USER MOD reduce.3.24.130724 H: found=0, std=0, add=621, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 624 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 NoAdj : A 143 ASNHD21 : A 143 ASN OD1 : A 163 CACA :(metal ligand) USER MOD NoAdj : A 143 ASNHD22 : A 143 ASN OD1 : A 163 CACA :(metal ligand) USER MOD Single : A 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 84 CYS SG : rot 180:sc= 0 USER MOD Single : A 85 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0.468 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 103 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 106 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.2) USER MOD Single : A 107 ASN : amide:sc= -1.61 K(o=-1.6,f=-8!) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 MET CE :methyl 158:sc= -1.25 (180deg=-2.85!) USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 124 THR OG1 : rot -58:sc= 0.554 USER MOD Single : A 127 THR OG1 : rot 50:sc= 0.975 USER MOD Single : A 129 THR OG1 : rot 129:sc= 1.25 USER MOD Single : A 137 MET CE :methyl -178:sc= -4.85! (180deg=-4.9!) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 ASN : amide:sc= 0 X(o=0,f=-0.02) USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 MET CE :methyl 167:sc= 0 (180deg=-0.282) USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 81 93.060 -6.901 3.466 1.00 0.00 N ATOM 2 CA MET A 81 93.536 -6.064 4.598 1.00 0.00 C ATOM 3 C MET A 81 94.687 -6.739 5.338 1.00 0.00 C ATOM 4 O MET A 81 94.470 -7.598 6.192 1.00 0.00 O ATOM 5 CB MET A 81 92.363 -5.819 5.551 1.00 0.00 C ATOM 6 CG MET A 81 91.811 -4.404 5.484 1.00 0.00 C ATOM 7 SD MET A 81 92.569 -3.307 6.699 1.00 0.00 S ATOM 8 CE MET A 81 93.473 -2.190 5.630 1.00 0.00 C ATOM 0 HA MET A 81 93.908 -5.116 4.210 1.00 0.00 H new ATOM 0 HB2 MET A 81 91.564 -6.523 5.319 1.00 0.00 H new ATOM 0 HB3 MET A 81 92.685 -6.027 6.571 1.00 0.00 H new ATOM 0 HG2 MET A 81 91.974 -4.001 4.484 1.00 0.00 H new ATOM 0 HG3 MET A 81 90.733 -4.430 5.646 1.00 0.00 H new ATOM 0 HE1 MET A 81 93.996 -1.450 6.236 1.00 0.00 H new ATOM 0 HE2 MET A 81 94.196 -2.755 5.042 1.00 0.00 H new ATOM 0 HE3 MET A 81 92.777 -1.684 4.961 1.00 0.00 H new ATOM 20 N VAL A 82 95.911 -6.342 5.005 1.00 0.00 N ATOM 21 CA VAL A 82 97.097 -6.908 5.638 1.00 0.00 C ATOM 22 C VAL A 82 97.181 -8.412 5.401 1.00 0.00 C ATOM 23 O VAL A 82 96.730 -9.205 6.226 1.00 0.00 O ATOM 24 CB VAL A 82 97.107 -6.638 7.154 1.00 0.00 C ATOM 25 CG1 VAL A 82 98.435 -7.059 7.764 1.00 0.00 C ATOM 26 CG2 VAL A 82 96.821 -5.171 7.438 1.00 0.00 C ATOM 0 H VAL A 82 96.108 -5.631 4.301 1.00 0.00 H new ATOM 0 HA VAL A 82 97.961 -6.422 5.184 1.00 0.00 H new ATOM 0 HB VAL A 82 96.318 -7.233 7.615 1.00 0.00 H new ATOM 0 HG11 VAL A 82 98.422 -6.860 8.836 1.00 0.00 H new ATOM 0 HG12 VAL A 82 98.592 -8.124 7.594 1.00 0.00 H new ATOM 0 HG13 VAL A 82 99.244 -6.495 7.300 1.00 0.00 H new ATOM 0 HG21 VAL A 82 96.832 -5.000 8.514 1.00 0.00 H new ATOM 0 HG22 VAL A 82 97.584 -4.553 6.964 1.00 0.00 H new ATOM 0 HG23 VAL A 82 95.842 -4.907 7.039 1.00 0.00 H new ATOM 36 N ARG A 83 97.763 -8.795 4.270 1.00 0.00 N ATOM 37 CA ARG A 83 97.909 -10.204 3.926 1.00 0.00 C ATOM 38 C ARG A 83 99.146 -10.801 4.591 1.00 0.00 C ATOM 39 O ARG A 83 100.275 -10.455 4.245 1.00 0.00 O ATOM 40 CB ARG A 83 97.999 -10.373 2.407 1.00 0.00 C ATOM 41 CG ARG A 83 97.180 -11.538 1.874 1.00 0.00 C ATOM 42 CD ARG A 83 98.008 -12.810 1.795 1.00 0.00 C ATOM 43 NE ARG A 83 97.496 -13.734 0.786 1.00 0.00 N ATOM 44 CZ ARG A 83 97.594 -13.527 -0.525 1.00 0.00 C ATOM 45 NH1 ARG A 83 98.181 -12.432 -0.989 1.00 0.00 N ATOM 46 NH2 ARG A 83 97.101 -14.418 -1.375 1.00 0.00 N ATOM 0 H ARG A 83 98.141 -8.150 3.576 1.00 0.00 H new ATOM 0 HA ARG A 83 97.030 -10.735 4.292 1.00 0.00 H new ATOM 0 HB2 ARG A 83 97.663 -9.454 1.927 1.00 0.00 H new ATOM 0 HB3 ARG A 83 99.043 -10.515 2.127 1.00 0.00 H new ATOM 0 HG2 ARG A 83 96.317 -11.703 2.520 1.00 0.00 H new ATOM 0 HG3 ARG A 83 96.795 -11.291 0.885 1.00 0.00 H new ATOM 0 HD2 ARG A 83 99.042 -12.556 1.562 1.00 0.00 H new ATOM 0 HD3 ARG A 83 98.012 -13.301 2.768 1.00 0.00 H new ATOM 0 HE ARG A 83 97.037 -14.587 1.105 1.00 0.00 H new ATOM 0 HH11 ARG A 83 98.561 -11.743 -0.340 1.00 0.00 H new ATOM 0 HH12 ARG A 83 98.253 -12.279 -1.995 1.00 0.00 H new ATOM 0 HH21 ARG A 83 96.647 -15.261 -1.024 1.00 0.00 H new ATOM 0 HH22 ARG A 83 97.176 -14.260 -2.380 1.00 0.00 H new ATOM 60 N CYS A 84 98.922 -11.698 5.547 1.00 0.00 N ATOM 61 CA CYS A 84 100.018 -12.345 6.264 1.00 0.00 C ATOM 62 C CYS A 84 100.789 -11.333 7.106 1.00 0.00 C ATOM 63 O CYS A 84 100.646 -11.289 8.327 1.00 0.00 O ATOM 64 CB CYS A 84 100.964 -13.042 5.282 1.00 0.00 C ATOM 65 SG CYS A 84 100.719 -14.829 5.163 1.00 0.00 S ATOM 0 H CYS A 84 97.992 -11.994 5.844 1.00 0.00 H new ATOM 0 HA CYS A 84 99.590 -13.093 6.931 1.00 0.00 H new ATOM 0 HB2 CYS A 84 100.833 -12.602 4.294 1.00 0.00 H new ATOM 0 HB3 CYS A 84 101.993 -12.847 5.584 1.00 0.00 H new ATOM 0 HG CYS A 84 101.562 -15.327 4.308 1.00 0.00 H new ATOM 71 N MET A 85 101.608 -10.520 6.444 1.00 0.00 N ATOM 72 CA MET A 85 102.400 -9.507 7.132 1.00 0.00 C ATOM 73 C MET A 85 102.258 -8.149 6.452 1.00 0.00 C ATOM 74 O MET A 85 101.987 -7.142 7.106 1.00 0.00 O ATOM 75 CB MET A 85 103.874 -9.920 7.170 1.00 0.00 C ATOM 76 CG MET A 85 104.440 -10.286 5.808 1.00 0.00 C ATOM 77 SD MET A 85 105.759 -11.509 5.909 1.00 0.00 S ATOM 78 CE MET A 85 106.432 -11.421 4.251 1.00 0.00 C ATOM 0 H MET A 85 101.740 -10.544 5.433 1.00 0.00 H new ATOM 0 HA MET A 85 102.027 -9.422 8.153 1.00 0.00 H new ATOM 0 HB2 MET A 85 104.461 -9.103 7.590 1.00 0.00 H new ATOM 0 HB3 MET A 85 103.987 -10.771 7.841 1.00 0.00 H new ATOM 0 HG2 MET A 85 103.639 -10.673 5.178 1.00 0.00 H new ATOM 0 HG3 MET A 85 104.820 -9.387 5.324 1.00 0.00 H new ATOM 0 HE1 MET A 85 107.260 -12.123 4.157 1.00 0.00 H new ATOM 0 HE2 MET A 85 105.656 -11.676 3.529 1.00 0.00 H new ATOM 0 HE3 MET A 85 106.790 -10.410 4.057 1.00 0.00 H new ATOM 88 N LYS A 86 102.440 -8.131 5.135 1.00 0.00 N ATOM 89 CA LYS A 86 102.330 -6.896 4.365 1.00 0.00 C ATOM 90 C LYS A 86 103.315 -5.847 4.872 1.00 0.00 C ATOM 91 O LYS A 86 102.957 -4.976 5.664 1.00 0.00 O ATOM 92 CB LYS A 86 100.902 -6.350 4.439 1.00 0.00 C ATOM 93 CG LYS A 86 100.559 -5.391 3.311 1.00 0.00 C ATOM 94 CD LYS A 86 99.078 -5.437 2.973 1.00 0.00 C ATOM 95 CE LYS A 86 98.753 -4.557 1.777 1.00 0.00 C ATOM 96 NZ LYS A 86 97.386 -4.820 1.247 1.00 0.00 N ATOM 0 H LYS A 86 102.664 -8.956 4.579 1.00 0.00 H new ATOM 0 HA LYS A 86 102.572 -7.122 3.327 1.00 0.00 H new ATOM 0 HB2 LYS A 86 100.201 -7.185 4.421 1.00 0.00 H new ATOM 0 HB3 LYS A 86 100.766 -5.840 5.393 1.00 0.00 H new ATOM 0 HG2 LYS A 86 100.837 -4.377 3.597 1.00 0.00 H new ATOM 0 HG3 LYS A 86 101.143 -5.644 2.426 1.00 0.00 H new ATOM 0 HD2 LYS A 86 98.784 -6.465 2.761 1.00 0.00 H new ATOM 0 HD3 LYS A 86 98.496 -5.111 3.835 1.00 0.00 H new ATOM 0 HE2 LYS A 86 98.835 -3.509 2.065 1.00 0.00 H new ATOM 0 HE3 LYS A 86 99.487 -4.730 0.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 97.204 -4.200 0.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 97.315 -5.814 0.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 96.683 -4.631 1.990 1.00 0.00 H new ATOM 110 N ASP A 87 104.559 -5.937 4.410 1.00 0.00 N ATOM 111 CA ASP A 87 105.595 -4.996 4.817 1.00 0.00 C ATOM 112 C ASP A 87 105.364 -3.626 4.186 1.00 0.00 C ATOM 113 O ASP A 87 105.637 -3.422 3.004 1.00 0.00 O ATOM 114 CB ASP A 87 106.977 -5.527 4.429 1.00 0.00 C ATOM 115 CG ASP A 87 107.787 -5.966 5.634 1.00 0.00 C ATOM 116 OD1 ASP A 87 107.607 -7.117 6.082 1.00 0.00 O ATOM 117 OD2 ASP A 87 108.601 -5.158 6.129 1.00 0.00 O ATOM 0 H ASP A 87 104.873 -6.652 3.754 1.00 0.00 H new ATOM 0 HA ASP A 87 105.548 -4.888 5.901 1.00 0.00 H new ATOM 0 HB2 ASP A 87 106.861 -6.369 3.746 1.00 0.00 H new ATOM 0 HB3 ASP A 87 107.523 -4.752 3.890 1.00 0.00 H new ATOM 122 N ASP A 88 104.859 -2.691 4.985 1.00 0.00 N ATOM 123 CA ASP A 88 104.592 -1.339 4.506 1.00 0.00 C ATOM 124 C ASP A 88 105.744 -0.397 4.846 1.00 0.00 C ATOM 125 O ASP A 88 105.925 0.635 4.201 1.00 0.00 O ATOM 126 CB ASP A 88 103.292 -0.810 5.113 1.00 0.00 C ATOM 127 CG ASP A 88 103.262 -0.943 6.623 1.00 0.00 C ATOM 128 OD1 ASP A 88 103.738 -0.017 7.311 1.00 0.00 O ATOM 129 OD2 ASP A 88 102.762 -1.976 7.118 1.00 0.00 O ATOM 0 H ASP A 88 104.627 -2.845 5.966 1.00 0.00 H new ATOM 0 HA ASP A 88 104.492 -1.381 3.421 1.00 0.00 H new ATOM 0 HB2 ASP A 88 103.168 0.238 4.841 1.00 0.00 H new ATOM 0 HB3 ASP A 88 102.448 -1.352 4.687 1.00 0.00 H new ATOM 134 N SER A 89 106.525 -0.760 5.862 1.00 0.00 N ATOM 135 CA SER A 89 107.660 0.054 6.281 1.00 0.00 C ATOM 136 C SER A 89 108.977 -0.591 5.865 1.00 0.00 C ATOM 137 O SER A 89 109.049 -1.805 5.664 1.00 0.00 O ATOM 138 CB SER A 89 107.634 0.257 7.797 1.00 0.00 C ATOM 139 OG SER A 89 108.607 1.205 8.202 1.00 0.00 O ATOM 0 H SER A 89 106.391 -1.611 6.408 1.00 0.00 H new ATOM 0 HA SER A 89 107.582 1.023 5.789 1.00 0.00 H new ATOM 0 HB2 SER A 89 106.644 0.593 8.105 1.00 0.00 H new ATOM 0 HB3 SER A 89 107.818 -0.694 8.297 1.00 0.00 H new ATOM 0 HG SER A 89 108.569 1.318 9.175 1.00 0.00 H new ATOM 145 N LYS A 90 110.017 0.226 5.737 1.00 0.00 N ATOM 146 CA LYS A 90 111.332 -0.266 5.344 1.00 0.00 C ATOM 147 C LYS A 90 112.271 -0.328 6.546 1.00 0.00 C ATOM 148 O LYS A 90 113.009 0.618 6.819 1.00 0.00 O ATOM 149 CB LYS A 90 111.932 0.629 4.258 1.00 0.00 C ATOM 150 CG LYS A 90 111.714 0.104 2.848 1.00 0.00 C ATOM 151 CD LYS A 90 112.489 0.920 1.825 1.00 0.00 C ATOM 152 CE LYS A 90 112.896 0.072 0.631 1.00 0.00 C ATOM 153 NZ LYS A 90 113.458 0.899 -0.472 1.00 0.00 N ATOM 0 H LYS A 90 109.975 1.232 5.900 1.00 0.00 H new ATOM 0 HA LYS A 90 111.212 -1.274 4.947 1.00 0.00 H new ATOM 0 HB2 LYS A 90 111.496 1.625 4.337 1.00 0.00 H new ATOM 0 HB3 LYS A 90 113.002 0.735 4.436 1.00 0.00 H new ATOM 0 HG2 LYS A 90 112.025 -0.939 2.795 1.00 0.00 H new ATOM 0 HG3 LYS A 90 110.651 0.132 2.608 1.00 0.00 H new ATOM 0 HD2 LYS A 90 111.878 1.757 1.487 1.00 0.00 H new ATOM 0 HD3 LYS A 90 113.378 1.343 2.293 1.00 0.00 H new ATOM 0 HE2 LYS A 90 113.635 -0.665 0.945 1.00 0.00 H new ATOM 0 HE3 LYS A 90 112.030 -0.480 0.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 113.723 0.283 -1.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 112.744 1.586 -0.789 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 114.300 1.406 -0.131 1.00 0.00 H new ATOM 167 N GLY A 91 112.239 -1.450 7.258 1.00 0.00 N ATOM 168 CA GLY A 91 113.092 -1.614 8.422 1.00 0.00 C ATOM 169 C GLY A 91 114.203 -2.620 8.187 1.00 0.00 C ATOM 170 O GLY A 91 114.550 -3.391 9.082 1.00 0.00 O ATOM 0 H GLY A 91 111.639 -2.248 7.050 1.00 0.00 H new ATOM 0 HA2 GLY A 91 113.528 -0.651 8.688 1.00 0.00 H new ATOM 0 HA3 GLY A 91 112.487 -1.936 9.270 1.00 0.00 H new ATOM 174 N LYS A 92 114.759 -2.611 6.981 1.00 0.00 N ATOM 175 CA LYS A 92 115.836 -3.530 6.631 1.00 0.00 C ATOM 176 C LYS A 92 117.171 -3.042 7.188 1.00 0.00 C ATOM 177 O LYS A 92 117.525 -1.871 7.046 1.00 0.00 O ATOM 178 CB LYS A 92 115.926 -3.687 5.112 1.00 0.00 C ATOM 179 CG LYS A 92 114.810 -4.535 4.523 1.00 0.00 C ATOM 180 CD LYS A 92 115.111 -4.936 3.084 1.00 0.00 C ATOM 181 CE LYS A 92 114.093 -4.352 2.117 1.00 0.00 C ATOM 182 NZ LYS A 92 114.721 -3.941 0.832 1.00 0.00 N ATOM 0 H LYS A 92 114.482 -1.979 6.230 1.00 0.00 H new ATOM 0 HA LYS A 92 115.613 -4.500 7.075 1.00 0.00 H new ATOM 0 HB2 LYS A 92 115.904 -2.700 4.651 1.00 0.00 H new ATOM 0 HB3 LYS A 92 116.886 -4.136 4.857 1.00 0.00 H new ATOM 0 HG2 LYS A 92 114.673 -5.430 5.130 1.00 0.00 H new ATOM 0 HG3 LYS A 92 113.873 -3.980 4.558 1.00 0.00 H new ATOM 0 HD2 LYS A 92 116.110 -4.595 2.812 1.00 0.00 H new ATOM 0 HD3 LYS A 92 115.111 -6.023 3.001 1.00 0.00 H new ATOM 0 HE2 LYS A 92 113.314 -5.089 1.921 1.00 0.00 H new ATOM 0 HE3 LYS A 92 113.609 -3.490 2.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 113.994 -3.548 0.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 115.447 -3.219 1.016 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 115.161 -4.768 0.381 1.00 0.00 H new ATOM 196 N THR A 93 117.906 -3.948 7.824 1.00 0.00 N ATOM 197 CA THR A 93 119.200 -3.615 8.409 1.00 0.00 C ATOM 198 C THR A 93 120.342 -4.083 7.511 1.00 0.00 C ATOM 199 O THR A 93 120.923 -3.291 6.770 1.00 0.00 O ATOM 200 CB THR A 93 119.332 -4.246 9.798 1.00 0.00 C ATOM 201 OG1 THR A 93 119.227 -5.657 9.720 1.00 0.00 O ATOM 202 CG2 THR A 93 118.284 -3.760 10.776 1.00 0.00 C ATOM 0 H THR A 93 117.627 -4.921 7.948 1.00 0.00 H new ATOM 0 HA THR A 93 119.260 -2.531 8.503 1.00 0.00 H new ATOM 0 HB THR A 93 120.314 -3.944 10.162 1.00 0.00 H new ATOM 0 HG1 THR A 93 119.316 -6.042 10.617 1.00 0.00 H new ATOM 0 HG21 THR A 93 118.433 -4.245 11.740 1.00 0.00 H new ATOM 0 HG22 THR A 93 118.371 -2.680 10.896 1.00 0.00 H new ATOM 0 HG23 THR A 93 117.292 -4.004 10.397 1.00 0.00 H new ATOM 210 N GLU A 94 120.657 -5.374 7.579 1.00 0.00 N ATOM 211 CA GLU A 94 121.725 -5.941 6.764 1.00 0.00 C ATOM 212 C GLU A 94 121.270 -6.089 5.317 1.00 0.00 C ATOM 213 O GLU A 94 121.986 -5.717 4.386 1.00 0.00 O ATOM 214 CB GLU A 94 122.155 -7.300 7.319 1.00 0.00 C ATOM 215 CG GLU A 94 123.062 -7.201 8.535 1.00 0.00 C ATOM 216 CD GLU A 94 122.969 -8.420 9.432 1.00 0.00 C ATOM 217 OE1 GLU A 94 123.065 -9.550 8.910 1.00 0.00 O ATOM 218 OE2 GLU A 94 122.799 -8.243 10.657 1.00 0.00 O ATOM 0 H GLU A 94 120.189 -6.045 8.189 1.00 0.00 H new ATOM 0 HA GLU A 94 122.578 -5.263 6.795 1.00 0.00 H new ATOM 0 HB2 GLU A 94 121.266 -7.872 7.585 1.00 0.00 H new ATOM 0 HB3 GLU A 94 122.670 -7.856 6.536 1.00 0.00 H new ATOM 0 HG2 GLU A 94 124.093 -7.075 8.205 1.00 0.00 H new ATOM 0 HG3 GLU A 94 122.800 -6.312 9.108 1.00 0.00 H new ATOM 225 N GLU A 95 120.069 -6.630 5.139 1.00 0.00 N ATOM 226 CA GLU A 95 119.507 -6.823 3.807 1.00 0.00 C ATOM 227 C GLU A 95 119.420 -5.493 3.060 1.00 0.00 C ATOM 228 O GLU A 95 119.374 -5.464 1.830 1.00 0.00 O ATOM 229 CB GLU A 95 118.118 -7.460 3.904 1.00 0.00 C ATOM 230 CG GLU A 95 117.883 -8.562 2.883 1.00 0.00 C ATOM 231 CD GLU A 95 117.091 -9.723 3.452 1.00 0.00 C ATOM 232 OE1 GLU A 95 117.337 -10.097 4.617 1.00 0.00 O ATOM 233 OE2 GLU A 95 116.223 -10.259 2.729 1.00 0.00 O ATOM 0 H GLU A 95 119.466 -6.942 5.900 1.00 0.00 H new ATOM 0 HA GLU A 95 120.166 -7.491 3.252 1.00 0.00 H new ATOM 0 HB2 GLU A 95 117.984 -7.869 4.905 1.00 0.00 H new ATOM 0 HB3 GLU A 95 117.362 -6.686 3.772 1.00 0.00 H new ATOM 0 HG2 GLU A 95 117.352 -8.150 2.025 1.00 0.00 H new ATOM 0 HG3 GLU A 95 118.844 -8.926 2.519 1.00 0.00 H new ATOM 240 N GLU A 96 119.399 -4.397 3.812 1.00 0.00 N ATOM 241 CA GLU A 96 119.320 -3.065 3.225 1.00 0.00 C ATOM 242 C GLU A 96 120.681 -2.610 2.689 1.00 0.00 C ATOM 243 O GLU A 96 120.779 -1.587 2.012 1.00 0.00 O ATOM 244 CB GLU A 96 118.785 -2.066 4.262 1.00 0.00 C ATOM 245 CG GLU A 96 119.860 -1.382 5.096 1.00 0.00 C ATOM 246 CD GLU A 96 120.141 0.034 4.637 1.00 0.00 C ATOM 247 OE1 GLU A 96 119.999 0.305 3.427 1.00 0.00 O ATOM 248 OE2 GLU A 96 120.503 0.874 5.489 1.00 0.00 O ATOM 0 H GLU A 96 119.436 -4.406 4.831 1.00 0.00 H new ATOM 0 HA GLU A 96 118.631 -3.104 2.381 1.00 0.00 H new ATOM 0 HB2 GLU A 96 118.204 -1.302 3.745 1.00 0.00 H new ATOM 0 HB3 GLU A 96 118.102 -2.588 4.932 1.00 0.00 H new ATOM 0 HG2 GLU A 96 119.549 -1.366 6.141 1.00 0.00 H new ATOM 0 HG3 GLU A 96 120.779 -1.965 5.046 1.00 0.00 H new ATOM 255 N LEU A 97 121.728 -3.374 3.001 1.00 0.00 N ATOM 256 CA LEU A 97 123.080 -3.048 2.557 1.00 0.00 C ATOM 257 C LEU A 97 123.128 -2.793 1.051 1.00 0.00 C ATOM 258 O LEU A 97 124.004 -2.078 0.563 1.00 0.00 O ATOM 259 CB LEU A 97 124.044 -4.178 2.925 1.00 0.00 C ATOM 260 CG LEU A 97 124.415 -4.258 4.407 1.00 0.00 C ATOM 261 CD1 LEU A 97 124.854 -5.667 4.770 1.00 0.00 C ATOM 262 CD2 LEU A 97 125.510 -3.253 4.735 1.00 0.00 C ATOM 0 H LEU A 97 121.664 -4.224 3.561 1.00 0.00 H new ATOM 0 HA LEU A 97 123.385 -2.133 3.065 1.00 0.00 H new ATOM 0 HB2 LEU A 97 123.598 -5.127 2.626 1.00 0.00 H new ATOM 0 HB3 LEU A 97 124.958 -4.059 2.344 1.00 0.00 H new ATOM 0 HG LEU A 97 123.534 -4.011 4.999 1.00 0.00 H new ATOM 0 HD11 LEU A 97 125.114 -5.706 5.828 1.00 0.00 H new ATOM 0 HD12 LEU A 97 124.040 -6.364 4.571 1.00 0.00 H new ATOM 0 HD13 LEU A 97 125.723 -5.943 4.172 1.00 0.00 H new ATOM 0 HD21 LEU A 97 125.763 -3.322 5.793 1.00 0.00 H new ATOM 0 HD22 LEU A 97 126.394 -3.470 4.136 1.00 0.00 H new ATOM 0 HD23 LEU A 97 125.158 -2.246 4.511 1.00 0.00 H new ATOM 274 N SER A 98 122.189 -3.383 0.320 1.00 0.00 N ATOM 275 CA SER A 98 122.131 -3.217 -1.127 1.00 0.00 C ATOM 276 C SER A 98 121.869 -1.761 -1.500 1.00 0.00 C ATOM 277 O SER A 98 122.415 -1.253 -2.481 1.00 0.00 O ATOM 278 CB SER A 98 121.041 -4.110 -1.721 1.00 0.00 C ATOM 279 OG SER A 98 121.066 -4.074 -3.136 1.00 0.00 O ATOM 0 H SER A 98 121.458 -3.980 0.706 1.00 0.00 H new ATOM 0 HA SER A 98 123.097 -3.510 -1.538 1.00 0.00 H new ATOM 0 HB2 SER A 98 121.180 -5.135 -1.378 1.00 0.00 H new ATOM 0 HB3 SER A 98 120.064 -3.784 -1.363 1.00 0.00 H new ATOM 0 HG SER A 98 120.360 -4.654 -3.491 1.00 0.00 H new ATOM 285 N ASP A 99 121.032 -1.095 -0.714 1.00 0.00 N ATOM 286 CA ASP A 99 120.697 0.303 -0.962 1.00 0.00 C ATOM 287 C ASP A 99 121.903 1.207 -0.723 1.00 0.00 C ATOM 288 O ASP A 99 122.181 2.109 -1.512 1.00 0.00 O ATOM 289 CB ASP A 99 119.533 0.737 -0.068 1.00 0.00 C ATOM 290 CG ASP A 99 118.561 1.651 -0.787 1.00 0.00 C ATOM 291 OD1 ASP A 99 118.092 1.276 -1.882 1.00 0.00 O ATOM 292 OD2 ASP A 99 118.267 2.742 -0.254 1.00 0.00 O ATOM 0 H ASP A 99 120.572 -1.500 0.101 1.00 0.00 H new ATOM 0 HA ASP A 99 120.400 0.397 -2.006 1.00 0.00 H new ATOM 0 HB2 ASP A 99 119.002 -0.146 0.287 1.00 0.00 H new ATOM 0 HB3 ASP A 99 119.925 1.248 0.811 1.00 0.00 H new ATOM 297 N LEU A 100 122.613 0.958 0.373 1.00 0.00 N ATOM 298 CA LEU A 100 123.788 1.753 0.717 1.00 0.00 C ATOM 299 C LEU A 100 124.890 1.587 -0.328 1.00 0.00 C ATOM 300 O LEU A 100 125.751 2.455 -0.474 1.00 0.00 O ATOM 301 CB LEU A 100 124.311 1.352 2.099 1.00 0.00 C ATOM 302 CG LEU A 100 123.821 2.229 3.255 1.00 0.00 C ATOM 303 CD1 LEU A 100 122.774 1.495 4.078 1.00 0.00 C ATOM 304 CD2 LEU A 100 124.988 2.655 4.133 1.00 0.00 C ATOM 0 H LEU A 100 122.397 0.214 1.037 1.00 0.00 H new ATOM 0 HA LEU A 100 123.492 2.802 0.737 1.00 0.00 H new ATOM 0 HB2 LEU A 100 124.019 0.320 2.296 1.00 0.00 H new ATOM 0 HB3 LEU A 100 125.401 1.377 2.080 1.00 0.00 H new ATOM 0 HG LEU A 100 123.361 3.124 2.835 1.00 0.00 H new ATOM 0 HD11 LEU A 100 122.439 2.135 4.894 1.00 0.00 H new ATOM 0 HD12 LEU A 100 121.925 1.241 3.444 1.00 0.00 H new ATOM 0 HD13 LEU A 100 123.207 0.582 4.487 1.00 0.00 H new ATOM 0 HD21 LEU A 100 124.621 3.277 4.949 1.00 0.00 H new ATOM 0 HD22 LEU A 100 125.477 1.771 4.542 1.00 0.00 H new ATOM 0 HD23 LEU A 100 125.703 3.222 3.537 1.00 0.00 H new ATOM 316 N PHE A 101 124.863 0.470 -1.048 1.00 0.00 N ATOM 317 CA PHE A 101 125.865 0.200 -2.073 1.00 0.00 C ATOM 318 C PHE A 101 125.787 1.224 -3.200 1.00 0.00 C ATOM 319 O PHE A 101 126.803 1.787 -3.610 1.00 0.00 O ATOM 320 CB PHE A 101 125.686 -1.211 -2.637 1.00 0.00 C ATOM 321 CG PHE A 101 126.778 -1.619 -3.582 1.00 0.00 C ATOM 322 CD1 PHE A 101 128.063 -1.853 -3.119 1.00 0.00 C ATOM 323 CD2 PHE A 101 126.520 -1.768 -4.936 1.00 0.00 C ATOM 324 CE1 PHE A 101 129.070 -2.227 -3.987 1.00 0.00 C ATOM 325 CE2 PHE A 101 127.524 -2.143 -5.809 1.00 0.00 C ATOM 326 CZ PHE A 101 128.801 -2.371 -5.334 1.00 0.00 C ATOM 0 H PHE A 101 124.160 -0.261 -0.941 1.00 0.00 H new ATOM 0 HA PHE A 101 126.848 0.275 -1.608 1.00 0.00 H new ATOM 0 HB2 PHE A 101 125.646 -1.922 -1.811 1.00 0.00 H new ATOM 0 HB3 PHE A 101 124.728 -1.269 -3.154 1.00 0.00 H new ATOM 0 HD1 PHE A 101 128.280 -1.742 -2.067 1.00 0.00 H new ATOM 0 HD2 PHE A 101 125.524 -1.589 -5.313 1.00 0.00 H new ATOM 0 HE1 PHE A 101 130.067 -2.407 -3.613 1.00 0.00 H new ATOM 0 HE2 PHE A 101 127.310 -2.258 -6.861 1.00 0.00 H new ATOM 0 HZ PHE A 101 129.588 -2.661 -6.015 1.00 0.00 H new ATOM 336 N ARG A 102 124.579 1.461 -3.701 1.00 0.00 N ATOM 337 CA ARG A 102 124.372 2.416 -4.784 1.00 0.00 C ATOM 338 C ARG A 102 124.906 3.795 -4.407 1.00 0.00 C ATOM 339 O ARG A 102 125.388 4.540 -5.259 1.00 0.00 O ATOM 340 CB ARG A 102 122.886 2.510 -5.132 1.00 0.00 C ATOM 341 CG ARG A 102 122.238 1.161 -5.398 1.00 0.00 C ATOM 342 CD ARG A 102 121.091 1.279 -6.389 1.00 0.00 C ATOM 343 NE ARG A 102 121.563 1.551 -7.744 1.00 0.00 N ATOM 344 CZ ARG A 102 120.833 1.356 -8.839 1.00 0.00 C ATOM 345 NH1 ARG A 102 119.594 0.886 -8.743 1.00 0.00 N ATOM 346 NH2 ARG A 102 121.340 1.629 -10.032 1.00 0.00 N ATOM 0 H ARG A 102 123.728 1.004 -3.374 1.00 0.00 H new ATOM 0 HA ARG A 102 124.921 2.061 -5.656 1.00 0.00 H new ATOM 0 HB2 ARG A 102 122.360 3.002 -4.314 1.00 0.00 H new ATOM 0 HB3 ARG A 102 122.767 3.141 -6.013 1.00 0.00 H new ATOM 0 HG2 ARG A 102 122.985 0.468 -5.785 1.00 0.00 H new ATOM 0 HG3 ARG A 102 121.869 0.742 -4.462 1.00 0.00 H new ATOM 0 HD2 ARG A 102 120.513 0.355 -6.385 1.00 0.00 H new ATOM 0 HD3 ARG A 102 120.419 2.077 -6.072 1.00 0.00 H new ATOM 0 HE ARG A 102 122.510 1.912 -7.858 1.00 0.00 H new ATOM 0 HH11 ARG A 102 119.199 0.673 -7.827 1.00 0.00 H new ATOM 0 HH12 ARG A 102 119.038 0.738 -9.585 1.00 0.00 H new ATOM 0 HH21 ARG A 102 122.291 1.989 -10.112 1.00 0.00 H new ATOM 0 HH22 ARG A 102 120.779 1.479 -10.871 1.00 0.00 H new ATOM 360 N MET A 103 124.816 4.128 -3.124 1.00 0.00 N ATOM 361 CA MET A 103 125.289 5.417 -2.634 1.00 0.00 C ATOM 362 C MET A 103 126.779 5.590 -2.913 1.00 0.00 C ATOM 363 O MET A 103 127.200 6.594 -3.487 1.00 0.00 O ATOM 364 CB MET A 103 125.021 5.547 -1.134 1.00 0.00 C ATOM 365 CG MET A 103 123.552 5.728 -0.792 1.00 0.00 C ATOM 366 SD MET A 103 123.296 6.829 0.613 1.00 0.00 S ATOM 367 CE MET A 103 121.809 7.686 0.104 1.00 0.00 C ATOM 0 H MET A 103 124.420 3.523 -2.405 1.00 0.00 H new ATOM 0 HA MET A 103 124.744 6.200 -3.161 1.00 0.00 H new ATOM 0 HB2 MET A 103 125.396 4.658 -0.628 1.00 0.00 H new ATOM 0 HB3 MET A 103 125.583 6.396 -0.745 1.00 0.00 H new ATOM 0 HG2 MET A 103 123.027 6.126 -1.661 1.00 0.00 H new ATOM 0 HG3 MET A 103 123.112 4.756 -0.571 1.00 0.00 H new ATOM 0 HE1 MET A 103 121.522 8.404 0.872 1.00 0.00 H new ATOM 0 HE2 MET A 103 121.994 8.211 -0.833 1.00 0.00 H new ATOM 0 HE3 MET A 103 121.004 6.965 -0.037 1.00 0.00 H new ATOM 377 N PHE A 104 127.569 4.604 -2.504 1.00 0.00 N ATOM 378 CA PHE A 104 129.014 4.647 -2.710 1.00 0.00 C ATOM 379 C PHE A 104 129.361 4.569 -4.196 1.00 0.00 C ATOM 380 O PHE A 104 130.442 4.986 -4.610 1.00 0.00 O ATOM 381 CB PHE A 104 129.689 3.500 -1.955 1.00 0.00 C ATOM 382 CG PHE A 104 130.317 3.925 -0.657 1.00 0.00 C ATOM 383 CD1 PHE A 104 129.598 4.670 0.264 1.00 0.00 C ATOM 384 CD2 PHE A 104 131.626 3.580 -0.361 1.00 0.00 C ATOM 385 CE1 PHE A 104 130.172 5.061 1.458 1.00 0.00 C ATOM 386 CE2 PHE A 104 132.206 3.969 0.833 1.00 0.00 C ATOM 387 CZ PHE A 104 131.477 4.710 1.743 1.00 0.00 C ATOM 0 H PHE A 104 127.235 3.766 -2.028 1.00 0.00 H new ATOM 0 HA PHE A 104 129.382 5.597 -2.323 1.00 0.00 H new ATOM 0 HB2 PHE A 104 128.951 2.723 -1.755 1.00 0.00 H new ATOM 0 HB3 PHE A 104 130.454 3.057 -2.592 1.00 0.00 H new ATOM 0 HD1 PHE A 104 128.577 4.948 0.046 1.00 0.00 H new ATOM 0 HD2 PHE A 104 132.199 3.001 -1.070 1.00 0.00 H new ATOM 0 HE1 PHE A 104 129.601 5.641 2.168 1.00 0.00 H new ATOM 0 HE2 PHE A 104 133.227 3.694 1.053 1.00 0.00 H new ATOM 0 HZ PHE A 104 131.927 5.014 2.676 1.00 0.00 H new ATOM 397 N ASP A 105 128.440 4.035 -4.993 1.00 0.00 N ATOM 398 CA ASP A 105 128.655 3.906 -6.430 1.00 0.00 C ATOM 399 C ASP A 105 128.390 5.230 -7.140 1.00 0.00 C ATOM 400 O ASP A 105 127.498 5.985 -6.754 1.00 0.00 O ATOM 401 CB ASP A 105 127.753 2.810 -7.005 1.00 0.00 C ATOM 402 CG ASP A 105 128.541 1.612 -7.498 1.00 0.00 C ATOM 403 OD1 ASP A 105 129.068 1.672 -8.628 1.00 0.00 O ATOM 404 OD2 ASP A 105 128.628 0.611 -6.754 1.00 0.00 O ATOM 0 H ASP A 105 127.539 3.685 -4.668 1.00 0.00 H new ATOM 0 HA ASP A 105 129.697 3.631 -6.595 1.00 0.00 H new ATOM 0 HB2 ASP A 105 127.046 2.487 -6.241 1.00 0.00 H new ATOM 0 HB3 ASP A 105 127.167 3.220 -7.828 1.00 0.00 H new ATOM 409 N LYS A 106 129.169 5.505 -8.181 1.00 0.00 N ATOM 410 CA LYS A 106 129.019 6.736 -8.947 1.00 0.00 C ATOM 411 C LYS A 106 128.473 6.448 -10.341 1.00 0.00 C ATOM 412 O LYS A 106 127.520 7.084 -10.792 1.00 0.00 O ATOM 413 CB LYS A 106 130.361 7.463 -9.052 1.00 0.00 C ATOM 414 CG LYS A 106 130.227 8.948 -9.348 1.00 0.00 C ATOM 415 CD LYS A 106 129.833 9.731 -8.107 1.00 0.00 C ATOM 416 CE LYS A 106 128.845 10.837 -8.437 1.00 0.00 C ATOM 417 NZ LYS A 106 129.058 12.044 -7.592 1.00 0.00 N ATOM 0 H LYS A 106 129.912 4.890 -8.514 1.00 0.00 H new ATOM 0 HA LYS A 106 128.307 7.375 -8.424 1.00 0.00 H new ATOM 0 HB2 LYS A 106 130.908 7.335 -8.118 1.00 0.00 H new ATOM 0 HB3 LYS A 106 130.957 6.997 -9.837 1.00 0.00 H new ATOM 0 HG2 LYS A 106 131.172 9.329 -9.735 1.00 0.00 H new ATOM 0 HG3 LYS A 106 129.479 9.099 -10.127 1.00 0.00 H new ATOM 0 HD2 LYS A 106 129.393 9.055 -7.374 1.00 0.00 H new ATOM 0 HD3 LYS A 106 130.724 10.162 -7.649 1.00 0.00 H new ATOM 0 HE2 LYS A 106 128.942 11.108 -9.488 1.00 0.00 H new ATOM 0 HE3 LYS A 106 127.829 10.470 -8.295 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 128.243 12.683 -7.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 129.160 11.758 -6.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 129.921 12.536 -7.901 1.00 0.00 H new ATOM 431 N ASN A 107 129.084 5.481 -11.019 1.00 0.00 N ATOM 432 CA ASN A 107 128.660 5.104 -12.364 1.00 0.00 C ATOM 433 C ASN A 107 127.512 4.098 -12.317 1.00 0.00 C ATOM 434 O ASN A 107 126.779 3.938 -13.293 1.00 0.00 O ATOM 435 CB ASN A 107 129.837 4.518 -13.145 1.00 0.00 C ATOM 436 CG ASN A 107 130.535 3.403 -12.390 1.00 0.00 C ATOM 437 OD1 ASN A 107 130.197 3.108 -11.245 1.00 0.00 O ATOM 438 ND2 ASN A 107 131.513 2.776 -13.033 1.00 0.00 N ATOM 0 H ASN A 107 129.874 4.944 -10.660 1.00 0.00 H new ATOM 0 HA ASN A 107 128.307 6.002 -12.870 1.00 0.00 H new ATOM 0 HB2 ASN A 107 129.481 4.137 -14.102 1.00 0.00 H new ATOM 0 HB3 ASN A 107 130.554 5.309 -13.364 1.00 0.00 H new ATOM 0 HD21 ASN A 107 132.018 2.016 -12.577 1.00 0.00 H new ATOM 0 HD22 ASN A 107 131.760 3.055 -13.983 1.00 0.00 H new ATOM 445 N ALA A 108 127.364 3.420 -11.180 1.00 0.00 N ATOM 446 CA ALA A 108 126.307 2.428 -11.012 1.00 0.00 C ATOM 447 C ALA A 108 126.544 1.218 -11.907 1.00 0.00 C ATOM 448 O ALA A 108 125.625 0.725 -12.564 1.00 0.00 O ATOM 449 CB ALA A 108 124.945 3.047 -11.304 1.00 0.00 C ATOM 0 H ALA A 108 127.963 3.540 -10.363 1.00 0.00 H new ATOM 0 HA ALA A 108 126.323 2.090 -9.976 1.00 0.00 H new ATOM 0 HB1 ALA A 108 124.168 2.294 -11.174 1.00 0.00 H new ATOM 0 HB2 ALA A 108 124.767 3.875 -10.617 1.00 0.00 H new ATOM 0 HB3 ALA A 108 124.925 3.416 -12.330 1.00 0.00 H new ATOM 455 N ASP A 109 127.784 0.740 -11.930 1.00 0.00 N ATOM 456 CA ASP A 109 128.145 -0.415 -12.745 1.00 0.00 C ATOM 457 C ASP A 109 128.104 -1.700 -11.921 1.00 0.00 C ATOM 458 O ASP A 109 127.896 -2.787 -12.459 1.00 0.00 O ATOM 459 CB ASP A 109 129.539 -0.226 -13.344 1.00 0.00 C ATOM 460 CG ASP A 109 130.607 -0.061 -12.282 1.00 0.00 C ATOM 461 OD1 ASP A 109 130.338 0.620 -11.270 1.00 0.00 O ATOM 462 OD2 ASP A 109 131.713 -0.613 -12.461 1.00 0.00 O ATOM 0 H ASP A 109 128.556 1.135 -11.393 1.00 0.00 H new ATOM 0 HA ASP A 109 127.417 -0.499 -13.552 1.00 0.00 H new ATOM 0 HB2 ASP A 109 129.782 -1.085 -13.969 1.00 0.00 H new ATOM 0 HB3 ASP A 109 129.537 0.650 -13.992 1.00 0.00 H new ATOM 467 N GLY A 110 128.303 -1.568 -10.613 1.00 0.00 N ATOM 468 CA GLY A 110 128.285 -2.727 -9.738 1.00 0.00 C ATOM 469 C GLY A 110 129.550 -2.861 -8.910 1.00 0.00 C ATOM 470 O GLY A 110 129.701 -3.821 -8.153 1.00 0.00 O ATOM 0 H GLY A 110 128.476 -0.679 -10.143 1.00 0.00 H new ATOM 0 HA2 GLY A 110 127.426 -2.659 -9.071 1.00 0.00 H new ATOM 0 HA3 GLY A 110 128.152 -3.627 -10.338 1.00 0.00 H new ATOM 474 N TYR A 111 130.461 -1.902 -9.049 1.00 0.00 N ATOM 475 CA TYR A 111 131.714 -1.926 -8.303 1.00 0.00 C ATOM 476 C TYR A 111 132.220 -0.511 -8.044 1.00 0.00 C ATOM 477 O TYR A 111 131.866 0.425 -8.761 1.00 0.00 O ATOM 478 CB TYR A 111 132.773 -2.723 -9.065 1.00 0.00 C ATOM 479 CG TYR A 111 132.300 -4.087 -9.511 1.00 0.00 C ATOM 480 CD1 TYR A 111 131.553 -4.240 -10.671 1.00 0.00 C ATOM 481 CD2 TYR A 111 132.603 -5.223 -8.771 1.00 0.00 C ATOM 482 CE1 TYR A 111 131.119 -5.486 -11.082 1.00 0.00 C ATOM 483 CE2 TYR A 111 132.173 -6.473 -9.175 1.00 0.00 C ATOM 484 CZ TYR A 111 131.432 -6.599 -10.330 1.00 0.00 C ATOM 485 OH TYR A 111 131.003 -7.841 -10.736 1.00 0.00 O ATOM 0 H TYR A 111 130.355 -1.100 -9.670 1.00 0.00 H new ATOM 0 HA TYR A 111 131.525 -2.409 -7.344 1.00 0.00 H new ATOM 0 HB2 TYR A 111 133.085 -2.152 -9.940 1.00 0.00 H new ATOM 0 HB3 TYR A 111 133.652 -2.842 -8.431 1.00 0.00 H new ATOM 0 HD1 TYR A 111 131.307 -3.370 -11.262 1.00 0.00 H new ATOM 0 HD2 TYR A 111 133.184 -5.128 -7.865 1.00 0.00 H new ATOM 0 HE1 TYR A 111 130.538 -5.588 -11.987 1.00 0.00 H new ATOM 0 HE2 TYR A 111 132.417 -7.347 -8.588 1.00 0.00 H new ATOM 0 HH TYR A 111 131.309 -8.518 -10.097 1.00 0.00 H new ATOM 495 N ILE A 112 133.048 -0.360 -7.016 1.00 0.00 N ATOM 496 CA ILE A 112 133.601 0.942 -6.668 1.00 0.00 C ATOM 497 C ILE A 112 135.120 0.881 -6.554 1.00 0.00 C ATOM 498 O ILE A 112 135.686 -0.147 -6.186 1.00 0.00 O ATOM 499 CB ILE A 112 133.015 1.469 -5.343 1.00 0.00 C ATOM 500 CG1 ILE A 112 131.487 1.374 -5.356 1.00 0.00 C ATOM 501 CG2 ILE A 112 133.458 2.905 -5.101 1.00 0.00 C ATOM 502 CD1 ILE A 112 130.903 0.873 -4.053 1.00 0.00 C ATOM 0 H ILE A 112 133.350 -1.123 -6.410 1.00 0.00 H new ATOM 0 HA ILE A 112 133.328 1.626 -7.471 1.00 0.00 H new ATOM 0 HB ILE A 112 133.390 0.849 -4.529 1.00 0.00 H new ATOM 0 HG12 ILE A 112 131.071 2.357 -5.577 1.00 0.00 H new ATOM 0 HG13 ILE A 112 131.179 0.709 -6.163 1.00 0.00 H new ATOM 0 HG21 ILE A 112 133.036 3.263 -4.162 1.00 0.00 H new ATOM 0 HG22 ILE A 112 134.546 2.946 -5.049 1.00 0.00 H new ATOM 0 HG23 ILE A 112 133.110 3.536 -5.919 1.00 0.00 H new ATOM 0 HD11 ILE A 112 129.817 0.831 -4.134 1.00 0.00 H new ATOM 0 HD12 ILE A 112 131.290 -0.123 -3.840 1.00 0.00 H new ATOM 0 HD13 ILE A 112 131.181 1.550 -3.245 1.00 0.00 H new ATOM 514 N ASP A 113 135.772 1.994 -6.877 1.00 0.00 N ATOM 515 CA ASP A 113 137.226 2.077 -6.816 1.00 0.00 C ATOM 516 C ASP A 113 137.669 3.361 -6.120 1.00 0.00 C ATOM 517 O ASP A 113 136.842 4.165 -5.694 1.00 0.00 O ATOM 518 CB ASP A 113 137.821 2.017 -8.225 1.00 0.00 C ATOM 519 CG ASP A 113 137.586 0.676 -8.894 1.00 0.00 C ATOM 520 OD1 ASP A 113 136.437 0.188 -8.857 1.00 0.00 O ATOM 521 OD2 ASP A 113 138.551 0.114 -9.454 1.00 0.00 O ATOM 0 H ASP A 113 135.314 2.852 -7.184 1.00 0.00 H new ATOM 0 HA ASP A 113 137.589 1.227 -6.238 1.00 0.00 H new ATOM 0 HB2 ASP A 113 137.383 2.807 -8.836 1.00 0.00 H new ATOM 0 HB3 ASP A 113 138.892 2.212 -8.173 1.00 0.00 H new ATOM 526 N LEU A 114 138.982 3.542 -6.005 1.00 0.00 N ATOM 527 CA LEU A 114 139.539 4.726 -5.357 1.00 0.00 C ATOM 528 C LEU A 114 139.035 6.008 -6.018 1.00 0.00 C ATOM 529 O LEU A 114 138.914 7.045 -5.367 1.00 0.00 O ATOM 530 CB LEU A 114 141.067 4.685 -5.402 1.00 0.00 C ATOM 531 CG LEU A 114 141.726 3.881 -4.277 1.00 0.00 C ATOM 532 CD1 LEU A 114 142.141 2.505 -4.777 1.00 0.00 C ATOM 533 CD2 LEU A 114 142.928 4.629 -3.717 1.00 0.00 C ATOM 0 H LEU A 114 139.680 2.884 -6.352 1.00 0.00 H new ATOM 0 HA LEU A 114 139.209 4.724 -4.318 1.00 0.00 H new ATOM 0 HB2 LEU A 114 141.376 4.264 -6.359 1.00 0.00 H new ATOM 0 HB3 LEU A 114 141.444 5.707 -5.367 1.00 0.00 H new ATOM 0 HG LEU A 114 140.998 3.752 -3.476 1.00 0.00 H new ATOM 0 HD11 LEU A 114 142.607 1.948 -3.964 1.00 0.00 H new ATOM 0 HD12 LEU A 114 141.262 1.965 -5.129 1.00 0.00 H new ATOM 0 HD13 LEU A 114 142.852 2.615 -5.596 1.00 0.00 H new ATOM 0 HD21 LEU A 114 143.382 4.042 -2.919 1.00 0.00 H new ATOM 0 HD22 LEU A 114 143.658 4.790 -4.510 1.00 0.00 H new ATOM 0 HD23 LEU A 114 142.605 5.592 -3.320 1.00 0.00 H new ATOM 545 N GLU A 115 138.747 5.929 -7.314 1.00 0.00 N ATOM 546 CA GLU A 115 138.260 7.085 -8.057 1.00 0.00 C ATOM 547 C GLU A 115 136.924 7.571 -7.500 1.00 0.00 C ATOM 548 O GLU A 115 136.701 8.773 -7.360 1.00 0.00 O ATOM 549 CB GLU A 115 138.112 6.739 -9.540 1.00 0.00 C ATOM 550 CG GLU A 115 139.326 7.113 -10.375 1.00 0.00 C ATOM 551 CD GLU A 115 138.952 7.795 -11.676 1.00 0.00 C ATOM 552 OE1 GLU A 115 138.291 8.854 -11.624 1.00 0.00 O ATOM 553 OE2 GLU A 115 139.320 7.272 -12.749 1.00 0.00 O ATOM 0 H GLU A 115 138.842 5.079 -7.869 1.00 0.00 H new ATOM 0 HA GLU A 115 138.990 7.887 -7.948 1.00 0.00 H new ATOM 0 HB2 GLU A 115 137.929 5.669 -9.639 1.00 0.00 H new ATOM 0 HB3 GLU A 115 137.236 7.250 -9.938 1.00 0.00 H new ATOM 0 HG2 GLU A 115 139.971 7.773 -9.796 1.00 0.00 H new ATOM 0 HG3 GLU A 115 139.903 6.214 -10.593 1.00 0.00 H new ATOM 560 N GLU A 116 136.041 6.629 -7.187 1.00 0.00 N ATOM 561 CA GLU A 116 134.727 6.962 -6.646 1.00 0.00 C ATOM 562 C GLU A 116 134.835 7.471 -5.212 1.00 0.00 C ATOM 563 O GLU A 116 134.140 8.408 -4.820 1.00 0.00 O ATOM 564 CB GLU A 116 133.806 5.741 -6.699 1.00 0.00 C ATOM 565 CG GLU A 116 132.935 5.688 -7.943 1.00 0.00 C ATOM 566 CD GLU A 116 133.188 4.451 -8.782 1.00 0.00 C ATOM 567 OE1 GLU A 116 134.371 4.114 -9.003 1.00 0.00 O ATOM 568 OE2 GLU A 116 132.204 3.819 -9.221 1.00 0.00 O ATOM 0 H GLU A 116 136.210 5.629 -7.298 1.00 0.00 H new ATOM 0 HA GLU A 116 134.303 7.757 -7.260 1.00 0.00 H new ATOM 0 HB2 GLU A 116 134.413 4.837 -6.652 1.00 0.00 H new ATOM 0 HB3 GLU A 116 133.165 5.741 -5.817 1.00 0.00 H new ATOM 0 HG2 GLU A 116 131.886 5.714 -7.648 1.00 0.00 H new ATOM 0 HG3 GLU A 116 133.118 6.576 -8.548 1.00 0.00 H new ATOM 575 N LEU A 117 135.714 6.847 -4.431 1.00 0.00 N ATOM 576 CA LEU A 117 135.914 7.237 -3.038 1.00 0.00 C ATOM 577 C LEU A 117 136.215 8.727 -2.928 1.00 0.00 C ATOM 578 O LEU A 117 135.660 9.422 -2.077 1.00 0.00 O ATOM 579 CB LEU A 117 137.053 6.428 -2.415 1.00 0.00 C ATOM 580 CG LEU A 117 136.898 4.911 -2.518 1.00 0.00 C ATOM 581 CD1 LEU A 117 138.190 4.211 -2.123 1.00 0.00 C ATOM 582 CD2 LEU A 117 135.742 4.436 -1.650 1.00 0.00 C ATOM 0 H LEU A 117 136.298 6.070 -4.739 1.00 0.00 H new ATOM 0 HA LEU A 117 134.992 7.029 -2.495 1.00 0.00 H new ATOM 0 HB2 LEU A 117 137.988 6.716 -2.895 1.00 0.00 H new ATOM 0 HB3 LEU A 117 137.138 6.699 -1.363 1.00 0.00 H new ATOM 0 HG LEU A 117 136.678 4.656 -3.555 1.00 0.00 H new ATOM 0 HD11 LEU A 117 138.058 3.132 -2.203 1.00 0.00 H new ATOM 0 HD12 LEU A 117 138.994 4.529 -2.787 1.00 0.00 H new ATOM 0 HD13 LEU A 117 138.445 4.470 -1.095 1.00 0.00 H new ATOM 0 HD21 LEU A 117 135.645 3.354 -1.734 1.00 0.00 H new ATOM 0 HD22 LEU A 117 135.934 4.703 -0.611 1.00 0.00 H new ATOM 0 HD23 LEU A 117 134.819 4.910 -1.982 1.00 0.00 H new ATOM 594 N LYS A 118 137.092 9.210 -3.800 1.00 0.00 N ATOM 595 CA LYS A 118 137.461 10.620 -3.806 1.00 0.00 C ATOM 596 C LYS A 118 136.261 11.484 -4.169 1.00 0.00 C ATOM 597 O LYS A 118 136.110 12.600 -3.668 1.00 0.00 O ATOM 598 CB LYS A 118 138.602 10.867 -4.794 1.00 0.00 C ATOM 599 CG LYS A 118 139.977 10.543 -4.231 1.00 0.00 C ATOM 600 CD LYS A 118 140.947 11.699 -4.419 1.00 0.00 C ATOM 601 CE LYS A 118 140.505 12.930 -3.645 1.00 0.00 C ATOM 602 NZ LYS A 118 140.985 14.189 -4.279 1.00 0.00 N ATOM 0 H LYS A 118 137.560 8.647 -4.511 1.00 0.00 H new ATOM 0 HA LYS A 118 137.797 10.891 -2.805 1.00 0.00 H new ATOM 0 HB2 LYS A 118 138.434 10.266 -5.688 1.00 0.00 H new ATOM 0 HB3 LYS A 118 138.583 11.912 -5.104 1.00 0.00 H new ATOM 0 HG2 LYS A 118 139.890 10.309 -3.170 1.00 0.00 H new ATOM 0 HG3 LYS A 118 140.371 9.653 -4.722 1.00 0.00 H new ATOM 0 HD2 LYS A 118 141.941 11.398 -4.089 1.00 0.00 H new ATOM 0 HD3 LYS A 118 141.023 11.942 -5.479 1.00 0.00 H new ATOM 0 HE2 LYS A 118 139.417 12.948 -3.582 1.00 0.00 H new ATOM 0 HE3 LYS A 118 140.882 12.871 -2.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 140.662 15.004 -3.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 142.024 14.185 -4.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 140.604 14.259 -5.244 1.00 0.00 H new ATOM 616 N ILE A 119 135.410 10.963 -5.046 1.00 0.00 N ATOM 617 CA ILE A 119 134.220 11.685 -5.482 1.00 0.00 C ATOM 618 C ILE A 119 133.138 11.666 -4.407 1.00 0.00 C ATOM 619 O ILE A 119 132.673 12.714 -3.961 1.00 0.00 O ATOM 620 CB ILE A 119 133.645 11.088 -6.783 1.00 0.00 C ATOM 621 CG1 ILE A 119 134.739 10.978 -7.846 1.00 0.00 C ATOM 622 CG2 ILE A 119 132.489 11.937 -7.293 1.00 0.00 C ATOM 623 CD1 ILE A 119 134.475 9.900 -8.875 1.00 0.00 C ATOM 0 H ILE A 119 135.522 10.042 -5.470 1.00 0.00 H new ATOM 0 HA ILE A 119 134.526 12.715 -5.667 1.00 0.00 H new ATOM 0 HB ILE A 119 133.268 10.088 -6.569 1.00 0.00 H new ATOM 0 HG12 ILE A 119 134.839 11.937 -8.354 1.00 0.00 H new ATOM 0 HG13 ILE A 119 135.692 10.776 -7.356 1.00 0.00 H new ATOM 0 HG21 ILE A 119 132.095 11.502 -8.211 1.00 0.00 H new ATOM 0 HG22 ILE A 119 131.702 11.969 -6.540 1.00 0.00 H new ATOM 0 HG23 ILE A 119 132.841 12.949 -7.493 1.00 0.00 H new ATOM 0 HD11 ILE A 119 135.291 9.879 -9.597 1.00 0.00 H new ATOM 0 HD12 ILE A 119 134.405 8.932 -8.378 1.00 0.00 H new ATOM 0 HD13 ILE A 119 133.539 10.112 -9.392 1.00 0.00 H new ATOM 635 N MET A 120 132.738 10.465 -3.999 1.00 0.00 N ATOM 636 CA MET A 120 131.708 10.308 -2.979 1.00 0.00 C ATOM 637 C MET A 120 132.110 10.997 -1.678 1.00 0.00 C ATOM 638 O MET A 120 131.257 11.449 -0.916 1.00 0.00 O ATOM 639 CB MET A 120 131.442 8.823 -2.721 1.00 0.00 C ATOM 640 CG MET A 120 132.661 8.061 -2.226 1.00 0.00 C ATOM 641 SD MET A 120 132.264 6.887 -0.917 1.00 0.00 S ATOM 642 CE MET A 120 133.079 7.650 0.482 1.00 0.00 C ATOM 0 H MET A 120 133.112 9.587 -4.359 1.00 0.00 H new ATOM 0 HA MET A 120 130.796 10.779 -3.347 1.00 0.00 H new ATOM 0 HB2 MET A 120 130.642 8.728 -1.986 1.00 0.00 H new ATOM 0 HB3 MET A 120 131.085 8.361 -3.642 1.00 0.00 H new ATOM 0 HG2 MET A 120 133.115 7.528 -3.061 1.00 0.00 H new ATOM 0 HG3 MET A 120 133.403 8.770 -1.860 1.00 0.00 H new ATOM 0 HE1 MET A 120 132.626 7.292 1.407 1.00 0.00 H new ATOM 0 HE2 MET A 120 134.138 7.391 0.472 1.00 0.00 H new ATOM 0 HE3 MET A 120 132.970 8.733 0.420 1.00 0.00 H new ATOM 652 N LEU A 121 133.414 11.073 -1.429 1.00 0.00 N ATOM 653 CA LEU A 121 133.924 11.707 -0.219 1.00 0.00 C ATOM 654 C LEU A 121 133.772 13.224 -0.289 1.00 0.00 C ATOM 655 O LEU A 121 133.659 13.893 0.738 1.00 0.00 O ATOM 656 CB LEU A 121 135.392 11.338 0.000 1.00 0.00 C ATOM 657 CG LEU A 121 135.626 9.971 0.648 1.00 0.00 C ATOM 658 CD1 LEU A 121 137.093 9.583 0.560 1.00 0.00 C ATOM 659 CD2 LEU A 121 135.162 9.984 2.097 1.00 0.00 C ATOM 0 H LEU A 121 134.135 10.704 -2.048 1.00 0.00 H new ATOM 0 HA LEU A 121 133.337 11.341 0.623 1.00 0.00 H new ATOM 0 HB2 LEU A 121 135.904 11.360 -0.962 1.00 0.00 H new ATOM 0 HB3 LEU A 121 135.854 12.103 0.624 1.00 0.00 H new ATOM 0 HG LEU A 121 135.042 9.227 0.106 1.00 0.00 H new ATOM 0 HD11 LEU A 121 137.240 8.609 1.026 1.00 0.00 H new ATOM 0 HD12 LEU A 121 137.394 9.534 -0.486 1.00 0.00 H new ATOM 0 HD13 LEU A 121 137.698 10.328 1.077 1.00 0.00 H new ATOM 0 HD21 LEU A 121 135.335 9.005 2.543 1.00 0.00 H new ATOM 0 HD22 LEU A 121 135.720 10.739 2.651 1.00 0.00 H new ATOM 0 HD23 LEU A 121 134.098 10.217 2.136 1.00 0.00 H new ATOM 671 N GLN A 122 133.765 13.763 -1.504 1.00 0.00 N ATOM 672 CA GLN A 122 133.621 15.201 -1.698 1.00 0.00 C ATOM 673 C GLN A 122 132.239 15.671 -1.252 1.00 0.00 C ATOM 674 O GLN A 122 132.056 16.830 -0.884 1.00 0.00 O ATOM 675 CB GLN A 122 133.849 15.568 -3.164 1.00 0.00 C ATOM 676 CG GLN A 122 135.317 15.712 -3.534 1.00 0.00 C ATOM 677 CD GLN A 122 135.557 16.811 -4.550 1.00 0.00 C ATOM 678 OE1 GLN A 122 135.302 16.637 -5.743 1.00 0.00 O ATOM 679 NE2 GLN A 122 136.050 17.952 -4.082 1.00 0.00 N ATOM 0 H GLN A 122 133.857 13.227 -2.367 1.00 0.00 H new ATOM 0 HA GLN A 122 134.373 15.702 -1.088 1.00 0.00 H new ATOM 0 HB2 GLN A 122 133.397 14.803 -3.796 1.00 0.00 H new ATOM 0 HB3 GLN A 122 133.335 16.505 -3.380 1.00 0.00 H new ATOM 0 HG2 GLN A 122 135.896 15.921 -2.634 1.00 0.00 H new ATOM 0 HG3 GLN A 122 135.681 14.766 -3.935 1.00 0.00 H new ATOM 0 HE21 GLN A 122 136.246 18.052 -3.086 1.00 0.00 H new ATOM 0 HE22 GLN A 122 136.232 18.728 -4.718 1.00 0.00 H new ATOM 688 N ALA A 123 131.269 14.760 -1.287 1.00 0.00 N ATOM 689 CA ALA A 123 129.905 15.081 -0.885 1.00 0.00 C ATOM 690 C ALA A 123 129.868 15.580 0.555 1.00 0.00 C ATOM 691 O ALA A 123 129.289 16.627 0.843 1.00 0.00 O ATOM 692 CB ALA A 123 129.006 13.865 -1.049 1.00 0.00 C ATOM 0 H ALA A 123 131.404 13.795 -1.590 1.00 0.00 H new ATOM 0 HA ALA A 123 129.536 15.878 -1.531 1.00 0.00 H new ATOM 0 HB1 ALA A 123 127.991 14.120 -0.745 1.00 0.00 H new ATOM 0 HB2 ALA A 123 129.005 13.552 -2.093 1.00 0.00 H new ATOM 0 HB3 ALA A 123 129.378 13.051 -0.427 1.00 0.00 H new ATOM 698 N THR A 124 130.491 14.827 1.455 1.00 0.00 N ATOM 699 CA THR A 124 130.531 15.199 2.864 1.00 0.00 C ATOM 700 C THR A 124 131.243 16.535 3.042 1.00 0.00 C ATOM 701 O THR A 124 131.758 17.105 2.079 1.00 0.00 O ATOM 702 CB THR A 124 131.236 14.117 3.682 1.00 0.00 C ATOM 703 OG1 THR A 124 132.639 14.182 3.498 1.00 0.00 O ATOM 704 CG2 THR A 124 130.792 12.714 3.329 1.00 0.00 C ATOM 0 H THR A 124 130.975 13.957 1.234 1.00 0.00 H new ATOM 0 HA THR A 124 129.506 15.297 3.222 1.00 0.00 H new ATOM 0 HB THR A 124 130.964 14.317 4.718 1.00 0.00 H new ATOM 0 HG1 THR A 124 132.849 14.088 2.545 1.00 0.00 H new ATOM 0 HG21 THR A 124 131.331 11.996 3.946 1.00 0.00 H new ATOM 0 HG22 THR A 124 129.721 12.615 3.509 1.00 0.00 H new ATOM 0 HG23 THR A 124 131.003 12.519 2.277 1.00 0.00 H new ATOM 712 N GLY A 125 131.274 17.033 4.275 1.00 0.00 N ATOM 713 CA GLY A 125 131.934 18.298 4.544 1.00 0.00 C ATOM 714 C GLY A 125 133.150 18.138 5.438 1.00 0.00 C ATOM 715 O GLY A 125 133.604 19.102 6.054 1.00 0.00 O ATOM 0 H GLY A 125 130.855 16.585 5.090 1.00 0.00 H new ATOM 0 HA2 GLY A 125 132.237 18.754 3.602 1.00 0.00 H new ATOM 0 HA3 GLY A 125 131.227 18.980 5.016 1.00 0.00 H new ATOM 719 N GLU A 126 133.676 16.919 5.511 1.00 0.00 N ATOM 720 CA GLU A 126 134.842 16.638 6.340 1.00 0.00 C ATOM 721 C GLU A 126 136.133 16.919 5.580 1.00 0.00 C ATOM 722 O GLU A 126 136.106 17.402 4.447 1.00 0.00 O ATOM 723 CB GLU A 126 134.819 15.180 6.806 1.00 0.00 C ATOM 724 CG GLU A 126 134.065 14.972 8.111 1.00 0.00 C ATOM 725 CD GLU A 126 134.982 14.622 9.267 1.00 0.00 C ATOM 726 OE1 GLU A 126 135.335 13.432 9.406 1.00 0.00 O ATOM 727 OE2 GLU A 126 135.346 15.539 10.033 1.00 0.00 O ATOM 0 H GLU A 126 133.313 16.111 5.006 1.00 0.00 H new ATOM 0 HA GLU A 126 134.805 17.294 7.210 1.00 0.00 H new ATOM 0 HB2 GLU A 126 134.362 14.566 6.030 1.00 0.00 H new ATOM 0 HB3 GLU A 126 135.844 14.830 6.928 1.00 0.00 H new ATOM 0 HG2 GLU A 126 133.510 15.878 8.354 1.00 0.00 H new ATOM 0 HG3 GLU A 126 133.332 14.176 7.980 1.00 0.00 H new ATOM 734 N THR A 127 137.263 16.613 6.208 1.00 0.00 N ATOM 735 CA THR A 127 138.566 16.831 5.591 1.00 0.00 C ATOM 736 C THR A 127 139.321 15.514 5.443 1.00 0.00 C ATOM 737 O THR A 127 139.887 15.001 6.409 1.00 0.00 O ATOM 738 CB THR A 127 139.390 17.814 6.425 1.00 0.00 C ATOM 739 OG1 THR A 127 139.873 17.191 7.603 1.00 0.00 O ATOM 740 CG2 THR A 127 138.613 19.045 6.841 1.00 0.00 C ATOM 0 H THR A 127 137.303 16.213 7.145 1.00 0.00 H new ATOM 0 HA THR A 127 138.407 17.253 4.599 1.00 0.00 H new ATOM 0 HB THR A 127 140.210 18.124 5.778 1.00 0.00 H new ATOM 0 HG1 THR A 127 140.302 16.341 7.371 1.00 0.00 H new ATOM 0 HG21 THR A 127 139.256 19.700 7.429 1.00 0.00 H new ATOM 0 HG22 THR A 127 138.270 19.576 5.953 1.00 0.00 H new ATOM 0 HG23 THR A 127 137.753 18.747 7.441 1.00 0.00 H new ATOM 748 N ILE A 128 139.324 14.972 4.231 1.00 0.00 N ATOM 749 CA ILE A 128 140.009 13.714 3.959 1.00 0.00 C ATOM 750 C ILE A 128 141.222 13.931 3.062 1.00 0.00 C ATOM 751 O ILE A 128 141.169 14.702 2.104 1.00 0.00 O ATOM 752 CB ILE A 128 139.068 12.695 3.289 1.00 0.00 C ATOM 753 CG1 ILE A 128 137.747 12.605 4.056 1.00 0.00 C ATOM 754 CG2 ILE A 128 139.734 11.330 3.209 1.00 0.00 C ATOM 755 CD1 ILE A 128 136.701 13.588 3.574 1.00 0.00 C ATOM 0 H ILE A 128 138.860 15.384 3.421 1.00 0.00 H new ATOM 0 HA ILE A 128 140.336 13.319 4.921 1.00 0.00 H new ATOM 0 HB ILE A 128 138.855 13.033 2.275 1.00 0.00 H new ATOM 0 HG12 ILE A 128 137.352 11.593 3.966 1.00 0.00 H new ATOM 0 HG13 ILE A 128 137.938 12.780 5.115 1.00 0.00 H new ATOM 0 HG21 ILE A 128 139.056 10.622 2.733 1.00 0.00 H new ATOM 0 HG22 ILE A 128 140.650 11.406 2.623 1.00 0.00 H new ATOM 0 HG23 ILE A 128 139.974 10.983 4.214 1.00 0.00 H new ATOM 0 HD11 ILE A 128 135.791 13.468 4.162 1.00 0.00 H new ATOM 0 HD12 ILE A 128 137.077 14.605 3.689 1.00 0.00 H new ATOM 0 HD13 ILE A 128 136.481 13.400 2.523 1.00 0.00 H new ATOM 767 N THR A 129 142.316 13.246 3.378 1.00 0.00 N ATOM 768 CA THR A 129 143.542 13.364 2.598 1.00 0.00 C ATOM 769 C THR A 129 143.556 12.353 1.456 1.00 0.00 C ATOM 770 O THR A 129 142.771 11.405 1.442 1.00 0.00 O ATOM 771 CB THR A 129 144.765 13.155 3.495 1.00 0.00 C ATOM 772 OG1 THR A 129 144.439 13.399 4.851 1.00 0.00 O ATOM 773 CG2 THR A 129 145.931 14.051 3.133 1.00 0.00 C ATOM 0 H THR A 129 142.378 12.604 4.168 1.00 0.00 H new ATOM 0 HA THR A 129 143.580 14.367 2.174 1.00 0.00 H new ATOM 0 HB THR A 129 145.063 12.118 3.342 1.00 0.00 H new ATOM 0 HG1 THR A 129 144.736 12.643 5.400 1.00 0.00 H new ATOM 0 HG21 THR A 129 146.765 13.853 3.806 1.00 0.00 H new ATOM 0 HG22 THR A 129 146.238 13.851 2.106 1.00 0.00 H new ATOM 0 HG23 THR A 129 145.630 15.095 3.225 1.00 0.00 H new ATOM 781 N GLU A 130 144.454 12.563 0.497 1.00 0.00 N ATOM 782 CA GLU A 130 144.568 11.669 -0.650 1.00 0.00 C ATOM 783 C GLU A 130 144.961 10.263 -0.206 1.00 0.00 C ATOM 784 O GLU A 130 144.382 9.275 -0.657 1.00 0.00 O ATOM 785 CB GLU A 130 145.597 12.212 -1.642 1.00 0.00 C ATOM 786 CG GLU A 130 145.200 12.019 -3.097 1.00 0.00 C ATOM 787 CD GLU A 130 146.326 11.451 -3.939 1.00 0.00 C ATOM 788 OE1 GLU A 130 146.842 10.369 -3.588 1.00 0.00 O ATOM 789 OE2 GLU A 130 146.689 12.088 -4.951 1.00 0.00 O ATOM 0 H GLU A 130 145.112 13.343 0.492 1.00 0.00 H new ATOM 0 HA GLU A 130 143.595 11.616 -1.139 1.00 0.00 H new ATOM 0 HB2 GLU A 130 145.746 13.275 -1.453 1.00 0.00 H new ATOM 0 HB3 GLU A 130 146.554 11.720 -1.467 1.00 0.00 H new ATOM 0 HG2 GLU A 130 144.340 11.351 -3.149 1.00 0.00 H new ATOM 0 HG3 GLU A 130 144.887 12.976 -3.514 1.00 0.00 H new ATOM 796 N ASP A 131 145.948 10.182 0.681 1.00 0.00 N ATOM 797 CA ASP A 131 146.417 8.897 1.185 1.00 0.00 C ATOM 798 C ASP A 131 145.380 8.262 2.107 1.00 0.00 C ATOM 799 O ASP A 131 145.280 7.038 2.197 1.00 0.00 O ATOM 800 CB ASP A 131 147.743 9.072 1.932 1.00 0.00 C ATOM 801 CG ASP A 131 148.939 8.684 1.085 1.00 0.00 C ATOM 802 OD1 ASP A 131 149.079 9.230 -0.030 1.00 0.00 O ATOM 803 OD2 ASP A 131 149.735 7.833 1.536 1.00 0.00 O ATOM 0 H ASP A 131 146.438 10.990 1.065 1.00 0.00 H new ATOM 0 HA ASP A 131 146.572 8.235 0.333 1.00 0.00 H new ATOM 0 HB2 ASP A 131 147.845 10.111 2.246 1.00 0.00 H new ATOM 0 HB3 ASP A 131 147.730 8.465 2.837 1.00 0.00 H new ATOM 808 N ASP A 132 144.609 9.104 2.790 1.00 0.00 N ATOM 809 CA ASP A 132 143.579 8.624 3.705 1.00 0.00 C ATOM 810 C ASP A 132 142.517 7.819 2.959 1.00 0.00 C ATOM 811 O ASP A 132 141.917 6.902 3.518 1.00 0.00 O ATOM 812 CB ASP A 132 142.925 9.803 4.430 1.00 0.00 C ATOM 813 CG ASP A 132 143.622 10.135 5.735 1.00 0.00 C ATOM 814 OD1 ASP A 132 143.242 9.558 6.776 1.00 0.00 O ATOM 815 OD2 ASP A 132 144.546 10.976 5.717 1.00 0.00 O ATOM 0 H ASP A 132 144.678 10.120 2.727 1.00 0.00 H new ATOM 0 HA ASP A 132 144.054 7.971 4.437 1.00 0.00 H new ATOM 0 HB2 ASP A 132 142.938 10.678 3.781 1.00 0.00 H new ATOM 0 HB3 ASP A 132 141.879 9.569 4.629 1.00 0.00 H new ATOM 820 N ILE A 133 142.292 8.169 1.698 1.00 0.00 N ATOM 821 CA ILE A 133 141.303 7.480 0.878 1.00 0.00 C ATOM 822 C ILE A 133 141.793 6.097 0.453 1.00 0.00 C ATOM 823 O ILE A 133 141.002 5.248 0.045 1.00 0.00 O ATOM 824 CB ILE A 133 140.953 8.296 -0.382 1.00 0.00 C ATOM 825 CG1 ILE A 133 140.601 9.738 -0.005 1.00 0.00 C ATOM 826 CG2 ILE A 133 139.802 7.646 -1.134 1.00 0.00 C ATOM 827 CD1 ILE A 133 141.073 10.759 -1.018 1.00 0.00 C ATOM 0 H ILE A 133 142.781 8.926 1.221 1.00 0.00 H new ATOM 0 HA ILE A 133 140.411 7.368 1.494 1.00 0.00 H new ATOM 0 HB ILE A 133 141.825 8.313 -1.035 1.00 0.00 H new ATOM 0 HG12 ILE A 133 139.520 9.822 0.107 1.00 0.00 H new ATOM 0 HG13 ILE A 133 141.041 9.970 0.965 1.00 0.00 H new ATOM 0 HG21 ILE A 133 139.568 8.235 -2.021 1.00 0.00 H new ATOM 0 HG22 ILE A 133 140.086 6.637 -1.433 1.00 0.00 H new ATOM 0 HG23 ILE A 133 138.925 7.599 -0.488 1.00 0.00 H new ATOM 0 HD11 ILE A 133 140.790 11.758 -0.687 1.00 0.00 H new ATOM 0 HD12 ILE A 133 142.157 10.702 -1.114 1.00 0.00 H new ATOM 0 HD13 ILE A 133 140.612 10.553 -1.984 1.00 0.00 H new ATOM 839 N GLU A 134 143.102 5.874 0.552 1.00 0.00 N ATOM 840 CA GLU A 134 143.687 4.593 0.177 1.00 0.00 C ATOM 841 C GLU A 134 143.338 3.513 1.197 1.00 0.00 C ATOM 842 O GLU A 134 143.123 2.355 0.840 1.00 0.00 O ATOM 843 CB GLU A 134 145.208 4.722 0.047 1.00 0.00 C ATOM 844 CG GLU A 134 145.709 4.602 -1.383 1.00 0.00 C ATOM 845 CD GLU A 134 146.064 3.177 -1.760 1.00 0.00 C ATOM 846 OE1 GLU A 134 146.917 2.577 -1.071 1.00 0.00 O ATOM 847 OE2 GLU A 134 145.492 2.661 -2.741 1.00 0.00 O ATOM 0 H GLU A 134 143.774 6.563 0.888 1.00 0.00 H new ATOM 0 HA GLU A 134 143.271 4.300 -0.787 1.00 0.00 H new ATOM 0 HB2 GLU A 134 145.518 5.685 0.452 1.00 0.00 H new ATOM 0 HB3 GLU A 134 145.683 3.952 0.655 1.00 0.00 H new ATOM 0 HG2 GLU A 134 144.944 4.974 -2.064 1.00 0.00 H new ATOM 0 HG3 GLU A 134 146.586 5.237 -1.511 1.00 0.00 H new ATOM 854 N GLU A 135 143.283 3.902 2.467 1.00 0.00 N ATOM 855 CA GLU A 135 142.960 2.967 3.540 1.00 0.00 C ATOM 856 C GLU A 135 141.493 2.546 3.480 1.00 0.00 C ATOM 857 O GLU A 135 141.119 1.496 4.002 1.00 0.00 O ATOM 858 CB GLU A 135 143.266 3.594 4.901 1.00 0.00 C ATOM 859 CG GLU A 135 142.411 4.810 5.218 1.00 0.00 C ATOM 860 CD GLU A 135 141.902 4.808 6.647 1.00 0.00 C ATOM 861 OE1 GLU A 135 142.664 5.216 7.547 1.00 0.00 O ATOM 862 OE2 GLU A 135 140.742 4.399 6.863 1.00 0.00 O ATOM 0 H GLU A 135 143.458 4.857 2.778 1.00 0.00 H new ATOM 0 HA GLU A 135 143.578 2.079 3.408 1.00 0.00 H new ATOM 0 HB2 GLU A 135 143.118 2.844 5.678 1.00 0.00 H new ATOM 0 HB3 GLU A 135 144.317 3.882 4.931 1.00 0.00 H new ATOM 0 HG2 GLU A 135 142.994 5.715 5.045 1.00 0.00 H new ATOM 0 HG3 GLU A 135 141.563 4.842 4.534 1.00 0.00 H new ATOM 869 N LEU A 136 140.665 3.369 2.843 1.00 0.00 N ATOM 870 CA LEU A 136 139.243 3.077 2.720 1.00 0.00 C ATOM 871 C LEU A 136 139.018 1.776 1.955 1.00 0.00 C ATOM 872 O LEU A 136 138.324 0.877 2.429 1.00 0.00 O ATOM 873 CB LEU A 136 138.523 4.229 2.013 1.00 0.00 C ATOM 874 CG LEU A 136 137.913 5.279 2.941 1.00 0.00 C ATOM 875 CD1 LEU A 136 138.936 6.351 3.281 1.00 0.00 C ATOM 876 CD2 LEU A 136 136.680 5.899 2.305 1.00 0.00 C ATOM 0 H LEU A 136 140.956 4.243 2.405 1.00 0.00 H new ATOM 0 HA LEU A 136 138.833 2.963 3.724 1.00 0.00 H new ATOM 0 HB2 LEU A 136 139.229 4.723 1.345 1.00 0.00 H new ATOM 0 HB3 LEU A 136 137.731 3.814 1.389 1.00 0.00 H new ATOM 0 HG LEU A 136 137.612 4.787 3.866 1.00 0.00 H new ATOM 0 HD11 LEU A 136 138.483 7.089 3.942 1.00 0.00 H new ATOM 0 HD12 LEU A 136 139.791 5.893 3.779 1.00 0.00 H new ATOM 0 HD13 LEU A 136 139.269 6.840 2.365 1.00 0.00 H new ATOM 0 HD21 LEU A 136 136.258 6.644 2.979 1.00 0.00 H new ATOM 0 HD22 LEU A 136 136.956 6.376 1.365 1.00 0.00 H new ATOM 0 HD23 LEU A 136 135.939 5.122 2.114 1.00 0.00 H new ATOM 888 N MET A 137 139.610 1.684 0.769 1.00 0.00 N ATOM 889 CA MET A 137 139.474 0.493 -0.065 1.00 0.00 C ATOM 890 C MET A 137 140.181 -0.705 0.567 1.00 0.00 C ATOM 891 O MET A 137 139.815 -1.852 0.315 1.00 0.00 O ATOM 892 CB MET A 137 140.043 0.757 -1.460 1.00 0.00 C ATOM 893 CG MET A 137 138.986 1.135 -2.486 1.00 0.00 C ATOM 894 SD MET A 137 138.220 -0.302 -3.257 1.00 0.00 S ATOM 895 CE MET A 137 136.598 0.346 -3.646 1.00 0.00 C ATOM 0 H MET A 137 140.189 2.419 0.363 1.00 0.00 H new ATOM 0 HA MET A 137 138.413 0.260 -0.148 1.00 0.00 H new ATOM 0 HB2 MET A 137 140.780 1.558 -1.397 1.00 0.00 H new ATOM 0 HB3 MET A 137 140.569 -0.134 -1.804 1.00 0.00 H new ATOM 0 HG2 MET A 137 138.216 1.737 -2.003 1.00 0.00 H new ATOM 0 HG3 MET A 137 139.440 1.757 -3.257 1.00 0.00 H new ATOM 0 HE1 MET A 137 135.991 -0.439 -4.097 1.00 0.00 H new ATOM 0 HE2 MET A 137 136.117 0.696 -2.732 1.00 0.00 H new ATOM 0 HE3 MET A 137 136.696 1.176 -4.345 1.00 0.00 H new ATOM 905 N LYS A 138 141.193 -0.433 1.385 1.00 0.00 N ATOM 906 CA LYS A 138 141.948 -1.493 2.046 1.00 0.00 C ATOM 907 C LYS A 138 141.017 -2.466 2.767 1.00 0.00 C ATOM 908 O LYS A 138 140.795 -3.583 2.304 1.00 0.00 O ATOM 909 CB LYS A 138 142.950 -0.892 3.038 1.00 0.00 C ATOM 910 CG LYS A 138 144.390 -0.953 2.558 1.00 0.00 C ATOM 911 CD LYS A 138 145.365 -0.959 3.722 1.00 0.00 C ATOM 912 CE LYS A 138 146.676 -0.281 3.356 1.00 0.00 C ATOM 913 NZ LYS A 138 147.851 -1.002 3.918 1.00 0.00 N ATOM 0 H LYS A 138 141.509 0.511 1.606 1.00 0.00 H new ATOM 0 HA LYS A 138 142.492 -2.046 1.280 1.00 0.00 H new ATOM 0 HB2 LYS A 138 142.682 0.148 3.227 1.00 0.00 H new ATOM 0 HB3 LYS A 138 142.870 -1.420 3.988 1.00 0.00 H new ATOM 0 HG2 LYS A 138 144.536 -1.849 1.955 1.00 0.00 H new ATOM 0 HG3 LYS A 138 144.596 -0.098 1.914 1.00 0.00 H new ATOM 0 HD2 LYS A 138 144.917 -0.450 4.575 1.00 0.00 H new ATOM 0 HD3 LYS A 138 145.559 -1.986 4.030 1.00 0.00 H new ATOM 0 HE2 LYS A 138 146.767 -0.229 2.271 1.00 0.00 H new ATOM 0 HE3 LYS A 138 146.669 0.745 3.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 148.724 -0.508 3.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 147.778 -1.030 4.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 147.873 -1.973 3.546 1.00 0.00 H new ATOM 927 N ASP A 139 140.478 -2.034 3.904 1.00 0.00 N ATOM 928 CA ASP A 139 139.575 -2.869 4.685 1.00 0.00 C ATOM 929 C ASP A 139 138.351 -3.279 3.866 1.00 0.00 C ATOM 930 O ASP A 139 137.822 -4.377 4.033 1.00 0.00 O ATOM 931 CB ASP A 139 139.153 -2.138 5.966 1.00 0.00 C ATOM 932 CG ASP A 139 138.186 -0.997 5.707 1.00 0.00 C ATOM 933 OD1 ASP A 139 138.197 -0.449 4.585 1.00 0.00 O ATOM 934 OD2 ASP A 139 137.423 -0.647 6.632 1.00 0.00 O ATOM 0 H ASP A 139 140.652 -1.112 4.303 1.00 0.00 H new ATOM 0 HA ASP A 139 140.106 -3.780 4.961 1.00 0.00 H new ATOM 0 HB2 ASP A 139 138.691 -2.851 6.649 1.00 0.00 H new ATOM 0 HB3 ASP A 139 140.041 -1.749 6.465 1.00 0.00 H new ATOM 939 N GLY A 140 137.908 -2.392 2.981 1.00 0.00 N ATOM 940 CA GLY A 140 136.754 -2.686 2.151 1.00 0.00 C ATOM 941 C GLY A 140 137.038 -3.760 1.117 1.00 0.00 C ATOM 942 O GLY A 140 136.116 -4.365 0.570 1.00 0.00 O ATOM 0 H GLY A 140 138.327 -1.475 2.824 1.00 0.00 H new ATOM 0 HA2 GLY A 140 135.927 -3.007 2.785 1.00 0.00 H new ATOM 0 HA3 GLY A 140 136.433 -1.775 1.645 1.00 0.00 H new ATOM 946 N ASP A 141 138.319 -4.001 0.850 1.00 0.00 N ATOM 947 CA ASP A 141 138.720 -5.011 -0.123 1.00 0.00 C ATOM 948 C ASP A 141 139.099 -6.314 0.572 1.00 0.00 C ATOM 949 O ASP A 141 140.035 -6.355 1.370 1.00 0.00 O ATOM 950 CB ASP A 141 139.894 -4.506 -0.965 1.00 0.00 C ATOM 951 CG ASP A 141 140.041 -5.268 -2.267 1.00 0.00 C ATOM 952 OD1 ASP A 141 139.430 -6.349 -2.396 1.00 0.00 O ATOM 953 OD2 ASP A 141 140.769 -4.782 -3.161 1.00 0.00 O ATOM 0 H ASP A 141 139.096 -3.511 1.294 1.00 0.00 H new ATOM 0 HA ASP A 141 137.871 -5.203 -0.779 1.00 0.00 H new ATOM 0 HB2 ASP A 141 139.754 -3.447 -1.181 1.00 0.00 H new ATOM 0 HB3 ASP A 141 140.815 -4.595 -0.389 1.00 0.00 H new ATOM 958 N LYS A 142 138.364 -7.378 0.264 1.00 0.00 N ATOM 959 CA LYS A 142 138.621 -8.685 0.860 1.00 0.00 C ATOM 960 C LYS A 142 139.433 -9.570 -0.082 1.00 0.00 C ATOM 961 O LYS A 142 140.102 -10.506 0.356 1.00 0.00 O ATOM 962 CB LYS A 142 137.302 -9.373 1.215 1.00 0.00 C ATOM 963 CG LYS A 142 136.404 -8.542 2.114 1.00 0.00 C ATOM 964 CD LYS A 142 136.836 -8.627 3.568 1.00 0.00 C ATOM 965 CE LYS A 142 136.639 -10.027 4.127 1.00 0.00 C ATOM 966 NZ LYS A 142 136.158 -10.000 5.537 1.00 0.00 N ATOM 0 H LYS A 142 137.586 -7.361 -0.395 1.00 0.00 H new ATOM 0 HA LYS A 142 139.202 -8.531 1.770 1.00 0.00 H new ATOM 0 HB2 LYS A 142 136.765 -9.607 0.296 1.00 0.00 H new ATOM 0 HB3 LYS A 142 137.518 -10.321 1.708 1.00 0.00 H new ATOM 0 HG2 LYS A 142 136.424 -7.502 1.788 1.00 0.00 H new ATOM 0 HG3 LYS A 142 135.374 -8.886 2.019 1.00 0.00 H new ATOM 0 HD2 LYS A 142 137.885 -8.344 3.654 1.00 0.00 H new ATOM 0 HD3 LYS A 142 136.264 -7.914 4.161 1.00 0.00 H new ATOM 0 HE2 LYS A 142 135.922 -10.567 3.509 1.00 0.00 H new ATOM 0 HE3 LYS A 142 137.580 -10.574 4.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 136.036 -10.974 5.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 136.854 -9.507 6.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 135.247 -9.500 5.584 1.00 0.00 H new ATOM 980 N ASN A 143 139.372 -9.270 -1.377 1.00 0.00 N ATOM 981 CA ASN A 143 140.105 -10.043 -2.374 1.00 0.00 C ATOM 982 C ASN A 143 141.254 -9.233 -2.973 1.00 0.00 C ATOM 983 O ASN A 143 141.978 -9.719 -3.843 1.00 0.00 O ATOM 984 CB ASN A 143 139.160 -10.504 -3.485 1.00 0.00 C ATOM 985 CG ASN A 143 138.358 -9.361 -4.077 1.00 0.00 C ATOM 986 OD1 ASN A 143 138.314 -8.265 -3.520 1.00 0.00 O ATOM 987 ND2 ASN A 143 137.718 -9.613 -5.213 1.00 0.00 N ATOM 0 H ASN A 143 138.824 -8.499 -1.759 1.00 0.00 H new ATOM 0 HA ASN A 143 140.528 -10.914 -1.874 1.00 0.00 H new ATOM 0 HB2 ASN A 143 139.739 -10.984 -4.274 1.00 0.00 H new ATOM 0 HB3 ASN A 143 138.477 -11.255 -3.088 1.00 0.00 H new ATOM 0 HD21 ASN A 143 137.162 -8.883 -5.658 1.00 0.00 H new ATOM 0 HD22 ASN A 143 137.782 -10.537 -5.640 1.00 0.00 H new ATOM 994 N ASN A 144 141.419 -7.997 -2.507 1.00 0.00 N ATOM 995 CA ASN A 144 142.482 -7.130 -3.000 1.00 0.00 C ATOM 996 C ASN A 144 142.352 -6.909 -4.505 1.00 0.00 C ATOM 997 O ASN A 144 143.350 -6.860 -5.224 1.00 0.00 O ATOM 998 CB ASN A 144 143.851 -7.733 -2.675 1.00 0.00 C ATOM 999 CG ASN A 144 144.426 -7.194 -1.379 1.00 0.00 C ATOM 1000 OD1 ASN A 144 143.727 -7.094 -0.370 1.00 0.00 O ATOM 1001 ND2 ASN A 144 145.707 -6.845 -1.399 1.00 0.00 N ATOM 0 H ASN A 144 140.830 -7.575 -1.789 1.00 0.00 H new ATOM 0 HA ASN A 144 142.391 -6.165 -2.502 1.00 0.00 H new ATOM 0 HB2 ASN A 144 143.761 -8.817 -2.606 1.00 0.00 H new ATOM 0 HB3 ASN A 144 144.541 -7.522 -3.492 1.00 0.00 H new ATOM 0 HD21 ASN A 144 146.149 -6.477 -0.556 1.00 0.00 H new ATOM 0 HD22 ASN A 144 146.249 -6.945 -2.257 1.00 0.00 H new ATOM 1008 N ASP A 145 141.116 -6.776 -4.976 1.00 0.00 N ATOM 1009 CA ASP A 145 140.860 -6.560 -6.397 1.00 0.00 C ATOM 1010 C ASP A 145 140.787 -5.070 -6.730 1.00 0.00 C ATOM 1011 O ASP A 145 140.324 -4.689 -7.806 1.00 0.00 O ATOM 1012 CB ASP A 145 139.562 -7.255 -6.810 1.00 0.00 C ATOM 1013 CG ASP A 145 138.355 -6.727 -6.057 1.00 0.00 C ATOM 1014 OD1 ASP A 145 138.543 -5.918 -5.125 1.00 0.00 O ATOM 1015 OD2 ASP A 145 137.222 -7.123 -6.402 1.00 0.00 O ATOM 0 H ASP A 145 140.277 -6.814 -4.397 1.00 0.00 H new ATOM 0 HA ASP A 145 141.691 -6.989 -6.956 1.00 0.00 H new ATOM 0 HB2 ASP A 145 139.406 -7.120 -7.880 1.00 0.00 H new ATOM 0 HB3 ASP A 145 139.656 -8.327 -6.634 1.00 0.00 H new ATOM 1020 N GLY A 146 141.256 -4.232 -5.809 1.00 0.00 N ATOM 1021 CA GLY A 146 141.243 -2.796 -6.031 1.00 0.00 C ATOM 1022 C GLY A 146 139.844 -2.223 -6.172 1.00 0.00 C ATOM 1023 O GLY A 146 139.678 -1.093 -6.631 1.00 0.00 O ATOM 0 H GLY A 146 141.645 -4.522 -4.912 1.00 0.00 H new ATOM 0 HA2 GLY A 146 141.748 -2.302 -5.201 1.00 0.00 H new ATOM 0 HA3 GLY A 146 141.814 -2.569 -6.932 1.00 0.00 H new ATOM 1027 N ARG A 147 138.835 -2.994 -5.777 1.00 0.00 N ATOM 1028 CA ARG A 147 137.452 -2.539 -5.866 1.00 0.00 C ATOM 1029 C ARG A 147 136.574 -3.237 -4.832 1.00 0.00 C ATOM 1030 O ARG A 147 137.048 -4.063 -4.053 1.00 0.00 O ATOM 1031 CB ARG A 147 136.894 -2.779 -7.272 1.00 0.00 C ATOM 1032 CG ARG A 147 137.417 -4.043 -7.936 1.00 0.00 C ATOM 1033 CD ARG A 147 136.281 -4.930 -8.425 1.00 0.00 C ATOM 1034 NE ARG A 147 136.616 -5.609 -9.674 1.00 0.00 N ATOM 1035 CZ ARG A 147 136.562 -5.027 -10.871 1.00 0.00 C ATOM 1036 NH1 ARG A 147 136.188 -3.759 -10.985 1.00 0.00 N ATOM 1037 NH2 ARG A 147 136.882 -5.716 -11.958 1.00 0.00 N ATOM 0 H ARG A 147 138.948 -3.932 -5.394 1.00 0.00 H new ATOM 0 HA ARG A 147 137.442 -1.469 -5.659 1.00 0.00 H new ATOM 0 HB2 ARG A 147 135.807 -2.833 -7.216 1.00 0.00 H new ATOM 0 HB3 ARG A 147 137.139 -1.923 -7.900 1.00 0.00 H new ATOM 0 HG2 ARG A 147 138.058 -3.775 -8.776 1.00 0.00 H new ATOM 0 HG3 ARG A 147 138.034 -4.598 -7.229 1.00 0.00 H new ATOM 0 HD2 ARG A 147 136.045 -5.671 -7.661 1.00 0.00 H new ATOM 0 HD3 ARG A 147 135.386 -4.326 -8.570 1.00 0.00 H new ATOM 0 HE ARG A 147 136.908 -6.585 -9.627 1.00 0.00 H new ATOM 0 HH11 ARG A 147 135.940 -3.224 -10.153 1.00 0.00 H new ATOM 0 HH12 ARG A 147 136.149 -3.320 -11.905 1.00 0.00 H new ATOM 0 HH21 ARG A 147 137.169 -6.691 -11.877 1.00 0.00 H new ATOM 0 HH22 ARG A 147 136.841 -5.271 -12.875 1.00 0.00 H new ATOM 1051 N ILE A 148 135.288 -2.897 -4.835 1.00 0.00 N ATOM 1052 CA ILE A 148 134.337 -3.489 -3.901 1.00 0.00 C ATOM 1053 C ILE A 148 132.982 -3.712 -4.566 1.00 0.00 C ATOM 1054 O ILE A 148 132.605 -2.989 -5.488 1.00 0.00 O ATOM 1055 CB ILE A 148 134.148 -2.600 -2.654 1.00 0.00 C ATOM 1056 CG1 ILE A 148 135.496 -2.333 -1.981 1.00 0.00 C ATOM 1057 CG2 ILE A 148 133.181 -3.250 -1.673 1.00 0.00 C ATOM 1058 CD1 ILE A 148 135.424 -1.314 -0.865 1.00 0.00 C ATOM 0 H ILE A 148 134.881 -2.214 -5.474 1.00 0.00 H new ATOM 0 HA ILE A 148 134.749 -4.450 -3.593 1.00 0.00 H new ATOM 0 HB ILE A 148 133.724 -1.647 -2.971 1.00 0.00 H new ATOM 0 HG12 ILE A 148 135.885 -3.270 -1.582 1.00 0.00 H new ATOM 0 HG13 ILE A 148 136.206 -1.987 -2.732 1.00 0.00 H new ATOM 0 HG21 ILE A 148 133.061 -2.608 -0.801 1.00 0.00 H new ATOM 0 HG22 ILE A 148 132.214 -3.391 -2.155 1.00 0.00 H new ATOM 0 HG23 ILE A 148 133.575 -4.217 -1.360 1.00 0.00 H new ATOM 0 HD11 ILE A 148 136.416 -1.175 -0.434 1.00 0.00 H new ATOM 0 HD12 ILE A 148 135.065 -0.364 -1.262 1.00 0.00 H new ATOM 0 HD13 ILE A 148 134.740 -1.667 -0.094 1.00 0.00 H new ATOM 1070 N ASP A 149 132.254 -4.718 -4.091 1.00 0.00 N ATOM 1071 CA ASP A 149 130.941 -5.037 -4.638 1.00 0.00 C ATOM 1072 C ASP A 149 129.986 -5.486 -3.535 1.00 0.00 C ATOM 1073 O ASP A 149 130.345 -5.498 -2.357 1.00 0.00 O ATOM 1074 CB ASP A 149 131.059 -6.128 -5.704 1.00 0.00 C ATOM 1075 CG ASP A 149 131.749 -7.372 -5.182 1.00 0.00 C ATOM 1076 OD1 ASP A 149 131.309 -7.901 -4.140 1.00 0.00 O ATOM 1077 OD2 ASP A 149 132.727 -7.819 -5.816 1.00 0.00 O ATOM 0 H ASP A 149 132.552 -5.326 -3.328 1.00 0.00 H new ATOM 0 HA ASP A 149 130.538 -4.134 -5.097 1.00 0.00 H new ATOM 0 HB2 ASP A 149 130.064 -6.391 -6.063 1.00 0.00 H new ATOM 0 HB3 ASP A 149 131.613 -5.739 -6.558 1.00 0.00 H new ATOM 1082 N TYR A 150 128.768 -5.850 -3.924 1.00 0.00 N ATOM 1083 CA TYR A 150 127.761 -6.296 -2.968 1.00 0.00 C ATOM 1084 C TYR A 150 128.215 -7.554 -2.233 1.00 0.00 C ATOM 1085 O TYR A 150 127.785 -7.817 -1.111 1.00 0.00 O ATOM 1086 CB TYR A 150 126.432 -6.560 -3.679 1.00 0.00 C ATOM 1087 CG TYR A 150 125.300 -6.906 -2.737 1.00 0.00 C ATOM 1088 CD1 TYR A 150 124.792 -5.959 -1.855 1.00 0.00 C ATOM 1089 CD2 TYR A 150 124.741 -8.177 -2.728 1.00 0.00 C ATOM 1090 CE1 TYR A 150 123.760 -6.270 -0.991 1.00 0.00 C ATOM 1091 CE2 TYR A 150 123.707 -8.496 -1.868 1.00 0.00 C ATOM 1092 CZ TYR A 150 123.220 -7.540 -1.002 1.00 0.00 C ATOM 1093 OH TYR A 150 122.192 -7.853 -0.143 1.00 0.00 O ATOM 0 H TYR A 150 128.455 -5.845 -4.895 1.00 0.00 H new ATOM 0 HA TYR A 150 127.624 -5.502 -2.234 1.00 0.00 H new ATOM 0 HB2 TYR A 150 126.157 -5.677 -4.256 1.00 0.00 H new ATOM 0 HB3 TYR A 150 126.565 -7.376 -4.389 1.00 0.00 H new ATOM 0 HD1 TYR A 150 125.211 -4.964 -1.845 1.00 0.00 H new ATOM 0 HD2 TYR A 150 125.120 -8.929 -3.404 1.00 0.00 H new ATOM 0 HE1 TYR A 150 123.378 -5.523 -0.311 1.00 0.00 H new ATOM 0 HE2 TYR A 150 123.283 -9.489 -1.874 1.00 0.00 H new ATOM 0 HH TYR A 150 121.925 -8.786 -0.278 1.00 0.00 H new ATOM 1103 N ASP A 151 129.086 -8.330 -2.871 1.00 0.00 N ATOM 1104 CA ASP A 151 129.593 -9.560 -2.270 1.00 0.00 C ATOM 1105 C ASP A 151 130.668 -9.254 -1.232 1.00 0.00 C ATOM 1106 O ASP A 151 130.606 -9.732 -0.100 1.00 0.00 O ATOM 1107 CB ASP A 151 130.158 -10.487 -3.349 1.00 0.00 C ATOM 1108 CG ASP A 151 129.207 -10.664 -4.515 1.00 0.00 C ATOM 1109 OD1 ASP A 151 129.187 -9.786 -5.403 1.00 0.00 O ATOM 1110 OD2 ASP A 151 128.482 -11.682 -4.542 1.00 0.00 O ATOM 0 H ASP A 151 129.455 -8.130 -3.801 1.00 0.00 H new ATOM 0 HA ASP A 151 128.763 -10.060 -1.772 1.00 0.00 H new ATOM 0 HB2 ASP A 151 131.103 -10.083 -3.713 1.00 0.00 H new ATOM 0 HB3 ASP A 151 130.375 -11.461 -2.910 1.00 0.00 H new ATOM 1115 N GLU A 152 131.652 -8.452 -1.627 1.00 0.00 N ATOM 1116 CA GLU A 152 132.742 -8.081 -0.732 1.00 0.00 C ATOM 1117 C GLU A 152 132.250 -7.144 0.367 1.00 0.00 C ATOM 1118 O GLU A 152 132.816 -7.104 1.460 1.00 0.00 O ATOM 1119 CB GLU A 152 133.871 -7.416 -1.519 1.00 0.00 C ATOM 1120 CG GLU A 152 134.343 -8.228 -2.714 1.00 0.00 C ATOM 1121 CD GLU A 152 135.340 -9.305 -2.330 1.00 0.00 C ATOM 1122 OE1 GLU A 152 136.427 -8.953 -1.824 1.00 0.00 O ATOM 1123 OE2 GLU A 152 135.034 -10.498 -2.536 1.00 0.00 O ATOM 0 H GLU A 152 131.717 -8.047 -2.561 1.00 0.00 H new ATOM 0 HA GLU A 152 133.121 -8.990 -0.265 1.00 0.00 H new ATOM 0 HB2 GLU A 152 133.534 -6.439 -1.865 1.00 0.00 H new ATOM 0 HB3 GLU A 152 134.715 -7.244 -0.851 1.00 0.00 H new ATOM 0 HG2 GLU A 152 133.482 -8.690 -3.197 1.00 0.00 H new ATOM 0 HG3 GLU A 152 134.799 -7.560 -3.445 1.00 0.00 H new ATOM 1130 N PHE A 153 131.194 -6.391 0.072 1.00 0.00 N ATOM 1131 CA PHE A 153 130.630 -5.456 1.038 1.00 0.00 C ATOM 1132 C PHE A 153 129.890 -6.199 2.145 1.00 0.00 C ATOM 1133 O PHE A 153 129.884 -5.771 3.299 1.00 0.00 O ATOM 1134 CB PHE A 153 129.681 -4.480 0.339 1.00 0.00 C ATOM 1135 CG PHE A 153 129.093 -3.450 1.263 1.00 0.00 C ATOM 1136 CD1 PHE A 153 129.900 -2.743 2.139 1.00 0.00 C ATOM 1137 CD2 PHE A 153 127.731 -3.190 1.255 1.00 0.00 C ATOM 1138 CE1 PHE A 153 129.362 -1.797 2.989 1.00 0.00 C ATOM 1139 CE2 PHE A 153 127.186 -2.244 2.103 1.00 0.00 C ATOM 1140 CZ PHE A 153 128.003 -1.546 2.971 1.00 0.00 C ATOM 0 H PHE A 153 130.713 -6.411 -0.827 1.00 0.00 H new ATOM 0 HA PHE A 153 131.450 -4.896 1.487 1.00 0.00 H new ATOM 0 HB2 PHE A 153 130.219 -3.973 -0.462 1.00 0.00 H new ATOM 0 HB3 PHE A 153 128.872 -5.043 -0.127 1.00 0.00 H new ATOM 0 HD1 PHE A 153 130.963 -2.934 2.157 1.00 0.00 H new ATOM 0 HD2 PHE A 153 127.088 -3.733 0.578 1.00 0.00 H new ATOM 0 HE1 PHE A 153 130.003 -1.254 3.668 1.00 0.00 H new ATOM 0 HE2 PHE A 153 126.123 -2.051 2.087 1.00 0.00 H new ATOM 0 HZ PHE A 153 127.581 -0.806 3.634 1.00 0.00 H new ATOM 1150 N LEU A 154 129.263 -7.316 1.785 1.00 0.00 N ATOM 1151 CA LEU A 154 128.519 -8.120 2.746 1.00 0.00 C ATOM 1152 C LEU A 154 129.443 -8.666 3.830 1.00 0.00 C ATOM 1153 O LEU A 154 129.036 -8.836 4.979 1.00 0.00 O ATOM 1154 CB LEU A 154 127.806 -9.273 2.033 1.00 0.00 C ATOM 1155 CG LEU A 154 126.290 -9.114 1.902 1.00 0.00 C ATOM 1156 CD1 LEU A 154 125.632 -9.131 3.274 1.00 0.00 C ATOM 1157 CD2 LEU A 154 125.951 -7.828 1.163 1.00 0.00 C ATOM 0 H LEU A 154 129.256 -7.684 0.834 1.00 0.00 H new ATOM 0 HA LEU A 154 127.774 -7.481 3.220 1.00 0.00 H new ATOM 0 HB2 LEU A 154 128.232 -9.382 1.036 1.00 0.00 H new ATOM 0 HB3 LEU A 154 128.014 -10.197 2.572 1.00 0.00 H new ATOM 0 HG LEU A 154 125.904 -9.954 1.325 1.00 0.00 H new ATOM 0 HD11 LEU A 154 124.554 -9.017 3.162 1.00 0.00 H new ATOM 0 HD12 LEU A 154 125.847 -10.078 3.769 1.00 0.00 H new ATOM 0 HD13 LEU A 154 126.023 -8.310 3.875 1.00 0.00 H new ATOM 0 HD21 LEU A 154 124.869 -7.731 1.079 1.00 0.00 H new ATOM 0 HD22 LEU A 154 126.350 -6.976 1.714 1.00 0.00 H new ATOM 0 HD23 LEU A 154 126.391 -7.854 0.166 1.00 0.00 H new ATOM 1169 N GLU A 155 130.691 -8.939 3.456 1.00 0.00 N ATOM 1170 CA GLU A 155 131.673 -9.464 4.398 1.00 0.00 C ATOM 1171 C GLU A 155 132.376 -8.330 5.134 1.00 0.00 C ATOM 1172 O GLU A 155 132.739 -8.464 6.303 1.00 0.00 O ATOM 1173 CB GLU A 155 132.700 -10.330 3.667 1.00 0.00 C ATOM 1174 CG GLU A 155 132.184 -11.714 3.309 1.00 0.00 C ATOM 1175 CD GLU A 155 133.259 -12.778 3.392 1.00 0.00 C ATOM 1176 OE1 GLU A 155 133.566 -13.224 4.517 1.00 0.00 O ATOM 1177 OE2 GLU A 155 133.795 -13.164 2.331 1.00 0.00 O ATOM 0 H GLU A 155 131.044 -8.805 2.509 1.00 0.00 H new ATOM 0 HA GLU A 155 131.148 -10.078 5.130 1.00 0.00 H new ATOM 0 HB2 GLU A 155 133.010 -9.820 2.755 1.00 0.00 H new ATOM 0 HB3 GLU A 155 133.587 -10.433 4.292 1.00 0.00 H new ATOM 0 HG2 GLU A 155 131.366 -11.977 3.979 1.00 0.00 H new ATOM 0 HG3 GLU A 155 131.775 -11.695 2.299 1.00 0.00 H new ATOM 1184 N PHE A 156 132.563 -7.210 4.444 1.00 0.00 N ATOM 1185 CA PHE A 156 133.219 -6.049 5.034 1.00 0.00 C ATOM 1186 C PHE A 156 132.339 -5.423 6.112 1.00 0.00 C ATOM 1187 O PHE A 156 132.839 -4.774 7.031 1.00 0.00 O ATOM 1188 CB PHE A 156 133.544 -5.019 3.947 1.00 0.00 C ATOM 1189 CG PHE A 156 134.065 -3.712 4.482 1.00 0.00 C ATOM 1190 CD1 PHE A 156 134.999 -3.691 5.504 1.00 0.00 C ATOM 1191 CD2 PHE A 156 133.613 -2.510 3.964 1.00 0.00 C ATOM 1192 CE1 PHE A 156 135.476 -2.491 5.998 1.00 0.00 C ATOM 1193 CE2 PHE A 156 134.086 -1.308 4.454 1.00 0.00 C ATOM 1194 CZ PHE A 156 135.018 -1.299 5.473 1.00 0.00 C ATOM 0 H PHE A 156 132.270 -7.082 3.476 1.00 0.00 H new ATOM 0 HA PHE A 156 134.149 -6.376 5.499 1.00 0.00 H new ATOM 0 HB2 PHE A 156 134.284 -5.443 3.268 1.00 0.00 H new ATOM 0 HB3 PHE A 156 132.645 -4.828 3.361 1.00 0.00 H new ATOM 0 HD1 PHE A 156 135.358 -4.621 5.919 1.00 0.00 H new ATOM 0 HD2 PHE A 156 132.883 -2.512 3.168 1.00 0.00 H new ATOM 0 HE1 PHE A 156 136.206 -2.486 6.794 1.00 0.00 H new ATOM 0 HE2 PHE A 156 133.727 -0.377 4.041 1.00 0.00 H new ATOM 0 HZ PHE A 156 135.388 -0.361 5.859 1.00 0.00 H new ATOM 1204 N MET A 157 131.031 -5.621 5.996 1.00 0.00 N ATOM 1205 CA MET A 157 130.088 -5.077 6.967 1.00 0.00 C ATOM 1206 C MET A 157 129.809 -6.079 8.086 1.00 0.00 C ATOM 1207 O MET A 157 128.925 -5.862 8.916 1.00 0.00 O ATOM 1208 CB MET A 157 128.781 -4.692 6.275 1.00 0.00 C ATOM 1209 CG MET A 157 128.766 -3.265 5.751 1.00 0.00 C ATOM 1210 SD MET A 157 127.939 -2.121 6.874 1.00 0.00 S ATOM 1211 CE MET A 157 129.321 -1.560 7.864 1.00 0.00 C ATOM 0 H MET A 157 130.599 -6.153 5.241 1.00 0.00 H new ATOM 0 HA MET A 157 130.536 -4.187 7.409 1.00 0.00 H new ATOM 0 HB2 MET A 157 128.604 -5.376 5.445 1.00 0.00 H new ATOM 0 HB3 MET A 157 127.957 -4.821 6.976 1.00 0.00 H new ATOM 0 HG2 MET A 157 129.791 -2.931 5.588 1.00 0.00 H new ATOM 0 HG3 MET A 157 128.266 -3.243 4.783 1.00 0.00 H new ATOM 0 HE1 MET A 157 129.022 -0.687 8.444 1.00 0.00 H new ATOM 0 HE2 MET A 157 129.631 -2.357 8.540 1.00 0.00 H new ATOM 0 HE3 MET A 157 130.152 -1.294 7.211 1.00 0.00 H new ATOM 1221 N LYS A 158 130.562 -7.178 8.108 1.00 0.00 N ATOM 1222 CA LYS A 158 130.388 -8.206 9.128 1.00 0.00 C ATOM 1223 C LYS A 158 131.283 -7.938 10.335 1.00 0.00 C ATOM 1224 O LYS A 158 131.900 -8.855 10.879 1.00 0.00 O ATOM 1225 CB LYS A 158 130.692 -9.588 8.548 1.00 0.00 C ATOM 1226 CG LYS A 158 129.496 -10.241 7.875 1.00 0.00 C ATOM 1227 CD LYS A 158 129.859 -11.595 7.286 1.00 0.00 C ATOM 1228 CE LYS A 158 128.619 -12.407 6.953 1.00 0.00 C ATOM 1229 NZ LYS A 158 128.889 -13.429 5.905 1.00 0.00 N ATOM 0 H LYS A 158 131.298 -7.377 7.430 1.00 0.00 H new ATOM 0 HA LYS A 158 129.350 -8.179 9.458 1.00 0.00 H new ATOM 0 HB2 LYS A 158 131.502 -9.499 7.824 1.00 0.00 H new ATOM 0 HB3 LYS A 158 131.049 -10.238 9.347 1.00 0.00 H new ATOM 0 HG2 LYS A 158 128.691 -10.362 8.600 1.00 0.00 H new ATOM 0 HG3 LYS A 158 129.120 -9.589 7.087 1.00 0.00 H new ATOM 0 HD2 LYS A 158 130.455 -11.453 6.385 1.00 0.00 H new ATOM 0 HD3 LYS A 158 130.478 -12.147 7.994 1.00 0.00 H new ATOM 0 HE2 LYS A 158 128.255 -12.899 7.855 1.00 0.00 H new ATOM 0 HE3 LYS A 158 127.828 -11.739 6.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 128.018 -13.961 5.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 129.212 -12.958 5.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 129.626 -14.083 6.239 1.00 0.00 H new ATOM 1243 N GLY A 159 131.350 -6.678 10.749 1.00 0.00 N ATOM 1244 CA GLY A 159 132.172 -6.312 11.887 1.00 0.00 C ATOM 1245 C GLY A 159 133.452 -5.612 11.475 1.00 0.00 C ATOM 1246 O GLY A 159 134.477 -6.256 11.257 1.00 0.00 O ATOM 0 H GLY A 159 130.849 -5.902 10.316 1.00 0.00 H new ATOM 0 HA2 GLY A 159 131.602 -5.660 12.549 1.00 0.00 H new ATOM 0 HA3 GLY A 159 132.418 -7.208 12.457 1.00 0.00 H new ATOM 1250 N VAL A 160 133.387 -4.290 11.364 1.00 0.00 N ATOM 1251 CA VAL A 160 134.546 -3.499 10.971 1.00 0.00 C ATOM 1252 C VAL A 160 135.182 -2.821 12.179 1.00 0.00 C ATOM 1253 O VAL A 160 136.338 -3.084 12.514 1.00 0.00 O ATOM 1254 CB VAL A 160 134.173 -2.420 9.932 1.00 0.00 C ATOM 1255 CG1 VAL A 160 135.389 -2.035 9.103 1.00 0.00 C ATOM 1256 CG2 VAL A 160 133.040 -2.899 9.033 1.00 0.00 C ATOM 0 H VAL A 160 132.544 -3.744 11.541 1.00 0.00 H new ATOM 0 HA VAL A 160 135.259 -4.191 10.523 1.00 0.00 H new ATOM 0 HB VAL A 160 133.827 -1.537 10.469 1.00 0.00 H new ATOM 0 HG11 VAL A 160 135.107 -1.273 8.376 1.00 0.00 H new ATOM 0 HG12 VAL A 160 136.166 -1.641 9.758 1.00 0.00 H new ATOM 0 HG13 VAL A 160 135.766 -2.914 8.580 1.00 0.00 H new ATOM 0 HG21 VAL A 160 132.796 -2.121 8.310 1.00 0.00 H new ATOM 0 HG22 VAL A 160 133.351 -3.801 8.505 1.00 0.00 H new ATOM 0 HG23 VAL A 160 132.162 -3.119 9.640 1.00 0.00 H new ATOM 1266 N GLU A 161 134.420 -1.950 12.831 1.00 0.00 N ATOM 1267 CA GLU A 161 134.908 -1.234 14.004 1.00 0.00 C ATOM 1268 C GLU A 161 134.712 -2.066 15.269 1.00 0.00 C ATOM 1269 O GLU A 161 135.611 -2.167 16.102 1.00 0.00 O ATOM 1270 CB GLU A 161 134.187 0.108 14.145 1.00 0.00 C ATOM 1271 CG GLU A 161 132.674 -0.020 14.211 1.00 0.00 C ATOM 1272 CD GLU A 161 132.011 0.217 12.868 1.00 0.00 C ATOM 1273 OE1 GLU A 161 131.857 1.393 12.481 1.00 0.00 O ATOM 1274 OE2 GLU A 161 131.644 -0.776 12.205 1.00 0.00 O ATOM 0 H GLU A 161 133.461 -1.723 12.567 1.00 0.00 H new ATOM 0 HA GLU A 161 135.975 -1.053 13.871 1.00 0.00 H new ATOM 0 HB2 GLU A 161 134.541 0.608 15.046 1.00 0.00 H new ATOM 0 HB3 GLU A 161 134.453 0.745 13.301 1.00 0.00 H new ATOM 0 HG2 GLU A 161 132.412 -1.015 14.571 1.00 0.00 H new ATOM 0 HG3 GLU A 161 132.284 0.694 14.936 1.00 0.00 H new TER 1281 GLU A 161 HETATM 1282 CA CA A 162 132.550 2.062 -9.433 1.00 0.00 CA HETATM 1283 CA CA A 163 136.333 -7.157 -2.744 1.00 0.00 CA