ATOM 529 C SER A 34 0.737 0.703 4.587 1.00 0.00 C ATOM 530 O SER A 34 1.250 1.788 4.323 1.00 0.00 O ATOM 531 CB SER A 34 1.452 0.782 6.996 1.00 0.00 C ATOM 532 OG SER A 34 1.946 0.025 8.089 1.00 0.00 O ATOM 0 H SER A 34 3.269 -0.281 5.459 1.00 0.00 H new ATOM 0 HA SER A 34 0.422 -0.833 6.039 1.00 0.00 H new ATOM 0 HB2 SER A 34 2.166 1.563 6.735 1.00 0.00 H new ATOM 0 HB3 SER A 34 0.525 1.279 7.280 1.00 0.00 H new ATOM 0 HG SER A 34 2.100 0.617 8.854 1.00 0.00 H new ATOM 538 N SER A 35 -0.231 0.167 3.864 1.00 0.00 N ATOM 539 CA SER A 35 -0.703 0.777 2.634 1.00 0.00 C ATOM 540 C SER A 35 -2.037 1.482 2.859 1.00 0.00 C ATOM 541 O SER A 35 -3.028 0.849 3.209 1.00 0.00 O ATOM 542 CB SER A 35 -0.857 -0.306 1.566 1.00 0.00 C ATOM 543 OG SER A 35 0.272 -1.166 1.561 1.00 0.00 O ATOM 0 H SER A 35 -0.710 -0.699 4.112 1.00 0.00 H new ATOM 0 HA SER A 35 0.022 1.521 2.304 1.00 0.00 H new ATOM 0 HB2 SER A 35 -1.761 -0.885 1.755 1.00 0.00 H new ATOM 0 HB3 SER A 35 -0.973 0.156 0.586 1.00 0.00 H new ATOM 0 HG SER A 35 0.642 -1.215 0.655 1.00 0.00 H new ATOM 549 N GLU A 36 -2.058 2.792 2.673 1.00 0.00 N ATOM 550 CA GLU A 36 -3.281 3.559 2.830 1.00 0.00 C ATOM 551 C GLU A 36 -3.696 4.166 1.495 1.00 0.00 C ATOM 552 O GLU A 36 -3.067 5.102 0.996 1.00 0.00 O ATOM 553 CB GLU A 36 -3.090 4.644 3.889 1.00 0.00 C ATOM 554 CG GLU A 36 -2.855 4.093 5.287 1.00 0.00 C ATOM 555 CD GLU A 36 -2.436 5.167 6.269 1.00 0.00 C ATOM 556 OE1 GLU A 36 -1.241 5.531 6.282 1.00 0.00 O ATOM 557 OE2 GLU A 36 -3.296 5.651 7.034 1.00 0.00 O ATOM 0 H GLU A 36 -1.242 3.345 2.413 1.00 0.00 H new ATOM 0 HA GLU A 36 -4.078 2.894 3.164 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -2.244 5.271 3.607 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -3.971 5.286 3.903 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -3.767 3.614 5.644 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -2.086 3.322 5.246 1.00 0.00 H new ATOM 564 N THR A 37 -4.744 3.608 0.913 1.00 0.00 N ATOM 565 CA THR A 37 -5.223 4.039 -0.391 1.00 0.00 C ATOM 566 C THR A 37 -6.264 5.151 -0.252 1.00 0.00 C ATOM 567 O THR A 37 -7.357 4.928 0.259 1.00 0.00 O ATOM 568 CB THR A 37 -5.839 2.851 -1.161 1.00 0.00 C ATOM 569 OG1 THR A 37 -4.915 1.759 -1.210 1.00 0.00 O ATOM 570 CG2 THR A 37 -6.228 3.253 -2.573 1.00 0.00 C ATOM 0 H THR A 37 -5.284 2.848 1.327 1.00 0.00 H new ATOM 0 HA THR A 37 -4.369 4.425 -0.947 1.00 0.00 H new ATOM 0 HB THR A 37 -6.739 2.541 -0.630 1.00 0.00 H new ATOM 0 HG1 THR A 37 -5.318 1.011 -1.699 1.00 0.00 H new ATOM 0 HG21 THR A 37 -6.659 2.395 -3.090 1.00 0.00 H new ATOM 0 HG22 THR A 37 -6.961 4.058 -2.533 1.00 0.00 H new ATOM 0 HG23 THR A 37 -5.343 3.594 -3.111 1.00 0.00 H new ATOM 578 N LYS A 38 -5.917 6.350 -0.690 1.00 0.00 N ATOM 579 CA LYS A 38 -6.826 7.486 -0.615 1.00 0.00 C ATOM 580 C LYS A 38 -7.491 7.722 -1.969 1.00 0.00 C ATOM 581 O LYS A 38 -6.909 8.325 -2.868 1.00 0.00 O ATOM 582 CB LYS A 38 -6.063 8.725 -0.132 1.00 0.00 C ATOM 583 CG LYS A 38 -6.917 9.967 0.075 1.00 0.00 C ATOM 584 CD LYS A 38 -6.229 10.935 1.028 1.00 0.00 C ATOM 585 CE LYS A 38 -6.966 12.258 1.145 1.00 0.00 C ATOM 586 NZ LYS A 38 -6.623 13.188 0.038 1.00 0.00 N ATOM 0 H LYS A 38 -5.009 6.564 -1.103 1.00 0.00 H new ATOM 0 HA LYS A 38 -7.618 7.275 0.104 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -5.566 8.484 0.808 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -5.281 8.957 -0.856 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -7.096 10.456 -0.883 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -7.890 9.684 0.475 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -6.153 10.477 2.014 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -5.212 11.119 0.682 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -8.041 12.075 1.145 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -6.722 12.725 2.099 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -7.380 13.893 -0.071 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -5.728 13.672 0.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -6.520 12.651 -0.847 1.00 0.00 H new ATOM 600 N ILE A 39 -8.706 7.210 -2.113 1.00 0.00 N ATOM 601 CA ILE A 39 -9.429 7.296 -3.373 1.00 0.00 C ATOM 602 C ILE A 39 -10.328 8.524 -3.389 1.00 0.00 C ATOM 603 O ILE A 39 -11.113 8.742 -2.463 1.00 0.00 O ATOM 604 CB ILE A 39 -10.316 6.051 -3.634 1.00 0.00 C ATOM 605 CG1 ILE A 39 -9.540 4.746 -3.436 1.00 0.00 C ATOM 606 CG2 ILE A 39 -10.898 6.100 -5.039 1.00 0.00 C ATOM 607 CD1 ILE A 39 -9.589 4.217 -2.018 1.00 0.00 C ATOM 0 H ILE A 39 -9.212 6.729 -1.369 1.00 0.00 H new ATOM 0 HA ILE A 39 -8.672 7.359 -4.154 1.00 0.00 H new ATOM 0 HB ILE A 39 -11.127 6.071 -2.906 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -9.941 3.989 -4.111 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -8.500 4.906 -3.719 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -11.518 5.219 -5.207 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -11.506 6.998 -5.150 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -10.088 6.118 -5.768 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -9.017 3.291 -1.955 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -9.161 4.955 -1.339 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -10.624 4.024 -1.737 1.00 0.00 H new ATOM 619 N GLN A 40 -10.207 9.326 -4.436 1.00 0.00 N ATOM 620 CA GLN A 40 -11.095 10.458 -4.629 1.00 0.00 C ATOM 621 C GLN A 40 -12.313 10.025 -5.438 1.00 0.00 C ATOM 622 O GLN A 40 -12.177 9.343 -6.459 1.00 0.00 O ATOM 623 CB GLN A 40 -10.360 11.602 -5.332 1.00 0.00 C ATOM 624 CG GLN A 40 -9.193 12.156 -4.525 1.00 0.00 C ATOM 625 CD GLN A 40 -9.622 12.698 -3.173 1.00 0.00 C ATOM 626 OE1 GLN A 40 -10.743 13.179 -3.010 1.00 0.00 O ATOM 627 NE2 GLN A 40 -8.735 12.625 -2.190 1.00 0.00 N ATOM 0 H GLN A 40 -9.502 9.212 -5.164 1.00 0.00 H new ATOM 0 HA GLN A 40 -11.428 10.818 -3.655 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -9.991 11.250 -6.295 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -11.066 12.407 -5.536 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -8.452 11.370 -4.379 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -8.708 12.950 -5.093 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -7.815 12.220 -2.362 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -8.973 12.974 -1.262 1.00 0.00 H new ATOM 636 N PHE A 41 -13.498 10.415 -4.981 1.00 0.00 N ATOM 637 CA PHE A 41 -14.748 9.969 -5.598 1.00 0.00 C ATOM 638 C PHE A 41 -14.856 10.416 -7.051 1.00 0.00 C ATOM 639 O PHE A 41 -15.413 9.703 -7.888 1.00 0.00 O ATOM 640 CB PHE A 41 -15.954 10.476 -4.805 1.00 0.00 C ATOM 641 CG PHE A 41 -16.169 9.772 -3.494 1.00 0.00 C ATOM 642 CD1 PHE A 41 -15.259 8.837 -3.025 1.00 0.00 C ATOM 643 CD2 PHE A 41 -17.292 10.044 -2.734 1.00 0.00 C ATOM 644 CE1 PHE A 41 -15.463 8.196 -1.820 1.00 0.00 C ATOM 645 CE2 PHE A 41 -17.501 9.406 -1.528 1.00 0.00 C ATOM 646 CZ PHE A 41 -16.588 8.478 -1.073 1.00 0.00 C ATOM 0 H PHE A 41 -13.622 11.040 -4.184 1.00 0.00 H new ATOM 0 HA PHE A 41 -14.742 8.879 -5.582 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -15.828 11.542 -4.616 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -16.850 10.364 -5.416 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -14.380 8.608 -3.609 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -18.014 10.764 -3.088 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -14.743 7.475 -1.462 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -18.379 9.633 -0.941 1.00 0.00 H new ATOM 0 HZ PHE A 41 -16.754 7.973 -0.133 1.00 0.00 H new ATOM 656 N ALA A 42 -14.304 11.584 -7.350 1.00 0.00 N ATOM 657 CA ALA A 42 -14.326 12.123 -8.704 1.00 0.00 C ATOM 658 C ALA A 42 -13.532 11.244 -9.669 1.00 0.00 C ATOM 659 O ALA A 42 -13.756 11.273 -10.878 1.00 0.00 O ATOM 660 CB ALA A 42 -13.775 13.540 -8.713 1.00 0.00 C ATOM 0 H ALA A 42 -13.833 12.180 -6.669 1.00 0.00 H new ATOM 0 HA ALA A 42 -15.363 12.138 -9.041 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -13.796 13.932 -9.730 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -14.385 14.172 -8.067 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -12.748 13.533 -8.348 1.00 0.00 H new ATOM 666 N SER A 43 -12.611 10.461 -9.123 1.00 0.00 N ATOM 667 CA SER A 43 -11.758 9.604 -9.929 1.00 0.00 C ATOM 668 C SER A 43 -12.376 8.218 -10.102 1.00 0.00 C ATOM 669 O SER A 43 -12.370 7.656 -11.197 1.00 0.00 O ATOM 670 CB SER A 43 -10.387 9.490 -9.274 1.00 0.00 C ATOM 671 OG SER A 43 -9.887 10.772 -8.931 1.00 0.00 O ATOM 0 H SER A 43 -12.437 10.403 -8.120 1.00 0.00 H new ATOM 0 HA SER A 43 -11.654 10.050 -10.918 1.00 0.00 H new ATOM 0 HB2 SER A 43 -10.456 8.870 -8.380 1.00 0.00 H new ATOM 0 HB3 SER A 43 -9.694 8.994 -9.953 1.00 0.00 H new ATOM 0 HG SER A 43 -9.522 11.205 -9.731 1.00 0.00 H new ATOM 677 N ILE A 44 -12.911 7.669 -9.013 1.00 0.00 N ATOM 678 CA ILE A 44 -13.536 6.349 -9.055 1.00 0.00 C ATOM 679 C ILE A 44 -14.858 6.408 -9.825 1.00 0.00 C ATOM 680 O ILE A 44 -15.286 5.420 -10.423 1.00 0.00 O ATOM 681 CB ILE A 44 -13.767 5.775 -7.631 1.00 0.00 C ATOM 682 CG1 ILE A 44 -14.419 4.387 -7.697 1.00 0.00 C ATOM 683 CG2 ILE A 44 -14.615 6.721 -6.795 1.00 0.00 C ATOM 684 CD1 ILE A 44 -14.678 3.769 -6.336 1.00 0.00 C ATOM 0 H ILE A 44 -12.924 8.115 -8.096 1.00 0.00 H new ATOM 0 HA ILE A 44 -12.851 5.678 -9.574 1.00 0.00 H new ATOM 0 HB ILE A 44 -12.793 5.673 -7.152 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -15.363 4.464 -8.237 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -13.776 3.721 -8.272 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -14.762 6.296 -5.802 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -14.109 7.682 -6.707 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -15.583 6.864 -7.276 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -15.140 2.790 -6.463 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -13.735 3.659 -5.801 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -15.346 4.414 -5.765 1.00 0.00 H new ATOM 696 N GLY A 45 -15.478 7.581 -9.838 1.00 0.00 N ATOM 697 CA GLY A 45 -16.723 7.753 -10.560 1.00 0.00 C ATOM 698 C GLY A 45 -17.925 7.578 -9.662 1.00 0.00 C ATOM 699 O GLY A 45 -19.015 7.251 -10.125 1.00 0.00 O ATOM 0 H GLY A 45 -15.140 8.417 -9.361 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -16.747 8.746 -11.010 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -16.772 7.032 -11.376 1.00 0.00 H new ATOM 703 N ALA A 46 -17.720 7.800 -8.373 1.00 0.00 N ATOM 704 CA ALA A 46 -18.782 7.647 -7.396 1.00 0.00 C ATOM 705 C ALA A 46 -19.327 9.002 -6.986 1.00 0.00 C ATOM 706 O ALA A 46 -18.569 9.910 -6.640 1.00 0.00 O ATOM 707 CB ALA A 46 -18.275 6.894 -6.179 1.00 0.00 C ATOM 0 H ALA A 46 -16.824 8.088 -7.980 1.00 0.00 H new ATOM 0 HA ALA A 46 -19.589 7.073 -7.851 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -19.083 6.787 -5.455 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -17.926 5.907 -6.481 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -17.452 7.447 -5.726 1.00 0.00 H new ATOM 713 N THR A 47 -20.638 9.142 -7.032 1.00 0.00 N ATOM 714 CA THR A 47 -21.278 10.393 -6.663 1.00 0.00 C ATOM 715 C THR A 47 -21.448 10.483 -5.148 1.00 0.00 C ATOM 716 O THR A 47 -21.103 11.490 -4.525 1.00 0.00 O ATOM 717 CB THR A 47 -22.653 10.528 -7.346 1.00 0.00 C ATOM 718 OG1 THR A 47 -22.545 10.151 -8.727 1.00 0.00 O ATOM 719 CG2 THR A 47 -23.173 11.955 -7.249 1.00 0.00 C ATOM 0 H THR A 47 -21.282 8.406 -7.321 1.00 0.00 H new ATOM 0 HA THR A 47 -20.636 11.207 -6.999 1.00 0.00 H new ATOM 0 HB THR A 47 -23.355 9.869 -6.835 1.00 0.00 H new ATOM 0 HG1 THR A 47 -23.421 10.236 -9.159 1.00 0.00 H new ATOM 0 HG21 THR A 47 -24.144 12.022 -7.739 1.00 0.00 H new ATOM 0 HG22 THR A 47 -23.275 12.235 -6.200 1.00 0.00 H new ATOM 0 HG23 THR A 47 -22.472 12.632 -7.738 1.00 0.00 H new ATOM 727 N THR A 48 -21.950 9.408 -4.563 1.00 0.00 N ATOM 728 CA THR A 48 -22.233 9.365 -3.139 1.00 0.00 C ATOM 729 C THR A 48 -21.210 8.489 -2.413 1.00 0.00 C ATOM 730 O THR A 48 -20.589 7.620 -3.025 1.00 0.00 O ATOM 731 CB THR A 48 -23.655 8.811 -2.899 1.00 0.00 C ATOM 732 OG1 THR A 48 -24.596 9.540 -3.694 1.00 0.00 O ATOM 733 CG2 THR A 48 -24.051 8.910 -1.433 1.00 0.00 C ATOM 0 H THR A 48 -22.172 8.545 -5.059 1.00 0.00 H new ATOM 0 HA THR A 48 -22.169 10.379 -2.745 1.00 0.00 H new ATOM 0 HB THR A 48 -23.658 7.759 -3.184 1.00 0.00 H new ATOM 0 HG1 THR A 48 -25.497 9.186 -3.541 1.00 0.00 H new ATOM 0 HG21 THR A 48 -25.057 8.512 -1.300 1.00 0.00 H new ATOM 0 HG22 THR A 48 -23.350 8.336 -0.827 1.00 0.00 H new ATOM 0 HG23 THR A 48 -24.030 9.954 -1.120 1.00 0.00 H new ATOM 741 N LYS A 49 -21.030 8.736 -1.119 1.00 0.00 N ATOM 742 CA LYS A 49 -20.170 7.910 -0.276 1.00 0.00 C ATOM 743 C LYS A 49 -20.548 6.436 -0.395 1.00 0.00 C ATOM 744 O LYS A 49 -19.688 5.569 -0.541 1.00 0.00 O ATOM 745 CB LYS A 49 -20.281 8.370 1.184 1.00 0.00 C ATOM 746 CG LYS A 49 -19.332 7.649 2.130 1.00 0.00 C ATOM 747 CD LYS A 49 -19.361 8.240 3.538 1.00 0.00 C ATOM 748 CE LYS A 49 -20.468 7.653 4.408 1.00 0.00 C ATOM 749 NZ LYS A 49 -21.831 7.997 3.924 1.00 0.00 N ATOM 0 H LYS A 49 -21.474 9.511 -0.626 1.00 0.00 H new ATOM 0 HA LYS A 49 -19.139 8.024 -0.612 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -20.084 9.441 1.234 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -21.305 8.218 1.526 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -19.600 6.593 2.175 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -18.317 7.704 1.736 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -18.398 8.067 4.019 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -19.494 9.320 3.470 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -20.362 6.569 4.438 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -20.349 8.014 5.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -22.498 7.977 4.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -21.821 8.949 3.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -22.129 7.306 3.206 1.00 0.00 H new ATOM 763 N GLU A 50 -21.848 6.170 -0.362 1.00 0.00 N ATOM 764 CA GLU A 50 -22.365 4.807 -0.451 1.00 0.00 C ATOM 765 C GLU A 50 -22.104 4.229 -1.837 1.00 0.00 C ATOM 766 O GLU A 50 -21.942 3.020 -2.009 1.00 0.00 O ATOM 767 CB GLU A 50 -23.870 4.807 -0.178 1.00 0.00 C ATOM 768 CG GLU A 50 -24.299 5.776 0.912 1.00 0.00 C ATOM 769 CD GLU A 50 -23.635 5.500 2.243 1.00 0.00 C ATOM 770 OE1 GLU A 50 -22.491 5.953 2.447 1.00 0.00 O ATOM 771 OE2 GLU A 50 -24.260 4.844 3.099 1.00 0.00 O ATOM 0 H GLU A 50 -22.570 6.885 -0.274 1.00 0.00 H new ATOM 0 HA GLU A 50 -21.856 4.193 0.292 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -24.396 5.056 -1.099 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -24.178 3.800 0.103 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -24.064 6.793 0.599 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -25.381 5.722 1.034 1.00 0.00 H new ATOM 778 N ASP A 51 -22.044 5.119 -2.816 1.00 0.00 N ATOM 779 CA ASP A 51 -21.872 4.737 -4.211 1.00 0.00 C ATOM 780 C ASP A 51 -20.442 4.264 -4.448 1.00 0.00 C ATOM 781 O ASP A 51 -20.188 3.403 -5.289 1.00 0.00 O ATOM 782 CB ASP A 51 -22.213 5.931 -5.110 1.00 0.00 C ATOM 783 CG ASP A 51 -22.290 5.585 -6.583 1.00 0.00 C ATOM 784 OD1 ASP A 51 -22.944 4.574 -6.929 1.00 0.00 O ATOM 785 OD2 ASP A 51 -21.751 6.358 -7.400 1.00 0.00 O ATOM 0 H ASP A 51 -22.113 6.126 -2.667 1.00 0.00 H new ATOM 0 HA ASP A 51 -22.544 3.914 -4.454 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -23.168 6.350 -4.794 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -21.461 6.707 -4.968 1.00 0.00 H new ATOM 790 N ALA A 52 -19.514 4.820 -3.677 1.00 0.00 N ATOM 791 CA ALA A 52 -18.119 4.406 -3.735 1.00 0.00 C ATOM 792 C ALA A 52 -17.912 3.121 -2.952 1.00 0.00 C ATOM 793 O ALA A 52 -17.113 2.264 -3.337 1.00 0.00 O ATOM 794 CB ALA A 52 -17.218 5.501 -3.190 1.00 0.00 C ATOM 0 H ALA A 52 -19.705 5.561 -3.003 1.00 0.00 H new ATOM 0 HA ALA A 52 -17.858 4.225 -4.778 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -16.179 5.176 -3.240 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -17.344 6.406 -3.785 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -17.483 5.708 -2.153 1.00 0.00 H new ATOM 800 N ALA A 53 -18.648 2.990 -1.854 1.00 0.00 N ATOM 801 CA ALA A 53 -18.561 1.812 -1.003 1.00 0.00 C ATOM 802 C ALA A 53 -18.879 0.549 -1.791 1.00 0.00 C ATOM 803 O ALA A 53 -18.195 -0.461 -1.657 1.00 0.00 O ATOM 804 CB ALA A 53 -19.497 1.949 0.187 1.00 0.00 C ATOM 0 H ALA A 53 -19.315 3.691 -1.532 1.00 0.00 H new ATOM 0 HA ALA A 53 -17.539 1.732 -0.634 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -19.421 1.061 0.814 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -19.220 2.828 0.768 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -20.522 2.056 -0.167 1.00 0.00 H new ATOM 810 N LYS A 54 -19.894 0.627 -2.644 1.00 0.00 N ATOM 811 CA LYS A 54 -20.314 -0.514 -3.460 1.00 0.00 C ATOM 812 C LYS A 54 -19.176 -1.046 -4.336 1.00 0.00 C ATOM 813 O LYS A 54 -19.229 -2.179 -4.816 1.00 0.00 O ATOM 814 CB LYS A 54 -21.506 -0.121 -4.332 1.00 0.00 C ATOM 815 CG LYS A 54 -22.766 0.155 -3.533 1.00 0.00 C ATOM 816 CD LYS A 54 -23.887 0.679 -4.413 1.00 0.00 C ATOM 817 CE LYS A 54 -25.186 0.812 -3.634 1.00 0.00 C ATOM 818 NZ LYS A 54 -25.028 1.666 -2.428 1.00 0.00 N ATOM 0 H LYS A 54 -20.446 1.472 -2.791 1.00 0.00 H new ATOM 0 HA LYS A 54 -20.604 -1.315 -2.780 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -21.248 0.767 -4.910 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -21.704 -0.920 -5.046 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -23.090 -0.760 -3.037 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -22.548 0.881 -2.750 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -23.606 1.649 -4.824 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -24.034 0.005 -5.257 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -25.954 1.236 -4.280 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -25.532 -0.177 -3.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -25.965 1.883 -2.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -24.460 1.162 -1.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -24.549 2.551 -2.690 1.00 0.00 H new ATOM 832 N THR A 55 -18.153 -0.231 -4.544 1.00 0.00 N ATOM 833 CA THR A 55 -17.003 -0.639 -5.331 1.00 0.00 C ATOM 834 C THR A 55 -15.851 -1.097 -4.432 1.00 0.00 C ATOM 835 O THR A 55 -15.219 -2.117 -4.693 1.00 0.00 O ATOM 836 CB THR A 55 -16.527 0.517 -6.233 1.00 0.00 C ATOM 837 OG1 THR A 55 -17.645 1.058 -6.951 1.00 0.00 O ATOM 838 CG2 THR A 55 -15.470 0.047 -7.222 1.00 0.00 C ATOM 0 H THR A 55 -18.097 0.719 -4.177 1.00 0.00 H new ATOM 0 HA THR A 55 -17.311 -1.478 -5.955 1.00 0.00 H new ATOM 0 HB THR A 55 -16.084 1.284 -5.597 1.00 0.00 H new ATOM 0 HG1 THR A 55 -17.342 1.794 -7.523 1.00 0.00 H new ATOM 0 HG21 THR A 55 -15.155 0.885 -7.843 1.00 0.00 H new ATOM 0 HG22 THR A 55 -14.611 -0.344 -6.677 1.00 0.00 H new ATOM 0 HG23 THR A 55 -15.886 -0.737 -7.854 1.00 0.00 H new ATOM 846 N LEU A 56 -15.604 -0.356 -3.356 1.00 0.00 N ATOM 847 CA LEU A 56 -14.441 -0.603 -2.502 1.00 0.00 C ATOM 848 C LEU A 56 -14.661 -1.767 -1.534 1.00 0.00 C ATOM 849 O LEU A 56 -13.734 -2.529 -1.259 1.00 0.00 O ATOM 850 CB LEU A 56 -14.084 0.663 -1.719 1.00 0.00 C ATOM 851 CG LEU A 56 -13.684 1.866 -2.576 1.00 0.00 C ATOM 852 CD1 LEU A 56 -13.403 3.074 -1.700 1.00 0.00 C ATOM 853 CD2 LEU A 56 -12.469 1.534 -3.430 1.00 0.00 C ATOM 0 H LEU A 56 -16.192 0.421 -3.053 1.00 0.00 H new ATOM 0 HA LEU A 56 -13.616 -0.878 -3.159 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -14.939 0.944 -1.103 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -13.264 0.432 -1.040 1.00 0.00 H new ATOM 0 HG LEU A 56 -14.515 2.106 -3.239 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -13.120 3.920 -2.327 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -14.298 3.327 -1.131 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -12.589 2.843 -1.013 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -12.200 2.402 -4.032 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -11.633 1.267 -2.784 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -12.703 0.696 -4.086 1.00 0.00 H new ATOM 865 N GLU A 57 -15.885 -1.906 -1.029 1.00 0.00 N ATOM 866 CA GLU A 57 -16.209 -2.947 -0.047 1.00 0.00 C ATOM 867 C GLU A 57 -15.770 -4.354 -0.512 1.00 0.00 C ATOM 868 O GLU A 57 -15.078 -5.053 0.230 1.00 0.00 O ATOM 869 CB GLU A 57 -17.709 -2.928 0.282 1.00 0.00 C ATOM 870 CG GLU A 57 -18.165 -1.705 1.065 1.00 0.00 C ATOM 871 CD GLU A 57 -17.648 -1.671 2.484 1.00 0.00 C ATOM 872 OE1 GLU A 57 -18.021 -2.555 3.279 1.00 0.00 O ATOM 873 OE2 GLU A 57 -16.878 -0.749 2.819 1.00 0.00 O ATOM 0 H GLU A 57 -16.673 -1.310 -1.283 1.00 0.00 H new ATOM 0 HA GLU A 57 -15.644 -2.721 0.858 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -18.274 -2.980 -0.649 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -17.955 -3.823 0.854 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -17.834 -0.806 0.545 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -19.255 -1.680 1.083 1.00 0.00 H new ATOM 880 N PRO A 58 -16.182 -4.809 -1.723 1.00 0.00 N ATOM 881 CA PRO A 58 -15.701 -6.078 -2.293 1.00 0.00 C ATOM 882 C PRO A 58 -14.173 -6.191 -2.334 1.00 0.00 C ATOM 883 O PRO A 58 -13.618 -7.265 -2.093 1.00 0.00 O ATOM 884 CB PRO A 58 -16.237 -6.067 -3.725 1.00 0.00 C ATOM 885 CG PRO A 58 -17.400 -5.140 -3.718 1.00 0.00 C ATOM 886 CD PRO A 58 -17.191 -4.169 -2.589 1.00 0.00 C ATOM 0 HA PRO A 58 -16.038 -6.918 -1.685 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -15.473 -5.730 -4.425 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -16.537 -7.067 -4.038 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -17.477 -4.613 -4.669 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -18.330 -5.692 -3.583 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -16.842 -3.204 -2.957 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -18.119 -3.987 -2.047 1.00 0.00 H new ATOM 894 N LEU A 59 -13.502 -5.083 -2.631 1.00 0.00 N ATOM 895 CA LEU A 59 -12.063 -5.098 -2.898 1.00 0.00 C ATOM 896 C LEU A 59 -11.238 -5.389 -1.648 1.00 0.00 C ATOM 897 O LEU A 59 -10.420 -6.312 -1.647 1.00 0.00 O ATOM 898 CB LEU A 59 -11.616 -3.774 -3.527 1.00 0.00 C ATOM 899 CG LEU A 59 -11.609 -3.743 -5.062 1.00 0.00 C ATOM 900 CD1 LEU A 59 -12.977 -4.096 -5.627 1.00 0.00 C ATOM 901 CD2 LEU A 59 -11.168 -2.377 -5.562 1.00 0.00 C ATOM 0 H LEU A 59 -13.931 -4.160 -2.694 1.00 0.00 H new ATOM 0 HA LEU A 59 -11.884 -5.911 -3.601 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -12.272 -2.981 -3.168 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -10.612 -3.543 -3.171 1.00 0.00 H new ATOM 0 HG LEU A 59 -10.898 -4.492 -5.409 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -12.940 -4.065 -6.716 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -13.258 -5.098 -5.301 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -13.715 -3.378 -5.269 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -11.168 -2.371 -6.652 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -11.856 -1.616 -5.195 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -10.163 -2.163 -5.198 1.00 0.00 H new ATOM 913 N SER A 60 -11.448 -4.620 -0.587 1.00 0.00 N ATOM 914 CA SER A 60 -10.651 -4.776 0.626 1.00 0.00 C ATOM 915 C SER A 60 -10.904 -6.137 1.268 1.00 0.00 C ATOM 916 O SER A 60 -10.013 -6.717 1.888 1.00 0.00 O ATOM 917 CB SER A 60 -10.966 -3.665 1.624 1.00 0.00 C ATOM 918 OG SER A 60 -12.279 -3.803 2.136 1.00 0.00 O ATOM 0 H SER A 60 -12.157 -3.888 -0.540 1.00 0.00 H new ATOM 0 HA SER A 60 -9.599 -4.711 0.347 1.00 0.00 H new ATOM 0 HB2 SER A 60 -10.247 -3.692 2.443 1.00 0.00 H new ATOM 0 HB3 SER A 60 -10.861 -2.694 1.139 1.00 0.00 H new ATOM 0 HG SER A 60 -12.244 -4.239 3.013 1.00 0.00 H new ATOM 924 N ALA A 61 -12.116 -6.658 1.071 1.00 0.00 N ATOM 925 CA ALA A 61 -12.526 -7.930 1.660 1.00 0.00 C ATOM 926 C ALA A 61 -11.751 -9.104 1.069 1.00 0.00 C ATOM 927 O ALA A 61 -11.961 -10.256 1.448 1.00 0.00 O ATOM 928 CB ALA A 61 -14.018 -8.138 1.470 1.00 0.00 C ATOM 0 H ALA A 61 -12.836 -6.212 0.502 1.00 0.00 H new ATOM 0 HA ALA A 61 -12.300 -7.889 2.726 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -14.312 -9.089 1.913 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -14.563 -7.328 1.955 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -14.252 -8.146 0.405 1.00 0.00 H new ATOM 934 N LYS A 62 -10.858 -8.813 0.139 1.00 0.00 N ATOM 935 CA LYS A 62 -9.994 -9.833 -0.422 1.00 0.00 C ATOM 936 C LYS A 62 -8.737 -9.988 0.429 1.00 0.00 C ATOM 937 O LYS A 62 -7.868 -10.801 0.122 1.00 0.00 O ATOM 938 CB LYS A 62 -9.626 -9.487 -1.868 1.00 0.00 C ATOM 939 CG LYS A 62 -10.824 -9.428 -2.803 1.00 0.00 C ATOM 940 CD LYS A 62 -10.402 -9.217 -4.249 1.00 0.00 C ATOM 941 CE LYS A 62 -11.602 -9.226 -5.182 1.00 0.00 C ATOM 942 NZ LYS A 62 -11.198 -9.225 -6.615 1.00 0.00 N ATOM 0 H LYS A 62 -10.713 -7.878 -0.243 1.00 0.00 H new ATOM 0 HA LYS A 62 -10.530 -10.782 -0.423 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -9.115 -8.524 -1.884 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -8.920 -10.228 -2.242 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -11.394 -10.353 -2.722 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -11.486 -8.618 -2.496 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -9.874 -8.268 -4.341 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -9.703 -10.000 -4.544 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -12.212 -10.106 -4.979 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -12.224 -8.354 -4.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -12.047 -9.231 -7.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -10.638 -8.373 -6.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -10.626 -10.071 -6.815 1.00 0.00 H new ATOM 956 N TYR A 63 -8.648 -9.206 1.506 1.00 0.00 N ATOM 957 CA TYR A 63 -7.494 -9.263 2.398 1.00 0.00 C ATOM 958 C TYR A 63 -7.839 -9.813 3.777 1.00 0.00 C ATOM 959 O TYR A 63 -6.946 -10.220 4.513 1.00 0.00 O ATOM 960 CB TYR A 63 -6.859 -7.880 2.559 1.00 0.00 C ATOM 961 CG TYR A 63 -5.980 -7.483 1.401 1.00 0.00 C ATOM 962 CD1 TYR A 63 -4.661 -7.909 1.349 1.00 0.00 C ATOM 963 CD2 TYR A 63 -6.462 -6.697 0.361 1.00 0.00 C ATOM 964 CE1 TYR A 63 -3.843 -7.563 0.298 1.00 0.00 C ATOM 965 CE2 TYR A 63 -5.648 -6.347 -0.699 1.00 0.00 C ATOM 966 CZ TYR A 63 -4.338 -6.784 -0.726 1.00 0.00 C ATOM 967 OH TYR A 63 -3.524 -6.443 -1.782 1.00 0.00 O ATOM 0 H TYR A 63 -9.360 -8.529 1.779 1.00 0.00 H new ATOM 0 HA TYR A 63 -6.786 -9.947 1.929 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -7.649 -7.138 2.676 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -6.268 -7.865 3.475 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -4.269 -8.523 2.147 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -7.486 -6.355 0.382 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -2.817 -7.900 0.275 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -6.034 -5.736 -1.501 1.00 0.00 H new ATOM 0 HH TYR A 63 -4.027 -5.892 -2.418 1.00 0.00 H new ATOM 977 N LYS A 64 -9.118 -9.822 4.130 1.00 0.00 N ATOM 978 CA LYS A 64 -9.534 -10.229 5.472 1.00 0.00 C ATOM 979 C LYS A 64 -8.953 -11.590 5.883 1.00 0.00 C ATOM 980 O LYS A 64 -9.218 -12.617 5.260 1.00 0.00 O ATOM 981 CB LYS A 64 -11.068 -10.204 5.601 1.00 0.00 C ATOM 982 CG LYS A 64 -11.826 -10.836 4.440 1.00 0.00 C ATOM 983 CD LYS A 64 -12.056 -12.324 4.643 1.00 0.00 C ATOM 984 CE LYS A 64 -12.663 -12.967 3.407 1.00 0.00 C ATOM 985 NZ LYS A 64 -11.767 -12.847 2.226 1.00 0.00 N ATOM 0 H LYS A 64 -9.884 -9.554 3.512 1.00 0.00 H new ATOM 0 HA LYS A 64 -9.123 -9.500 6.170 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -11.348 -10.719 6.520 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -11.391 -9.168 5.704 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -12.787 -10.335 4.321 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -11.268 -10.680 3.517 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -11.110 -12.811 4.880 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -12.716 -12.478 5.496 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -12.863 -14.020 3.606 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -13.621 -12.497 3.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -11.915 -13.659 1.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -11.982 -11.967 1.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -10.776 -12.831 2.542 1.00 0.00 H new ATOM 999 N ASN A 65 -8.103 -11.551 6.909 1.00 0.00 N ATOM 1000 CA ASN A 65 -7.556 -12.749 7.558 1.00 0.00 C ATOM 1001 C ASN A 65 -6.642 -13.576 6.648 1.00 0.00 C ATOM 1002 O ASN A 65 -6.556 -14.794 6.801 1.00 0.00 O ATOM 1003 CB ASN A 65 -8.680 -13.638 8.104 1.00 0.00 C ATOM 1004 CG ASN A 65 -9.490 -12.960 9.192 1.00 0.00 C ATOM 1005 OD1 ASN A 65 -10.526 -12.355 8.924 1.00 0.00 O ATOM 1006 ND2 ASN A 65 -9.023 -13.049 10.429 1.00 0.00 N ATOM 0 H ASN A 65 -7.769 -10.679 7.319 1.00 0.00 H new ATOM 0 HA ASN A 65 -6.941 -12.382 8.380 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -9.343 -13.920 7.286 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -8.250 -14.559 8.498 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -9.527 -12.607 11.198 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -8.159 -13.560 10.613 1.00 0.00 H new ATOM 1013 N ILE A 66 -5.946 -12.929 5.719 1.00 0.00 N ATOM 1014 CA ILE A 66 -4.904 -13.618 4.950 1.00 0.00 C ATOM 1015 C ILE A 66 -3.682 -13.849 5.839 1.00 0.00 C ATOM 1016 O ILE A 66 -2.978 -14.855 5.729 1.00 0.00 O ATOM 1017 CB ILE A 66 -4.459 -12.806 3.709 1.00 0.00 C ATOM 1018 CG1 ILE A 66 -5.649 -12.498 2.803 1.00 0.00 C ATOM 1019 CG2 ILE A 66 -3.383 -13.557 2.934 1.00 0.00 C ATOM 1020 CD1 ILE A 66 -5.258 -11.795 1.522 1.00 0.00 C ATOM 0 H ILE A 66 -6.077 -11.946 5.480 1.00 0.00 H new ATOM 0 HA ILE A 66 -5.326 -14.563 4.609 1.00 0.00 H new ATOM 0 HB ILE A 66 -4.041 -11.861 4.057 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -6.160 -13.429 2.557 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -6.361 -11.877 3.348 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -3.084 -12.970 2.066 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -2.518 -13.720 3.577 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -3.776 -14.518 2.604 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -6.150 -11.606 0.924 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -4.773 -10.848 1.760 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -4.570 -12.424 0.957 1.00 0.00 H new ATOM 1032 N ALA A 67 -3.471 -12.900 6.737 1.00 0.00 N ATOM 1033 CA ALA A 67 -2.315 -12.867 7.615 1.00 0.00 C ATOM 1034 C ALA A 67 -2.527 -11.755 8.629 1.00 0.00 C ATOM 1035 O ALA A 67 -3.668 -11.453 8.980 1.00 0.00 O ATOM 1036 CB ALA A 67 -1.047 -12.617 6.805 1.00 0.00 C ATOM 0 H ALA A 67 -4.110 -12.118 6.878 1.00 0.00 H new ATOM 0 HA ALA A 67 -2.201 -13.822 8.128 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -0.187 -12.594 7.474 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -0.918 -13.416 6.075 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -1.129 -11.662 6.287 1.00 0.00 H new ATOM 1042 N GLY A 68 -1.446 -11.137 9.083 1.00 0.00 N ATOM 1043 CA GLY A 68 -1.565 -9.953 9.912 1.00 0.00 C ATOM 1044 C GLY A 68 -1.969 -8.741 9.090 1.00 0.00 C ATOM 1045 O GLY A 68 -1.294 -7.714 9.099 1.00 0.00 O ATOM 0 H GLY A 68 -0.489 -11.433 8.893 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -2.304 -10.127 10.694 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -0.615 -9.758 10.409 1.00 0.00 H new ATOM 1049 N VAL A 69 -3.065 -8.885 8.359 1.00 0.00 N ATOM 1050 CA VAL A 69 -3.569 -7.831 7.497 1.00 0.00 C ATOM 1051 C VAL A 69 -4.866 -7.253 8.048 1.00 0.00 C ATOM 1052 O VAL A 69 -5.826 -7.978 8.311 1.00 0.00 O ATOM 1053 CB VAL A 69 -3.795 -8.325 6.047 1.00 0.00 C ATOM 1054 CG1 VAL A 69 -2.478 -8.441 5.303 1.00 0.00 C ATOM 1055 CG2 VAL A 69 -4.509 -9.660 6.034 1.00 0.00 C ATOM 0 H VAL A 69 -3.628 -9.736 8.348 1.00 0.00 H new ATOM 0 HA VAL A 69 -2.807 -7.052 7.475 1.00 0.00 H new ATOM 0 HB VAL A 69 -4.420 -7.588 5.543 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -2.664 -8.790 4.287 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -1.992 -7.466 5.269 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -1.831 -9.151 5.818 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -4.655 -9.984 5.004 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -3.909 -10.399 6.565 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -5.478 -9.559 6.524 1.00 0.00 H new ATOM 1065 N GLU A 70 -4.878 -5.946 8.237 1.00 0.00 N ATOM 1066 CA GLU A 70 -6.050 -5.259 8.745 1.00 0.00 C ATOM 1067 C GLU A 70 -6.599 -4.306 7.695 1.00 0.00 C ATOM 1068 O GLU A 70 -5.921 -3.354 7.301 1.00 0.00 O ATOM 1069 CB GLU A 70 -5.710 -4.466 10.007 1.00 0.00 C ATOM 1070 CG GLU A 70 -4.920 -5.248 11.040 1.00 0.00 C ATOM 1071 CD GLU A 70 -4.794 -4.492 12.343 1.00 0.00 C ATOM 1072 OE1 GLU A 70 -4.583 -3.259 12.300 1.00 0.00 O ATOM 1073 OE2 GLU A 70 -4.940 -5.114 13.412 1.00 0.00 O ATOM 0 H GLU A 70 -4.083 -5.336 8.045 1.00 0.00 H new ATOM 0 HA GLU A 70 -6.800 -6.012 8.986 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -5.140 -3.581 9.724 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -6.636 -4.116 10.463 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -5.408 -6.206 11.222 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -3.926 -5.466 10.649 1.00 0.00 H new ATOM 1080 N GLU A 71 -7.811 -4.568 7.234 1.00 0.00 N ATOM 1081 CA GLU A 71 -8.473 -3.674 6.299 1.00 0.00 C ATOM 1082 C GLU A 71 -9.346 -2.678 7.062 1.00 0.00 C ATOM 1083 O GLU A 71 -10.174 -3.068 7.886 1.00 0.00 O ATOM 1084 CB GLU A 71 -9.321 -4.463 5.289 1.00 0.00 C ATOM 1085 CG GLU A 71 -10.390 -5.339 5.927 1.00 0.00 C ATOM 1086 CD GLU A 71 -11.316 -5.971 4.910 1.00 0.00 C ATOM 1087 OE1 GLU A 71 -12.206 -5.262 4.392 1.00 0.00 O ATOM 1088 OE2 GLU A 71 -11.161 -7.174 4.627 1.00 0.00 O ATOM 0 H GLU A 71 -8.356 -5.391 7.492 1.00 0.00 H new ATOM 0 HA GLU A 71 -7.710 -3.129 5.744 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -9.801 -3.761 4.607 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -8.662 -5.091 4.689 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -9.909 -6.124 6.511 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -10.977 -4.739 6.622 1.00 0.00 H new ATOM 1095 N LYS A 72 -9.125 -1.395 6.827 1.00 0.00 N ATOM 1096 CA LYS A 72 -9.944 -0.360 7.437 1.00 0.00 C ATOM 1097 C LYS A 72 -10.417 0.634 6.386 1.00 0.00 C ATOM 1098 O LYS A 72 -9.689 1.552 6.013 1.00 0.00 O ATOM 1099 CB LYS A 72 -9.171 0.369 8.542 1.00 0.00 C ATOM 1100 CG LYS A 72 -8.821 -0.509 9.733 1.00 0.00 C ATOM 1101 CD LYS A 72 -8.066 0.267 10.799 1.00 0.00 C ATOM 1102 CE LYS A 72 -7.805 -0.578 12.039 1.00 0.00 C ATOM 1103 NZ LYS A 72 -6.886 -1.716 11.762 1.00 0.00 N ATOM 0 H LYS A 72 -8.385 -1.045 6.218 1.00 0.00 H new ATOM 0 HA LYS A 72 -10.814 -0.839 7.885 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -8.252 0.776 8.121 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -9.764 1.215 8.889 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -9.734 -0.922 10.162 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -8.216 -1.352 9.399 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -7.117 0.615 10.391 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -8.638 1.152 11.077 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -7.377 0.050 12.821 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -8.751 -0.962 12.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -7.401 -2.613 11.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -6.526 -1.642 10.789 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -6.089 -1.689 12.429 1.00 0.00 H new ATOM 1117 N LEU A 73 -11.624 0.427 5.889 1.00 0.00 N ATOM 1118 CA LEU A 73 -12.217 1.335 4.918 1.00 0.00 C ATOM 1119 C LEU A 73 -12.864 2.514 5.626 1.00 0.00 C ATOM 1120 O LEU A 73 -13.919 2.369 6.248 1.00 0.00 O ATOM 1121 CB LEU A 73 -13.257 0.607 4.064 1.00 0.00 C ATOM 1122 CG LEU A 73 -12.693 -0.370 3.036 1.00 0.00 C ATOM 1123 CD1 LEU A 73 -13.813 -1.135 2.360 1.00 0.00 C ATOM 1124 CD2 LEU A 73 -11.873 0.371 1.998 1.00 0.00 C ATOM 0 H LEU A 73 -12.216 -0.364 6.142 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.425 1.703 4.266 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.929 0.062 4.727 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -13.858 1.351 3.541 1.00 0.00 H new ATOM 0 HG LEU A 73 -12.048 -1.079 3.555 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.392 -1.827 1.630 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -14.375 -1.694 3.108 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -14.478 -0.435 1.855 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -11.478 -0.339 1.272 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -12.504 1.099 1.487 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -11.047 0.887 2.487 1.00 0.00 H new ATOM 1136 N THR A 74 -12.225 3.669 5.553 1.00 0.00 N ATOM 1137 CA THR A 74 -12.762 4.866 6.170 1.00 0.00 C ATOM 1138 C THR A 74 -13.307 5.822 5.114 1.00 0.00 C ATOM 1139 O THR A 74 -12.558 6.408 4.330 1.00 0.00 O ATOM 1140 CB THR A 74 -11.706 5.578 7.040 1.00 0.00 C ATOM 1141 OG1 THR A 74 -10.525 5.851 6.276 1.00 0.00 O ATOM 1142 CG2 THR A 74 -11.346 4.731 8.250 1.00 0.00 C ATOM 0 H THR A 74 -11.335 3.802 5.073 1.00 0.00 H new ATOM 0 HA THR A 74 -13.581 4.558 6.820 1.00 0.00 H new ATOM 0 HB THR A 74 -12.134 6.520 7.383 1.00 0.00 H new ATOM 0 HG1 THR A 74 -9.790 5.288 6.597 1.00 0.00 H new ATOM 0 HG21 THR A 74 -10.600 5.252 8.850 1.00 0.00 H new ATOM 0 HG22 THR A 74 -12.238 4.558 8.851 1.00 0.00 H new ATOM 0 HG23 THR A 74 -10.941 3.775 7.918 1.00 0.00 H new ATOM 1150 N TYR A 75 -14.621 5.957 5.082 1.00 0.00 N ATOM 1151 CA TYR A 75 -15.282 6.831 4.127 1.00 0.00 C ATOM 1152 C TYR A 75 -15.633 8.155 4.790 1.00 0.00 C ATOM 1153 O TYR A 75 -16.134 8.172 5.913 1.00 0.00 O ATOM 1154 CB TYR A 75 -16.560 6.177 3.593 1.00 0.00 C ATOM 1155 CG TYR A 75 -16.355 4.836 2.925 1.00 0.00 C ATOM 1156 CD1 TYR A 75 -16.228 3.678 3.681 1.00 0.00 C ATOM 1157 CD2 TYR A 75 -16.304 4.726 1.542 1.00 0.00 C ATOM 1158 CE1 TYR A 75 -16.053 2.450 3.080 1.00 0.00 C ATOM 1159 CE2 TYR A 75 -16.126 3.498 0.932 1.00 0.00 C ATOM 1160 CZ TYR A 75 -16.001 2.364 1.707 1.00 0.00 C ATOM 1161 OH TYR A 75 -15.833 1.137 1.106 1.00 0.00 O ATOM 0 H TYR A 75 -15.257 5.468 5.712 1.00 0.00 H new ATOM 0 HA TYR A 75 -14.600 7.008 3.295 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -17.260 6.052 4.419 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -17.027 6.855 2.879 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -16.267 3.741 4.758 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -16.405 5.613 0.934 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -15.957 1.559 3.683 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -16.085 3.427 -0.145 1.00 0.00 H new ATOM 0 HH TYR A 75 -16.298 0.450 1.628 1.00 0.00 H new ATOM 1171 N THR A 76 -15.364 9.258 4.106 1.00 0.00 N ATOM 1172 CA THR A 76 -15.696 10.571 4.636 1.00 0.00 C ATOM 1173 C THR A 76 -16.965 11.112 3.983 1.00 0.00 C ATOM 1174 O THR A 76 -18.048 11.068 4.567 1.00 0.00 O ATOM 1175 CB THR A 76 -14.535 11.572 4.437 1.00 0.00 C ATOM 1176 OG1 THR A 76 -14.138 11.607 3.056 1.00 0.00 O ATOM 1177 CG2 THR A 76 -13.337 11.195 5.297 1.00 0.00 C ATOM 0 H THR A 76 -14.919 9.270 3.188 1.00 0.00 H new ATOM 0 HA THR A 76 -15.868 10.456 5.706 1.00 0.00 H new ATOM 0 HB THR A 76 -14.888 12.558 4.739 1.00 0.00 H new ATOM 0 HG1 THR A 76 -13.748 10.744 2.806 1.00 0.00 H new ATOM 0 HG21 THR A 76 -12.534 11.915 5.138 1.00 0.00 H new ATOM 0 HG22 THR A 76 -13.627 11.201 6.348 1.00 0.00 H new ATOM 0 HG23 THR A 76 -12.991 10.199 5.022 1.00 0.00 H new ATOM 1185 N ASP A 77 -16.814 11.589 2.757 1.00 0.00 N ATOM 1186 CA ASP A 77 -17.915 12.152 1.983 1.00 0.00 C ATOM 1187 C ASP A 77 -17.452 12.478 0.570 1.00 0.00 C ATOM 1188 O ASP A 77 -18.200 12.315 -0.394 1.00 0.00 O ATOM 1189 CB ASP A 77 -18.483 13.415 2.654 1.00 0.00 C ATOM 1190 CG ASP A 77 -17.415 14.428 3.029 1.00 0.00 C ATOM 1191 OD1 ASP A 77 -16.837 15.066 2.125 1.00 0.00 O ATOM 1192 OD2 ASP A 77 -17.143 14.585 4.239 1.00 0.00 O ATOM 0 H ASP A 77 -15.920 11.597 2.266 1.00 0.00 H new ATOM 0 HA ASP A 77 -18.708 11.406 1.939 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -19.199 13.885 1.980 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -19.031 13.126 3.551 1.00 0.00 H new ATOM 1197 N THR A 78 -16.211 12.935 0.456 1.00 0.00 N ATOM 1198 CA THR A 78 -15.636 13.281 -0.833 1.00 0.00 C ATOM 1199 C THR A 78 -14.552 12.275 -1.234 1.00 0.00 C ATOM 1200 O THR A 78 -14.260 12.092 -2.419 1.00 0.00 O ATOM 1201 CB THR A 78 -15.046 14.706 -0.793 1.00 0.00 C ATOM 1202 OG1 THR A 78 -16.031 15.621 -0.286 1.00 0.00 O ATOM 1203 CG2 THR A 78 -14.602 15.160 -2.177 1.00 0.00 C ATOM 0 H THR A 78 -15.582 13.074 1.247 1.00 0.00 H new ATOM 0 HA THR A 78 -16.431 13.248 -1.578 1.00 0.00 H new ATOM 0 HB THR A 78 -14.174 14.693 -0.139 1.00 0.00 H new ATOM 0 HG1 THR A 78 -16.255 15.382 0.638 1.00 0.00 H new ATOM 0 HG21 THR A 78 -14.191 16.168 -2.115 1.00 0.00 H new ATOM 0 HG22 THR A 78 -13.839 14.480 -2.556 1.00 0.00 H new ATOM 0 HG23 THR A 78 -15.458 15.158 -2.852 1.00 0.00 H new ATOM 1211 N TYR A 79 -13.970 11.609 -0.242 1.00 0.00 N ATOM 1212 CA TYR A 79 -12.931 10.623 -0.501 1.00 0.00 C ATOM 1213 C TYR A 79 -13.039 9.456 0.473 1.00 0.00 C ATOM 1214 O TYR A 79 -13.750 9.533 1.479 1.00 0.00 O ATOM 1215 CB TYR A 79 -11.538 11.263 -0.410 1.00 0.00 C ATOM 1216 CG TYR A 79 -11.180 11.805 0.959 1.00 0.00 C ATOM 1217 CD1 TYR A 79 -11.576 13.078 1.349 1.00 0.00 C ATOM 1218 CD2 TYR A 79 -10.436 11.048 1.859 1.00 0.00 C ATOM 1219 CE1 TYR A 79 -11.244 13.580 2.592 1.00 0.00 C ATOM 1220 CE2 TYR A 79 -10.099 11.545 3.104 1.00 0.00 C ATOM 1221 CZ TYR A 79 -10.505 12.810 3.466 1.00 0.00 C ATOM 1222 OH TYR A 79 -10.168 13.312 4.701 1.00 0.00 O ATOM 0 H TYR A 79 -14.200 11.734 0.744 1.00 0.00 H new ATOM 0 HA TYR A 79 -13.072 10.244 -1.513 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -10.793 10.522 -0.699 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -11.478 12.075 -1.135 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -12.154 13.686 0.668 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -10.116 10.055 1.580 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -11.562 14.572 2.879 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -9.520 10.944 3.790 1.00 0.00 H new ATOM 0 HH TYR A 79 -9.648 12.644 5.195 1.00 0.00 H new ATOM 1232 N ALA A 80 -12.338 8.380 0.169 1.00 0.00 N ATOM 1233 CA ALA A 80 -12.314 7.211 1.028 1.00 0.00 C ATOM 1234 C ALA A 80 -10.893 6.697 1.166 1.00 0.00 C ATOM 1235 O ALA A 80 -10.133 6.705 0.199 1.00 0.00 O ATOM 1236 CB ALA A 80 -13.220 6.126 0.472 1.00 0.00 C ATOM 0 H ALA A 80 -11.772 8.291 -0.675 1.00 0.00 H new ATOM 0 HA ALA A 80 -12.682 7.492 2.015 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -13.191 5.256 1.128 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -14.242 6.501 0.412 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -12.879 5.842 -0.523 1.00 0.00 H new ATOM 1242 N GLN A 81 -10.529 6.270 2.361 1.00 0.00 N ATOM 1243 CA GLN A 81 -9.189 5.764 2.601 1.00 0.00 C ATOM 1244 C GLN A 81 -9.212 4.303 3.016 1.00 0.00 C ATOM 1245 O GLN A 81 -9.867 3.932 3.993 1.00 0.00 O ATOM 1246 CB GLN A 81 -8.477 6.584 3.677 1.00 0.00 C ATOM 1247 CG GLN A 81 -8.111 7.994 3.246 1.00 0.00 C ATOM 1248 CD GLN A 81 -7.270 8.715 4.283 1.00 0.00 C ATOM 1249 OE1 GLN A 81 -6.482 7.961 5.038 1.00 0.00 O flip ATOM 1250 NE2 GLN A 81 -7.325 9.937 4.401 1.00 0.00 N flip ATOM 0 H GLN A 81 -11.139 6.263 3.178 1.00 0.00 H new ATOM 0 HA GLN A 81 -8.643 5.853 1.662 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -9.117 6.640 4.558 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -7.569 6.060 3.975 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -7.565 7.953 2.304 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -9.022 8.563 3.062 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -7.945 10.480 3.800 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -6.751 10.408 5.100 1.00 0.00 H new ATOM 1259 N GLU A 82 -8.511 3.479 2.259 1.00 0.00 N ATOM 1260 CA GLU A 82 -8.262 2.110 2.654 1.00 0.00 C ATOM 1261 C GLU A 82 -7.043 2.082 3.560 1.00 0.00 C ATOM 1262 O GLU A 82 -5.913 2.008 3.079 1.00 0.00 O ATOM 1263 CB GLU A 82 -7.995 1.208 1.445 1.00 0.00 C ATOM 1264 CG GLU A 82 -9.034 1.293 0.342 1.00 0.00 C ATOM 1265 CD GLU A 82 -8.790 0.266 -0.746 1.00 0.00 C ATOM 1266 OE1 GLU A 82 -7.904 0.501 -1.596 1.00 0.00 O ATOM 1267 OE2 GLU A 82 -9.472 -0.779 -0.741 1.00 0.00 O ATOM 0 H GLU A 82 -8.103 3.739 1.361 1.00 0.00 H new ATOM 0 HA GLU A 82 -9.148 1.736 3.167 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -7.021 1.464 1.027 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -7.934 0.175 1.787 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -10.027 1.143 0.766 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -9.021 2.292 -0.093 1.00 0.00 H new ATOM 1274 N ASN A 83 -7.258 2.206 4.856 1.00 0.00 N ATOM 1275 CA ASN A 83 -6.159 2.125 5.803 1.00 0.00 C ATOM 1276 C ASN A 83 -5.808 0.661 6.007 1.00 0.00 C ATOM 1277 O ASN A 83 -6.438 -0.036 6.803 1.00 0.00 O ATOM 1278 CB ASN A 83 -6.526 2.778 7.141 1.00 0.00 C ATOM 1279 CG ASN A 83 -6.990 4.218 6.998 1.00 0.00 C ATOM 1280 OD1 ASN A 83 -8.180 4.485 6.827 1.00 0.00 O ATOM 1281 ND2 ASN A 83 -6.060 5.161 7.068 1.00 0.00 N ATOM 0 H ASN A 83 -8.174 2.362 5.276 1.00 0.00 H new ATOM 0 HA ASN A 83 -5.301 2.666 5.404 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -7.314 2.195 7.618 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -5.660 2.746 7.803 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -6.322 6.143 6.979 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -5.083 4.904 7.210 1.00 0.00 H new ATOM 1288 N VAL A 84 -4.837 0.179 5.249 1.00 0.00 N ATOM 1289 CA VAL A 84 -4.529 -1.244 5.243 1.00 0.00 C ATOM 1290 C VAL A 84 -3.174 -1.522 5.879 1.00 0.00 C ATOM 1291 O VAL A 84 -2.170 -0.902 5.534 1.00 0.00 O ATOM 1292 CB VAL A 84 -4.549 -1.821 3.807 1.00 0.00 C ATOM 1293 CG1 VAL A 84 -4.368 -3.332 3.828 1.00 0.00 C ATOM 1294 CG2 VAL A 84 -5.841 -1.448 3.091 1.00 0.00 C ATOM 0 H VAL A 84 -4.252 0.745 4.634 1.00 0.00 H new ATOM 0 HA VAL A 84 -5.304 -1.735 5.832 1.00 0.00 H new ATOM 0 HB VAL A 84 -3.715 -1.384 3.258 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -4.385 -3.715 2.808 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -3.412 -3.578 4.291 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -5.176 -3.787 4.400 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -5.832 -1.865 2.084 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -6.691 -1.849 3.642 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -5.925 -0.363 3.034 1.00 0.00 H new ATOM 1304 N THR A 85 -3.154 -2.447 6.821 1.00 0.00 N ATOM 1305 CA THR A 85 -1.914 -2.884 7.432 1.00 0.00 C ATOM 1306 C THR A 85 -1.615 -4.313 7.005 1.00 0.00 C ATOM 1307 O THR A 85 -2.332 -5.233 7.372 1.00 0.00 O ATOM 1308 CB THR A 85 -1.991 -2.812 8.969 1.00 0.00 C ATOM 1309 OG1 THR A 85 -2.428 -1.506 9.373 1.00 0.00 O ATOM 1310 CG2 THR A 85 -0.635 -3.114 9.592 1.00 0.00 C ATOM 0 H THR A 85 -3.988 -2.912 7.181 1.00 0.00 H new ATOM 0 HA THR A 85 -1.117 -2.219 7.100 1.00 0.00 H new ATOM 0 HB THR A 85 -2.706 -3.559 9.314 1.00 0.00 H new ATOM 0 HG1 THR A 85 -2.477 -1.465 10.351 1.00 0.00 H new ATOM 0 HG21 THR A 85 -0.713 -3.058 10.678 1.00 0.00 H new ATOM 0 HG22 THR A 85 -0.317 -4.115 9.303 1.00 0.00 H new ATOM 0 HG23 THR A 85 0.096 -2.385 9.242 1.00 0.00 H new ATOM 1318 N ILE A 86 -0.576 -4.483 6.206 1.00 0.00 N ATOM 1319 CA ILE A 86 -0.225 -5.791 5.674 1.00 0.00 C ATOM 1320 C ILE A 86 1.068 -6.305 6.295 1.00 0.00 C ATOM 1321 O ILE A 86 2.147 -5.788 6.009 1.00 0.00 O ATOM 1322 CB ILE A 86 -0.053 -5.737 4.137 1.00 0.00 C ATOM 1323 CG1 ILE A 86 -1.344 -5.249 3.472 1.00 0.00 C ATOM 1324 CG2 ILE A 86 0.350 -7.102 3.589 1.00 0.00 C ATOM 1325 CD1 ILE A 86 -1.231 -5.078 1.971 1.00 0.00 C ATOM 0 H ILE A 86 0.043 -3.728 5.909 1.00 0.00 H new ATOM 0 HA ILE A 86 -1.041 -6.469 5.924 1.00 0.00 H new ATOM 0 HB ILE A 86 0.744 -5.030 3.906 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -2.144 -5.957 3.689 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -1.633 -4.297 3.916 1.00 0.00 H new ATOM 0 HG21 ILE A 86 0.465 -7.040 2.507 1.00 0.00 H new ATOM 0 HG22 ILE A 86 1.295 -7.410 4.037 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -0.421 -7.833 3.830 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -2.184 -4.730 1.572 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -0.455 -4.347 1.746 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.973 -6.034 1.514 1.00 0.00 H new ATOM 1337 N ASP A 87 0.964 -7.297 7.165 1.00 0.00 N ATOM 1338 CA ASP A 87 2.154 -7.968 7.673 1.00 0.00 C ATOM 1339 C ASP A 87 2.795 -8.778 6.559 1.00 0.00 C ATOM 1340 O ASP A 87 2.136 -9.593 5.914 1.00 0.00 O ATOM 1341 CB ASP A 87 1.829 -8.879 8.853 1.00 0.00 C ATOM 1342 CG ASP A 87 3.041 -9.672 9.298 1.00 0.00 C ATOM 1343 OD1 ASP A 87 3.870 -9.121 10.051 1.00 0.00 O ATOM 1344 OD2 ASP A 87 3.171 -10.847 8.887 1.00 0.00 O ATOM 0 H ASP A 87 0.081 -7.653 7.531 1.00 0.00 H new ATOM 0 HA ASP A 87 2.847 -7.204 8.025 1.00 0.00 H new ATOM 0 HB2 ASP A 87 1.461 -8.279 9.685 1.00 0.00 H new ATOM 0 HB3 ASP A 87 1.028 -9.564 8.574 1.00 0.00 H new ATOM 1349 N MET A 88 4.078 -8.553 6.337 1.00 0.00 N ATOM 1350 CA MET A 88 4.773 -9.176 5.225 1.00 0.00 C ATOM 1351 C MET A 88 5.710 -10.272 5.710 1.00 0.00 C ATOM 1352 O MET A 88 6.599 -10.709 4.980 1.00 0.00 O ATOM 1353 CB MET A 88 5.545 -8.126 4.428 1.00 0.00 C ATOM 1354 CG MET A 88 4.662 -7.030 3.854 1.00 0.00 C ATOM 1355 SD MET A 88 5.580 -5.861 2.838 1.00 0.00 S ATOM 1356 CE MET A 88 6.211 -6.961 1.581 1.00 0.00 C ATOM 0 H MET A 88 4.659 -7.943 6.912 1.00 0.00 H new ATOM 0 HA MET A 88 4.029 -9.634 4.573 1.00 0.00 H new ATOM 0 HB2 MET A 88 6.299 -7.674 5.073 1.00 0.00 H new ATOM 0 HB3 MET A 88 6.076 -8.618 3.613 1.00 0.00 H new ATOM 0 HG2 MET A 88 3.871 -7.482 3.256 1.00 0.00 H new ATOM 0 HG3 MET A 88 4.178 -6.494 4.670 1.00 0.00 H new ATOM 0 HE1 MET A 88 6.157 -6.471 0.609 1.00 0.00 H new ATOM 0 HE2 MET A 88 7.248 -7.212 1.804 1.00 0.00 H new ATOM 0 HE3 MET A 88 5.613 -7.872 1.562 1.00 0.00 H new ATOM 1366 N GLU A 89 5.501 -10.723 6.936 1.00 0.00 N ATOM 1367 CA GLU A 89 6.254 -11.849 7.459 1.00 0.00 C ATOM 1368 C GLU A 89 5.469 -13.134 7.253 1.00 0.00 C ATOM 1369 O GLU A 89 6.042 -14.192 6.996 1.00 0.00 O ATOM 1370 CB GLU A 89 6.578 -11.659 8.941 1.00 0.00 C ATOM 1371 CG GLU A 89 7.572 -10.544 9.202 1.00 0.00 C ATOM 1372 CD GLU A 89 7.987 -10.459 10.655 1.00 0.00 C ATOM 1373 OE1 GLU A 89 8.702 -11.367 11.127 1.00 0.00 O ATOM 1374 OE2 GLU A 89 7.610 -9.481 11.332 1.00 0.00 O ATOM 0 H GLU A 89 4.819 -10.328 7.584 1.00 0.00 H new ATOM 0 HA GLU A 89 7.197 -11.911 6.916 1.00 0.00 H new ATOM 0 HB2 GLU A 89 5.656 -11.448 9.483 1.00 0.00 H new ATOM 0 HB3 GLU A 89 6.976 -12.592 9.341 1.00 0.00 H new ATOM 0 HG2 GLU A 89 8.457 -10.700 8.584 1.00 0.00 H new ATOM 0 HG3 GLU A 89 7.134 -9.594 8.897 1.00 0.00 H new ATOM 1381 N LYS A 90 4.151 -13.032 7.360 1.00 0.00 N ATOM 1382 CA LYS A 90 3.283 -14.180 7.160 1.00 0.00 C ATOM 1383 C LYS A 90 2.395 -13.972 5.927 1.00 0.00 C ATOM 1384 O LYS A 90 1.342 -14.597 5.792 1.00 0.00 O ATOM 1385 CB LYS A 90 2.439 -14.417 8.423 1.00 0.00 C ATOM 1386 CG LYS A 90 1.729 -15.765 8.456 1.00 0.00 C ATOM 1387 CD LYS A 90 0.219 -15.616 8.333 1.00 0.00 C ATOM 1388 CE LYS A 90 -0.441 -16.926 7.932 1.00 0.00 C ATOM 1389 NZ LYS A 90 0.022 -17.394 6.595 1.00 0.00 N ATOM 0 H LYS A 90 3.662 -12.166 7.584 1.00 0.00 H new ATOM 0 HA LYS A 90 3.892 -15.066 6.982 1.00 0.00 H new ATOM 0 HB2 LYS A 90 3.084 -14.337 9.298 1.00 0.00 H new ATOM 0 HB3 LYS A 90 1.695 -13.625 8.503 1.00 0.00 H new ATOM 0 HG2 LYS A 90 2.099 -16.390 7.643 1.00 0.00 H new ATOM 0 HG3 LYS A 90 1.968 -16.278 9.387 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -0.192 -15.276 9.284 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -0.013 -14.850 7.593 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -0.220 -17.688 8.680 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -1.523 -16.798 7.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -0.796 -17.707 6.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 0.502 -16.615 6.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 0.684 -18.187 6.715 1.00 0.00 H new ATOM 1403 N VAL A 91 2.833 -13.098 5.018 1.00 0.00 N ATOM 1404 CA VAL A 91 2.101 -12.861 3.769 1.00 0.00 C ATOM 1405 C VAL A 91 1.820 -14.162 3.044 1.00 0.00 C ATOM 1406 O VAL A 91 2.730 -14.811 2.525 1.00 0.00 O ATOM 1407 CB VAL A 91 2.845 -11.930 2.788 1.00 0.00 C ATOM 1408 CG1 VAL A 91 2.272 -10.526 2.840 1.00 0.00 C ATOM 1409 CG2 VAL A 91 4.338 -11.922 3.068 1.00 0.00 C ATOM 0 H VAL A 91 3.684 -12.546 5.121 1.00 0.00 H new ATOM 0 HA VAL A 91 1.174 -12.375 4.075 1.00 0.00 H new ATOM 0 HB VAL A 91 2.699 -12.317 1.779 1.00 0.00 H new ATOM 0 HG11 VAL A 91 2.811 -9.887 2.141 1.00 0.00 H new ATOM 0 HG12 VAL A 91 1.217 -10.553 2.567 1.00 0.00 H new ATOM 0 HG13 VAL A 91 2.376 -10.128 3.849 1.00 0.00 H new ATOM 0 HG21 VAL A 91 4.837 -11.258 2.362 1.00 0.00 H new ATOM 0 HG22 VAL A 91 4.516 -11.571 4.084 1.00 0.00 H new ATOM 0 HG23 VAL A 91 4.734 -12.932 2.959 1.00 0.00 H new ATOM 1419 N ASP A 92 0.559 -14.547 3.015 1.00 0.00 N ATOM 1420 CA ASP A 92 0.170 -15.753 2.319 1.00 0.00 C ATOM 1421 C ASP A 92 0.052 -15.460 0.835 1.00 0.00 C ATOM 1422 O ASP A 92 -1.006 -15.056 0.346 1.00 0.00 O ATOM 1423 CB ASP A 92 -1.144 -16.301 2.868 1.00 0.00 C ATOM 1424 CG ASP A 92 -1.439 -17.694 2.355 1.00 0.00 C ATOM 1425 OD1 ASP A 92 -0.995 -18.666 2.993 1.00 0.00 O ATOM 1426 OD2 ASP A 92 -2.120 -17.820 1.320 1.00 0.00 O ATOM 0 H ASP A 92 -0.207 -14.045 3.463 1.00 0.00 H new ATOM 0 HA ASP A 92 0.934 -16.515 2.475 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -1.102 -16.318 3.957 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -1.959 -15.633 2.590 1.00 0.00 H new ATOM 1431 N PHE A 93 1.165 -15.621 0.129 1.00 0.00 N ATOM 1432 CA PHE A 93 1.211 -15.362 -1.304 1.00 0.00 C ATOM 1433 C PHE A 93 0.333 -16.353 -2.060 1.00 0.00 C ATOM 1434 O PHE A 93 0.001 -16.140 -3.225 1.00 0.00 O ATOM 1435 CB PHE A 93 2.650 -15.433 -1.824 1.00 0.00 C ATOM 1436 CG PHE A 93 3.534 -14.332 -1.313 1.00 0.00 C ATOM 1437 CD1 PHE A 93 3.338 -13.023 -1.724 1.00 0.00 C ATOM 1438 CD2 PHE A 93 4.563 -14.604 -0.427 1.00 0.00 C ATOM 1439 CE1 PHE A 93 4.147 -12.005 -1.258 1.00 0.00 C ATOM 1440 CE2 PHE A 93 5.378 -13.591 0.042 1.00 0.00 C ATOM 1441 CZ PHE A 93 5.171 -12.290 -0.375 1.00 0.00 C ATOM 0 H PHE A 93 2.051 -15.931 0.528 1.00 0.00 H new ATOM 0 HA PHE A 93 0.829 -14.356 -1.475 1.00 0.00 H new ATOM 0 HB2 PHE A 93 3.081 -16.393 -1.542 1.00 0.00 H new ATOM 0 HB3 PHE A 93 2.635 -15.398 -2.913 1.00 0.00 H new ATOM 0 HD1 PHE A 93 2.542 -12.796 -2.418 1.00 0.00 H new ATOM 0 HD2 PHE A 93 4.731 -15.619 -0.099 1.00 0.00 H new ATOM 0 HE1 PHE A 93 3.980 -10.989 -1.583 1.00 0.00 H new ATOM 0 HE2 PHE A 93 6.176 -13.816 0.734 1.00 0.00 H new ATOM 0 HZ PHE A 93 5.808 -11.497 -0.012 1.00 0.00 H new ATOM 1451 N LYS A 94 -0.037 -17.432 -1.385 1.00 0.00 N ATOM 1452 CA LYS A 94 -0.924 -18.432 -1.955 1.00 0.00 C ATOM 1453 C LYS A 94 -2.307 -17.821 -2.178 1.00 0.00 C ATOM 1454 O LYS A 94 -2.894 -17.952 -3.254 1.00 0.00 O ATOM 1455 CB LYS A 94 -0.984 -19.652 -1.020 1.00 0.00 C ATOM 1456 CG LYS A 94 -1.777 -20.839 -1.550 1.00 0.00 C ATOM 1457 CD LYS A 94 -3.262 -20.719 -1.240 1.00 0.00 C ATOM 1458 CE LYS A 94 -4.026 -21.947 -1.702 1.00 0.00 C ATOM 1459 NZ LYS A 94 -3.920 -22.151 -3.171 1.00 0.00 N ATOM 0 H LYS A 94 0.268 -17.637 -0.433 1.00 0.00 H new ATOM 0 HA LYS A 94 -0.547 -18.766 -2.922 1.00 0.00 H new ATOM 0 HB2 LYS A 94 0.034 -19.980 -0.812 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -1.419 -19.340 -0.070 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -1.637 -20.916 -2.628 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -1.389 -21.759 -1.112 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -3.401 -20.584 -0.167 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -3.666 -19.832 -1.728 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -3.643 -22.827 -1.186 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -5.075 -21.846 -1.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -4.587 -22.892 -3.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -4.148 -21.263 -3.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -2.951 -22.441 -3.412 1.00 0.00 H new ATOM 1473 N ALA A 95 -2.817 -17.144 -1.158 1.00 0.00 N ATOM 1474 CA ALA A 95 -4.080 -16.433 -1.266 1.00 0.00 C ATOM 1475 C ALA A 95 -3.907 -15.144 -2.062 1.00 0.00 C ATOM 1476 O ALA A 95 -4.717 -14.834 -2.935 1.00 0.00 O ATOM 1477 CB ALA A 95 -4.645 -16.135 0.116 1.00 0.00 C ATOM 0 H ALA A 95 -2.372 -17.073 -0.243 1.00 0.00 H new ATOM 0 HA ALA A 95 -4.786 -17.071 -1.798 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -5.591 -15.602 0.015 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -4.810 -17.070 0.651 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -3.939 -15.519 0.673 1.00 0.00 H new ATOM 1483 N LEU A 96 -2.826 -14.412 -1.778 1.00 0.00 N ATOM 1484 CA LEU A 96 -2.554 -13.136 -2.445 1.00 0.00 C ATOM 1485 C LEU A 96 -2.403 -13.299 -3.951 1.00 0.00 C ATOM 1486 O LEU A 96 -2.526 -12.329 -4.697 1.00 0.00 O ATOM 1487 CB LEU A 96 -1.291 -12.481 -1.884 1.00 0.00 C ATOM 1488 CG LEU A 96 -1.439 -11.835 -0.509 1.00 0.00 C ATOM 1489 CD1 LEU A 96 -0.131 -11.184 -0.093 1.00 0.00 C ATOM 1490 CD2 LEU A 96 -2.560 -10.810 -0.522 1.00 0.00 C ATOM 0 H LEU A 96 -2.124 -14.682 -1.089 1.00 0.00 H new ATOM 0 HA LEU A 96 -3.415 -12.496 -2.250 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -0.506 -13.235 -1.829 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -0.954 -11.721 -2.589 1.00 0.00 H new ATOM 0 HG LEU A 96 -1.690 -12.610 0.215 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -0.249 -10.726 0.889 1.00 0.00 H new ATOM 0 HD12 LEU A 96 0.654 -11.939 -0.050 1.00 0.00 H new ATOM 0 HD13 LEU A 96 0.142 -10.419 -0.819 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -2.652 -10.359 0.466 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -2.336 -10.035 -1.255 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -3.497 -11.299 -0.786 1.00 0.00 H new ATOM 1502 N GLN A 97 -2.141 -14.521 -4.391 1.00 0.00 N ATOM 1503 CA GLN A 97 -2.007 -14.824 -5.812 1.00 0.00 C ATOM 1504 C GLN A 97 -3.293 -14.475 -6.567 1.00 0.00 C ATOM 1505 O GLN A 97 -3.280 -14.265 -7.782 1.00 0.00 O ATOM 1506 CB GLN A 97 -1.671 -16.305 -5.987 1.00 0.00 C ATOM 1507 CG GLN A 97 -1.275 -16.693 -7.400 1.00 0.00 C ATOM 1508 CD GLN A 97 -0.956 -18.169 -7.511 1.00 0.00 C ATOM 1509 OE1 GLN A 97 0.186 -18.588 -7.324 1.00 0.00 O ATOM 1510 NE2 GLN A 97 -1.965 -18.967 -7.816 1.00 0.00 N ATOM 0 H GLN A 97 -2.016 -15.327 -3.779 1.00 0.00 H new ATOM 0 HA GLN A 97 -1.200 -14.220 -6.227 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -0.857 -16.563 -5.310 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -2.534 -16.899 -5.688 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -2.085 -16.444 -8.086 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -0.407 -16.110 -7.707 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -2.896 -18.578 -7.963 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -1.812 -19.972 -7.904 1.00 0.00 H new ATOM 1519 N GLY A 98 -4.402 -14.411 -5.839 1.00 0.00 N ATOM 1520 CA GLY A 98 -5.667 -14.050 -6.445 1.00 0.00 C ATOM 1521 C GLY A 98 -5.969 -12.566 -6.322 1.00 0.00 C ATOM 1522 O GLY A 98 -6.989 -12.094 -6.822 1.00 0.00 O ATOM 0 H GLY A 98 -4.446 -14.603 -4.838 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -5.654 -14.329 -7.499 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -6.468 -14.621 -5.974 1.00 0.00 H new ATOM 1526 N ILE A 99 -5.090 -11.830 -5.648 1.00 0.00 N ATOM 1527 CA ILE A 99 -5.277 -10.395 -5.466 1.00 0.00 C ATOM 1528 C ILE A 99 -4.017 -9.636 -5.888 1.00 0.00 C ATOM 1529 O ILE A 99 -3.865 -9.285 -7.060 1.00 0.00 O ATOM 1530 CB ILE A 99 -5.640 -10.014 -4.000 1.00 0.00 C ATOM 1531 CG1 ILE A 99 -6.804 -10.860 -3.469 1.00 0.00 C ATOM 1532 CG2 ILE A 99 -6.008 -8.539 -3.907 1.00 0.00 C ATOM 1533 CD1 ILE A 99 -6.381 -12.170 -2.840 1.00 0.00 C ATOM 0 H ILE A 99 -4.243 -12.203 -5.220 1.00 0.00 H new ATOM 0 HA ILE A 99 -6.118 -10.110 -6.099 1.00 0.00 H new ATOM 0 HB ILE A 99 -4.760 -10.212 -3.388 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -7.356 -10.277 -2.732 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -7.491 -11.069 -4.289 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -6.259 -8.291 -2.876 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -5.163 -7.932 -4.231 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -6.866 -8.337 -4.548 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -7.263 -12.707 -2.490 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -5.856 -12.776 -3.579 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -5.719 -11.972 -1.997 1.00 0.00 H new ATOM 1545 N SER A 100 -3.110 -9.424 -4.930 1.00 0.00 N ATOM 1546 CA SER A 100 -1.864 -8.683 -5.149 1.00 0.00 C ATOM 1547 C SER A 100 -2.127 -7.242 -5.592 1.00 0.00 C ATOM 1548 O SER A 100 -2.161 -6.328 -4.770 1.00 0.00 O ATOM 1549 CB SER A 100 -0.968 -9.403 -6.161 1.00 0.00 C ATOM 1550 OG SER A 100 -0.638 -10.708 -5.716 1.00 0.00 O ATOM 0 H SER A 100 -3.220 -9.764 -3.975 1.00 0.00 H new ATOM 0 HA SER A 100 -1.343 -8.642 -4.193 1.00 0.00 H new ATOM 0 HB2 SER A 100 -1.476 -9.462 -7.123 1.00 0.00 H new ATOM 0 HB3 SER A 100 -0.056 -8.827 -6.317 1.00 0.00 H new ATOM 0 HG SER A 100 -1.457 -11.185 -5.466 1.00 0.00 H new ATOM 1556 N GLY A 101 -2.311 -7.048 -6.888 1.00 0.00 N ATOM 1557 CA GLY A 101 -2.561 -5.722 -7.418 1.00 0.00 C ATOM 1558 C GLY A 101 -1.283 -5.026 -7.844 1.00 0.00 C ATOM 1559 O GLY A 101 -1.306 -3.889 -8.307 1.00 0.00 O ATOM 0 H GLY A 101 -2.292 -7.790 -7.588 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -3.235 -5.795 -8.271 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -3.066 -5.120 -6.663 1.00 0.00 H new ATOM 1563 N ILE A 102 -0.164 -5.719 -7.687 1.00 0.00 N ATOM 1564 CA ILE A 102 1.135 -5.165 -8.031 1.00 0.00 C ATOM 1565 C ILE A 102 1.598 -5.697 -9.380 1.00 0.00 C ATOM 1566 O ILE A 102 1.542 -6.904 -9.633 1.00 0.00 O ATOM 1567 CB ILE A 102 2.195 -5.509 -6.959 1.00 0.00 C ATOM 1568 CG1 ILE A 102 1.721 -5.050 -5.576 1.00 0.00 C ATOM 1569 CG2 ILE A 102 3.537 -4.872 -7.304 1.00 0.00 C ATOM 1570 CD1 ILE A 102 2.649 -5.448 -4.447 1.00 0.00 C ATOM 0 H ILE A 102 -0.131 -6.671 -7.322 1.00 0.00 H new ATOM 0 HA ILE A 102 1.026 -4.082 -8.081 1.00 0.00 H new ATOM 0 HB ILE A 102 2.327 -6.591 -6.940 1.00 0.00 H new ATOM 0 HG12 ILE A 102 1.614 -3.965 -5.581 1.00 0.00 H new ATOM 0 HG13 ILE A 102 0.732 -5.467 -5.385 1.00 0.00 H new ATOM 0 HG21 ILE A 102 4.268 -5.127 -6.537 1.00 0.00 H new ATOM 0 HG22 ILE A 102 3.879 -5.245 -8.270 1.00 0.00 H new ATOM 0 HG23 ILE A 102 3.424 -3.789 -7.352 1.00 0.00 H new ATOM 0 HD11 ILE A 102 2.246 -5.088 -3.501 1.00 0.00 H new ATOM 0 HD12 ILE A 102 2.737 -6.534 -4.414 1.00 0.00 H new ATOM 0 HD13 ILE A 102 3.633 -5.009 -4.613 1.00 0.00 H new ATOM 1582 N ASN A 103 2.036 -4.796 -10.248 1.00 0.00 N ATOM 1583 CA ASN A 103 2.584 -5.185 -11.541 1.00 0.00 C ATOM 1584 C ASN A 103 4.008 -5.693 -11.368 1.00 0.00 C ATOM 1585 O ASN A 103 4.971 -4.927 -11.448 1.00 0.00 O ATOM 1586 CB ASN A 103 2.558 -4.009 -12.527 1.00 0.00 C ATOM 1587 CG ASN A 103 1.153 -3.634 -12.967 1.00 0.00 C ATOM 1588 OD1 ASN A 103 0.182 -3.808 -12.231 1.00 0.00 O ATOM 1589 ND2 ASN A 103 1.036 -3.100 -14.171 1.00 0.00 N ATOM 0 H ASN A 103 2.023 -3.790 -10.081 1.00 0.00 H new ATOM 0 HA ASN A 103 1.965 -5.983 -11.950 1.00 0.00 H new ATOM 0 HB2 ASN A 103 3.031 -3.143 -12.064 1.00 0.00 H new ATOM 0 HB3 ASN A 103 3.152 -4.265 -13.405 1.00 0.00 H new ATOM 0 HD21 ASN A 103 0.119 -2.817 -14.517 1.00 0.00 H new ATOM 0 HD22 ASN A 103 1.863 -2.971 -14.754 1.00 0.00 H new ATOM 1596 N VAL A 104 4.128 -6.981 -11.090 1.00 0.00 N ATOM 1597 CA VAL A 104 5.420 -7.599 -10.843 1.00 0.00 C ATOM 1598 C VAL A 104 5.383 -9.055 -11.315 1.00 0.00 C ATOM 1599 O VAL A 104 4.321 -9.558 -11.692 1.00 0.00 O ATOM 1600 CB VAL A 104 5.784 -7.517 -9.336 1.00 0.00 C ATOM 1601 CG1 VAL A 104 4.937 -8.475 -8.510 1.00 0.00 C ATOM 1602 CG2 VAL A 104 7.269 -7.764 -9.111 1.00 0.00 C ATOM 0 H VAL A 104 3.338 -7.624 -11.029 1.00 0.00 H new ATOM 0 HA VAL A 104 6.188 -7.064 -11.401 1.00 0.00 H new ATOM 0 HB VAL A 104 5.562 -6.504 -9.000 1.00 0.00 H new ATOM 0 HG11 VAL A 104 5.216 -8.394 -7.459 1.00 0.00 H new ATOM 0 HG12 VAL A 104 3.883 -8.222 -8.626 1.00 0.00 H new ATOM 0 HG13 VAL A 104 5.105 -9.496 -8.852 1.00 0.00 H new ATOM 0 HG21 VAL A 104 7.491 -7.700 -8.046 1.00 0.00 H new ATOM 0 HG22 VAL A 104 7.532 -8.756 -9.477 1.00 0.00 H new ATOM 0 HG23 VAL A 104 7.848 -7.013 -9.648 1.00 0.00 H new ATOM 1612 N SER A 105 6.529 -9.720 -11.317 1.00 0.00 N ATOM 1613 CA SER A 105 6.608 -11.102 -11.758 1.00 0.00 C ATOM 1614 C SER A 105 6.412 -12.065 -10.587 1.00 0.00 C ATOM 1615 O SER A 105 6.302 -11.648 -9.431 1.00 0.00 O ATOM 1616 CB SER A 105 7.954 -11.347 -12.435 1.00 0.00 C ATOM 1617 OG SER A 105 9.015 -10.807 -11.667 1.00 0.00 O ATOM 0 H SER A 105 7.419 -9.322 -11.017 1.00 0.00 H new ATOM 0 HA SER A 105 5.808 -11.286 -12.475 1.00 0.00 H new ATOM 0 HB2 SER A 105 8.107 -12.418 -12.571 1.00 0.00 H new ATOM 0 HB3 SER A 105 7.953 -10.897 -13.428 1.00 0.00 H new ATOM 0 HG SER A 105 9.867 -10.978 -12.120 1.00 0.00 H new ATOM 1623 N ALA A 106 6.377 -13.356 -10.890 1.00 0.00 N ATOM 1624 CA ALA A 106 6.165 -14.371 -9.871 1.00 0.00 C ATOM 1625 C ALA A 106 7.474 -14.708 -9.175 1.00 0.00 C ATOM 1626 O ALA A 106 7.486 -15.156 -8.025 1.00 0.00 O ATOM 1627 CB ALA A 106 5.553 -15.616 -10.490 1.00 0.00 C ATOM 0 H ALA A 106 6.493 -13.724 -11.834 1.00 0.00 H new ATOM 0 HA ALA A 106 5.473 -13.978 -9.126 1.00 0.00 H new ATOM 0 HB1 ALA A 106 5.399 -16.369 -9.717 1.00 0.00 H new ATOM 0 HB2 ALA A 106 4.596 -15.363 -10.946 1.00 0.00 H new ATOM 0 HB3 ALA A 106 6.224 -16.011 -11.252 1.00 0.00 H new ATOM 1633 N GLU A 107 8.576 -14.465 -9.874 1.00 0.00 N ATOM 1634 CA GLU A 107 9.908 -14.745 -9.351 1.00 0.00 C ATOM 1635 C GLU A 107 10.364 -13.631 -8.413 1.00 0.00 C ATOM 1636 O GLU A 107 11.550 -13.519 -8.098 1.00 0.00 O ATOM 1637 CB GLU A 107 10.925 -14.888 -10.492 1.00 0.00 C ATOM 1638 CG GLU A 107 10.405 -15.626 -11.718 1.00 0.00 C ATOM 1639 CD GLU A 107 9.693 -14.705 -12.690 1.00 0.00 C ATOM 1640 OE1 GLU A 107 10.379 -14.063 -13.514 1.00 0.00 O ATOM 1641 OE2 GLU A 107 8.448 -14.610 -12.632 1.00 0.00 O ATOM 0 H GLU A 107 8.572 -14.070 -10.815 1.00 0.00 H new ATOM 0 HA GLU A 107 9.854 -15.683 -8.799 1.00 0.00 H new ATOM 0 HB2 GLU A 107 11.253 -13.894 -10.795 1.00 0.00 H new ATOM 0 HB3 GLU A 107 11.803 -15.412 -10.114 1.00 0.00 H new ATOM 0 HG2 GLU A 107 11.238 -16.112 -12.226 1.00 0.00 H new ATOM 0 HG3 GLU A 107 9.721 -16.414 -11.401 1.00 0.00 H new ATOM 1648 N ASP A 108 9.416 -12.817 -7.965 1.00 0.00 N ATOM 1649 CA ASP A 108 9.705 -11.707 -7.082 1.00 0.00 C ATOM 1650 C ASP A 108 8.821 -11.817 -5.847 1.00 0.00 C ATOM 1651 O ASP A 108 9.297 -12.112 -4.749 1.00 0.00 O ATOM 1652 CB ASP A 108 9.447 -10.384 -7.810 1.00 0.00 C ATOM 1653 CG ASP A 108 9.997 -9.188 -7.066 1.00 0.00 C ATOM 1654 OD1 ASP A 108 9.299 -8.661 -6.184 1.00 0.00 O ATOM 1655 OD2 ASP A 108 11.138 -8.775 -7.373 1.00 0.00 O ATOM 0 H ASP A 108 8.429 -12.912 -8.206 1.00 0.00 H new ATOM 0 HA ASP A 108 10.752 -11.734 -6.779 1.00 0.00 H new ATOM 0 HB2 ASP A 108 9.897 -10.427 -8.802 1.00 0.00 H new ATOM 0 HB3 ASP A 108 8.374 -10.256 -7.952 1.00 0.00 H new ATOM 1660 N ALA A 109 7.520 -11.643 -6.059 1.00 0.00 N ATOM 1661 CA ALA A 109 6.534 -11.720 -4.987 1.00 0.00 C ATOM 1662 C ALA A 109 6.545 -13.084 -4.302 1.00 0.00 C ATOM 1663 O ALA A 109 6.675 -13.171 -3.084 1.00 0.00 O ATOM 1664 CB ALA A 109 5.146 -11.414 -5.529 1.00 0.00 C ATOM 0 H ALA A 109 7.121 -11.445 -6.976 1.00 0.00 H new ATOM 0 HA ALA A 109 6.801 -10.974 -4.238 1.00 0.00 H new ATOM 0 HB1 ALA A 109 4.418 -11.474 -4.720 1.00 0.00 H new ATOM 0 HB2 ALA A 109 5.134 -10.410 -5.953 1.00 0.00 H new ATOM 0 HB3 ALA A 109 4.890 -12.138 -6.303 1.00 0.00 H new ATOM 1670 N LYS A 110 6.434 -14.150 -5.088 1.00 0.00 N ATOM 1671 CA LYS A 110 6.346 -15.496 -4.527 1.00 0.00 C ATOM 1672 C LYS A 110 7.735 -16.069 -4.251 1.00 0.00 C ATOM 1673 O LYS A 110 7.873 -17.224 -3.850 1.00 0.00 O ATOM 1674 CB LYS A 110 5.576 -16.432 -5.467 1.00 0.00 C ATOM 1675 CG LYS A 110 4.190 -15.925 -5.846 1.00 0.00 C ATOM 1676 CD LYS A 110 3.348 -17.016 -6.496 1.00 0.00 C ATOM 1677 CE LYS A 110 4.003 -17.559 -7.756 1.00 0.00 C ATOM 1678 NZ LYS A 110 3.161 -18.585 -8.426 1.00 0.00 N ATOM 0 H LYS A 110 6.403 -14.111 -6.107 1.00 0.00 H new ATOM 0 HA LYS A 110 5.806 -15.422 -3.583 1.00 0.00 H new ATOM 0 HB2 LYS A 110 6.160 -16.578 -6.376 1.00 0.00 H new ATOM 0 HB3 LYS A 110 5.477 -17.408 -4.991 1.00 0.00 H new ATOM 0 HG2 LYS A 110 3.682 -15.555 -4.955 1.00 0.00 H new ATOM 0 HG3 LYS A 110 4.286 -15.083 -6.531 1.00 0.00 H new ATOM 0 HD2 LYS A 110 3.196 -17.829 -5.786 1.00 0.00 H new ATOM 0 HD3 LYS A 110 2.363 -16.618 -6.741 1.00 0.00 H new ATOM 0 HE2 LYS A 110 4.193 -16.738 -8.448 1.00 0.00 H new ATOM 0 HE3 LYS A 110 4.970 -17.993 -7.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 3.561 -19.529 -8.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 2.194 -18.543 -8.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 3.139 -18.401 -9.449 1.00 0.00 H new ATOM 1692 N LYS A 111 8.759 -15.258 -4.469 1.00 0.00 N ATOM 1693 CA LYS A 111 10.133 -15.684 -4.241 1.00 0.00 C ATOM 1694 C LYS A 111 10.613 -15.219 -2.871 1.00 0.00 C ATOM 1695 O LYS A 111 11.416 -15.886 -2.217 1.00 0.00 O ATOM 1696 CB LYS A 111 11.040 -15.122 -5.339 1.00 0.00 C ATOM 1697 CG LYS A 111 12.494 -15.553 -5.230 1.00 0.00 C ATOM 1698 CD LYS A 111 12.650 -17.055 -5.401 1.00 0.00 C ATOM 1699 CE LYS A 111 14.105 -17.479 -5.297 1.00 0.00 C ATOM 1700 NZ LYS A 111 14.672 -17.214 -3.948 1.00 0.00 N ATOM 0 H LYS A 111 8.665 -14.299 -4.804 1.00 0.00 H new ATOM 0 HA LYS A 111 10.174 -16.773 -4.269 1.00 0.00 H new ATOM 0 HB2 LYS A 111 10.653 -15.433 -6.309 1.00 0.00 H new ATOM 0 HB3 LYS A 111 10.993 -14.033 -5.311 1.00 0.00 H new ATOM 0 HG2 LYS A 111 13.084 -15.037 -5.988 1.00 0.00 H new ATOM 0 HG3 LYS A 111 12.890 -15.254 -4.260 1.00 0.00 H new ATOM 0 HD2 LYS A 111 12.064 -17.572 -4.641 1.00 0.00 H new ATOM 0 HD3 LYS A 111 12.251 -17.355 -6.370 1.00 0.00 H new ATOM 0 HE2 LYS A 111 14.189 -18.542 -5.522 1.00 0.00 H new ATOM 0 HE3 LYS A 111 14.691 -16.947 -6.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 15.589 -17.696 -3.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 14.805 -16.190 -3.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 14.019 -17.570 -3.221 1.00 0.00 H new ATOM 1714 N GLY A 112 10.109 -14.074 -2.442 1.00 0.00 N ATOM 1715 CA GLY A 112 10.517 -13.506 -1.176 1.00 0.00 C ATOM 1716 C GLY A 112 10.856 -12.042 -1.321 1.00 0.00 C ATOM 1717 O GLY A 112 11.799 -11.686 -2.024 1.00 0.00 O ATOM 0 H GLY A 112 9.419 -13.524 -2.953 1.00 0.00 H new ATOM 0 HA2 GLY A 112 9.717 -13.627 -0.445 1.00 0.00 H new ATOM 0 HA3 GLY A 112 11.383 -14.047 -0.793 1.00 0.00 H new ATOM 1721 N ILE A 113 10.086 -11.194 -0.668 1.00 0.00 N ATOM 1722 CA ILE A 113 10.243 -9.760 -0.823 1.00 0.00 C ATOM 1723 C ILE A 113 11.315 -9.208 0.113 1.00 0.00 C ATOM 1724 O ILE A 113 11.400 -9.584 1.283 1.00 0.00 O ATOM 1725 CB ILE A 113 8.905 -9.028 -0.590 1.00 0.00 C ATOM 1726 CG1 ILE A 113 7.891 -9.418 -1.677 1.00 0.00 C ATOM 1727 CG2 ILE A 113 9.100 -7.519 -0.549 1.00 0.00 C ATOM 1728 CD1 ILE A 113 8.404 -9.242 -3.097 1.00 0.00 C ATOM 0 H ILE A 113 9.345 -11.472 -0.025 1.00 0.00 H new ATOM 0 HA ILE A 113 10.565 -9.581 -1.849 1.00 0.00 H new ATOM 0 HB ILE A 113 8.514 -9.335 0.380 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.603 -10.459 -1.533 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.990 -8.817 -1.551 1.00 0.00 H new ATOM 0 HG21 ILE A 113 8.139 -7.032 -0.383 1.00 0.00 H new ATOM 0 HG22 ILE A 113 9.781 -7.262 0.262 1.00 0.00 H new ATOM 0 HG23 ILE A 113 9.520 -7.180 -1.496 1.00 0.00 H new ATOM 0 HD11 ILE A 113 7.629 -9.539 -3.803 1.00 0.00 H new ATOM 0 HD12 ILE A 113 8.665 -8.197 -3.263 1.00 0.00 H new ATOM 0 HD13 ILE A 113 9.287 -9.864 -3.245 1.00 0.00 H new ATOM 1740 N THR A 114 12.133 -8.318 -0.425 1.00 0.00 N ATOM 1741 CA THR A 114 13.206 -7.690 0.325 1.00 0.00 C ATOM 1742 C THR A 114 13.103 -6.172 0.199 1.00 0.00 C ATOM 1743 O THR A 114 12.129 -5.658 -0.354 1.00 0.00 O ATOM 1744 CB THR A 114 14.590 -8.149 -0.180 1.00 0.00 C ATOM 1745 OG1 THR A 114 14.745 -7.814 -1.567 1.00 0.00 O ATOM 1746 CG2 THR A 114 14.775 -9.648 0.009 1.00 0.00 C ATOM 0 H THR A 114 12.071 -8.011 -1.396 1.00 0.00 H new ATOM 0 HA THR A 114 13.104 -7.988 1.369 1.00 0.00 H new ATOM 0 HB THR A 114 15.350 -7.632 0.406 1.00 0.00 H new ATOM 0 HG1 THR A 114 14.389 -8.540 -2.121 1.00 0.00 H new ATOM 0 HG21 THR A 114 15.759 -9.942 -0.356 1.00 0.00 H new ATOM 0 HG22 THR A 114 14.692 -9.894 1.068 1.00 0.00 H new ATOM 0 HG23 THR A 114 14.006 -10.183 -0.549 1.00 0.00 H new ATOM 1754 N MET A 115 14.100 -5.456 0.700 1.00 0.00 N ATOM 1755 CA MET A 115 14.111 -4.003 0.593 1.00 0.00 C ATOM 1756 C MET A 115 14.554 -3.588 -0.802 1.00 0.00 C ATOM 1757 O MET A 115 13.914 -2.755 -1.447 1.00 0.00 O ATOM 1758 CB MET A 115 15.025 -3.378 1.651 1.00 0.00 C ATOM 1759 CG MET A 115 15.076 -1.860 1.585 1.00 0.00 C ATOM 1760 SD MET A 115 13.444 -1.109 1.739 1.00 0.00 S ATOM 1761 CE MET A 115 13.848 0.616 1.501 1.00 0.00 C ATOM 0 H MET A 115 14.907 -5.854 1.181 1.00 0.00 H new ATOM 0 HA MET A 115 13.099 -3.639 0.769 1.00 0.00 H new ATOM 0 HB2 MET A 115 14.682 -3.680 2.641 1.00 0.00 H new ATOM 0 HB3 MET A 115 16.033 -3.774 1.529 1.00 0.00 H new ATOM 0 HG2 MET A 115 15.721 -1.486 2.380 1.00 0.00 H new ATOM 0 HG3 MET A 115 15.525 -1.555 0.640 1.00 0.00 H new ATOM 0 HE1 MET A 115 13.057 1.236 1.923 1.00 0.00 H new ATOM 0 HE2 MET A 115 14.791 0.841 2.000 1.00 0.00 H new ATOM 0 HE3 MET A 115 13.943 0.824 0.435 1.00 0.00 H new ATOM 1771 N ALA A 116 15.641 -4.189 -1.277 1.00 0.00 N ATOM 1772 CA ALA A 116 16.140 -3.914 -2.619 1.00 0.00 C ATOM 1773 C ALA A 116 15.110 -4.316 -3.670 1.00 0.00 C ATOM 1774 O ALA A 116 15.078 -3.755 -4.766 1.00 0.00 O ATOM 1775 CB ALA A 116 17.454 -4.637 -2.855 1.00 0.00 C ATOM 0 H ALA A 116 16.192 -4.869 -0.753 1.00 0.00 H new ATOM 0 HA ALA A 116 16.316 -2.842 -2.707 1.00 0.00 H new ATOM 0 HB1 ALA A 116 17.813 -4.421 -3.861 1.00 0.00 H new ATOM 0 HB2 ALA A 116 18.191 -4.299 -2.127 1.00 0.00 H new ATOM 0 HB3 ALA A 116 17.303 -5.711 -2.746 1.00 0.00 H new ATOM 1781 N GLN A 117 14.274 -5.292 -3.317 1.00 0.00 N ATOM 1782 CA GLN A 117 13.142 -5.693 -4.146 1.00 0.00 C ATOM 1783 C GLN A 117 12.274 -4.488 -4.442 1.00 0.00 C ATOM 1784 O GLN A 117 12.284 -3.989 -5.547 1.00 0.00 O ATOM 1785 CB GLN A 117 12.316 -6.757 -3.421 1.00 0.00 C ATOM 1786 CG GLN A 117 11.881 -7.917 -4.295 1.00 0.00 C ATOM 1787 CD GLN A 117 12.989 -8.927 -4.518 1.00 0.00 C ATOM 1788 OE1 GLN A 117 13.857 -9.118 -3.665 1.00 0.00 O ATOM 1789 NE2 GLN A 117 12.968 -9.585 -5.662 1.00 0.00 N ATOM 0 H GLN A 117 14.363 -5.824 -2.451 1.00 0.00 H new ATOM 0 HA GLN A 117 13.515 -6.108 -5.082 1.00 0.00 H new ATOM 0 HB2 GLN A 117 12.899 -7.146 -2.586 1.00 0.00 H new ATOM 0 HB3 GLN A 117 11.430 -6.285 -2.998 1.00 0.00 H new ATOM 0 HG2 GLN A 117 11.028 -8.415 -3.833 1.00 0.00 H new ATOM 0 HG3 GLN A 117 11.544 -7.535 -5.258 1.00 0.00 H new ATOM 0 HE21 GLN A 117 12.233 -9.399 -6.344 1.00 0.00 H new ATOM 0 HE22 GLN A 117 13.687 -10.279 -5.864 1.00 0.00 H new ATOM 1798 N MET A 118 11.557 -4.008 -3.437 1.00 0.00 N ATOM 1799 CA MET A 118 10.671 -2.857 -3.591 1.00 0.00 C ATOM 1800 C MET A 118 11.396 -1.623 -4.129 1.00 0.00 C ATOM 1801 O MET A 118 10.797 -0.813 -4.822 1.00 0.00 O ATOM 1802 CB MET A 118 9.975 -2.540 -2.268 1.00 0.00 C ATOM 1803 CG MET A 118 8.616 -3.203 -2.142 1.00 0.00 C ATOM 1804 SD MET A 118 8.673 -4.963 -2.520 1.00 0.00 S ATOM 1805 CE MET A 118 6.940 -5.396 -2.415 1.00 0.00 C ATOM 0 H MET A 118 11.570 -4.401 -2.496 1.00 0.00 H new ATOM 0 HA MET A 118 9.921 -3.129 -4.334 1.00 0.00 H new ATOM 0 HB2 MET A 118 10.609 -2.864 -1.443 1.00 0.00 H new ATOM 0 HB3 MET A 118 9.857 -1.460 -2.175 1.00 0.00 H new ATOM 0 HG2 MET A 118 8.239 -3.064 -1.129 1.00 0.00 H new ATOM 0 HG3 MET A 118 7.912 -2.712 -2.814 1.00 0.00 H new ATOM 0 HE1 MET A 118 6.833 -6.480 -2.448 1.00 0.00 H new ATOM 0 HE2 MET A 118 6.527 -5.019 -1.479 1.00 0.00 H new ATOM 0 HE3 MET A 118 6.403 -4.953 -3.253 1.00 0.00 H new ATOM 1815 N GLU A 119 12.675 -1.472 -3.822 1.00 0.00 N ATOM 1816 CA GLU A 119 13.456 -0.384 -4.404 1.00 0.00 C ATOM 1817 C GLU A 119 13.461 -0.484 -5.929 1.00 0.00 C ATOM 1818 O GLU A 119 12.941 0.388 -6.625 1.00 0.00 O ATOM 1819 CB GLU A 119 14.888 -0.404 -3.869 1.00 0.00 C ATOM 1820 CG GLU A 119 15.027 0.143 -2.458 1.00 0.00 C ATOM 1821 CD GLU A 119 14.871 1.648 -2.403 1.00 0.00 C ATOM 1822 OE1 GLU A 119 15.838 2.363 -2.754 1.00 0.00 O ATOM 1823 OE2 GLU A 119 13.794 2.129 -2.000 1.00 0.00 O ATOM 0 H GLU A 119 13.191 -2.077 -3.183 1.00 0.00 H new ATOM 0 HA GLU A 119 12.992 0.560 -4.118 1.00 0.00 H new ATOM 0 HB2 GLU A 119 15.258 -1.429 -3.889 1.00 0.00 H new ATOM 0 HB3 GLU A 119 15.523 0.177 -4.537 1.00 0.00 H new ATOM 0 HG2 GLU A 119 14.278 -0.321 -1.816 1.00 0.00 H new ATOM 0 HG3 GLU A 119 16.003 -0.133 -2.059 1.00 0.00 H new ATOM 1830 N LEU A 120 14.025 -1.568 -6.438 1.00 0.00 N ATOM 1831 CA LEU A 120 14.106 -1.800 -7.877 1.00 0.00 C ATOM 1832 C LEU A 120 12.719 -1.903 -8.506 1.00 0.00 C ATOM 1833 O LEU A 120 12.449 -1.343 -9.564 1.00 0.00 O ATOM 1834 CB LEU A 120 14.882 -3.095 -8.129 1.00 0.00 C ATOM 1835 CG LEU A 120 16.390 -3.009 -7.888 1.00 0.00 C ATOM 1836 CD1 LEU A 120 17.044 -4.360 -8.128 1.00 0.00 C ATOM 1837 CD2 LEU A 120 17.013 -1.949 -8.784 1.00 0.00 C ATOM 0 H LEU A 120 14.438 -2.309 -5.872 1.00 0.00 H new ATOM 0 HA LEU A 120 14.618 -0.954 -8.335 1.00 0.00 H new ATOM 0 HB2 LEU A 120 14.472 -3.876 -7.488 1.00 0.00 H new ATOM 0 HB3 LEU A 120 14.712 -3.407 -9.160 1.00 0.00 H new ATOM 0 HG LEU A 120 16.558 -2.724 -6.849 1.00 0.00 H new ATOM 0 HD11 LEU A 120 18.117 -4.281 -7.952 1.00 0.00 H new ATOM 0 HD12 LEU A 120 16.618 -5.097 -7.447 1.00 0.00 H new ATOM 0 HD13 LEU A 120 16.867 -4.672 -9.157 1.00 0.00 H new ATOM 0 HD21 LEU A 120 18.086 -1.901 -8.599 1.00 0.00 H new ATOM 0 HD22 LEU A 120 16.836 -2.205 -9.828 1.00 0.00 H new ATOM 0 HD23 LEU A 120 16.564 -0.980 -8.567 1.00 0.00 H new ATOM 1849 N VAL A 121 11.848 -2.589 -7.803 1.00 0.00 N ATOM 1850 CA VAL A 121 10.550 -3.003 -8.308 1.00 0.00 C ATOM 1851 C VAL A 121 9.522 -1.867 -8.274 1.00 0.00 C ATOM 1852 O VAL A 121 8.849 -1.607 -9.272 1.00 0.00 O ATOM 1853 CB VAL A 121 10.071 -4.228 -7.490 1.00 0.00 C ATOM 1854 CG1 VAL A 121 8.592 -4.494 -7.643 1.00 0.00 C ATOM 1855 CG2 VAL A 121 10.862 -5.462 -7.891 1.00 0.00 C ATOM 0 H VAL A 121 12.022 -2.884 -6.842 1.00 0.00 H new ATOM 0 HA VAL A 121 10.651 -3.278 -9.358 1.00 0.00 H new ATOM 0 HB VAL A 121 10.247 -3.996 -6.440 1.00 0.00 H new ATOM 0 HG11 VAL A 121 8.315 -5.364 -7.047 1.00 0.00 H new ATOM 0 HG12 VAL A 121 8.029 -3.626 -7.301 1.00 0.00 H new ATOM 0 HG13 VAL A 121 8.363 -4.685 -8.691 1.00 0.00 H new ATOM 0 HG21 VAL A 121 10.519 -6.319 -7.311 1.00 0.00 H new ATOM 0 HG22 VAL A 121 10.714 -5.660 -8.953 1.00 0.00 H new ATOM 0 HG23 VAL A 121 11.921 -5.294 -7.697 1.00 0.00 H new ATOM 1865 N MET A 122 9.417 -1.173 -7.149 1.00 0.00 N ATOM 1866 CA MET A 122 8.452 -0.085 -7.016 1.00 0.00 C ATOM 1867 C MET A 122 8.881 1.130 -7.828 1.00 0.00 C ATOM 1868 O MET A 122 8.043 1.855 -8.368 1.00 0.00 O ATOM 1869 CB MET A 122 8.256 0.301 -5.547 1.00 0.00 C ATOM 1870 CG MET A 122 6.982 -0.260 -4.939 1.00 0.00 C ATOM 1871 SD MET A 122 6.865 -2.053 -5.099 1.00 0.00 S ATOM 1872 CE MET A 122 5.194 -2.332 -4.523 1.00 0.00 C ATOM 0 H MET A 122 9.984 -1.341 -6.318 1.00 0.00 H new ATOM 0 HA MET A 122 7.499 -0.441 -7.408 1.00 0.00 H new ATOM 0 HB2 MET A 122 9.111 -0.051 -4.970 1.00 0.00 H new ATOM 0 HB3 MET A 122 8.241 1.388 -5.464 1.00 0.00 H new ATOM 0 HG2 MET A 122 6.938 0.010 -3.884 1.00 0.00 H new ATOM 0 HG3 MET A 122 6.120 0.201 -5.422 1.00 0.00 H new ATOM 0 HE1 MET A 122 5.214 -2.987 -3.652 1.00 0.00 H new ATOM 0 HE2 MET A 122 4.739 -1.380 -4.250 1.00 0.00 H new ATOM 0 HE3 MET A 122 4.609 -2.799 -5.315 1.00 0.00 H new ATOM 1882 N LYS A 123 10.184 1.352 -7.930 1.00 0.00 N ATOM 1883 CA LYS A 123 10.684 2.458 -8.729 1.00 0.00 C ATOM 1884 C LYS A 123 10.624 2.112 -10.216 1.00 0.00 C ATOM 1885 O LYS A 123 10.607 3.001 -11.066 1.00 0.00 O ATOM 1886 CB LYS A 123 12.099 2.844 -8.296 1.00 0.00 C ATOM 1887 CG LYS A 123 12.146 3.418 -6.887 1.00 0.00 C ATOM 1888 CD LYS A 123 13.570 3.688 -6.430 1.00 0.00 C ATOM 1889 CE LYS A 123 13.591 4.301 -5.039 1.00 0.00 C ATOM 1890 NZ LYS A 123 14.974 4.561 -4.564 1.00 0.00 N ATOM 0 H LYS A 123 10.904 0.789 -7.476 1.00 0.00 H new ATOM 0 HA LYS A 123 10.045 3.325 -8.564 1.00 0.00 H new ATOM 0 HB2 LYS A 123 12.743 1.966 -8.348 1.00 0.00 H new ATOM 0 HB3 LYS A 123 12.502 3.576 -8.996 1.00 0.00 H new ATOM 0 HG2 LYS A 123 11.573 4.344 -6.854 1.00 0.00 H new ATOM 0 HG3 LYS A 123 11.669 2.723 -6.196 1.00 0.00 H new ATOM 0 HD2 LYS A 123 14.138 2.758 -6.429 1.00 0.00 H new ATOM 0 HD3 LYS A 123 14.060 4.360 -7.134 1.00 0.00 H new ATOM 0 HE2 LYS A 123 13.029 5.235 -5.046 1.00 0.00 H new ATOM 0 HE3 LYS A 123 13.088 3.632 -4.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 15.003 5.472 -4.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 15.268 3.801 -3.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 15.620 4.593 -5.378 1.00 0.00 H new ATOM 1904 N ALA A 124 10.575 0.817 -10.524 1.00 0.00 N ATOM 1905 CA ALA A 124 10.351 0.365 -11.894 1.00 0.00 C ATOM 1906 C ALA A 124 8.912 0.640 -12.316 1.00 0.00 C ATOM 1907 O ALA A 124 8.637 0.933 -13.482 1.00 0.00 O ATOM 1908 CB ALA A 124 10.663 -1.117 -12.028 1.00 0.00 C ATOM 0 H ALA A 124 10.687 0.065 -9.844 1.00 0.00 H new ATOM 0 HA ALA A 124 11.021 0.920 -12.551 1.00 0.00 H new ATOM 0 HB1 ALA A 124 10.490 -1.434 -13.056 1.00 0.00 H new ATOM 0 HB2 ALA A 124 11.706 -1.295 -11.764 1.00 0.00 H new ATOM 0 HB3 ALA A 124 10.018 -1.687 -11.359 1.00 0.00 H new ATOM 1914 N ALA A 125 7.997 0.547 -11.354 1.00 0.00 N ATOM 1915 CA ALA A 125 6.585 0.826 -11.596 1.00 0.00 C ATOM 1916 C ALA A 125 6.356 2.317 -11.809 1.00 0.00 C ATOM 1917 O ALA A 125 5.305 2.733 -12.297 1.00 0.00 O ATOM 1918 CB ALA A 125 5.734 0.327 -10.437 1.00 0.00 C ATOM 0 H ALA A 125 8.211 0.279 -10.394 1.00 0.00 H new ATOM 0 HA ALA A 125 6.288 0.297 -12.502 1.00 0.00 H new ATOM 0 HB1 ALA A 125 4.685 0.544 -10.636 1.00 0.00 H new ATOM 0 HB2 ALA A 125 5.867 -0.749 -10.325 1.00 0.00 H new ATOM 0 HB3 ALA A 125 6.040 0.828 -9.519 1.00 0.00 H new ATOM 1924 N GLY A 126 7.346 3.117 -11.438 1.00 0.00 N ATOM 1925 CA GLY A 126 7.241 4.549 -11.602 1.00 0.00 C ATOM 1926 C GLY A 126 6.407 5.188 -10.515 1.00 0.00 C ATOM 1927 O GLY A 126 5.647 6.122 -10.772 1.00 0.00 O ATOM 0 H GLY A 126 8.222 2.796 -11.025 1.00 0.00 H new ATOM 0 HA2 GLY A 126 8.239 4.988 -11.597 1.00 0.00 H new ATOM 0 HA3 GLY A 126 6.800 4.770 -12.574 1.00 0.00 H new ATOM 1931 N PHE A 127 6.533 4.672 -9.299 1.00 0.00 N ATOM 1932 CA PHE A 127 5.837 5.244 -8.157 1.00 0.00 C ATOM 1933 C PHE A 127 6.564 6.491 -7.661 1.00 0.00 C ATOM 1934 O PHE A 127 7.738 6.701 -7.971 1.00 0.00 O ATOM 1935 CB PHE A 127 5.716 4.221 -7.025 1.00 0.00 C ATOM 1936 CG PHE A 127 4.771 3.084 -7.317 1.00 0.00 C ATOM 1937 CD1 PHE A 127 3.502 3.328 -7.821 1.00 0.00 C ATOM 1938 CD2 PHE A 127 5.143 1.774 -7.065 1.00 0.00 C ATOM 1939 CE1 PHE A 127 2.626 2.289 -8.068 1.00 0.00 C ATOM 1940 CE2 PHE A 127 4.270 0.731 -7.313 1.00 0.00 C ATOM 1941 CZ PHE A 127 3.010 0.988 -7.814 1.00 0.00 C ATOM 0 H PHE A 127 7.110 3.860 -9.080 1.00 0.00 H new ATOM 0 HA PHE A 127 4.834 5.524 -8.477 1.00 0.00 H new ATOM 0 HB2 PHE A 127 6.704 3.812 -6.813 1.00 0.00 H new ATOM 0 HB3 PHE A 127 5.383 4.733 -6.122 1.00 0.00 H new ATOM 0 HD1 PHE A 127 3.195 4.344 -8.023 1.00 0.00 H new ATOM 0 HD2 PHE A 127 6.126 1.565 -6.670 1.00 0.00 H new ATOM 0 HE1 PHE A 127 1.641 2.495 -8.460 1.00 0.00 H new ATOM 0 HE2 PHE A 127 4.574 -0.286 -7.114 1.00 0.00 H new ATOM 0 HZ PHE A 127 2.327 0.174 -8.007 1.00 0.00 H new ATOM 1951 N LYS A 128 5.868 7.312 -6.889 1.00 0.00 N ATOM 1952 CA LYS A 128 6.435 8.554 -6.391 1.00 0.00 C ATOM 1953 C LYS A 128 7.077 8.320 -5.027 1.00 0.00 C ATOM 1954 O LYS A 128 6.391 8.224 -4.007 1.00 0.00 O ATOM 1955 CB LYS A 128 5.347 9.630 -6.325 1.00 0.00 C ATOM 1956 CG LYS A 128 5.832 11.004 -5.890 1.00 0.00 C ATOM 1957 CD LYS A 128 4.716 12.029 -6.014 1.00 0.00 C ATOM 1958 CE LYS A 128 5.135 13.395 -5.499 1.00 0.00 C ATOM 1959 NZ LYS A 128 4.055 14.400 -5.678 1.00 0.00 N ATOM 0 H LYS A 128 4.907 7.139 -6.594 1.00 0.00 H new ATOM 0 HA LYS A 128 7.212 8.903 -7.071 1.00 0.00 H new ATOM 0 HB2 LYS A 128 4.884 9.718 -7.308 1.00 0.00 H new ATOM 0 HB3 LYS A 128 4.571 9.299 -5.635 1.00 0.00 H new ATOM 0 HG2 LYS A 128 6.182 10.962 -4.859 1.00 0.00 H new ATOM 0 HG3 LYS A 128 6.681 11.307 -6.503 1.00 0.00 H new ATOM 0 HD2 LYS A 128 4.415 12.112 -7.058 1.00 0.00 H new ATOM 0 HD3 LYS A 128 3.844 11.684 -5.458 1.00 0.00 H new ATOM 0 HE2 LYS A 128 5.395 13.323 -4.443 1.00 0.00 H new ATOM 0 HE3 LYS A 128 6.031 13.724 -6.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 4.374 15.321 -5.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 3.825 14.486 -6.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 3.209 14.097 -5.155 1.00 0.00 H new ATOM 1973 N GLU A 129 8.394 8.198 -5.037 1.00 0.00 N ATOM 1974 CA GLU A 129 9.157 7.853 -3.848 1.00 0.00 C ATOM 1975 C GLU A 129 9.477 9.115 -3.041 1.00 0.00 C ATOM 1976 O GLU A 129 10.035 10.078 -3.574 1.00 0.00 O ATOM 1977 CB GLU A 129 10.426 7.120 -4.287 1.00 0.00 C ATOM 1978 CG GLU A 129 10.844 5.995 -3.361 1.00 0.00 C ATOM 1979 CD GLU A 129 11.719 6.470 -2.232 1.00 0.00 C ATOM 1980 OE1 GLU A 129 11.186 7.020 -1.250 1.00 0.00 O ATOM 1981 OE2 GLU A 129 12.954 6.288 -2.324 1.00 0.00 O ATOM 0 H GLU A 129 8.965 8.335 -5.871 1.00 0.00 H new ATOM 0 HA GLU A 129 8.578 7.197 -3.197 1.00 0.00 H new ATOM 0 HB2 GLU A 129 10.271 6.714 -5.287 1.00 0.00 H new ATOM 0 HB3 GLU A 129 11.242 7.839 -4.358 1.00 0.00 H new ATOM 0 HG2 GLU A 129 9.954 5.518 -2.950 1.00 0.00 H new ATOM 0 HG3 GLU A 129 11.377 5.236 -3.934 1.00 0.00 H new ATOM 1988 N VAL A 130 9.127 9.098 -1.757 1.00 0.00 N ATOM 1989 CA VAL A 130 9.127 10.313 -0.941 1.00 0.00 C ATOM 1990 C VAL A 130 10.115 10.237 0.235 1.00 0.00 C ATOM 1991 O VAL A 130 10.552 11.273 0.750 1.00 0.00 O ATOM 1992 CB VAL A 130 7.704 10.580 -0.381 1.00 0.00 C ATOM 1993 CG1 VAL A 130 7.637 11.891 0.390 1.00 0.00 C ATOM 1994 CG2 VAL A 130 6.672 10.567 -1.499 1.00 0.00 C ATOM 0 H VAL A 130 8.839 8.256 -1.258 1.00 0.00 H new ATOM 0 HA VAL A 130 9.442 11.127 -1.594 1.00 0.00 H new ATOM 0 HB VAL A 130 7.474 9.774 0.316 1.00 0.00 H new ATOM 0 HG11 VAL A 130 6.625 12.041 0.765 1.00 0.00 H new ATOM 0 HG12 VAL A 130 8.333 11.856 1.228 1.00 0.00 H new ATOM 0 HG13 VAL A 130 7.905 12.716 -0.271 1.00 0.00 H new ATOM 0 HG21 VAL A 130 5.682 10.756 -1.083 1.00 0.00 H new ATOM 0 HG22 VAL A 130 6.914 11.342 -2.227 1.00 0.00 H new ATOM 0 HG23 VAL A 130 6.679 9.594 -1.990 1.00 0.00 H new ATOM 2004 N LYS A 131 10.498 9.021 0.621 1.00 0.00 N ATOM 2005 CA LYS A 131 11.181 8.790 1.898 1.00 0.00 C ATOM 2006 C LYS A 131 10.253 9.201 3.043 1.00 0.00 C ATOM 2007 O LYS A 131 9.214 8.585 3.239 1.00 0.00 O ATOM 2008 CB LYS A 131 12.521 9.549 2.007 1.00 0.00 C ATOM 2009 CG LYS A 131 13.678 8.936 1.229 1.00 0.00 C ATOM 2010 CD LYS A 131 13.483 9.044 -0.271 1.00 0.00 C ATOM 2011 CE LYS A 131 14.711 8.568 -1.026 1.00 0.00 C ATOM 2012 NZ LYS A 131 14.448 8.453 -2.482 1.00 0.00 N ATOM 0 H LYS A 131 10.348 8.177 0.068 1.00 0.00 H new ATOM 0 HA LYS A 131 11.417 7.728 1.958 1.00 0.00 H new ATOM 0 HB2 LYS A 131 12.371 10.571 1.659 1.00 0.00 H new ATOM 0 HB3 LYS A 131 12.802 9.609 3.058 1.00 0.00 H new ATOM 0 HG2 LYS A 131 14.606 9.434 1.509 1.00 0.00 H new ATOM 0 HG3 LYS A 131 13.783 7.887 1.505 1.00 0.00 H new ATOM 0 HD2 LYS A 131 12.618 8.452 -0.570 1.00 0.00 H new ATOM 0 HD3 LYS A 131 13.269 10.079 -0.538 1.00 0.00 H new ATOM 0 HE2 LYS A 131 15.534 9.263 -0.858 1.00 0.00 H new ATOM 0 HE3 LYS A 131 15.026 7.601 -0.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 15.314 8.681 -3.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 14.151 7.482 -2.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 13.694 9.116 -2.752 1.00 0.00 H new ATOM 2026 N LEU A 132 10.642 10.244 3.778 1.00 0.00 N ATOM 2027 CA LEU A 132 9.809 10.861 4.822 1.00 0.00 C ATOM 2028 C LEU A 132 10.644 11.827 5.645 1.00 0.00 C ATOM 2029 O LEU A 132 10.155 12.850 6.108 1.00 0.00 O ATOM 2030 CB LEU A 132 9.116 9.829 5.743 1.00 0.00 C ATOM 2031 CG LEU A 132 10.003 8.759 6.400 1.00 0.00 C ATOM 2032 CD1 LEU A 132 10.725 9.300 7.626 1.00 0.00 C ATOM 2033 CD2 LEU A 132 9.160 7.552 6.778 1.00 0.00 C ATOM 0 H LEU A 132 11.552 10.691 3.667 1.00 0.00 H new ATOM 0 HA LEU A 132 9.011 11.399 4.311 1.00 0.00 H new ATOM 0 HB2 LEU A 132 8.604 10.375 6.535 1.00 0.00 H new ATOM 0 HB3 LEU A 132 8.349 9.319 5.160 1.00 0.00 H new ATOM 0 HG LEU A 132 10.762 8.462 5.676 1.00 0.00 H new ATOM 0 HD11 LEU A 132 11.341 8.514 8.062 1.00 0.00 H new ATOM 0 HD12 LEU A 132 11.358 10.138 7.335 1.00 0.00 H new ATOM 0 HD13 LEU A 132 9.993 9.636 8.360 1.00 0.00 H new ATOM 0 HD21 LEU A 132 9.794 6.797 7.243 1.00 0.00 H new ATOM 0 HD22 LEU A 132 8.383 7.856 7.480 1.00 0.00 H new ATOM 0 HD23 LEU A 132 8.698 7.136 5.883 1.00 0.00 H new ATOM 2045 N GLU A 133 11.916 11.497 5.804 1.00 0.00 N ATOM 2046 CA GLU A 133 12.830 12.313 6.587 1.00 0.00 C ATOM 2047 C GLU A 133 13.231 13.561 5.809 1.00 0.00 C ATOM 2048 O GLU A 133 13.353 14.649 6.371 1.00 0.00 O ATOM 2049 CB GLU A 133 14.057 11.481 6.950 1.00 0.00 C ATOM 2050 CG GLU A 133 15.057 12.190 7.842 1.00 0.00 C ATOM 2051 CD GLU A 133 16.203 11.284 8.222 1.00 0.00 C ATOM 2052 OE1 GLU A 133 17.077 11.034 7.367 1.00 0.00 O ATOM 2053 OE2 GLU A 133 16.223 10.790 9.371 1.00 0.00 O ATOM 0 H GLU A 133 12.341 10.663 5.398 1.00 0.00 H new ATOM 0 HA GLU A 133 12.335 12.638 7.502 1.00 0.00 H new ATOM 0 HB2 GLU A 133 13.727 10.569 7.448 1.00 0.00 H new ATOM 0 HB3 GLU A 133 14.560 11.178 6.031 1.00 0.00 H new ATOM 0 HG2 GLU A 133 15.443 13.070 7.328 1.00 0.00 H new ATOM 0 HG3 GLU A 133 14.556 12.541 8.744 1.00 0.00 H new ATOM 2060 N HIS A 134 13.369 13.402 4.498 1.00 0.00 N ATOM 2061 CA HIS A 134 13.794 14.488 3.617 1.00 0.00 C ATOM 2062 C HIS A 134 12.629 15.445 3.333 1.00 0.00 C ATOM 2063 O HIS A 134 12.696 16.284 2.437 1.00 0.00 O ATOM 2064 CB HIS A 134 14.337 13.894 2.308 1.00 0.00 C ATOM 2065 CG HIS A 134 15.220 14.818 1.521 1.00 0.00 C ATOM 2066 ND1 HIS A 134 16.594 14.819 1.635 1.00 0.00 N ATOM 2067 CD2 HIS A 134 14.924 15.760 0.592 1.00 0.00 C ATOM 2068 CE1 HIS A 134 17.101 15.718 0.814 1.00 0.00 C ATOM 2069 NE2 HIS A 134 16.110 16.301 0.172 1.00 0.00 N ATOM 0 H HIS A 134 13.191 12.521 4.015 1.00 0.00 H new ATOM 0 HA HIS A 134 14.582 15.060 4.108 1.00 0.00 H new ATOM 0 HB2 HIS A 134 14.897 12.988 2.540 1.00 0.00 H new ATOM 0 HB3 HIS A 134 13.495 13.597 1.683 1.00 0.00 H new ATOM 0 HD2 HIS A 134 13.937 16.033 0.248 1.00 0.00 H new ATOM 0 HE1 HIS A 134 18.151 15.939 0.689 1.00 0.00 H new ATOM 0 HE2 HIS A 134 16.210 17.038 -0.526 1.00 0.00 H new ATOM 2078 N HIS A 135 11.558 15.312 4.105 1.00 0.00 N ATOM 2079 CA HIS A 135 10.379 16.149 3.928 1.00 0.00 C ATOM 2080 C HIS A 135 10.659 17.588 4.357 1.00 0.00 C ATOM 2081 O HIS A 135 11.083 17.846 5.483 1.00 0.00 O ATOM 2082 CB HIS A 135 9.171 15.575 4.698 1.00 0.00 C ATOM 2083 CG HIS A 135 9.225 15.704 6.202 1.00 0.00 C ATOM 2084 ND1 HIS A 135 10.376 15.559 6.954 1.00 0.00 N ATOM 2085 CD2 HIS A 135 8.235 15.953 7.093 1.00 0.00 C ATOM 2086 CE1 HIS A 135 10.088 15.711 8.232 1.00 0.00 C ATOM 2087 NE2 HIS A 135 8.796 15.952 8.345 1.00 0.00 N ATOM 0 H HIS A 135 11.482 14.631 4.861 1.00 0.00 H new ATOM 0 HA HIS A 135 10.132 16.154 2.866 1.00 0.00 H new ATOM 0 HB2 HIS A 135 8.269 16.072 4.342 1.00 0.00 H new ATOM 0 HB3 HIS A 135 9.073 14.519 4.447 1.00 0.00 H new ATOM 0 HD1 HIS A 135 11.304 15.365 6.579 1.00 0.00 H new ATOM 0 HD2 HIS A 135 7.194 16.122 6.860 1.00 0.00 H new ATOM 0 HE1 HIS A 135 10.792 15.649 9.049 1.00 0.00 H new ATOM 2096 N HIS A 136 10.451 18.520 3.445 1.00 0.00 N ATOM 2097 CA HIS A 136 10.581 19.930 3.772 1.00 0.00 C ATOM 2098 C HIS A 136 9.216 20.515 4.090 1.00 0.00 C ATOM 2099 O HIS A 136 9.099 21.479 4.843 1.00 0.00 O ATOM 2100 CB HIS A 136 11.233 20.703 2.626 1.00 0.00 C ATOM 2101 CG HIS A 136 12.515 21.366 3.018 1.00 0.00 C ATOM 2102 ND1 HIS A 136 12.571 22.594 3.639 1.00 0.00 N ATOM 2103 CD2 HIS A 136 13.798 20.959 2.880 1.00 0.00 C ATOM 2104 CE1 HIS A 136 13.830 22.914 3.862 1.00 0.00 C ATOM 2105 NE2 HIS A 136 14.595 21.940 3.412 1.00 0.00 N ATOM 0 H HIS A 136 10.193 18.329 2.477 1.00 0.00 H new ATOM 0 HA HIS A 136 11.224 20.021 4.648 1.00 0.00 H new ATOM 0 HB2 HIS A 136 11.423 20.021 1.797 1.00 0.00 H new ATOM 0 HB3 HIS A 136 10.536 21.459 2.263 1.00 0.00 H new ATOM 0 HD2 HIS A 136 14.132 20.034 2.434 1.00 0.00 H new ATOM 0 HE1 HIS A 136 14.176 23.822 4.334 1.00 0.00 H new ATOM 0 HE2 HIS A 136 15.614 21.919 3.453 1.00 0.00 H new ATOM 2114 N HIS A 137 8.182 19.917 3.515 1.00 0.00 N ATOM 2115 CA HIS A 137 6.818 20.351 3.760 1.00 0.00 C ATOM 2116 C HIS A 137 6.158 19.396 4.748 1.00 0.00 C ATOM 2117 O HIS A 137 6.362 18.182 4.679 1.00 0.00 O ATOM 2118 CB HIS A 137 6.031 20.399 2.447 1.00 0.00 C ATOM 2119 CG HIS A 137 4.900 21.382 2.455 1.00 0.00 C ATOM 2120 ND1 HIS A 137 4.952 22.587 1.787 1.00 0.00 N ATOM 2121 CD2 HIS A 137 3.684 21.339 3.051 1.00 0.00 C ATOM 2122 CE1 HIS A 137 3.823 23.241 1.973 1.00 0.00 C ATOM 2123 NE2 HIS A 137 3.038 22.506 2.736 1.00 0.00 N ATOM 0 H HIS A 137 8.265 19.128 2.874 1.00 0.00 H new ATOM 0 HA HIS A 137 6.826 21.355 4.184 1.00 0.00 H new ATOM 0 HB2 HIS A 137 6.713 20.651 1.635 1.00 0.00 H new ATOM 0 HB3 HIS A 137 5.635 19.406 2.235 1.00 0.00 H new ATOM 0 HD2 HIS A 137 3.296 20.536 3.660 1.00 0.00 H new ATOM 0 HE1 HIS A 137 3.582 24.213 1.569 1.00 0.00 H new ATOM 0 HE2 HIS A 137 2.100 22.765 3.043 1.00 0.00 H new ATOM 2132 N HIS A 138 5.385 19.943 5.673 1.00 0.00 N ATOM 2133 CA HIS A 138 4.778 19.147 6.732 1.00 0.00 C ATOM 2134 C HIS A 138 3.392 18.656 6.338 1.00 0.00 C ATOM 2135 O HIS A 138 2.682 19.308 5.570 1.00 0.00 O ATOM 2136 CB HIS A 138 4.695 19.964 8.025 1.00 0.00 C ATOM 2137 CG HIS A 138 6.036 20.354 8.558 1.00 0.00 C ATOM 2138 ND1 HIS A 138 6.631 21.567 8.289 1.00 0.00 N ATOM 2139 CD2 HIS A 138 6.914 19.672 9.328 1.00 0.00 C ATOM 2140 CE1 HIS A 138 7.815 21.611 8.867 1.00 0.00 C ATOM 2141 NE2 HIS A 138 8.016 20.472 9.503 1.00 0.00 N ATOM 0 H HIS A 138 5.162 20.937 5.713 1.00 0.00 H new ATOM 0 HA HIS A 138 5.410 18.274 6.895 1.00 0.00 H new ATOM 0 HB2 HIS A 138 4.107 20.864 7.842 1.00 0.00 H new ATOM 0 HB3 HIS A 138 4.165 19.385 8.781 1.00 0.00 H new ATOM 0 HD2 HIS A 138 6.774 18.680 9.731 1.00 0.00 H new ATOM 0 HE1 HIS A 138 8.505 22.441 8.827 1.00 0.00 H new ATOM 0 HE2 HIS A 138 8.851 20.227 10.036 1.00 0.00 H new ATOM 2150 N HIS A 139 3.023 17.496 6.857 1.00 0.00 N ATOM 2151 CA HIS A 139 1.692 16.939 6.651 1.00 0.00 C ATOM 2152 C HIS A 139 1.063 16.618 7.993 1.00 0.00 C ATOM 2153 O HIS A 139 1.094 15.441 8.396 1.00 0.00 O ATOM 2154 CB HIS A 139 1.741 15.675 5.788 1.00 0.00 C ATOM 2155 CG HIS A 139 1.885 15.942 4.325 1.00 0.00 C ATOM 2156 ND1 HIS A 139 0.808 16.031 3.471 1.00 0.00 N ATOM 2157 CD2 HIS A 139 2.985 16.129 3.561 1.00 0.00 C ATOM 2158 CE1 HIS A 139 1.240 16.257 2.246 1.00 0.00 C ATOM 2159 NE2 HIS A 139 2.557 16.325 2.272 1.00 0.00 N ATOM 2160 OXT HIS A 139 0.587 17.558 8.661 1.00 0.00 O ATOM 0 H HIS A 139 3.634 16.915 7.431 1.00 0.00 H new ATOM 0 HA HIS A 139 1.091 17.682 6.126 1.00 0.00 H new ATOM 0 HB2 HIS A 139 2.575 15.055 6.117 1.00 0.00 H new ATOM 0 HB3 HIS A 139 0.831 15.099 5.954 1.00 0.00 H new ATOM 0 HD2 HIS A 139 4.010 16.125 3.902 1.00 0.00 H new ATOM 0 HE1 HIS A 139 0.620 16.368 1.369 1.00 0.00 H new ATOM 0 HE2 HIS A 139 3.159 16.495 1.466 1.00 0.00 H new TER 2169 HIS A 139