USER MOD reduce.3.24.130724 H: found=0, std=0, add=621, rem=0, adj=15 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 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 -161:sc= -0.0294 (180deg=-0.333) USER MOD Single : A 86 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.184) USER MOD Single : A 89 SER OG : rot 42:sc= 0.812 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ -108:sc= 1.11 (180deg=-0.044) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0.0382 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+ -126:sc= 0 (180deg=-0.74) USER MOD Single : A 107 ASN : amide:sc= -1.52 K(o=-1.5,f=-6.3!) 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 171:sc= 0 (180deg=-0.0273) USER MOD Single : A 122 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 124 THR OG1 : rot -59:sc= 1.18 USER MOD Single : A 127 THR OG1 : rot 45:sc= 0.0346 USER MOD Single : A 129 THR OG1 : rot 180:sc= -0.478 USER MOD Single : A 137 MET CE :methyl -152:sc= -1.31 (180deg=-2) 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 143 ASN : amide:sc= -0.336 K(o=-0.34,f=-1.9!) USER MOD Single : A 144 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 81 94.341 -17.661 -1.244 1.00 0.00 N ATOM 2 CA MET A 81 94.147 -17.071 -2.595 1.00 0.00 C ATOM 3 C MET A 81 94.644 -15.629 -2.644 1.00 0.00 C ATOM 4 O MET A 81 93.901 -14.717 -3.005 1.00 0.00 O ATOM 5 CB MET A 81 92.657 -17.131 -2.941 1.00 0.00 C ATOM 6 CG MET A 81 92.193 -18.505 -3.396 1.00 0.00 C ATOM 7 SD MET A 81 90.519 -18.890 -2.850 1.00 0.00 S ATOM 8 CE MET A 81 90.283 -20.505 -3.588 1.00 0.00 C ATOM 0 HA MET A 81 94.725 -17.640 -3.323 1.00 0.00 H new ATOM 0 HB2 MET A 81 92.077 -16.832 -2.068 1.00 0.00 H new ATOM 0 HB3 MET A 81 92.446 -16.406 -3.727 1.00 0.00 H new ATOM 0 HG2 MET A 81 92.237 -18.557 -4.484 1.00 0.00 H new ATOM 0 HG3 MET A 81 92.879 -19.261 -3.013 1.00 0.00 H new ATOM 0 HE1 MET A 81 89.289 -20.877 -3.339 1.00 0.00 H new ATOM 0 HE2 MET A 81 90.381 -20.428 -4.671 1.00 0.00 H new ATOM 0 HE3 MET A 81 91.035 -21.194 -3.204 1.00 0.00 H new ATOM 20 N VAL A 82 95.907 -15.432 -2.277 1.00 0.00 N ATOM 21 CA VAL A 82 96.503 -14.101 -2.279 1.00 0.00 C ATOM 22 C VAL A 82 95.718 -13.144 -1.388 1.00 0.00 C ATOM 23 O VAL A 82 94.917 -12.346 -1.873 1.00 0.00 O ATOM 24 CB VAL A 82 96.577 -13.519 -3.703 1.00 0.00 C ATOM 25 CG1 VAL A 82 97.381 -12.227 -3.712 1.00 0.00 C ATOM 26 CG2 VAL A 82 97.175 -14.535 -4.665 1.00 0.00 C ATOM 0 H VAL A 82 96.536 -16.176 -1.975 1.00 0.00 H new ATOM 0 HA VAL A 82 97.515 -14.208 -1.887 1.00 0.00 H new ATOM 0 HB VAL A 82 95.564 -13.291 -4.035 1.00 0.00 H new ATOM 0 HG11 VAL A 82 97.422 -11.831 -4.727 1.00 0.00 H new ATOM 0 HG12 VAL A 82 96.905 -11.498 -3.057 1.00 0.00 H new ATOM 0 HG13 VAL A 82 98.393 -12.426 -3.359 1.00 0.00 H new ATOM 0 HG21 VAL A 82 97.219 -14.106 -5.666 1.00 0.00 H new ATOM 0 HG22 VAL A 82 98.181 -14.797 -4.338 1.00 0.00 H new ATOM 0 HG23 VAL A 82 96.554 -15.430 -4.681 1.00 0.00 H new ATOM 36 N ARG A 83 95.954 -13.231 -0.083 1.00 0.00 N ATOM 37 CA ARG A 83 95.269 -12.372 0.876 1.00 0.00 C ATOM 38 C ARG A 83 96.244 -11.391 1.522 1.00 0.00 C ATOM 39 O ARG A 83 95.951 -10.203 1.647 1.00 0.00 O ATOM 40 CB ARG A 83 94.590 -13.219 1.954 1.00 0.00 C ATOM 41 CG ARG A 83 95.564 -14.034 2.790 1.00 0.00 C ATOM 42 CD ARG A 83 94.860 -15.172 3.513 1.00 0.00 C ATOM 43 NE ARG A 83 95.768 -16.280 3.801 1.00 0.00 N ATOM 44 CZ ARG A 83 95.362 -17.494 4.172 1.00 0.00 C ATOM 45 NH1 ARG A 83 94.067 -17.758 4.300 1.00 0.00 N ATOM 46 NH2 ARG A 83 96.253 -18.445 4.415 1.00 0.00 N ATOM 0 H ARG A 83 96.614 -13.887 0.334 1.00 0.00 H new ATOM 0 HA ARG A 83 94.511 -11.802 0.340 1.00 0.00 H new ATOM 0 HB2 ARG A 83 94.018 -12.565 2.612 1.00 0.00 H new ATOM 0 HB3 ARG A 83 93.878 -13.894 1.479 1.00 0.00 H new ATOM 0 HG2 ARG A 83 96.347 -14.438 2.148 1.00 0.00 H new ATOM 0 HG3 ARG A 83 96.052 -13.386 3.518 1.00 0.00 H new ATOM 0 HD2 ARG A 83 94.433 -14.801 4.445 1.00 0.00 H new ATOM 0 HD3 ARG A 83 94.031 -15.531 2.903 1.00 0.00 H new ATOM 0 HE ARG A 83 96.771 -16.115 3.713 1.00 0.00 H new ATOM 0 HH11 ARG A 83 93.377 -17.030 4.114 1.00 0.00 H new ATOM 0 HH12 ARG A 83 93.762 -18.689 4.584 1.00 0.00 H new ATOM 0 HH21 ARG A 83 97.249 -18.248 4.318 1.00 0.00 H new ATOM 0 HH22 ARG A 83 95.943 -19.374 4.699 1.00 0.00 H new ATOM 60 N CYS A 84 97.402 -11.900 1.927 1.00 0.00 N ATOM 61 CA CYS A 84 98.421 -11.069 2.560 1.00 0.00 C ATOM 62 C CYS A 84 99.519 -10.702 1.566 1.00 0.00 C ATOM 63 O CYS A 84 100.051 -9.592 1.598 1.00 0.00 O ATOM 64 CB CYS A 84 99.028 -11.796 3.762 1.00 0.00 C ATOM 65 SG CYS A 84 99.519 -10.701 5.114 1.00 0.00 S ATOM 0 H CYS A 84 97.659 -12.882 1.829 1.00 0.00 H new ATOM 0 HA CYS A 84 97.944 -10.151 2.902 1.00 0.00 H new ATOM 0 HB2 CYS A 84 98.305 -12.520 4.139 1.00 0.00 H new ATOM 0 HB3 CYS A 84 99.900 -12.360 3.430 1.00 0.00 H new ATOM 0 HG CYS A 84 100.019 -11.407 6.085 1.00 0.00 H new ATOM 71 N MET A 85 99.853 -11.644 0.686 1.00 0.00 N ATOM 72 CA MET A 85 100.888 -11.430 -0.324 1.00 0.00 C ATOM 73 C MET A 85 102.136 -10.793 0.287 1.00 0.00 C ATOM 74 O MET A 85 102.265 -10.703 1.507 1.00 0.00 O ATOM 75 CB MET A 85 100.352 -10.555 -1.462 1.00 0.00 C ATOM 76 CG MET A 85 100.104 -9.108 -1.063 1.00 0.00 C ATOM 77 SD MET A 85 99.825 -8.035 -2.486 1.00 0.00 S ATOM 78 CE MET A 85 101.480 -7.934 -3.164 1.00 0.00 C ATOM 0 H MET A 85 99.420 -12.567 0.652 1.00 0.00 H new ATOM 0 HA MET A 85 101.167 -12.404 -0.727 1.00 0.00 H new ATOM 0 HB2 MET A 85 101.062 -10.577 -2.289 1.00 0.00 H new ATOM 0 HB3 MET A 85 99.420 -10.985 -1.830 1.00 0.00 H new ATOM 0 HG2 MET A 85 99.239 -9.060 -0.401 1.00 0.00 H new ATOM 0 HG3 MET A 85 100.959 -8.739 -0.497 1.00 0.00 H new ATOM 0 HE1 MET A 85 101.552 -7.067 -3.821 1.00 0.00 H new ATOM 0 HE2 MET A 85 102.200 -7.834 -2.352 1.00 0.00 H new ATOM 0 HE3 MET A 85 101.696 -8.839 -3.732 1.00 0.00 H new ATOM 88 N LYS A 86 103.052 -10.356 -0.571 1.00 0.00 N ATOM 89 CA LYS A 86 104.287 -9.730 -0.116 1.00 0.00 C ATOM 90 C LYS A 86 104.000 -8.412 0.594 1.00 0.00 C ATOM 91 O LYS A 86 102.955 -7.795 0.381 1.00 0.00 O ATOM 92 CB LYS A 86 105.229 -9.491 -1.297 1.00 0.00 C ATOM 93 CG LYS A 86 105.967 -10.742 -1.749 1.00 0.00 C ATOM 94 CD LYS A 86 107.470 -10.514 -1.809 1.00 0.00 C ATOM 95 CE LYS A 86 108.168 -11.074 -0.581 1.00 0.00 C ATOM 96 NZ LYS A 86 107.797 -10.332 0.656 1.00 0.00 N ATOM 0 H LYS A 86 102.962 -10.424 -1.585 1.00 0.00 H new ATOM 0 HA LYS A 86 104.767 -10.406 0.591 1.00 0.00 H new ATOM 0 HB2 LYS A 86 104.655 -9.095 -2.135 1.00 0.00 H new ATOM 0 HB3 LYS A 86 105.958 -8.729 -1.021 1.00 0.00 H new ATOM 0 HG2 LYS A 86 105.750 -11.561 -1.063 1.00 0.00 H new ATOM 0 HG3 LYS A 86 105.605 -11.044 -2.732 1.00 0.00 H new ATOM 0 HD2 LYS A 86 107.875 -10.984 -2.705 1.00 0.00 H new ATOM 0 HD3 LYS A 86 107.674 -9.446 -1.890 1.00 0.00 H new ATOM 0 HE2 LYS A 86 107.909 -12.126 -0.465 1.00 0.00 H new ATOM 0 HE3 LYS A 86 109.248 -11.025 -0.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 108.515 -10.499 1.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 107.745 -9.314 0.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 106.872 -10.664 0.996 1.00 0.00 H new ATOM 110 N ASP A 87 104.931 -7.984 1.438 1.00 0.00 N ATOM 111 CA ASP A 87 104.778 -6.738 2.181 1.00 0.00 C ATOM 112 C ASP A 87 105.653 -5.640 1.586 1.00 0.00 C ATOM 113 O ASP A 87 106.518 -5.904 0.751 1.00 0.00 O ATOM 114 CB ASP A 87 105.134 -6.952 3.653 1.00 0.00 C ATOM 115 CG ASP A 87 104.201 -6.205 4.587 1.00 0.00 C ATOM 116 OD1 ASP A 87 103.817 -5.063 4.255 1.00 0.00 O ATOM 117 OD2 ASP A 87 103.855 -6.762 5.649 1.00 0.00 O ATOM 0 H ASP A 87 105.801 -8.482 1.626 1.00 0.00 H new ATOM 0 HA ASP A 87 103.736 -6.425 2.109 1.00 0.00 H new ATOM 0 HB2 ASP A 87 105.097 -8.017 3.882 1.00 0.00 H new ATOM 0 HB3 ASP A 87 106.159 -6.624 3.828 1.00 0.00 H new ATOM 122 N ASP A 88 105.422 -4.406 2.022 1.00 0.00 N ATOM 123 CA ASP A 88 106.189 -3.266 1.534 1.00 0.00 C ATOM 124 C ASP A 88 107.565 -3.214 2.190 1.00 0.00 C ATOM 125 O ASP A 88 107.815 -3.897 3.183 1.00 0.00 O ATOM 126 CB ASP A 88 105.435 -1.963 1.802 1.00 0.00 C ATOM 127 CG ASP A 88 105.078 -1.792 3.265 1.00 0.00 C ATOM 128 OD1 ASP A 88 105.990 -1.504 4.068 1.00 0.00 O ATOM 129 OD2 ASP A 88 103.887 -1.946 3.608 1.00 0.00 O ATOM 0 H ASP A 88 104.709 -4.170 2.713 1.00 0.00 H new ATOM 0 HA ASP A 88 106.323 -3.385 0.459 1.00 0.00 H new ATOM 0 HB2 ASP A 88 106.046 -1.120 1.479 1.00 0.00 H new ATOM 0 HB3 ASP A 88 104.524 -1.944 1.204 1.00 0.00 H new ATOM 134 N SER A 89 108.453 -2.400 1.630 1.00 0.00 N ATOM 135 CA SER A 89 109.803 -2.259 2.162 1.00 0.00 C ATOM 136 C SER A 89 109.774 -1.690 3.576 1.00 0.00 C ATOM 137 O SER A 89 109.428 -0.526 3.781 1.00 0.00 O ATOM 138 CB SER A 89 110.640 -1.357 1.253 1.00 0.00 C ATOM 139 OG SER A 89 110.097 -0.048 1.193 1.00 0.00 O ATOM 0 H SER A 89 108.262 -1.828 0.808 1.00 0.00 H new ATOM 0 HA SER A 89 110.258 -3.249 2.198 1.00 0.00 H new ATOM 0 HB2 SER A 89 111.664 -1.313 1.623 1.00 0.00 H new ATOM 0 HB3 SER A 89 110.681 -1.783 0.251 1.00 0.00 H new ATOM 0 HG SER A 89 109.818 0.232 2.090 1.00 0.00 H new ATOM 145 N LYS A 90 110.138 -2.519 4.549 1.00 0.00 N ATOM 146 CA LYS A 90 110.152 -2.098 5.946 1.00 0.00 C ATOM 147 C LYS A 90 111.569 -1.759 6.397 1.00 0.00 C ATOM 148 O LYS A 90 112.488 -1.677 5.582 1.00 0.00 O ATOM 149 CB LYS A 90 109.569 -3.198 6.837 1.00 0.00 C ATOM 150 CG LYS A 90 108.718 -2.666 7.980 1.00 0.00 C ATOM 151 CD LYS A 90 107.235 -2.870 7.715 1.00 0.00 C ATOM 152 CE LYS A 90 106.493 -3.281 8.977 1.00 0.00 C ATOM 153 NZ LYS A 90 105.893 -2.111 9.675 1.00 0.00 N ATOM 0 H LYS A 90 110.427 -3.485 4.396 1.00 0.00 H new ATOM 0 HA LYS A 90 109.537 -1.202 6.037 1.00 0.00 H new ATOM 0 HB2 LYS A 90 108.964 -3.867 6.225 1.00 0.00 H new ATOM 0 HB3 LYS A 90 110.385 -3.792 7.248 1.00 0.00 H new ATOM 0 HG2 LYS A 90 108.995 -3.170 8.906 1.00 0.00 H new ATOM 0 HG3 LYS A 90 108.920 -1.604 8.122 1.00 0.00 H new ATOM 0 HD2 LYS A 90 106.805 -1.949 7.323 1.00 0.00 H new ATOM 0 HD3 LYS A 90 107.103 -3.634 6.949 1.00 0.00 H new ATOM 0 HE2 LYS A 90 105.708 -3.993 8.721 1.00 0.00 H new ATOM 0 HE3 LYS A 90 107.180 -3.793 9.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 105.396 -2.434 10.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 106.644 -1.443 9.942 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 105.218 -1.637 9.041 1.00 0.00 H new ATOM 167 N GLY A 91 111.738 -1.563 7.701 1.00 0.00 N ATOM 168 CA GLY A 91 113.047 -1.236 8.236 1.00 0.00 C ATOM 169 C GLY A 91 114.040 -2.371 8.076 1.00 0.00 C ATOM 170 O GLY A 91 113.995 -3.353 8.816 1.00 0.00 O ATOM 0 H GLY A 91 110.993 -1.625 8.395 1.00 0.00 H new ATOM 0 HA2 GLY A 91 113.430 -0.349 7.732 1.00 0.00 H new ATOM 0 HA3 GLY A 91 112.952 -0.987 9.293 1.00 0.00 H new ATOM 174 N LYS A 92 114.939 -2.234 7.107 1.00 0.00 N ATOM 175 CA LYS A 92 115.948 -3.254 6.852 1.00 0.00 C ATOM 176 C LYS A 92 117.315 -2.810 7.365 1.00 0.00 C ATOM 177 O LYS A 92 117.715 -1.661 7.180 1.00 0.00 O ATOM 178 CB LYS A 92 116.024 -3.563 5.356 1.00 0.00 C ATOM 179 CG LYS A 92 114.768 -4.222 4.806 1.00 0.00 C ATOM 180 CD LYS A 92 114.739 -5.710 5.117 1.00 0.00 C ATOM 181 CE LYS A 92 113.313 -6.227 5.243 1.00 0.00 C ATOM 182 NZ LYS A 92 113.022 -7.300 4.252 1.00 0.00 N ATOM 0 H LYS A 92 114.989 -1.427 6.486 1.00 0.00 H new ATOM 0 HA LYS A 92 115.658 -4.158 7.387 1.00 0.00 H new ATOM 0 HB2 LYS A 92 116.207 -2.637 4.811 1.00 0.00 H new ATOM 0 HB3 LYS A 92 116.877 -4.215 5.171 1.00 0.00 H new ATOM 0 HG2 LYS A 92 113.887 -3.743 5.233 1.00 0.00 H new ATOM 0 HG3 LYS A 92 114.720 -4.073 3.727 1.00 0.00 H new ATOM 0 HD2 LYS A 92 115.257 -6.257 4.329 1.00 0.00 H new ATOM 0 HD3 LYS A 92 115.279 -5.899 6.045 1.00 0.00 H new ATOM 0 HE2 LYS A 92 113.154 -6.611 6.251 1.00 0.00 H new ATOM 0 HE3 LYS A 92 112.614 -5.403 5.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 112.385 -6.931 3.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 113.910 -7.617 3.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 112.568 -8.103 4.733 1.00 0.00 H new ATOM 196 N THR A 93 118.022 -3.727 8.015 1.00 0.00 N ATOM 197 CA THR A 93 119.343 -3.434 8.564 1.00 0.00 C ATOM 198 C THR A 93 120.444 -3.990 7.666 1.00 0.00 C ATOM 199 O THR A 93 121.062 -3.254 6.897 1.00 0.00 O ATOM 200 CB THR A 93 119.470 -4.020 9.972 1.00 0.00 C ATOM 201 OG1 THR A 93 118.730 -5.223 10.085 1.00 0.00 O ATOM 202 CG2 THR A 93 118.991 -3.081 11.057 1.00 0.00 C ATOM 0 H THR A 93 117.703 -4.682 8.176 1.00 0.00 H new ATOM 0 HA THR A 93 119.457 -2.351 8.615 1.00 0.00 H new ATOM 0 HB THR A 93 120.536 -4.199 10.114 1.00 0.00 H new ATOM 0 HG1 THR A 93 118.826 -5.582 10.992 1.00 0.00 H new ATOM 0 HG21 THR A 93 119.109 -3.559 12.030 1.00 0.00 H new ATOM 0 HG22 THR A 93 119.579 -2.163 11.030 1.00 0.00 H new ATOM 0 HG23 THR A 93 117.940 -2.843 10.895 1.00 0.00 H new ATOM 210 N GLU A 94 120.685 -5.294 7.767 1.00 0.00 N ATOM 211 CA GLU A 94 121.711 -5.947 6.960 1.00 0.00 C ATOM 212 C GLU A 94 121.227 -6.134 5.525 1.00 0.00 C ATOM 213 O GLU A 94 121.961 -5.875 4.572 1.00 0.00 O ATOM 214 CB GLU A 94 122.082 -7.302 7.566 1.00 0.00 C ATOM 215 CG GLU A 94 122.972 -7.196 8.794 1.00 0.00 C ATOM 216 CD GLU A 94 124.426 -7.490 8.486 1.00 0.00 C ATOM 217 OE1 GLU A 94 124.723 -8.618 8.040 1.00 0.00 O ATOM 218 OE2 GLU A 94 125.270 -6.591 8.690 1.00 0.00 O ATOM 0 H GLU A 94 120.184 -5.919 8.399 1.00 0.00 H new ATOM 0 HA GLU A 94 122.595 -5.309 6.950 1.00 0.00 H new ATOM 0 HB2 GLU A 94 121.169 -7.833 7.834 1.00 0.00 H new ATOM 0 HB3 GLU A 94 122.589 -7.902 6.810 1.00 0.00 H new ATOM 0 HG2 GLU A 94 122.889 -6.193 9.213 1.00 0.00 H new ATOM 0 HG3 GLU A 94 122.618 -7.890 9.556 1.00 0.00 H new ATOM 225 N GLU A 95 119.983 -6.577 5.386 1.00 0.00 N ATOM 226 CA GLU A 95 119.392 -6.793 4.071 1.00 0.00 C ATOM 227 C GLU A 95 119.326 -5.486 3.283 1.00 0.00 C ATOM 228 O GLU A 95 119.203 -5.495 2.058 1.00 0.00 O ATOM 229 CB GLU A 95 117.990 -7.390 4.210 1.00 0.00 C ATOM 230 CG GLU A 95 117.660 -8.425 3.147 1.00 0.00 C ATOM 231 CD GLU A 95 116.414 -8.076 2.357 1.00 0.00 C ATOM 232 OE1 GLU A 95 115.301 -8.263 2.893 1.00 0.00 O ATOM 233 OE2 GLU A 95 116.549 -7.615 1.205 1.00 0.00 O ATOM 0 H GLU A 95 119.364 -6.794 6.167 1.00 0.00 H new ATOM 0 HA GLU A 95 120.025 -7.494 3.526 1.00 0.00 H new ATOM 0 HB2 GLU A 95 117.896 -7.850 5.194 1.00 0.00 H new ATOM 0 HB3 GLU A 95 117.256 -6.586 4.162 1.00 0.00 H new ATOM 0 HG2 GLU A 95 118.504 -8.520 2.464 1.00 0.00 H new ATOM 0 HG3 GLU A 95 117.524 -9.397 3.622 1.00 0.00 H new ATOM 240 N GLU A 96 119.402 -4.364 3.993 1.00 0.00 N ATOM 241 CA GLU A 96 119.348 -3.049 3.362 1.00 0.00 C ATOM 242 C GLU A 96 120.703 -2.661 2.760 1.00 0.00 C ATOM 243 O GLU A 96 120.834 -1.606 2.141 1.00 0.00 O ATOM 244 CB GLU A 96 118.890 -1.998 4.383 1.00 0.00 C ATOM 245 CG GLU A 96 120.016 -1.383 5.206 1.00 0.00 C ATOM 246 CD GLU A 96 120.328 0.043 4.791 1.00 0.00 C ATOM 247 OE1 GLU A 96 120.267 0.337 3.579 1.00 0.00 O ATOM 248 OE2 GLU A 96 120.634 0.865 5.681 1.00 0.00 O ATOM 0 H GLU A 96 119.501 -4.339 5.008 1.00 0.00 H new ATOM 0 HA GLU A 96 118.627 -3.092 2.546 1.00 0.00 H new ATOM 0 HB2 GLU A 96 118.366 -1.201 3.855 1.00 0.00 H new ATOM 0 HB3 GLU A 96 118.171 -2.458 5.061 1.00 0.00 H new ATOM 0 HG2 GLU A 96 119.741 -1.399 6.261 1.00 0.00 H new ATOM 0 HG3 GLU A 96 120.913 -1.993 5.101 1.00 0.00 H new ATOM 255 N LEU A 97 121.706 -3.515 2.950 1.00 0.00 N ATOM 256 CA LEU A 97 123.045 -3.255 2.431 1.00 0.00 C ATOM 257 C LEU A 97 123.038 -3.106 0.910 1.00 0.00 C ATOM 258 O LEU A 97 123.970 -2.549 0.332 1.00 0.00 O ATOM 259 CB LEU A 97 123.998 -4.380 2.837 1.00 0.00 C ATOM 260 CG LEU A 97 124.451 -4.350 4.299 1.00 0.00 C ATOM 261 CD1 LEU A 97 125.153 -5.648 4.667 1.00 0.00 C ATOM 262 CD2 LEU A 97 125.364 -3.159 4.547 1.00 0.00 C ATOM 0 H LEU A 97 121.616 -4.394 3.460 1.00 0.00 H new ATOM 0 HA LEU A 97 123.389 -2.315 2.862 1.00 0.00 H new ATOM 0 HB2 LEU A 97 123.511 -5.336 2.643 1.00 0.00 H new ATOM 0 HB3 LEU A 97 124.880 -4.336 2.198 1.00 0.00 H new ATOM 0 HG LEU A 97 123.570 -4.246 4.932 1.00 0.00 H new ATOM 0 HD11 LEU A 97 125.468 -5.608 5.710 1.00 0.00 H new ATOM 0 HD12 LEU A 97 124.468 -6.484 4.526 1.00 0.00 H new ATOM 0 HD13 LEU A 97 126.027 -5.783 4.029 1.00 0.00 H new ATOM 0 HD21 LEU A 97 125.677 -3.152 5.591 1.00 0.00 H new ATOM 0 HD22 LEU A 97 126.242 -3.234 3.905 1.00 0.00 H new ATOM 0 HD23 LEU A 97 124.828 -2.237 4.323 1.00 0.00 H new ATOM 274 N SER A 98 121.987 -3.607 0.266 1.00 0.00 N ATOM 275 CA SER A 98 121.877 -3.524 -1.186 1.00 0.00 C ATOM 276 C SER A 98 121.649 -2.084 -1.638 1.00 0.00 C ATOM 277 O SER A 98 122.101 -1.681 -2.709 1.00 0.00 O ATOM 278 CB SER A 98 120.735 -4.413 -1.682 1.00 0.00 C ATOM 279 OG SER A 98 120.583 -4.314 -3.086 1.00 0.00 O ATOM 0 H SER A 98 121.204 -4.072 0.725 1.00 0.00 H new ATOM 0 HA SER A 98 122.816 -3.874 -1.615 1.00 0.00 H new ATOM 0 HB2 SER A 98 120.931 -5.449 -1.407 1.00 0.00 H new ATOM 0 HB3 SER A 98 119.806 -4.124 -1.191 1.00 0.00 H new ATOM 0 HG SER A 98 119.848 -4.893 -3.377 1.00 0.00 H new ATOM 285 N ASP A 99 120.939 -1.316 -0.817 1.00 0.00 N ATOM 286 CA ASP A 99 120.651 0.078 -1.136 1.00 0.00 C ATOM 287 C ASP A 99 121.835 0.975 -0.793 1.00 0.00 C ATOM 288 O ASP A 99 122.073 1.986 -1.454 1.00 0.00 O ATOM 289 CB ASP A 99 119.405 0.548 -0.383 1.00 0.00 C ATOM 290 CG ASP A 99 118.846 1.841 -0.940 1.00 0.00 C ATOM 291 OD1 ASP A 99 118.759 1.966 -2.181 1.00 0.00 O ATOM 292 OD2 ASP A 99 118.494 2.732 -0.138 1.00 0.00 O ATOM 0 H ASP A 99 120.553 -1.635 0.072 1.00 0.00 H new ATOM 0 HA ASP A 99 120.468 0.147 -2.208 1.00 0.00 H new ATOM 0 HB2 ASP A 99 118.640 -0.227 -0.433 1.00 0.00 H new ATOM 0 HB3 ASP A 99 119.651 0.686 0.670 1.00 0.00 H new ATOM 297 N LEU A 100 122.574 0.601 0.246 1.00 0.00 N ATOM 298 CA LEU A 100 123.733 1.374 0.679 1.00 0.00 C ATOM 299 C LEU A 100 124.856 1.299 -0.351 1.00 0.00 C ATOM 300 O LEU A 100 125.662 2.221 -0.472 1.00 0.00 O ATOM 301 CB LEU A 100 124.233 0.866 2.033 1.00 0.00 C ATOM 302 CG LEU A 100 123.421 1.338 3.240 1.00 0.00 C ATOM 303 CD1 LEU A 100 123.580 0.367 4.401 1.00 0.00 C ATOM 304 CD2 LEU A 100 123.847 2.739 3.652 1.00 0.00 C ATOM 0 H LEU A 100 122.391 -0.233 0.804 1.00 0.00 H new ATOM 0 HA LEU A 100 123.426 2.415 0.778 1.00 0.00 H new ATOM 0 HB2 LEU A 100 124.233 -0.224 2.018 1.00 0.00 H new ATOM 0 HB3 LEU A 100 125.268 1.183 2.164 1.00 0.00 H new ATOM 0 HG LEU A 100 122.368 1.368 2.959 1.00 0.00 H new ATOM 0 HD11 LEU A 100 122.996 0.718 5.252 1.00 0.00 H new ATOM 0 HD12 LEU A 100 123.227 -0.620 4.101 1.00 0.00 H new ATOM 0 HD13 LEU A 100 124.631 0.306 4.683 1.00 0.00 H new ATOM 0 HD21 LEU A 100 123.259 3.060 4.512 1.00 0.00 H new ATOM 0 HD22 LEU A 100 124.905 2.735 3.916 1.00 0.00 H new ATOM 0 HD23 LEU A 100 123.683 3.428 2.823 1.00 0.00 H new ATOM 316 N PHE A 101 124.908 0.194 -1.087 1.00 0.00 N ATOM 317 CA PHE A 101 125.936 0.000 -2.103 1.00 0.00 C ATOM 318 C PHE A 101 125.843 1.065 -3.190 1.00 0.00 C ATOM 319 O PHE A 101 126.826 1.738 -3.498 1.00 0.00 O ATOM 320 CB PHE A 101 125.814 -1.392 -2.725 1.00 0.00 C ATOM 321 CG PHE A 101 126.927 -1.720 -3.677 1.00 0.00 C ATOM 322 CD1 PHE A 101 128.154 -2.154 -3.205 1.00 0.00 C ATOM 323 CD2 PHE A 101 126.747 -1.590 -5.046 1.00 0.00 C ATOM 324 CE1 PHE A 101 129.182 -2.455 -4.077 1.00 0.00 C ATOM 325 CE2 PHE A 101 127.772 -1.890 -5.924 1.00 0.00 C ATOM 326 CZ PHE A 101 128.990 -2.323 -5.439 1.00 0.00 C ATOM 0 H PHE A 101 124.250 -0.581 -0.999 1.00 0.00 H new ATOM 0 HA PHE A 101 126.908 0.090 -1.617 1.00 0.00 H new ATOM 0 HB2 PHE A 101 125.795 -2.137 -1.929 1.00 0.00 H new ATOM 0 HB3 PHE A 101 124.862 -1.464 -3.252 1.00 0.00 H new ATOM 0 HD1 PHE A 101 128.309 -2.259 -2.141 1.00 0.00 H new ATOM 0 HD2 PHE A 101 125.796 -1.251 -5.430 1.00 0.00 H new ATOM 0 HE1 PHE A 101 130.134 -2.793 -3.695 1.00 0.00 H new ATOM 0 HE2 PHE A 101 127.620 -1.786 -6.988 1.00 0.00 H new ATOM 0 HZ PHE A 101 129.792 -2.558 -6.123 1.00 0.00 H new ATOM 336 N ARG A 102 124.655 1.215 -3.770 1.00 0.00 N ATOM 337 CA ARG A 102 124.437 2.198 -4.827 1.00 0.00 C ATOM 338 C ARG A 102 124.818 3.599 -4.358 1.00 0.00 C ATOM 339 O ARG A 102 125.263 4.430 -5.148 1.00 0.00 O ATOM 340 CB ARG A 102 122.977 2.178 -5.277 1.00 0.00 C ATOM 341 CG ARG A 102 122.671 1.101 -6.305 1.00 0.00 C ATOM 342 CD ARG A 102 121.336 1.345 -6.989 1.00 0.00 C ATOM 343 NE ARG A 102 120.218 0.814 -6.212 1.00 0.00 N ATOM 344 CZ ARG A 102 118.949 1.174 -6.398 1.00 0.00 C ATOM 345 NH1 ARG A 102 118.634 2.063 -7.332 1.00 0.00 N ATOM 346 NH2 ARG A 102 117.993 0.644 -5.647 1.00 0.00 N ATOM 0 H ARG A 102 123.829 0.669 -3.526 1.00 0.00 H new ATOM 0 HA ARG A 102 125.074 1.933 -5.671 1.00 0.00 H new ATOM 0 HB2 ARG A 102 122.339 2.028 -4.406 1.00 0.00 H new ATOM 0 HB3 ARG A 102 122.721 3.151 -5.696 1.00 0.00 H new ATOM 0 HG2 ARG A 102 123.464 1.074 -7.052 1.00 0.00 H new ATOM 0 HG3 ARG A 102 122.659 0.126 -5.819 1.00 0.00 H new ATOM 0 HD2 ARG A 102 121.196 2.415 -7.140 1.00 0.00 H new ATOM 0 HD3 ARG A 102 121.344 0.882 -7.976 1.00 0.00 H new ATOM 0 HE ARG A 102 120.421 0.128 -5.485 1.00 0.00 H new ATOM 0 HH11 ARG A 102 119.365 2.474 -7.912 1.00 0.00 H new ATOM 0 HH12 ARG A 102 117.661 2.335 -7.470 1.00 0.00 H new ATOM 0 HH21 ARG A 102 118.230 -0.039 -4.927 1.00 0.00 H new ATOM 0 HH22 ARG A 102 117.021 0.919 -5.789 1.00 0.00 H new ATOM 360 N MET A 103 124.641 3.852 -3.065 1.00 0.00 N ATOM 361 CA MET A 103 124.966 5.152 -2.490 1.00 0.00 C ATOM 362 C MET A 103 126.463 5.438 -2.586 1.00 0.00 C ATOM 363 O MET A 103 126.888 6.592 -2.519 1.00 0.00 O ATOM 364 CB MET A 103 124.518 5.211 -1.027 1.00 0.00 C ATOM 365 CG MET A 103 123.011 5.298 -0.857 1.00 0.00 C ATOM 366 SD MET A 103 122.531 6.032 0.718 1.00 0.00 S ATOM 367 CE MET A 103 120.804 5.563 0.798 1.00 0.00 C ATOM 0 H MET A 103 124.275 3.174 -2.396 1.00 0.00 H new ATOM 0 HA MET A 103 124.434 5.914 -3.060 1.00 0.00 H new ATOM 0 HB2 MET A 103 124.884 4.325 -0.508 1.00 0.00 H new ATOM 0 HB3 MET A 103 124.980 6.075 -0.549 1.00 0.00 H new ATOM 0 HG2 MET A 103 122.591 5.888 -1.671 1.00 0.00 H new ATOM 0 HG3 MET A 103 122.582 4.299 -0.933 1.00 0.00 H new ATOM 0 HE1 MET A 103 120.365 5.946 1.720 1.00 0.00 H new ATOM 0 HE2 MET A 103 120.273 5.981 -0.057 1.00 0.00 H new ATOM 0 HE3 MET A 103 120.721 4.476 0.780 1.00 0.00 H new ATOM 377 N PHE A 104 127.259 4.383 -2.744 1.00 0.00 N ATOM 378 CA PHE A 104 128.706 4.528 -2.848 1.00 0.00 C ATOM 379 C PHE A 104 129.154 4.571 -4.309 1.00 0.00 C ATOM 380 O PHE A 104 130.243 5.053 -4.618 1.00 0.00 O ATOM 381 CB PHE A 104 129.408 3.378 -2.123 1.00 0.00 C ATOM 382 CG PHE A 104 129.645 3.645 -0.663 1.00 0.00 C ATOM 383 CD1 PHE A 104 128.607 3.545 0.250 1.00 0.00 C ATOM 384 CD2 PHE A 104 130.905 3.994 -0.206 1.00 0.00 C ATOM 385 CE1 PHE A 104 128.822 3.789 1.593 1.00 0.00 C ATOM 386 CE2 PHE A 104 131.127 4.239 1.136 1.00 0.00 C ATOM 387 CZ PHE A 104 130.084 4.136 2.037 1.00 0.00 C ATOM 0 H PHE A 104 126.926 3.421 -2.803 1.00 0.00 H new ATOM 0 HA PHE A 104 128.982 5.472 -2.377 1.00 0.00 H new ATOM 0 HB2 PHE A 104 128.808 2.474 -2.226 1.00 0.00 H new ATOM 0 HB3 PHE A 104 130.364 3.183 -2.608 1.00 0.00 H new ATOM 0 HD1 PHE A 104 127.619 3.273 -0.092 1.00 0.00 H new ATOM 0 HD2 PHE A 104 131.723 4.076 -0.906 1.00 0.00 H new ATOM 0 HE1 PHE A 104 128.005 3.709 2.295 1.00 0.00 H new ATOM 0 HE2 PHE A 104 132.114 4.511 1.480 1.00 0.00 H new ATOM 0 HZ PHE A 104 130.255 4.326 3.086 1.00 0.00 H new ATOM 397 N ASP A 105 128.308 4.066 -5.204 1.00 0.00 N ATOM 398 CA ASP A 105 128.623 4.051 -6.628 1.00 0.00 C ATOM 399 C ASP A 105 128.305 5.399 -7.268 1.00 0.00 C ATOM 400 O ASP A 105 127.329 6.055 -6.903 1.00 0.00 O ATOM 401 CB ASP A 105 127.843 2.938 -7.332 1.00 0.00 C ATOM 402 CG ASP A 105 128.713 2.122 -8.267 1.00 0.00 C ATOM 403 OD1 ASP A 105 128.971 2.588 -9.397 1.00 0.00 O ATOM 404 OD2 ASP A 105 129.135 1.014 -7.871 1.00 0.00 O ATOM 0 H ASP A 105 127.401 3.663 -4.968 1.00 0.00 H new ATOM 0 HA ASP A 105 129.690 3.861 -6.739 1.00 0.00 H new ATOM 0 HB2 ASP A 105 127.401 2.279 -6.584 1.00 0.00 H new ATOM 0 HB3 ASP A 105 127.020 3.376 -7.897 1.00 0.00 H new ATOM 409 N LYS A 106 129.135 5.809 -8.222 1.00 0.00 N ATOM 410 CA LYS A 106 128.941 7.079 -8.910 1.00 0.00 C ATOM 411 C LYS A 106 128.213 6.877 -10.236 1.00 0.00 C ATOM 412 O LYS A 106 127.428 7.724 -10.660 1.00 0.00 O ATOM 413 CB LYS A 106 130.288 7.762 -9.155 1.00 0.00 C ATOM 414 CG LYS A 106 131.067 8.043 -7.880 1.00 0.00 C ATOM 415 CD LYS A 106 130.657 9.368 -7.257 1.00 0.00 C ATOM 416 CE LYS A 106 129.304 9.267 -6.574 1.00 0.00 C ATOM 417 NZ LYS A 106 129.161 10.258 -5.472 1.00 0.00 N ATOM 0 H LYS A 106 129.948 5.279 -8.536 1.00 0.00 H new ATOM 0 HA LYS A 106 128.328 7.716 -8.273 1.00 0.00 H new ATOM 0 HB2 LYS A 106 130.892 7.133 -9.809 1.00 0.00 H new ATOM 0 HB3 LYS A 106 130.120 8.701 -9.683 1.00 0.00 H new ATOM 0 HG2 LYS A 106 130.900 7.237 -7.166 1.00 0.00 H new ATOM 0 HG3 LYS A 106 132.134 8.058 -8.100 1.00 0.00 H new ATOM 0 HD2 LYS A 106 131.409 9.679 -6.532 1.00 0.00 H new ATOM 0 HD3 LYS A 106 130.620 10.138 -8.028 1.00 0.00 H new ATOM 0 HE2 LYS A 106 128.514 9.425 -7.308 1.00 0.00 H new ATOM 0 HE3 LYS A 106 129.173 8.261 -6.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 128.895 9.766 -4.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 130.065 10.753 -5.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 128.424 10.948 -5.719 1.00 0.00 H new ATOM 431 N ASN A 107 128.478 5.747 -10.884 1.00 0.00 N ATOM 432 CA ASN A 107 127.849 5.433 -12.162 1.00 0.00 C ATOM 433 C ASN A 107 126.966 4.189 -12.056 1.00 0.00 C ATOM 434 O ASN A 107 126.223 3.869 -12.983 1.00 0.00 O ATOM 435 CB ASN A 107 128.914 5.224 -13.241 1.00 0.00 C ATOM 436 CG ASN A 107 129.936 4.176 -12.849 1.00 0.00 C ATOM 437 OD1 ASN A 107 129.666 3.310 -12.018 1.00 0.00 O ATOM 438 ND2 ASN A 107 131.119 4.251 -13.447 1.00 0.00 N ATOM 0 H ASN A 107 129.124 5.034 -10.545 1.00 0.00 H new ATOM 0 HA ASN A 107 127.217 6.277 -12.438 1.00 0.00 H new ATOM 0 HB2 ASN A 107 128.431 4.926 -14.172 1.00 0.00 H new ATOM 0 HB3 ASN A 107 129.422 6.169 -13.434 1.00 0.00 H new ATOM 0 HD21 ASN A 107 131.848 3.573 -13.223 1.00 0.00 H new ATOM 0 HD22 ASN A 107 131.299 4.986 -14.130 1.00 0.00 H new ATOM 445 N ALA A 108 127.051 3.491 -10.926 1.00 0.00 N ATOM 446 CA ALA A 108 126.259 2.285 -10.712 1.00 0.00 C ATOM 447 C ALA A 108 126.640 1.196 -11.709 1.00 0.00 C ATOM 448 O ALA A 108 125.825 0.782 -12.535 1.00 0.00 O ATOM 449 CB ALA A 108 124.774 2.604 -10.810 1.00 0.00 C ATOM 0 H ALA A 108 127.660 3.740 -10.146 1.00 0.00 H new ATOM 0 HA ALA A 108 126.471 1.912 -9.710 1.00 0.00 H new ATOM 0 HB1 ALA A 108 124.195 1.695 -10.648 1.00 0.00 H new ATOM 0 HB2 ALA A 108 124.510 3.342 -10.053 1.00 0.00 H new ATOM 0 HB3 ALA A 108 124.552 3.004 -11.799 1.00 0.00 H new ATOM 455 N ASP A 109 127.884 0.735 -11.626 1.00 0.00 N ATOM 456 CA ASP A 109 128.375 -0.307 -12.522 1.00 0.00 C ATOM 457 C ASP A 109 128.472 -1.655 -11.809 1.00 0.00 C ATOM 458 O ASP A 109 128.765 -2.675 -12.433 1.00 0.00 O ATOM 459 CB ASP A 109 129.743 0.084 -13.086 1.00 0.00 C ATOM 460 CG ASP A 109 130.775 0.303 -11.999 1.00 0.00 C ATOM 461 OD1 ASP A 109 130.538 1.157 -11.118 1.00 0.00 O ATOM 462 OD2 ASP A 109 131.823 -0.377 -12.028 1.00 0.00 O ATOM 0 H ASP A 109 128.570 1.066 -10.948 1.00 0.00 H new ATOM 0 HA ASP A 109 127.662 -0.407 -13.340 1.00 0.00 H new ATOM 0 HB2 ASP A 109 130.091 -0.697 -13.762 1.00 0.00 H new ATOM 0 HB3 ASP A 109 129.643 0.995 -13.677 1.00 0.00 H new ATOM 467 N GLY A 110 128.227 -1.658 -10.500 1.00 0.00 N ATOM 468 CA GLY A 110 128.295 -2.892 -9.738 1.00 0.00 C ATOM 469 C GLY A 110 129.552 -2.990 -8.891 1.00 0.00 C ATOM 470 O GLY A 110 129.643 -3.834 -8.001 1.00 0.00 O ATOM 0 H GLY A 110 127.983 -0.830 -9.956 1.00 0.00 H new ATOM 0 HA2 GLY A 110 127.420 -2.964 -9.092 1.00 0.00 H new ATOM 0 HA3 GLY A 110 128.256 -3.739 -10.422 1.00 0.00 H new ATOM 474 N TYR A 111 130.522 -2.123 -9.167 1.00 0.00 N ATOM 475 CA TYR A 111 131.775 -2.115 -8.422 1.00 0.00 C ATOM 476 C TYR A 111 132.301 -0.693 -8.266 1.00 0.00 C ATOM 477 O TYR A 111 132.032 0.172 -9.099 1.00 0.00 O ATOM 478 CB TYR A 111 132.822 -2.981 -9.128 1.00 0.00 C ATOM 479 CG TYR A 111 132.285 -4.308 -9.615 1.00 0.00 C ATOM 480 CD1 TYR A 111 131.536 -4.391 -10.782 1.00 0.00 C ATOM 481 CD2 TYR A 111 132.530 -5.478 -8.907 1.00 0.00 C ATOM 482 CE1 TYR A 111 131.044 -5.602 -11.230 1.00 0.00 C ATOM 483 CE2 TYR A 111 132.042 -6.694 -9.350 1.00 0.00 C ATOM 484 CZ TYR A 111 131.300 -6.750 -10.511 1.00 0.00 C ATOM 485 OH TYR A 111 130.813 -7.958 -10.954 1.00 0.00 O ATOM 0 H TYR A 111 130.463 -1.417 -9.901 1.00 0.00 H new ATOM 0 HA TYR A 111 131.582 -2.527 -7.432 1.00 0.00 H new ATOM 0 HB2 TYR A 111 133.225 -2.429 -9.977 1.00 0.00 H new ATOM 0 HB3 TYR A 111 133.651 -3.163 -8.444 1.00 0.00 H new ATOM 0 HD1 TYR A 111 131.335 -3.494 -11.349 1.00 0.00 H new ATOM 0 HD2 TYR A 111 133.110 -5.437 -7.997 1.00 0.00 H new ATOM 0 HE1 TYR A 111 130.462 -5.649 -12.139 1.00 0.00 H new ATOM 0 HE2 TYR A 111 132.241 -7.595 -8.789 1.00 0.00 H new ATOM 0 HH TYR A 111 131.084 -8.667 -10.334 1.00 0.00 H new ATOM 495 N ILE A 112 133.052 -0.456 -7.196 1.00 0.00 N ATOM 496 CA ILE A 112 133.613 0.863 -6.939 1.00 0.00 C ATOM 497 C ILE A 112 135.117 0.786 -6.700 1.00 0.00 C ATOM 498 O ILE A 112 135.637 -0.240 -6.259 1.00 0.00 O ATOM 499 CB ILE A 112 132.944 1.539 -5.725 1.00 0.00 C ATOM 500 CG1 ILE A 112 131.419 1.457 -5.837 1.00 0.00 C ATOM 501 CG2 ILE A 112 133.398 2.986 -5.608 1.00 0.00 C ATOM 502 CD1 ILE A 112 130.750 0.927 -4.589 1.00 0.00 C ATOM 0 H ILE A 112 133.285 -1.159 -6.495 1.00 0.00 H new ATOM 0 HA ILE A 112 133.419 1.463 -7.828 1.00 0.00 H new ATOM 0 HB ILE A 112 133.248 1.009 -4.822 1.00 0.00 H new ATOM 0 HG12 ILE A 112 131.025 2.449 -6.057 1.00 0.00 H new ATOM 0 HG13 ILE A 112 131.158 0.816 -6.679 1.00 0.00 H new ATOM 0 HG21 ILE A 112 132.917 3.450 -4.747 1.00 0.00 H new ATOM 0 HG22 ILE A 112 134.480 3.019 -5.481 1.00 0.00 H new ATOM 0 HG23 ILE A 112 133.122 3.528 -6.513 1.00 0.00 H new ATOM 0 HD11 ILE A 112 129.671 0.896 -4.740 1.00 0.00 H new ATOM 0 HD12 ILE A 112 131.116 -0.078 -4.379 1.00 0.00 H new ATOM 0 HD13 ILE A 112 130.980 1.580 -3.747 1.00 0.00 H new ATOM 514 N ASP A 113 135.809 1.881 -7.000 1.00 0.00 N ATOM 515 CA ASP A 113 137.254 1.951 -6.826 1.00 0.00 C ATOM 516 C ASP A 113 137.658 3.276 -6.184 1.00 0.00 C ATOM 517 O ASP A 113 136.821 4.151 -5.966 1.00 0.00 O ATOM 518 CB ASP A 113 137.956 1.787 -8.176 1.00 0.00 C ATOM 519 CG ASP A 113 139.364 1.243 -8.038 1.00 0.00 C ATOM 520 OD1 ASP A 113 139.510 0.032 -7.771 1.00 0.00 O ATOM 521 OD2 ASP A 113 140.321 2.028 -8.200 1.00 0.00 O ATOM 0 H ASP A 113 135.389 2.735 -7.366 1.00 0.00 H new ATOM 0 HA ASP A 113 137.559 1.140 -6.165 1.00 0.00 H new ATOM 0 HB2 ASP A 113 137.372 1.117 -8.806 1.00 0.00 H new ATOM 0 HB3 ASP A 113 137.991 2.751 -8.683 1.00 0.00 H new ATOM 526 N LEU A 114 138.945 3.415 -5.880 1.00 0.00 N ATOM 527 CA LEU A 114 139.461 4.631 -5.260 1.00 0.00 C ATOM 528 C LEU A 114 139.093 5.867 -6.077 1.00 0.00 C ATOM 529 O LEU A 114 138.739 6.906 -5.523 1.00 0.00 O ATOM 530 CB LEU A 114 140.980 4.543 -5.105 1.00 0.00 C ATOM 531 CG LEU A 114 141.574 5.441 -4.018 1.00 0.00 C ATOM 532 CD1 LEU A 114 141.557 4.733 -2.673 1.00 0.00 C ATOM 533 CD2 LEU A 114 142.991 5.856 -4.388 1.00 0.00 C ATOM 0 H LEU A 114 139.651 2.699 -6.053 1.00 0.00 H new ATOM 0 HA LEU A 114 139.004 4.724 -4.275 1.00 0.00 H new ATOM 0 HB2 LEU A 114 141.248 3.509 -4.887 1.00 0.00 H new ATOM 0 HB3 LEU A 114 141.442 4.798 -6.058 1.00 0.00 H new ATOM 0 HG LEU A 114 140.962 6.339 -3.939 1.00 0.00 H new ATOM 0 HD11 LEU A 114 141.983 5.387 -1.912 1.00 0.00 H new ATOM 0 HD12 LEU A 114 140.530 4.486 -2.405 1.00 0.00 H new ATOM 0 HD13 LEU A 114 142.146 3.818 -2.736 1.00 0.00 H new ATOM 0 HD21 LEU A 114 143.399 6.494 -3.605 1.00 0.00 H new ATOM 0 HD22 LEU A 114 143.614 4.968 -4.494 1.00 0.00 H new ATOM 0 HD23 LEU A 114 142.975 6.403 -5.331 1.00 0.00 H new ATOM 545 N GLU A 115 139.181 5.748 -7.399 1.00 0.00 N ATOM 546 CA GLU A 115 138.859 6.858 -8.289 1.00 0.00 C ATOM 547 C GLU A 115 137.426 7.334 -8.069 1.00 0.00 C ATOM 548 O GLU A 115 137.174 8.532 -7.937 1.00 0.00 O ATOM 549 CB GLU A 115 139.056 6.446 -9.749 1.00 0.00 C ATOM 550 CG GLU A 115 138.242 5.230 -10.153 1.00 0.00 C ATOM 551 CD GLU A 115 138.908 4.420 -11.249 1.00 0.00 C ATOM 552 OE1 GLU A 115 140.136 4.206 -11.168 1.00 0.00 O ATOM 553 OE2 GLU A 115 138.203 4.002 -12.191 1.00 0.00 O ATOM 0 H GLU A 115 139.472 4.895 -7.876 1.00 0.00 H new ATOM 0 HA GLU A 115 139.535 7.682 -8.060 1.00 0.00 H new ATOM 0 HB2 GLU A 115 138.787 7.283 -10.393 1.00 0.00 H new ATOM 0 HB3 GLU A 115 140.112 6.239 -9.920 1.00 0.00 H new ATOM 0 HG2 GLU A 115 138.087 4.595 -9.281 1.00 0.00 H new ATOM 0 HG3 GLU A 115 137.258 5.553 -10.492 1.00 0.00 H new ATOM 560 N GLU A 116 136.492 6.390 -8.030 1.00 0.00 N ATOM 561 CA GLU A 116 135.085 6.714 -7.822 1.00 0.00 C ATOM 562 C GLU A 116 134.841 7.166 -6.385 1.00 0.00 C ATOM 563 O GLU A 116 134.273 8.231 -6.146 1.00 0.00 O ATOM 564 CB GLU A 116 134.206 5.505 -8.150 1.00 0.00 C ATOM 565 CG GLU A 116 133.350 5.693 -9.394 1.00 0.00 C ATOM 566 CD GLU A 116 132.451 4.504 -9.666 1.00 0.00 C ATOM 567 OE1 GLU A 116 131.529 4.259 -8.860 1.00 0.00 O ATOM 568 OE2 GLU A 116 132.666 3.819 -10.689 1.00 0.00 O ATOM 0 H GLU A 116 136.684 5.394 -8.140 1.00 0.00 H new ATOM 0 HA GLU A 116 134.822 7.533 -8.491 1.00 0.00 H new ATOM 0 HB2 GLU A 116 134.842 4.630 -8.286 1.00 0.00 H new ATOM 0 HB3 GLU A 116 133.556 5.298 -7.300 1.00 0.00 H new ATOM 0 HG2 GLU A 116 132.738 6.588 -9.278 1.00 0.00 H new ATOM 0 HG3 GLU A 116 133.998 5.859 -10.255 1.00 0.00 H new ATOM 575 N LEU A 117 135.274 6.344 -5.434 1.00 0.00 N ATOM 576 CA LEU A 117 135.106 6.652 -4.017 1.00 0.00 C ATOM 577 C LEU A 117 135.627 8.049 -3.691 1.00 0.00 C ATOM 578 O LEU A 117 135.142 8.704 -2.768 1.00 0.00 O ATOM 579 CB LEU A 117 135.830 5.613 -3.160 1.00 0.00 C ATOM 580 CG LEU A 117 135.432 5.596 -1.684 1.00 0.00 C ATOM 581 CD1 LEU A 117 134.047 4.989 -1.512 1.00 0.00 C ATOM 582 CD2 LEU A 117 136.457 4.829 -0.864 1.00 0.00 C ATOM 0 H LEU A 117 135.745 5.458 -5.619 1.00 0.00 H new ATOM 0 HA LEU A 117 134.040 6.623 -3.792 1.00 0.00 H new ATOM 0 HB2 LEU A 117 135.645 4.625 -3.581 1.00 0.00 H new ATOM 0 HB3 LEU A 117 136.903 5.793 -3.229 1.00 0.00 H new ATOM 0 HG LEU A 117 135.404 6.624 -1.323 1.00 0.00 H new ATOM 0 HD11 LEU A 117 133.780 4.985 -0.455 1.00 0.00 H new ATOM 0 HD12 LEU A 117 133.319 5.580 -2.068 1.00 0.00 H new ATOM 0 HD13 LEU A 117 134.048 3.967 -1.890 1.00 0.00 H new ATOM 0 HD21 LEU A 117 136.157 4.827 0.184 1.00 0.00 H new ATOM 0 HD22 LEU A 117 136.518 3.803 -1.226 1.00 0.00 H new ATOM 0 HD23 LEU A 117 137.432 5.306 -0.962 1.00 0.00 H new ATOM 594 N LYS A 118 136.618 8.500 -4.455 1.00 0.00 N ATOM 595 CA LYS A 118 137.203 9.820 -4.247 1.00 0.00 C ATOM 596 C LYS A 118 136.149 10.912 -4.406 1.00 0.00 C ATOM 597 O LYS A 118 136.114 11.871 -3.634 1.00 0.00 O ATOM 598 CB LYS A 118 138.350 10.054 -5.231 1.00 0.00 C ATOM 599 CG LYS A 118 139.306 11.153 -4.800 1.00 0.00 C ATOM 600 CD LYS A 118 140.070 11.724 -5.985 1.00 0.00 C ATOM 601 CE LYS A 118 140.865 12.958 -5.591 1.00 0.00 C ATOM 602 NZ LYS A 118 141.832 13.356 -6.652 1.00 0.00 N ATOM 0 H LYS A 118 137.032 7.971 -5.223 1.00 0.00 H new ATOM 0 HA LYS A 118 137.593 9.861 -3.230 1.00 0.00 H new ATOM 0 HB2 LYS A 118 138.908 9.126 -5.353 1.00 0.00 H new ATOM 0 HB3 LYS A 118 137.935 10.307 -6.207 1.00 0.00 H new ATOM 0 HG2 LYS A 118 138.748 11.949 -4.308 1.00 0.00 H new ATOM 0 HG3 LYS A 118 140.010 10.758 -4.068 1.00 0.00 H new ATOM 0 HD2 LYS A 118 140.745 10.967 -6.383 1.00 0.00 H new ATOM 0 HD3 LYS A 118 139.371 11.979 -6.782 1.00 0.00 H new ATOM 0 HE2 LYS A 118 140.181 13.784 -5.395 1.00 0.00 H new ATOM 0 HE3 LYS A 118 141.403 12.763 -4.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 142.355 14.201 -6.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 142.501 12.578 -6.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 141.316 13.567 -7.530 1.00 0.00 H new ATOM 616 N ILE A 119 135.295 10.760 -5.411 1.00 0.00 N ATOM 617 CA ILE A 119 134.240 11.732 -5.673 1.00 0.00 C ATOM 618 C ILE A 119 133.136 11.643 -4.622 1.00 0.00 C ATOM 619 O ILE A 119 132.441 12.623 -4.354 1.00 0.00 O ATOM 620 CB ILE A 119 133.622 11.530 -7.070 1.00 0.00 C ATOM 621 CG1 ILE A 119 134.721 11.475 -8.136 1.00 0.00 C ATOM 622 CG2 ILE A 119 132.631 12.643 -7.380 1.00 0.00 C ATOM 623 CD1 ILE A 119 134.956 10.086 -8.690 1.00 0.00 C ATOM 0 H ILE A 119 135.312 9.972 -6.059 1.00 0.00 H new ATOM 0 HA ILE A 119 134.702 12.718 -5.628 1.00 0.00 H new ATOM 0 HB ILE A 119 133.085 10.581 -7.078 1.00 0.00 H new ATOM 0 HG12 ILE A 119 134.456 12.144 -8.955 1.00 0.00 H new ATOM 0 HG13 ILE A 119 135.651 11.849 -7.707 1.00 0.00 H new ATOM 0 HG21 ILE A 119 132.204 12.485 -8.370 1.00 0.00 H new ATOM 0 HG22 ILE A 119 131.834 12.638 -6.636 1.00 0.00 H new ATOM 0 HG23 ILE A 119 133.144 13.604 -7.356 1.00 0.00 H new ATOM 0 HD11 ILE A 119 135.747 10.122 -9.439 1.00 0.00 H new ATOM 0 HD12 ILE A 119 135.252 9.417 -7.882 1.00 0.00 H new ATOM 0 HD13 ILE A 119 134.038 9.717 -9.148 1.00 0.00 H new ATOM 635 N MET A 120 132.981 10.463 -4.029 1.00 0.00 N ATOM 636 CA MET A 120 131.962 10.250 -3.006 1.00 0.00 C ATOM 637 C MET A 120 132.313 11.001 -1.725 1.00 0.00 C ATOM 638 O MET A 120 131.438 11.554 -1.060 1.00 0.00 O ATOM 639 CB MET A 120 131.811 8.757 -2.711 1.00 0.00 C ATOM 640 CG MET A 120 130.528 8.411 -1.973 1.00 0.00 C ATOM 641 SD MET A 120 130.773 7.150 -0.706 1.00 0.00 S ATOM 642 CE MET A 120 131.601 8.104 0.563 1.00 0.00 C ATOM 0 H MET A 120 133.547 9.641 -4.239 1.00 0.00 H new ATOM 0 HA MET A 120 131.015 10.636 -3.384 1.00 0.00 H new ATOM 0 HB2 MET A 120 131.841 8.204 -3.650 1.00 0.00 H new ATOM 0 HB3 MET A 120 132.663 8.424 -2.118 1.00 0.00 H new ATOM 0 HG2 MET A 120 130.125 9.312 -1.510 1.00 0.00 H new ATOM 0 HG3 MET A 120 129.785 8.061 -2.689 1.00 0.00 H new ATOM 0 HE1 MET A 120 131.677 7.510 1.473 1.00 0.00 H new ATOM 0 HE2 MET A 120 132.600 8.374 0.221 1.00 0.00 H new ATOM 0 HE3 MET A 120 131.030 9.010 0.768 1.00 0.00 H new ATOM 652 N LEU A 121 133.598 11.014 -1.386 1.00 0.00 N ATOM 653 CA LEU A 121 134.064 11.698 -0.184 1.00 0.00 C ATOM 654 C LEU A 121 133.889 13.207 -0.312 1.00 0.00 C ATOM 655 O LEU A 121 133.734 13.909 0.688 1.00 0.00 O ATOM 656 CB LEU A 121 135.533 11.362 0.081 1.00 0.00 C ATOM 657 CG LEU A 121 135.778 10.006 0.749 1.00 0.00 C ATOM 658 CD1 LEU A 121 136.732 9.162 -0.082 1.00 0.00 C ATOM 659 CD2 LEU A 121 136.321 10.194 2.158 1.00 0.00 C ATOM 0 H LEU A 121 134.335 10.559 -1.926 1.00 0.00 H new ATOM 0 HA LEU A 121 133.462 11.353 0.657 1.00 0.00 H new ATOM 0 HB2 LEU A 121 136.072 11.386 -0.866 1.00 0.00 H new ATOM 0 HB3 LEU A 121 135.960 12.142 0.711 1.00 0.00 H new ATOM 0 HG LEU A 121 134.825 9.481 0.815 1.00 0.00 H new ATOM 0 HD11 LEU A 121 136.892 8.203 0.410 1.00 0.00 H new ATOM 0 HD12 LEU A 121 136.304 8.995 -1.070 1.00 0.00 H new ATOM 0 HD13 LEU A 121 137.685 9.682 -0.183 1.00 0.00 H new ATOM 0 HD21 LEU A 121 136.489 9.219 2.616 1.00 0.00 H new ATOM 0 HD22 LEU A 121 137.262 10.742 2.115 1.00 0.00 H new ATOM 0 HD23 LEU A 121 135.601 10.756 2.753 1.00 0.00 H new ATOM 671 N GLN A 122 133.912 13.702 -1.544 1.00 0.00 N ATOM 672 CA GLN A 122 133.750 15.130 -1.797 1.00 0.00 C ATOM 673 C GLN A 122 132.434 15.639 -1.215 1.00 0.00 C ATOM 674 O GLN A 122 132.290 16.827 -0.927 1.00 0.00 O ATOM 675 CB GLN A 122 133.800 15.413 -3.299 1.00 0.00 C ATOM 676 CG GLN A 122 135.211 15.473 -3.860 1.00 0.00 C ATOM 677 CD GLN A 122 135.823 16.856 -3.753 1.00 0.00 C ATOM 678 OE1 GLN A 122 136.024 17.375 -2.655 1.00 0.00 O ATOM 679 NE2 GLN A 122 136.122 17.460 -4.897 1.00 0.00 N ATOM 0 H GLN A 122 134.041 13.137 -2.383 1.00 0.00 H new ATOM 0 HA GLN A 122 134.571 15.655 -1.309 1.00 0.00 H new ATOM 0 HB2 GLN A 122 133.241 14.639 -3.825 1.00 0.00 H new ATOM 0 HB3 GLN A 122 133.298 16.360 -3.499 1.00 0.00 H new ATOM 0 HG2 GLN A 122 135.840 14.759 -3.328 1.00 0.00 H new ATOM 0 HG3 GLN A 122 135.195 15.167 -4.906 1.00 0.00 H new ATOM 0 HE21 GLN A 122 135.938 16.992 -5.784 1.00 0.00 H new ATOM 0 HE22 GLN A 122 136.536 18.392 -4.889 1.00 0.00 H new ATOM 688 N ALA A 123 131.476 14.730 -1.041 1.00 0.00 N ATOM 689 CA ALA A 123 130.174 15.085 -0.490 1.00 0.00 C ATOM 690 C ALA A 123 130.320 15.766 0.866 1.00 0.00 C ATOM 691 O ALA A 123 129.688 16.788 1.130 1.00 0.00 O ATOM 692 CB ALA A 123 129.297 13.849 -0.372 1.00 0.00 C ATOM 0 H ALA A 123 131.579 13.742 -1.274 1.00 0.00 H new ATOM 0 HA ALA A 123 129.698 15.790 -1.171 1.00 0.00 H new ATOM 0 HB1 ALA A 123 128.328 14.129 0.041 1.00 0.00 H new ATOM 0 HB2 ALA A 123 129.157 13.406 -1.358 1.00 0.00 H new ATOM 0 HB3 ALA A 123 129.776 13.124 0.286 1.00 0.00 H new ATOM 698 N THR A 124 131.161 15.194 1.723 1.00 0.00 N ATOM 699 CA THR A 124 131.391 15.752 3.050 1.00 0.00 C ATOM 700 C THR A 124 132.064 17.116 2.948 1.00 0.00 C ATOM 701 O THR A 124 132.488 17.529 1.868 1.00 0.00 O ATOM 702 CB THR A 124 132.255 14.803 3.883 1.00 0.00 C ATOM 703 OG1 THR A 124 133.539 14.652 3.303 1.00 0.00 O ATOM 704 CG2 THR A 124 131.655 13.422 4.033 1.00 0.00 C ATOM 0 H THR A 124 131.693 14.347 1.522 1.00 0.00 H new ATOM 0 HA THR A 124 130.426 15.875 3.542 1.00 0.00 H new ATOM 0 HB THR A 124 132.319 15.263 4.869 1.00 0.00 H new ATOM 0 HG1 THR A 124 133.447 14.306 2.391 1.00 0.00 H new ATOM 0 HG21 THR A 124 132.318 12.800 4.634 1.00 0.00 H new ATOM 0 HG22 THR A 124 130.685 13.498 4.524 1.00 0.00 H new ATOM 0 HG23 THR A 124 131.529 12.971 3.049 1.00 0.00 H new ATOM 712 N GLY A 125 132.162 17.815 4.075 1.00 0.00 N ATOM 713 CA GLY A 125 132.785 19.126 4.081 1.00 0.00 C ATOM 714 C GLY A 125 134.075 19.153 4.876 1.00 0.00 C ATOM 715 O GLY A 125 134.471 20.197 5.392 1.00 0.00 O ATOM 0 H GLY A 125 131.822 17.497 4.983 1.00 0.00 H new ATOM 0 HA2 GLY A 125 132.988 19.433 3.055 1.00 0.00 H new ATOM 0 HA3 GLY A 125 132.089 19.853 4.499 1.00 0.00 H new ATOM 719 N GLU A 126 134.730 18.001 4.975 1.00 0.00 N ATOM 720 CA GLU A 126 135.984 17.897 5.713 1.00 0.00 C ATOM 721 C GLU A 126 137.175 17.880 4.760 1.00 0.00 C ATOM 722 O GLU A 126 137.037 18.183 3.574 1.00 0.00 O ATOM 723 CB GLU A 126 135.988 16.634 6.577 1.00 0.00 C ATOM 724 CG GLU A 126 134.692 16.414 7.339 1.00 0.00 C ATOM 725 CD GLU A 126 134.828 15.370 8.430 1.00 0.00 C ATOM 726 OE1 GLU A 126 135.162 14.212 8.105 1.00 0.00 O ATOM 727 OE2 GLU A 126 134.601 15.711 9.611 1.00 0.00 O ATOM 0 H GLU A 126 134.414 17.127 4.554 1.00 0.00 H new ATOM 0 HA GLU A 126 136.071 18.771 6.359 1.00 0.00 H new ATOM 0 HB2 GLU A 126 136.177 15.769 5.941 1.00 0.00 H new ATOM 0 HB3 GLU A 126 136.812 16.693 7.288 1.00 0.00 H new ATOM 0 HG2 GLU A 126 134.370 17.357 7.781 1.00 0.00 H new ATOM 0 HG3 GLU A 126 133.913 16.107 6.642 1.00 0.00 H new ATOM 734 N THR A 127 138.343 17.523 5.282 1.00 0.00 N ATOM 735 CA THR A 127 139.557 17.466 4.477 1.00 0.00 C ATOM 736 C THR A 127 140.129 16.051 4.460 1.00 0.00 C ATOM 737 O THR A 127 140.620 15.559 5.475 1.00 0.00 O ATOM 738 CB THR A 127 140.601 18.443 5.019 1.00 0.00 C ATOM 739 OG1 THR A 127 140.632 18.408 6.435 1.00 0.00 O ATOM 740 CG2 THR A 127 140.352 19.876 4.599 1.00 0.00 C ATOM 0 H THR A 127 138.475 17.268 6.261 1.00 0.00 H new ATOM 0 HA THR A 127 139.301 17.750 3.456 1.00 0.00 H new ATOM 0 HB THR A 127 141.551 18.117 4.596 1.00 0.00 H new ATOM 0 HG1 THR A 127 140.624 17.477 6.739 1.00 0.00 H new ATOM 0 HG21 THR A 127 141.128 20.518 5.017 1.00 0.00 H new ATOM 0 HG22 THR A 127 140.371 19.945 3.511 1.00 0.00 H new ATOM 0 HG23 THR A 127 139.378 20.199 4.966 1.00 0.00 H new ATOM 748 N ILE A 128 140.061 15.403 3.301 1.00 0.00 N ATOM 749 CA ILE A 128 140.570 14.045 3.155 1.00 0.00 C ATOM 750 C ILE A 128 141.787 14.010 2.238 1.00 0.00 C ATOM 751 O ILE A 128 141.844 14.727 1.239 1.00 0.00 O ATOM 752 CB ILE A 128 139.492 13.100 2.592 1.00 0.00 C ATOM 753 CG1 ILE A 128 138.185 13.257 3.372 1.00 0.00 C ATOM 754 CG2 ILE A 128 139.975 11.658 2.642 1.00 0.00 C ATOM 755 CD1 ILE A 128 138.306 12.888 4.835 1.00 0.00 C ATOM 0 H ILE A 128 139.659 15.797 2.450 1.00 0.00 H new ATOM 0 HA ILE A 128 140.858 13.706 4.150 1.00 0.00 H new ATOM 0 HB ILE A 128 139.305 13.365 1.551 1.00 0.00 H new ATOM 0 HG12 ILE A 128 137.846 14.290 3.293 1.00 0.00 H new ATOM 0 HG13 ILE A 128 137.419 12.634 2.911 1.00 0.00 H new ATOM 0 HG21 ILE A 128 139.203 11.002 2.241 1.00 0.00 H new ATOM 0 HG22 ILE A 128 140.882 11.557 2.046 1.00 0.00 H new ATOM 0 HG23 ILE A 128 140.186 11.381 3.675 1.00 0.00 H new ATOM 0 HD11 ILE A 128 137.342 13.023 5.325 1.00 0.00 H new ATOM 0 HD12 ILE A 128 138.615 11.846 4.923 1.00 0.00 H new ATOM 0 HD13 ILE A 128 139.049 13.528 5.311 1.00 0.00 H new ATOM 767 N THR A 129 142.758 13.172 2.584 1.00 0.00 N ATOM 768 CA THR A 129 143.975 13.045 1.790 1.00 0.00 C ATOM 769 C THR A 129 143.945 11.769 0.952 1.00 0.00 C ATOM 770 O THR A 129 143.118 10.888 1.176 1.00 0.00 O ATOM 771 CB THR A 129 145.206 13.043 2.700 1.00 0.00 C ATOM 772 OG1 THR A 129 144.950 12.312 3.886 1.00 0.00 O ATOM 773 CG2 THR A 129 145.653 14.432 3.103 1.00 0.00 C ATOM 0 H THR A 129 142.726 12.571 3.408 1.00 0.00 H new ATOM 0 HA THR A 129 144.032 13.901 1.117 1.00 0.00 H new ATOM 0 HB THR A 129 146.000 12.579 2.114 1.00 0.00 H new ATOM 0 HG1 THR A 129 145.748 12.321 4.454 1.00 0.00 H new ATOM 0 HG21 THR A 129 146.529 14.360 3.747 1.00 0.00 H new ATOM 0 HG22 THR A 129 145.904 15.006 2.211 1.00 0.00 H new ATOM 0 HG23 THR A 129 144.847 14.932 3.641 1.00 0.00 H new ATOM 781 N GLU A 130 144.856 11.679 -0.012 1.00 0.00 N ATOM 782 CA GLU A 130 144.934 10.511 -0.882 1.00 0.00 C ATOM 783 C GLU A 130 145.179 9.242 -0.070 1.00 0.00 C ATOM 784 O GLU A 130 144.752 8.155 -0.456 1.00 0.00 O ATOM 785 CB GLU A 130 146.049 10.694 -1.915 1.00 0.00 C ATOM 786 CG GLU A 130 145.723 10.095 -3.273 1.00 0.00 C ATOM 787 CD GLU A 130 146.134 10.995 -4.421 1.00 0.00 C ATOM 788 OE1 GLU A 130 145.782 12.194 -4.392 1.00 0.00 O ATOM 789 OE2 GLU A 130 146.808 10.504 -5.350 1.00 0.00 O ATOM 0 H GLU A 130 145.550 12.400 -0.210 1.00 0.00 H new ATOM 0 HA GLU A 130 143.980 10.409 -1.400 1.00 0.00 H new ATOM 0 HB2 GLU A 130 146.250 11.758 -2.035 1.00 0.00 H new ATOM 0 HB3 GLU A 130 146.963 10.237 -1.536 1.00 0.00 H new ATOM 0 HG2 GLU A 130 146.226 9.133 -3.372 1.00 0.00 H new ATOM 0 HG3 GLU A 130 144.652 9.902 -3.333 1.00 0.00 H new ATOM 796 N ASP A 131 145.870 9.392 1.056 1.00 0.00 N ATOM 797 CA ASP A 131 146.171 8.258 1.923 1.00 0.00 C ATOM 798 C ASP A 131 144.942 7.848 2.730 1.00 0.00 C ATOM 799 O ASP A 131 144.769 6.676 3.062 1.00 0.00 O ATOM 800 CB ASP A 131 147.323 8.605 2.868 1.00 0.00 C ATOM 801 CG ASP A 131 148.061 7.374 3.355 1.00 0.00 C ATOM 802 OD1 ASP A 131 148.352 6.488 2.524 1.00 0.00 O ATOM 803 OD2 ASP A 131 148.349 7.295 4.568 1.00 0.00 O ATOM 0 H ASP A 131 146.231 10.286 1.389 1.00 0.00 H new ATOM 0 HA ASP A 131 146.466 7.419 1.293 1.00 0.00 H new ATOM 0 HB2 ASP A 131 148.023 9.266 2.356 1.00 0.00 H new ATOM 0 HB3 ASP A 131 146.934 9.155 3.725 1.00 0.00 H new ATOM 808 N ASP A 132 144.092 8.821 3.041 1.00 0.00 N ATOM 809 CA ASP A 132 142.880 8.562 3.808 1.00 0.00 C ATOM 810 C ASP A 132 141.877 7.758 2.988 1.00 0.00 C ATOM 811 O ASP A 132 141.262 6.817 3.489 1.00 0.00 O ATOM 812 CB ASP A 132 142.247 9.879 4.261 1.00 0.00 C ATOM 813 CG ASP A 132 142.753 10.328 5.618 1.00 0.00 C ATOM 814 OD1 ASP A 132 142.556 9.584 6.601 1.00 0.00 O ATOM 815 OD2 ASP A 132 143.348 11.423 5.696 1.00 0.00 O ATOM 0 H ASP A 132 144.221 9.797 2.773 1.00 0.00 H new ATOM 0 HA ASP A 132 143.154 7.977 4.686 1.00 0.00 H new ATOM 0 HB2 ASP A 132 142.458 10.653 3.523 1.00 0.00 H new ATOM 0 HB3 ASP A 132 141.164 9.764 4.300 1.00 0.00 H new ATOM 820 N ILE A 133 141.714 8.136 1.724 1.00 0.00 N ATOM 821 CA ILE A 133 140.785 7.450 0.833 1.00 0.00 C ATOM 822 C ILE A 133 141.207 6.000 0.603 1.00 0.00 C ATOM 823 O ILE A 133 140.388 5.157 0.240 1.00 0.00 O ATOM 824 CB ILE A 133 140.677 8.167 -0.528 1.00 0.00 C ATOM 825 CG1 ILE A 133 140.344 9.647 -0.327 1.00 0.00 C ATOM 826 CG2 ILE A 133 139.624 7.498 -1.401 1.00 0.00 C ATOM 827 CD1 ILE A 133 140.753 10.521 -1.491 1.00 0.00 C ATOM 0 H ILE A 133 142.214 8.914 1.294 1.00 0.00 H new ATOM 0 HA ILE A 133 139.811 7.466 1.321 1.00 0.00 H new ATOM 0 HB ILE A 133 141.640 8.095 -1.034 1.00 0.00 H new ATOM 0 HG12 ILE A 133 139.271 9.751 -0.164 1.00 0.00 H new ATOM 0 HG13 ILE A 133 140.839 10.003 0.576 1.00 0.00 H new ATOM 0 HG21 ILE A 133 139.561 8.017 -2.357 1.00 0.00 H new ATOM 0 HG22 ILE A 133 139.900 6.457 -1.570 1.00 0.00 H new ATOM 0 HG23 ILE A 133 138.656 7.540 -0.901 1.00 0.00 H new ATOM 0 HD11 ILE A 133 140.487 11.557 -1.280 1.00 0.00 H new ATOM 0 HD12 ILE A 133 141.830 10.447 -1.641 1.00 0.00 H new ATOM 0 HD13 ILE A 133 140.238 10.191 -2.393 1.00 0.00 H new ATOM 839 N GLU A 134 142.488 5.717 0.815 1.00 0.00 N ATOM 840 CA GLU A 134 143.012 4.368 0.630 1.00 0.00 C ATOM 841 C GLU A 134 142.555 3.446 1.755 1.00 0.00 C ATOM 842 O GLU A 134 142.305 2.262 1.536 1.00 0.00 O ATOM 843 CB GLU A 134 144.540 4.399 0.564 1.00 0.00 C ATOM 844 CG GLU A 134 145.090 4.345 -0.853 1.00 0.00 C ATOM 845 CD GLU A 134 146.306 3.447 -0.972 1.00 0.00 C ATOM 846 OE1 GLU A 134 147.271 3.651 -0.205 1.00 0.00 O ATOM 847 OE2 GLU A 134 146.295 2.543 -1.834 1.00 0.00 O ATOM 0 H GLU A 134 143.182 6.402 1.115 1.00 0.00 H new ATOM 0 HA GLU A 134 142.623 3.979 -0.311 1.00 0.00 H new ATOM 0 HB2 GLU A 134 144.898 5.307 1.049 1.00 0.00 H new ATOM 0 HB3 GLU A 134 144.937 3.557 1.131 1.00 0.00 H new ATOM 0 HG2 GLU A 134 144.312 3.988 -1.528 1.00 0.00 H new ATOM 0 HG3 GLU A 134 145.354 5.352 -1.175 1.00 0.00 H new ATOM 854 N GLU A 135 142.453 3.998 2.961 1.00 0.00 N ATOM 855 CA GLU A 135 142.027 3.225 4.123 1.00 0.00 C ATOM 856 C GLU A 135 140.658 2.594 3.892 1.00 0.00 C ATOM 857 O GLU A 135 140.374 1.504 4.391 1.00 0.00 O ATOM 858 CB GLU A 135 141.987 4.116 5.365 1.00 0.00 C ATOM 859 CG GLU A 135 143.303 4.162 6.124 1.00 0.00 C ATOM 860 CD GLU A 135 143.123 4.548 7.580 1.00 0.00 C ATOM 861 OE1 GLU A 135 142.895 5.745 7.854 1.00 0.00 O ATOM 862 OE2 GLU A 135 143.211 3.652 8.447 1.00 0.00 O ATOM 0 H GLU A 135 142.659 4.977 3.159 1.00 0.00 H new ATOM 0 HA GLU A 135 142.751 2.425 4.278 1.00 0.00 H new ATOM 0 HB2 GLU A 135 141.714 5.128 5.067 1.00 0.00 H new ATOM 0 HB3 GLU A 135 141.204 3.758 6.034 1.00 0.00 H new ATOM 0 HG2 GLU A 135 143.785 3.186 6.068 1.00 0.00 H new ATOM 0 HG3 GLU A 135 143.971 4.876 5.643 1.00 0.00 H new ATOM 869 N LEU A 136 139.813 3.283 3.133 1.00 0.00 N ATOM 870 CA LEU A 136 138.474 2.789 2.836 1.00 0.00 C ATOM 871 C LEU A 136 138.530 1.593 1.891 1.00 0.00 C ATOM 872 O LEU A 136 137.846 0.590 2.099 1.00 0.00 O ATOM 873 CB LEU A 136 137.621 3.902 2.223 1.00 0.00 C ATOM 874 CG LEU A 136 136.654 4.584 3.191 1.00 0.00 C ATOM 875 CD1 LEU A 136 136.308 5.983 2.705 1.00 0.00 C ATOM 876 CD2 LEU A 136 135.392 3.750 3.357 1.00 0.00 C ATOM 0 H LEU A 136 140.032 4.186 2.712 1.00 0.00 H new ATOM 0 HA LEU A 136 138.018 2.466 3.772 1.00 0.00 H new ATOM 0 HB2 LEU A 136 138.285 4.658 1.803 1.00 0.00 H new ATOM 0 HB3 LEU A 136 137.048 3.485 1.394 1.00 0.00 H new ATOM 0 HG LEU A 136 137.142 4.669 4.162 1.00 0.00 H new ATOM 0 HD11 LEU A 136 135.619 6.452 3.407 1.00 0.00 H new ATOM 0 HD12 LEU A 136 137.218 6.580 2.636 1.00 0.00 H new ATOM 0 HD13 LEU A 136 135.839 5.921 1.723 1.00 0.00 H new ATOM 0 HD21 LEU A 136 134.714 4.250 4.049 1.00 0.00 H new ATOM 0 HD22 LEU A 136 134.903 3.634 2.390 1.00 0.00 H new ATOM 0 HD23 LEU A 136 135.654 2.768 3.751 1.00 0.00 H new ATOM 888 N MET A 137 139.349 1.707 0.849 1.00 0.00 N ATOM 889 CA MET A 137 139.493 0.634 -0.129 1.00 0.00 C ATOM 890 C MET A 137 140.303 -0.523 0.445 1.00 0.00 C ATOM 891 O MET A 137 140.034 -1.689 0.152 1.00 0.00 O ATOM 892 CB MET A 137 140.160 1.164 -1.400 1.00 0.00 C ATOM 893 CG MET A 137 139.418 0.799 -2.675 1.00 0.00 C ATOM 894 SD MET A 137 138.301 2.104 -3.225 1.00 0.00 S ATOM 895 CE MET A 137 136.778 1.184 -3.424 1.00 0.00 C ATOM 0 H MET A 137 139.922 2.530 0.661 1.00 0.00 H new ATOM 0 HA MET A 137 138.498 0.264 -0.377 1.00 0.00 H new ATOM 0 HB2 MET A 137 140.239 2.249 -1.333 1.00 0.00 H new ATOM 0 HB3 MET A 137 141.176 0.774 -1.457 1.00 0.00 H new ATOM 0 HG2 MET A 137 140.140 0.588 -3.464 1.00 0.00 H new ATOM 0 HG3 MET A 137 138.849 -0.116 -2.511 1.00 0.00 H new ATOM 0 HE1 MET A 137 136.161 1.661 -4.185 1.00 0.00 H new ATOM 0 HE2 MET A 137 137.007 0.163 -3.730 1.00 0.00 H new ATOM 0 HE3 MET A 137 136.237 1.166 -2.478 1.00 0.00 H new ATOM 905 N LYS A 138 141.300 -0.195 1.262 1.00 0.00 N ATOM 906 CA LYS A 138 142.152 -1.208 1.875 1.00 0.00 C ATOM 907 C LYS A 138 141.329 -2.174 2.724 1.00 0.00 C ATOM 908 O LYS A 138 141.150 -3.337 2.362 1.00 0.00 O ATOM 909 CB LYS A 138 143.232 -0.545 2.734 1.00 0.00 C ATOM 910 CG LYS A 138 144.647 -0.918 2.325 1.00 0.00 C ATOM 911 CD LYS A 138 145.669 -0.425 3.338 1.00 0.00 C ATOM 912 CE LYS A 138 146.926 0.090 2.657 1.00 0.00 C ATOM 913 NZ LYS A 138 148.014 0.362 3.636 1.00 0.00 N ATOM 0 H LYS A 138 141.537 0.764 1.515 1.00 0.00 H new ATOM 0 HA LYS A 138 142.631 -1.775 1.076 1.00 0.00 H new ATOM 0 HB2 LYS A 138 143.119 0.537 2.674 1.00 0.00 H new ATOM 0 HB3 LYS A 138 143.078 -0.824 3.776 1.00 0.00 H new ATOM 0 HG2 LYS A 138 144.725 -2.001 2.226 1.00 0.00 H new ATOM 0 HG3 LYS A 138 144.868 -0.492 1.347 1.00 0.00 H new ATOM 0 HD2 LYS A 138 145.230 0.369 3.942 1.00 0.00 H new ATOM 0 HD3 LYS A 138 145.929 -1.236 4.018 1.00 0.00 H new ATOM 0 HE2 LYS A 138 147.269 -0.642 1.926 1.00 0.00 H new ATOM 0 HE3 LYS A 138 146.694 1.003 2.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 148.854 0.712 3.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 147.696 1.079 4.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 148.253 -0.515 4.142 1.00 0.00 H new ATOM 927 N ASP A 139 140.838 -1.686 3.859 1.00 0.00 N ATOM 928 CA ASP A 139 140.038 -2.506 4.762 1.00 0.00 C ATOM 929 C ASP A 139 138.788 -3.049 4.071 1.00 0.00 C ATOM 930 O ASP A 139 138.195 -4.027 4.528 1.00 0.00 O ATOM 931 CB ASP A 139 139.657 -1.698 6.009 1.00 0.00 C ATOM 932 CG ASP A 139 138.601 -0.645 5.730 1.00 0.00 C ATOM 933 OD1 ASP A 139 138.316 -0.387 4.543 1.00 0.00 O ATOM 934 OD2 ASP A 139 138.062 -0.074 6.702 1.00 0.00 O ATOM 0 H ASP A 139 140.980 -0.727 4.175 1.00 0.00 H new ATOM 0 HA ASP A 139 140.642 -3.362 5.063 1.00 0.00 H new ATOM 0 HB2 ASP A 139 139.291 -2.378 6.778 1.00 0.00 H new ATOM 0 HB3 ASP A 139 140.548 -1.215 6.409 1.00 0.00 H new ATOM 939 N GLY A 140 138.392 -2.417 2.970 1.00 0.00 N ATOM 940 CA GLY A 140 137.219 -2.862 2.244 1.00 0.00 C ATOM 941 C GLY A 140 137.547 -3.914 1.201 1.00 0.00 C ATOM 942 O GLY A 140 136.702 -4.740 0.853 1.00 0.00 O ATOM 0 H GLY A 140 138.863 -1.606 2.569 1.00 0.00 H new ATOM 0 HA2 GLY A 140 136.492 -3.267 2.948 1.00 0.00 H new ATOM 0 HA3 GLY A 140 136.750 -2.007 1.758 1.00 0.00 H new ATOM 946 N ASP A 141 138.779 -3.883 0.703 1.00 0.00 N ATOM 947 CA ASP A 141 139.221 -4.841 -0.306 1.00 0.00 C ATOM 948 C ASP A 141 139.314 -6.245 0.280 1.00 0.00 C ATOM 949 O ASP A 141 140.178 -6.526 1.111 1.00 0.00 O ATOM 950 CB ASP A 141 140.577 -4.422 -0.878 1.00 0.00 C ATOM 951 CG ASP A 141 141.045 -5.337 -1.992 1.00 0.00 C ATOM 952 OD1 ASP A 141 140.239 -6.173 -2.452 1.00 0.00 O ATOM 953 OD2 ASP A 141 142.218 -5.217 -2.404 1.00 0.00 O ATOM 0 H ASP A 141 139.489 -3.206 0.981 1.00 0.00 H new ATOM 0 HA ASP A 141 138.484 -4.851 -1.109 1.00 0.00 H new ATOM 0 HB2 ASP A 141 140.509 -3.401 -1.255 1.00 0.00 H new ATOM 0 HB3 ASP A 141 141.319 -4.418 -0.080 1.00 0.00 H new ATOM 958 N LYS A 142 138.418 -7.124 -0.157 1.00 0.00 N ATOM 959 CA LYS A 142 138.398 -8.501 0.324 1.00 0.00 C ATOM 960 C LYS A 142 138.859 -9.467 -0.764 1.00 0.00 C ATOM 961 O LYS A 142 139.433 -10.516 -0.473 1.00 0.00 O ATOM 962 CB LYS A 142 136.993 -8.878 0.794 1.00 0.00 C ATOM 963 CG LYS A 142 136.439 -7.950 1.863 1.00 0.00 C ATOM 964 CD LYS A 142 137.165 -8.128 3.188 1.00 0.00 C ATOM 965 CE LYS A 142 136.367 -8.994 4.149 1.00 0.00 C ATOM 966 NZ LYS A 142 137.194 -9.451 5.299 1.00 0.00 N ATOM 0 H LYS A 142 137.696 -6.907 -0.844 1.00 0.00 H new ATOM 0 HA LYS A 142 139.088 -8.575 1.165 1.00 0.00 H new ATOM 0 HB2 LYS A 142 136.319 -8.875 -0.063 1.00 0.00 H new ATOM 0 HB3 LYS A 142 137.010 -9.896 1.182 1.00 0.00 H new ATOM 0 HG2 LYS A 142 136.532 -6.916 1.532 1.00 0.00 H new ATOM 0 HG3 LYS A 142 135.376 -8.146 2.001 1.00 0.00 H new ATOM 0 HD2 LYS A 142 138.140 -8.582 3.012 1.00 0.00 H new ATOM 0 HD3 LYS A 142 137.345 -7.152 3.639 1.00 0.00 H new ATOM 0 HE2 LYS A 142 135.510 -8.431 4.519 1.00 0.00 H new ATOM 0 HE3 LYS A 142 135.974 -9.860 3.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 136.614 -10.039 5.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 137.998 -10.009 4.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 137.548 -8.625 5.822 1.00 0.00 H new ATOM 980 N ASN A 143 138.604 -9.103 -2.018 1.00 0.00 N ATOM 981 CA ASN A 143 138.996 -9.937 -3.149 1.00 0.00 C ATOM 982 C ASN A 143 140.420 -9.618 -3.604 1.00 0.00 C ATOM 983 O ASN A 143 140.956 -10.277 -4.496 1.00 0.00 O ATOM 984 CB ASN A 143 138.021 -9.740 -4.311 1.00 0.00 C ATOM 985 CG ASN A 143 138.313 -10.666 -5.476 1.00 0.00 C ATOM 986 OD1 ASN A 143 138.632 -10.218 -6.576 1.00 0.00 O ATOM 987 ND2 ASN A 143 138.205 -11.969 -5.236 1.00 0.00 N ATOM 0 H ASN A 143 138.129 -8.238 -2.276 1.00 0.00 H new ATOM 0 HA ASN A 143 138.967 -10.978 -2.826 1.00 0.00 H new ATOM 0 HB2 ASN A 143 137.003 -9.912 -3.960 1.00 0.00 H new ATOM 0 HB3 ASN A 143 138.071 -8.706 -4.652 1.00 0.00 H new ATOM 0 HD21 ASN A 143 138.390 -12.642 -5.980 1.00 0.00 H new ATOM 0 HD22 ASN A 143 137.937 -12.296 -4.308 1.00 0.00 H new ATOM 994 N ASN A 144 141.028 -8.607 -2.989 1.00 0.00 N ATOM 995 CA ASN A 144 142.386 -8.205 -3.332 1.00 0.00 C ATOM 996 C ASN A 144 142.468 -7.711 -4.772 1.00 0.00 C ATOM 997 O ASN A 144 143.524 -7.775 -5.401 1.00 0.00 O ATOM 998 CB ASN A 144 143.357 -9.368 -3.122 1.00 0.00 C ATOM 999 CG ASN A 144 143.948 -9.381 -1.725 1.00 0.00 C ATOM 1000 OD1 ASN A 144 145.044 -8.868 -1.497 1.00 0.00 O ATOM 1001 ND2 ASN A 144 143.223 -9.970 -0.781 1.00 0.00 N ATOM 0 H ASN A 144 140.599 -8.051 -2.249 1.00 0.00 H new ATOM 0 HA ASN A 144 142.667 -7.384 -2.673 1.00 0.00 H new ATOM 0 HB2 ASN A 144 142.837 -10.309 -3.303 1.00 0.00 H new ATOM 0 HB3 ASN A 144 144.162 -9.303 -3.854 1.00 0.00 H new ATOM 0 HD21 ASN A 144 143.569 -10.010 0.178 1.00 0.00 H new ATOM 0 HD22 ASN A 144 142.320 -10.382 -1.015 1.00 0.00 H new ATOM 1008 N ASP A 145 141.349 -7.209 -5.287 1.00 0.00 N ATOM 1009 CA ASP A 145 141.298 -6.695 -6.650 1.00 0.00 C ATOM 1010 C ASP A 145 141.446 -5.176 -6.660 1.00 0.00 C ATOM 1011 O ASP A 145 141.838 -4.585 -7.666 1.00 0.00 O ATOM 1012 CB ASP A 145 139.983 -7.097 -7.320 1.00 0.00 C ATOM 1013 CG ASP A 145 138.773 -6.533 -6.603 1.00 0.00 C ATOM 1014 OD1 ASP A 145 138.904 -6.162 -5.417 1.00 0.00 O ATOM 1015 OD2 ASP A 145 137.693 -6.460 -7.227 1.00 0.00 O ATOM 0 H ASP A 145 140.466 -7.148 -4.780 1.00 0.00 H new ATOM 0 HA ASP A 145 142.127 -7.128 -7.209 1.00 0.00 H new ATOM 0 HB2 ASP A 145 139.984 -6.750 -8.353 1.00 0.00 H new ATOM 0 HB3 ASP A 145 139.911 -8.184 -7.349 1.00 0.00 H new ATOM 1020 N GLY A 146 141.128 -4.549 -5.531 1.00 0.00 N ATOM 1021 CA GLY A 146 141.230 -3.107 -5.426 1.00 0.00 C ATOM 1022 C GLY A 146 139.887 -2.411 -5.555 1.00 0.00 C ATOM 1023 O GLY A 146 139.824 -1.184 -5.627 1.00 0.00 O ATOM 0 H GLY A 146 140.801 -5.017 -4.686 1.00 0.00 H new ATOM 0 HA2 GLY A 146 141.678 -2.848 -4.466 1.00 0.00 H new ATOM 0 HA3 GLY A 146 141.901 -2.737 -6.201 1.00 0.00 H new ATOM 1027 N ARG A 147 138.810 -3.191 -5.583 1.00 0.00 N ATOM 1028 CA ARG A 147 137.467 -2.633 -5.703 1.00 0.00 C ATOM 1029 C ARG A 147 136.553 -3.173 -4.610 1.00 0.00 C ATOM 1030 O ARG A 147 137.003 -3.860 -3.692 1.00 0.00 O ATOM 1031 CB ARG A 147 136.874 -2.955 -7.076 1.00 0.00 C ATOM 1032 CG ARG A 147 137.817 -2.670 -8.234 1.00 0.00 C ATOM 1033 CD ARG A 147 137.080 -2.076 -9.425 1.00 0.00 C ATOM 1034 NE ARG A 147 137.147 -2.944 -10.598 1.00 0.00 N ATOM 1035 CZ ARG A 147 138.198 -3.011 -11.410 1.00 0.00 C ATOM 1036 NH1 ARG A 147 139.276 -2.270 -11.178 1.00 0.00 N ATOM 1037 NH2 ARG A 147 138.175 -3.823 -12.459 1.00 0.00 N ATOM 0 H ARG A 147 138.841 -4.209 -5.524 1.00 0.00 H new ATOM 0 HA ARG A 147 137.544 -1.551 -5.591 1.00 0.00 H new ATOM 0 HB2 ARG A 147 136.590 -4.007 -7.101 1.00 0.00 H new ATOM 0 HB3 ARG A 147 135.961 -2.375 -7.212 1.00 0.00 H new ATOM 0 HG2 ARG A 147 138.597 -1.981 -7.908 1.00 0.00 H new ATOM 0 HG3 ARG A 147 138.313 -3.593 -8.536 1.00 0.00 H new ATOM 0 HD2 ARG A 147 136.037 -1.907 -9.158 1.00 0.00 H new ATOM 0 HD3 ARG A 147 137.508 -1.104 -9.668 1.00 0.00 H new ATOM 0 HE ARG A 147 136.341 -3.533 -10.806 1.00 0.00 H new ATOM 0 HH11 ARG A 147 139.301 -1.644 -10.373 1.00 0.00 H new ATOM 0 HH12 ARG A 147 140.078 -2.327 -11.805 1.00 0.00 H new ATOM 0 HH21 ARG A 147 137.351 -4.396 -12.643 1.00 0.00 H new ATOM 0 HH22 ARG A 147 138.981 -3.874 -13.082 1.00 0.00 H new ATOM 1051 N ILE A 148 135.267 -2.860 -4.717 1.00 0.00 N ATOM 1052 CA ILE A 148 134.285 -3.315 -3.740 1.00 0.00 C ATOM 1053 C ILE A 148 132.938 -3.584 -4.404 1.00 0.00 C ATOM 1054 O ILE A 148 132.460 -2.781 -5.204 1.00 0.00 O ATOM 1055 CB ILE A 148 134.094 -2.284 -2.610 1.00 0.00 C ATOM 1056 CG1 ILE A 148 135.447 -1.893 -2.012 1.00 0.00 C ATOM 1057 CG2 ILE A 148 133.175 -2.841 -1.531 1.00 0.00 C ATOM 1058 CD1 ILE A 148 135.348 -0.827 -0.943 1.00 0.00 C ATOM 0 H ILE A 148 134.880 -2.293 -5.471 1.00 0.00 H new ATOM 0 HA ILE A 148 134.669 -4.241 -3.312 1.00 0.00 H new ATOM 0 HB ILE A 148 133.630 -1.391 -3.030 1.00 0.00 H new ATOM 0 HG12 ILE A 148 135.918 -2.780 -1.587 1.00 0.00 H new ATOM 0 HG13 ILE A 148 136.099 -1.537 -2.810 1.00 0.00 H new ATOM 0 HG21 ILE A 148 133.051 -2.100 -0.741 1.00 0.00 H new ATOM 0 HG22 ILE A 148 132.203 -3.074 -1.966 1.00 0.00 H new ATOM 0 HG23 ILE A 148 133.612 -3.748 -1.113 1.00 0.00 H new ATOM 0 HD11 ILE A 148 136.344 -0.599 -0.563 1.00 0.00 H new ATOM 0 HD12 ILE A 148 134.906 0.074 -1.368 1.00 0.00 H new ATOM 0 HD13 ILE A 148 134.722 -1.188 -0.127 1.00 0.00 H new ATOM 1070 N ASP A 149 132.333 -4.717 -4.064 1.00 0.00 N ATOM 1071 CA ASP A 149 131.040 -5.089 -4.627 1.00 0.00 C ATOM 1072 C ASP A 149 130.096 -5.582 -3.534 1.00 0.00 C ATOM 1073 O ASP A 149 130.413 -5.511 -2.347 1.00 0.00 O ATOM 1074 CB ASP A 149 131.215 -6.167 -5.697 1.00 0.00 C ATOM 1075 CG ASP A 149 131.776 -7.459 -5.135 1.00 0.00 C ATOM 1076 OD1 ASP A 149 133.014 -7.565 -5.009 1.00 0.00 O ATOM 1077 OD2 ASP A 149 130.975 -8.366 -4.821 1.00 0.00 O ATOM 0 H ASP A 149 132.716 -5.392 -3.403 1.00 0.00 H new ATOM 0 HA ASP A 149 130.602 -4.204 -5.088 1.00 0.00 H new ATOM 0 HB2 ASP A 149 130.252 -6.367 -6.167 1.00 0.00 H new ATOM 0 HB3 ASP A 149 131.879 -5.795 -6.477 1.00 0.00 H new ATOM 1082 N TYR A 150 128.932 -6.078 -3.943 1.00 0.00 N ATOM 1083 CA TYR A 150 127.940 -6.578 -2.998 1.00 0.00 C ATOM 1084 C TYR A 150 128.510 -7.712 -2.150 1.00 0.00 C ATOM 1085 O TYR A 150 128.080 -7.927 -1.016 1.00 0.00 O ATOM 1086 CB TYR A 150 126.693 -7.062 -3.741 1.00 0.00 C ATOM 1087 CG TYR A 150 125.488 -7.246 -2.847 1.00 0.00 C ATOM 1088 CD1 TYR A 150 125.109 -6.259 -1.947 1.00 0.00 C ATOM 1089 CD2 TYR A 150 124.729 -8.409 -2.903 1.00 0.00 C ATOM 1090 CE1 TYR A 150 124.007 -6.423 -1.128 1.00 0.00 C ATOM 1091 CE2 TYR A 150 123.627 -8.582 -2.087 1.00 0.00 C ATOM 1092 CZ TYR A 150 123.271 -7.587 -1.202 1.00 0.00 C ATOM 1093 OH TYR A 150 122.174 -7.755 -0.389 1.00 0.00 O ATOM 0 H TYR A 150 128.653 -6.144 -4.922 1.00 0.00 H new ATOM 0 HA TYR A 150 127.666 -5.757 -2.335 1.00 0.00 H new ATOM 0 HB2 TYR A 150 126.447 -6.346 -4.525 1.00 0.00 H new ATOM 0 HB3 TYR A 150 126.918 -8.008 -4.233 1.00 0.00 H new ATOM 0 HD1 TYR A 150 125.685 -5.347 -1.886 1.00 0.00 H new ATOM 0 HD2 TYR A 150 125.005 -9.190 -3.596 1.00 0.00 H new ATOM 0 HE1 TYR A 150 123.724 -5.645 -0.435 1.00 0.00 H new ATOM 0 HE2 TYR A 150 123.048 -9.492 -2.142 1.00 0.00 H new ATOM 0 HH TYR A 150 121.766 -8.628 -0.566 1.00 0.00 H new ATOM 1103 N ASP A 151 129.480 -8.432 -2.702 1.00 0.00 N ATOM 1104 CA ASP A 151 130.106 -9.541 -1.990 1.00 0.00 C ATOM 1105 C ASP A 151 131.095 -9.025 -0.950 1.00 0.00 C ATOM 1106 O ASP A 151 131.024 -9.390 0.223 1.00 0.00 O ATOM 1107 CB ASP A 151 130.820 -10.472 -2.971 1.00 0.00 C ATOM 1108 CG ASP A 151 129.912 -10.944 -4.091 1.00 0.00 C ATOM 1109 OD1 ASP A 151 128.783 -10.420 -4.203 1.00 0.00 O ATOM 1110 OD2 ASP A 151 130.328 -11.839 -4.856 1.00 0.00 O ATOM 0 H ASP A 151 129.850 -8.269 -3.638 1.00 0.00 H new ATOM 0 HA ASP A 151 129.322 -10.100 -1.479 1.00 0.00 H new ATOM 0 HB2 ASP A 151 131.679 -9.955 -3.398 1.00 0.00 H new ATOM 0 HB3 ASP A 151 131.205 -11.337 -2.431 1.00 0.00 H new ATOM 1115 N GLU A 152 132.016 -8.174 -1.391 1.00 0.00 N ATOM 1116 CA GLU A 152 133.021 -7.606 -0.501 1.00 0.00 C ATOM 1117 C GLU A 152 132.382 -6.667 0.518 1.00 0.00 C ATOM 1118 O GLU A 152 132.924 -6.453 1.602 1.00 0.00 O ATOM 1119 CB GLU A 152 134.081 -6.856 -1.308 1.00 0.00 C ATOM 1120 CG GLU A 152 134.689 -7.681 -2.430 1.00 0.00 C ATOM 1121 CD GLU A 152 135.584 -6.861 -3.338 1.00 0.00 C ATOM 1122 OE1 GLU A 152 135.056 -6.220 -4.272 1.00 0.00 O ATOM 1123 OE2 GLU A 152 136.813 -6.859 -3.116 1.00 0.00 O ATOM 0 H GLU A 152 132.087 -7.863 -2.360 1.00 0.00 H new ATOM 0 HA GLU A 152 133.496 -8.426 0.038 1.00 0.00 H new ATOM 0 HB2 GLU A 152 133.634 -5.956 -1.731 1.00 0.00 H new ATOM 0 HB3 GLU A 152 134.875 -6.532 -0.636 1.00 0.00 H new ATOM 0 HG2 GLU A 152 135.266 -8.501 -2.002 1.00 0.00 H new ATOM 0 HG3 GLU A 152 133.890 -8.128 -3.021 1.00 0.00 H new ATOM 1130 N PHE A 153 131.227 -6.106 0.165 1.00 0.00 N ATOM 1131 CA PHE A 153 130.521 -5.189 1.053 1.00 0.00 C ATOM 1132 C PHE A 153 129.889 -5.941 2.220 1.00 0.00 C ATOM 1133 O PHE A 153 129.927 -5.481 3.362 1.00 0.00 O ATOM 1134 CB PHE A 153 129.446 -4.424 0.282 1.00 0.00 C ATOM 1135 CG PHE A 153 128.772 -3.355 1.092 1.00 0.00 C ATOM 1136 CD1 PHE A 153 129.516 -2.491 1.879 1.00 0.00 C ATOM 1137 CD2 PHE A 153 127.393 -3.213 1.064 1.00 0.00 C ATOM 1138 CE1 PHE A 153 128.898 -1.505 2.625 1.00 0.00 C ATOM 1139 CE2 PHE A 153 126.770 -2.228 1.809 1.00 0.00 C ATOM 1140 CZ PHE A 153 127.523 -1.374 2.590 1.00 0.00 C ATOM 0 H PHE A 153 130.762 -6.271 -0.728 1.00 0.00 H new ATOM 0 HA PHE A 153 131.246 -4.479 1.451 1.00 0.00 H new ATOM 0 HB2 PHE A 153 129.897 -3.970 -0.600 1.00 0.00 H new ATOM 0 HB3 PHE A 153 128.694 -5.129 -0.072 1.00 0.00 H new ATOM 0 HD1 PHE A 153 130.591 -2.589 1.910 1.00 0.00 H new ATOM 0 HD2 PHE A 153 126.799 -3.878 0.454 1.00 0.00 H new ATOM 0 HE1 PHE A 153 129.489 -0.838 3.235 1.00 0.00 H new ATOM 0 HE2 PHE A 153 125.695 -2.127 1.780 1.00 0.00 H new ATOM 0 HZ PHE A 153 127.038 -0.605 3.173 1.00 0.00 H new ATOM 1150 N LEU A 154 129.308 -7.100 1.927 1.00 0.00 N ATOM 1151 CA LEU A 154 128.669 -7.915 2.952 1.00 0.00 C ATOM 1152 C LEU A 154 129.689 -8.400 3.976 1.00 0.00 C ATOM 1153 O LEU A 154 129.370 -8.574 5.152 1.00 0.00 O ATOM 1154 CB LEU A 154 127.958 -9.111 2.313 1.00 0.00 C ATOM 1155 CG LEU A 154 126.462 -8.913 2.058 1.00 0.00 C ATOM 1156 CD1 LEU A 154 125.713 -8.753 3.372 1.00 0.00 C ATOM 1157 CD2 LEU A 154 126.231 -7.706 1.161 1.00 0.00 C ATOM 0 H LEU A 154 129.267 -7.495 0.988 1.00 0.00 H new ATOM 0 HA LEU A 154 127.933 -7.297 3.466 1.00 0.00 H new ATOM 0 HB2 LEU A 154 128.446 -9.341 1.366 1.00 0.00 H new ATOM 0 HB3 LEU A 154 128.090 -9.980 2.958 1.00 0.00 H new ATOM 0 HG LEU A 154 126.079 -9.798 1.550 1.00 0.00 H new ATOM 0 HD11 LEU A 154 124.651 -8.613 3.171 1.00 0.00 H new ATOM 0 HD12 LEU A 154 125.852 -9.646 3.981 1.00 0.00 H new ATOM 0 HD13 LEU A 154 126.098 -7.885 3.907 1.00 0.00 H new ATOM 0 HD21 LEU A 154 125.162 -7.579 0.990 1.00 0.00 H new ATOM 0 HD22 LEU A 154 126.630 -6.813 1.643 1.00 0.00 H new ATOM 0 HD23 LEU A 154 126.736 -7.860 0.207 1.00 0.00 H new ATOM 1169 N GLU A 155 130.920 -8.617 3.520 1.00 0.00 N ATOM 1170 CA GLU A 155 131.989 -9.081 4.398 1.00 0.00 C ATOM 1171 C GLU A 155 132.631 -7.912 5.137 1.00 0.00 C ATOM 1172 O GLU A 155 132.927 -8.004 6.327 1.00 0.00 O ATOM 1173 CB GLU A 155 133.049 -9.836 3.592 1.00 0.00 C ATOM 1174 CG GLU A 155 132.624 -11.238 3.190 1.00 0.00 C ATOM 1175 CD GLU A 155 133.691 -12.276 3.481 1.00 0.00 C ATOM 1176 OE1 GLU A 155 134.550 -12.507 2.604 1.00 0.00 O ATOM 1177 OE2 GLU A 155 133.669 -12.859 4.585 1.00 0.00 O ATOM 0 H GLU A 155 131.201 -8.479 2.549 1.00 0.00 H new ATOM 0 HA GLU A 155 131.554 -9.757 5.134 1.00 0.00 H new ATOM 0 HB2 GLU A 155 133.285 -9.265 2.694 1.00 0.00 H new ATOM 0 HB3 GLU A 155 133.965 -9.898 4.180 1.00 0.00 H new ATOM 0 HG2 GLU A 155 131.710 -11.503 3.721 1.00 0.00 H new ATOM 0 HG3 GLU A 155 132.390 -11.252 2.126 1.00 0.00 H new ATOM 1184 N PHE A 156 132.842 -6.813 4.421 1.00 0.00 N ATOM 1185 CA PHE A 156 133.449 -5.623 5.009 1.00 0.00 C ATOM 1186 C PHE A 156 132.558 -5.033 6.098 1.00 0.00 C ATOM 1187 O PHE A 156 133.032 -4.311 6.975 1.00 0.00 O ATOM 1188 CB PHE A 156 133.715 -4.577 3.924 1.00 0.00 C ATOM 1189 CG PHE A 156 134.373 -3.328 4.440 1.00 0.00 C ATOM 1190 CD1 PHE A 156 135.470 -3.405 5.283 1.00 0.00 C ATOM 1191 CD2 PHE A 156 133.892 -2.079 4.084 1.00 0.00 C ATOM 1192 CE1 PHE A 156 136.075 -2.259 5.760 1.00 0.00 C ATOM 1193 CE2 PHE A 156 134.492 -0.928 4.558 1.00 0.00 C ATOM 1194 CZ PHE A 156 135.586 -1.018 5.398 1.00 0.00 C ATOM 0 H PHE A 156 132.602 -6.721 3.434 1.00 0.00 H new ATOM 0 HA PHE A 156 134.395 -5.915 5.465 1.00 0.00 H new ATOM 0 HB2 PHE A 156 134.347 -5.018 3.153 1.00 0.00 H new ATOM 0 HB3 PHE A 156 132.771 -4.310 3.449 1.00 0.00 H new ATOM 0 HD1 PHE A 156 135.856 -4.372 5.570 1.00 0.00 H new ATOM 0 HD2 PHE A 156 133.037 -2.004 3.428 1.00 0.00 H new ATOM 0 HE1 PHE A 156 136.930 -2.332 6.416 1.00 0.00 H new ATOM 0 HE2 PHE A 156 134.107 0.040 4.273 1.00 0.00 H new ATOM 0 HZ PHE A 156 136.058 -0.121 5.771 1.00 0.00 H new ATOM 1204 N MET A 157 131.265 -5.341 6.039 1.00 0.00 N ATOM 1205 CA MET A 157 130.316 -4.838 7.026 1.00 0.00 C ATOM 1206 C MET A 157 129.983 -5.901 8.073 1.00 0.00 C ATOM 1207 O MET A 157 129.026 -5.754 8.833 1.00 0.00 O ATOM 1208 CB MET A 157 129.034 -4.371 6.334 1.00 0.00 C ATOM 1209 CG MET A 157 129.138 -2.978 5.734 1.00 0.00 C ATOM 1210 SD MET A 157 129.314 -1.694 6.988 1.00 0.00 S ATOM 1211 CE MET A 157 130.889 -0.979 6.522 1.00 0.00 C ATOM 0 H MET A 157 130.852 -5.935 5.320 1.00 0.00 H new ATOM 0 HA MET A 157 130.781 -3.994 7.536 1.00 0.00 H new ATOM 0 HB2 MET A 157 128.778 -5.079 5.545 1.00 0.00 H new ATOM 0 HB3 MET A 157 128.216 -4.387 7.054 1.00 0.00 H new ATOM 0 HG2 MET A 157 129.993 -2.940 5.058 1.00 0.00 H new ATOM 0 HG3 MET A 157 128.249 -2.777 5.136 1.00 0.00 H new ATOM 0 HE1 MET A 157 131.137 -0.168 7.206 1.00 0.00 H new ATOM 0 HE2 MET A 157 131.664 -1.744 6.570 1.00 0.00 H new ATOM 0 HE3 MET A 157 130.825 -0.590 5.506 1.00 0.00 H new ATOM 1221 N LYS A 158 130.771 -6.974 8.106 1.00 0.00 N ATOM 1222 CA LYS A 158 130.545 -8.057 9.060 1.00 0.00 C ATOM 1223 C LYS A 158 131.333 -7.836 10.349 1.00 0.00 C ATOM 1224 O LYS A 158 131.806 -8.790 10.968 1.00 0.00 O ATOM 1225 CB LYS A 158 130.931 -9.400 8.437 1.00 0.00 C ATOM 1226 CG LYS A 158 129.776 -10.102 7.742 1.00 0.00 C ATOM 1227 CD LYS A 158 128.908 -10.866 8.731 1.00 0.00 C ATOM 1228 CE LYS A 158 128.820 -12.342 8.374 1.00 0.00 C ATOM 1229 NZ LYS A 158 128.888 -13.209 9.584 1.00 0.00 N ATOM 0 H LYS A 158 131.568 -7.116 7.486 1.00 0.00 H new ATOM 0 HA LYS A 158 129.484 -8.067 9.308 1.00 0.00 H new ATOM 0 HB2 LYS A 158 131.734 -9.240 7.717 1.00 0.00 H new ATOM 0 HB3 LYS A 158 131.326 -10.052 9.216 1.00 0.00 H new ATOM 0 HG2 LYS A 158 129.167 -9.367 7.215 1.00 0.00 H new ATOM 0 HG3 LYS A 158 130.166 -10.790 6.992 1.00 0.00 H new ATOM 0 HD2 LYS A 158 129.318 -10.758 9.735 1.00 0.00 H new ATOM 0 HD3 LYS A 158 127.907 -10.434 8.747 1.00 0.00 H new ATOM 0 HE2 LYS A 158 127.888 -12.532 7.842 1.00 0.00 H new ATOM 0 HE3 LYS A 158 129.633 -12.601 7.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 128.825 -14.207 9.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 129.789 -13.046 10.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 128.098 -12.980 10.220 1.00 0.00 H new ATOM 1243 N GLY A 159 131.467 -6.576 10.755 1.00 0.00 N ATOM 1244 CA GLY A 159 132.192 -6.265 11.973 1.00 0.00 C ATOM 1245 C GLY A 159 133.571 -5.694 11.703 1.00 0.00 C ATOM 1246 O GLY A 159 134.568 -6.415 11.752 1.00 0.00 O ATOM 0 H GLY A 159 131.087 -5.767 10.263 1.00 0.00 H new ATOM 0 HA2 GLY A 159 131.616 -5.551 12.562 1.00 0.00 H new ATOM 0 HA3 GLY A 159 132.289 -7.169 12.574 1.00 0.00 H new ATOM 1250 N VAL A 160 133.627 -4.398 11.420 1.00 0.00 N ATOM 1251 CA VAL A 160 134.891 -3.729 11.144 1.00 0.00 C ATOM 1252 C VAL A 160 135.215 -2.697 12.219 1.00 0.00 C ATOM 1253 O VAL A 160 136.357 -2.591 12.669 1.00 0.00 O ATOM 1254 CB VAL A 160 134.870 -3.031 9.770 1.00 0.00 C ATOM 1255 CG1 VAL A 160 135.193 -4.020 8.664 1.00 0.00 C ATOM 1256 CG2 VAL A 160 133.523 -2.363 9.525 1.00 0.00 C ATOM 0 H VAL A 160 132.810 -3.789 11.376 1.00 0.00 H new ATOM 0 HA VAL A 160 135.661 -4.500 11.141 1.00 0.00 H new ATOM 0 HB VAL A 160 135.636 -2.256 9.767 1.00 0.00 H new ATOM 0 HG11 VAL A 160 135.173 -3.509 7.702 1.00 0.00 H new ATOM 0 HG12 VAL A 160 136.184 -4.441 8.831 1.00 0.00 H new ATOM 0 HG13 VAL A 160 134.454 -4.821 8.665 1.00 0.00 H new ATOM 0 HG21 VAL A 160 133.530 -1.876 8.550 1.00 0.00 H new ATOM 0 HG22 VAL A 160 132.734 -3.115 9.550 1.00 0.00 H new ATOM 0 HG23 VAL A 160 133.339 -1.619 10.300 1.00 0.00 H new ATOM 1266 N GLU A 161 134.201 -1.941 12.629 1.00 0.00 N ATOM 1267 CA GLU A 161 134.378 -0.917 13.651 1.00 0.00 C ATOM 1268 C GLU A 161 133.886 -1.413 15.008 1.00 0.00 C ATOM 1269 O GLU A 161 133.732 -2.615 15.221 1.00 0.00 O ATOM 1270 CB GLU A 161 133.630 0.359 13.260 1.00 0.00 C ATOM 1271 CG GLU A 161 134.318 1.157 12.166 1.00 0.00 C ATOM 1272 CD GLU A 161 133.568 2.426 11.809 1.00 0.00 C ATOM 1273 OE1 GLU A 161 132.387 2.327 11.415 1.00 0.00 O ATOM 1274 OE2 GLU A 161 134.163 3.518 11.923 1.00 0.00 O ATOM 0 H GLU A 161 133.250 -2.019 12.269 1.00 0.00 H new ATOM 0 HA GLU A 161 135.443 -0.696 13.728 1.00 0.00 H new ATOM 0 HB2 GLU A 161 132.626 0.094 12.928 1.00 0.00 H new ATOM 0 HB3 GLU A 161 133.518 0.989 14.142 1.00 0.00 H new ATOM 0 HG2 GLU A 161 135.327 1.414 12.489 1.00 0.00 H new ATOM 0 HG3 GLU A 161 134.417 0.536 11.276 1.00 0.00 H new TER 1281 GLU A 161 HETATM 1282 CA CA A 162 131.265 2.224 -9.447 1.00 0.00 CA HETATM 1283 CA CA A 163 137.521 -7.194 -4.961 1.00 0.00 CA