USER MOD reduce.3.24.130724 H: found=0, std=0, add=764, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 758 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-H: A 63 HIS HE2 : A 63 HIS NE2 : A 401 ZNZN :(H bumps) USER MOD Set 1.1: A 10 THR OG1 : rot 180:sc= -0.053 USER MOD Set 1.2: A 56 HIS : no HD1:sc= 0.013 K(o=-0.04,f=-2.4!) USER MOD Set 2.1: A 28 SER OG : rot -151:sc= 0.0525 USER MOD Set 2.2: A 30 HIS : no HD1:sc= -4.89! C(o=-4.8!,f=-6.1!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0.254 USER MOD Single : A 3 SER OG : rot 180:sc= -0.0131 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 11 ASN : amide:sc= -1.71 K(o=-1.7,f=-1.1) USER MOD Single : A 19 THR OG1 : rot 34:sc= 0.00751 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 ASN : amide:sc= -0.839 K(o=-0.84,f=-2.2!) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 HIS : no HD1:sc= -1.53 K(o=-1.5,f=-0.33) USER MOD Single : A 26 ASN : amide:sc= -1.38 K(o=-1.4,f=-0.36) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 ASN : amide:sc= -1.36 X(o=-1.4,f=-1.8!) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 THR OG1 : rot 150:sc= 0.0304 USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 CYS SG : rot -150:sc= -0.862 USER MOD Single : A 72 THR OG1 : rot -49:sc= 0.686 USER MOD Single : A 74 GLN : amide:sc= -1.77 K(o=-1.8,f=-4.4!) USER MOD Single : A 75 THR OG1 : rot -135:sc= 0.596 USER MOD Single : A 79 LYS NZ :NH3+ 157:sc= -0.124 (180deg=-0.541) USER MOD Single : A 80 MET CE :methyl -144:sc= -1.92 (180deg=-6.05!) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 CYS SG : rot 180:sc= 0 USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 HIS : no HD1:sc= -0.216 X(o=-0.22,f=-0.0075) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= -0.23 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -21.254 3.073 48.468 1.00 0.00 N ATOM 2 CA GLY A 1 -21.603 2.289 47.298 1.00 0.00 C ATOM 3 C GLY A 1 -20.588 2.431 46.181 1.00 0.00 C ATOM 4 O GLY A 1 -20.483 3.488 45.558 1.00 0.00 O ATOM 0 H1 GLY A 1 -21.979 2.942 49.202 1.00 0.00 H new ATOM 0 H2 GLY A 1 -20.331 2.761 48.832 1.00 0.00 H new ATOM 0 H3 GLY A 1 -21.202 4.079 48.209 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -21.685 1.239 47.579 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -22.583 2.599 46.936 1.00 0.00 H new ATOM 8 N SER A 2 -19.837 1.364 45.928 1.00 0.00 N ATOM 9 CA SER A 2 -18.820 1.376 44.882 1.00 0.00 C ATOM 10 C SER A 2 -18.943 0.143 43.992 1.00 0.00 C ATOM 11 O SER A 2 -19.938 -0.579 44.046 1.00 0.00 O ATOM 12 CB SER A 2 -17.422 1.435 45.501 1.00 0.00 C ATOM 13 OG SER A 2 -16.436 1.670 44.511 1.00 0.00 O ATOM 0 H SER A 2 -19.913 0.481 46.432 1.00 0.00 H new ATOM 0 HA SER A 2 -18.975 2.263 44.268 1.00 0.00 H new ATOM 0 HB2 SER A 2 -17.386 2.226 46.250 1.00 0.00 H new ATOM 0 HB3 SER A 2 -17.209 0.498 46.016 1.00 0.00 H new ATOM 0 HG SER A 2 -15.552 1.705 44.932 1.00 0.00 H new ATOM 19 N SER A 3 -17.923 -0.091 43.172 1.00 0.00 N ATOM 20 CA SER A 3 -17.916 -1.234 42.266 1.00 0.00 C ATOM 21 C SER A 3 -16.518 -1.834 42.159 1.00 0.00 C ATOM 22 O SER A 3 -15.647 -1.560 42.984 1.00 0.00 O ATOM 23 CB SER A 3 -18.412 -0.816 40.881 1.00 0.00 C ATOM 24 OG SER A 3 -19.401 0.194 40.976 1.00 0.00 O ATOM 0 H SER A 3 -17.091 0.496 43.116 1.00 0.00 H new ATOM 0 HA SER A 3 -18.587 -1.992 42.671 1.00 0.00 H new ATOM 0 HB2 SER A 3 -17.574 -0.454 40.285 1.00 0.00 H new ATOM 0 HB3 SER A 3 -18.821 -1.682 40.361 1.00 0.00 H new ATOM 0 HG SER A 3 -19.700 0.444 40.077 1.00 0.00 H new ATOM 30 N GLY A 4 -16.311 -2.656 41.135 1.00 0.00 N ATOM 31 CA GLY A 4 -15.017 -3.283 40.937 1.00 0.00 C ATOM 32 C GLY A 4 -14.595 -3.295 39.481 1.00 0.00 C ATOM 33 O GLY A 4 -14.083 -4.298 38.984 1.00 0.00 O ATOM 0 H GLY A 4 -17.016 -2.899 40.439 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -14.267 -2.754 41.525 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -15.052 -4.306 41.310 1.00 0.00 H new ATOM 37 N SER A 5 -14.811 -2.177 38.795 1.00 0.00 N ATOM 38 CA SER A 5 -14.454 -2.064 37.386 1.00 0.00 C ATOM 39 C SER A 5 -14.717 -0.653 36.870 1.00 0.00 C ATOM 40 O SER A 5 -15.289 0.181 37.573 1.00 0.00 O ATOM 41 CB SER A 5 -15.244 -3.078 36.555 1.00 0.00 C ATOM 42 OG SER A 5 -14.434 -3.649 35.542 1.00 0.00 O ATOM 0 H SER A 5 -15.231 -1.337 39.192 1.00 0.00 H new ATOM 0 HA SER A 5 -13.389 -2.275 37.289 1.00 0.00 H new ATOM 0 HB2 SER A 5 -15.628 -3.865 37.204 1.00 0.00 H new ATOM 0 HB3 SER A 5 -16.107 -2.589 36.103 1.00 0.00 H new ATOM 0 HG SER A 5 -14.961 -4.294 35.026 1.00 0.00 H new ATOM 48 N SER A 6 -14.295 -0.392 35.637 1.00 0.00 N ATOM 49 CA SER A 6 -14.481 0.920 35.027 1.00 0.00 C ATOM 50 C SER A 6 -14.601 0.802 33.511 1.00 0.00 C ATOM 51 O SER A 6 -14.284 -0.236 32.931 1.00 0.00 O ATOM 52 CB SER A 6 -13.315 1.843 35.387 1.00 0.00 C ATOM 53 OG SER A 6 -12.462 2.045 34.274 1.00 0.00 O ATOM 0 H SER A 6 -13.822 -1.071 35.041 1.00 0.00 H new ATOM 0 HA SER A 6 -15.406 1.346 35.415 1.00 0.00 H new ATOM 0 HB2 SER A 6 -13.700 2.802 35.733 1.00 0.00 H new ATOM 0 HB3 SER A 6 -12.747 1.412 36.211 1.00 0.00 H new ATOM 0 HG SER A 6 -11.726 2.639 34.530 1.00 0.00 H new ATOM 59 N GLY A 7 -15.062 1.875 32.875 1.00 0.00 N ATOM 60 CA GLY A 7 -15.217 1.872 31.432 1.00 0.00 C ATOM 61 C GLY A 7 -14.295 2.861 30.748 1.00 0.00 C ATOM 62 O GLY A 7 -14.747 3.876 30.217 1.00 0.00 O ATOM 0 H GLY A 7 -15.331 2.746 33.333 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -15.018 0.871 31.050 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -16.251 2.109 31.180 1.00 0.00 H new ATOM 66 N MET A 8 -12.999 2.567 30.761 1.00 0.00 N ATOM 67 CA MET A 8 -12.011 3.440 30.137 1.00 0.00 C ATOM 68 C MET A 8 -10.854 2.628 29.564 1.00 0.00 C ATOM 69 O MET A 8 -10.484 1.576 30.085 1.00 0.00 O ATOM 70 CB MET A 8 -11.484 4.456 31.152 1.00 0.00 C ATOM 71 CG MET A 8 -11.667 5.901 30.716 1.00 0.00 C ATOM 72 SD MET A 8 -12.215 6.968 32.062 1.00 0.00 S ATOM 73 CE MET A 8 -10.722 7.905 32.381 1.00 0.00 C ATOM 0 H MET A 8 -12.608 1.731 31.197 1.00 0.00 H new ATOM 0 HA MET A 8 -12.497 3.973 29.320 1.00 0.00 H new ATOM 0 HB2 MET A 8 -11.994 4.305 32.103 1.00 0.00 H new ATOM 0 HB3 MET A 8 -10.424 4.269 31.325 1.00 0.00 H new ATOM 0 HG2 MET A 8 -10.725 6.279 30.319 1.00 0.00 H new ATOM 0 HG3 MET A 8 -12.394 5.943 29.905 1.00 0.00 H new ATOM 0 HE1 MET A 8 -10.902 8.611 33.192 1.00 0.00 H new ATOM 0 HE2 MET A 8 -9.919 7.225 32.664 1.00 0.00 H new ATOM 0 HE3 MET A 8 -10.436 8.450 31.482 1.00 0.00 H new ATOM 83 N PRO A 9 -10.267 3.127 28.466 1.00 0.00 N ATOM 84 CA PRO A 9 -9.143 2.463 27.798 1.00 0.00 C ATOM 85 C PRO A 9 -7.863 2.519 28.626 1.00 0.00 C ATOM 86 O PRO A 9 -7.494 3.571 29.149 1.00 0.00 O ATOM 87 CB PRO A 9 -8.977 3.263 26.504 1.00 0.00 C ATOM 88 CG PRO A 9 -9.535 4.608 26.815 1.00 0.00 C ATOM 89 CD PRO A 9 -10.656 4.376 27.791 1.00 0.00 C ATOM 0 HA PRO A 9 -9.333 1.402 27.638 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -7.929 3.328 26.210 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -9.511 2.794 25.678 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -8.772 5.257 27.244 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -9.899 5.098 25.912 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -10.752 5.201 28.497 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -11.616 4.277 27.284 1.00 0.00 H new ATOM 97 N THR A 10 -7.189 1.379 28.742 1.00 0.00 N ATOM 98 CA THR A 10 -5.951 1.297 29.506 1.00 0.00 C ATOM 99 C THR A 10 -6.223 1.387 31.003 1.00 0.00 C ATOM 100 O THR A 10 -7.019 2.211 31.451 1.00 0.00 O ATOM 101 CB THR A 10 -4.969 2.415 29.106 1.00 0.00 C ATOM 102 OG1 THR A 10 -5.033 2.641 27.693 1.00 0.00 O ATOM 103 CG2 THR A 10 -3.546 2.052 29.503 1.00 0.00 C ATOM 0 H THR A 10 -7.480 0.499 28.316 1.00 0.00 H new ATOM 0 HA THR A 10 -5.502 0.330 29.278 1.00 0.00 H new ATOM 0 HB THR A 10 -5.255 3.326 29.632 1.00 0.00 H new ATOM 0 HG1 THR A 10 -4.407 3.354 27.447 1.00 0.00 H new ATOM 0 HG21 THR A 10 -2.870 2.856 29.211 1.00 0.00 H new ATOM 0 HG22 THR A 10 -3.495 1.909 30.582 1.00 0.00 H new ATOM 0 HG23 THR A 10 -3.252 1.130 29.001 1.00 0.00 H new ATOM 111 N ASN A 11 -5.554 0.535 31.774 1.00 0.00 N ATOM 112 CA ASN A 11 -5.724 0.519 33.222 1.00 0.00 C ATOM 113 C ASN A 11 -4.704 -0.406 33.879 1.00 0.00 C ATOM 114 O ASN A 11 -4.217 -1.352 33.259 1.00 0.00 O ATOM 115 CB ASN A 11 -7.142 0.072 33.585 1.00 0.00 C ATOM 116 CG ASN A 11 -7.819 -0.679 32.455 1.00 0.00 C ATOM 117 OD1 ASN A 11 -7.595 -1.875 32.268 1.00 0.00 O ATOM 118 ND2 ASN A 11 -8.652 0.023 31.695 1.00 0.00 N ATOM 0 H ASN A 11 -4.889 -0.153 31.420 1.00 0.00 H new ATOM 0 HA ASN A 11 -5.563 1.531 33.593 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -7.104 -0.564 34.469 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -7.740 0.945 33.846 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -9.137 -0.428 30.919 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -8.807 1.013 31.888 1.00 0.00 H new ATOM 125 N CYS A 12 -4.384 -0.125 35.138 1.00 0.00 N ATOM 126 CA CYS A 12 -3.422 -0.930 35.881 1.00 0.00 C ATOM 127 C CYS A 12 -3.907 -2.370 36.016 1.00 0.00 C ATOM 128 O CYS A 12 -5.057 -2.617 36.380 1.00 0.00 O ATOM 129 CB CYS A 12 -3.183 -0.328 37.267 1.00 0.00 C ATOM 130 SG CYS A 12 -1.905 -1.186 38.240 1.00 0.00 S ATOM 0 H CYS A 12 -4.777 0.655 35.665 1.00 0.00 H new ATOM 0 HA CYS A 12 -2.483 -0.932 35.327 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -2.897 0.717 37.153 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -4.120 -0.343 37.824 1.00 0.00 H new ATOM 135 N ALA A 13 -3.023 -3.318 35.722 1.00 0.00 N ATOM 136 CA ALA A 13 -3.360 -4.733 35.814 1.00 0.00 C ATOM 137 C ALA A 13 -3.364 -5.204 37.264 1.00 0.00 C ATOM 138 O ALA A 13 -3.958 -6.230 37.591 1.00 0.00 O ATOM 139 CB ALA A 13 -2.385 -5.562 34.990 1.00 0.00 C ATOM 0 H ALA A 13 -2.067 -3.131 35.418 1.00 0.00 H new ATOM 0 HA ALA A 13 -4.365 -4.869 35.413 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -2.648 -6.617 35.068 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -2.435 -5.251 33.946 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -1.373 -5.412 35.365 1.00 0.00 H new ATOM 145 N ALA A 14 -2.696 -4.447 38.129 1.00 0.00 N ATOM 146 CA ALA A 14 -2.624 -4.787 39.544 1.00 0.00 C ATOM 147 C ALA A 14 -4.017 -4.919 40.149 1.00 0.00 C ATOM 148 O ALA A 14 -4.827 -3.995 40.074 1.00 0.00 O ATOM 149 CB ALA A 14 -1.816 -3.740 40.298 1.00 0.00 C ATOM 0 H ALA A 14 -2.197 -3.595 37.874 1.00 0.00 H new ATOM 0 HA ALA A 14 -2.124 -5.751 39.635 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -1.770 -4.007 41.354 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -0.806 -3.697 39.891 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -2.292 -2.766 40.190 1.00 0.00 H new ATOM 155 N ALA A 15 -4.291 -6.073 40.747 1.00 0.00 N ATOM 156 CA ALA A 15 -5.586 -6.325 41.366 1.00 0.00 C ATOM 157 C ALA A 15 -5.693 -5.629 42.719 1.00 0.00 C ATOM 158 O ALA A 15 -4.902 -5.887 43.625 1.00 0.00 O ATOM 159 CB ALA A 15 -5.815 -7.822 41.520 1.00 0.00 C ATOM 0 H ALA A 15 -3.633 -6.849 40.816 1.00 0.00 H new ATOM 0 HA ALA A 15 -6.358 -5.916 40.715 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -6.786 -7.996 41.984 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -5.791 -8.297 40.539 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.032 -8.247 42.148 1.00 0.00 H new ATOM 165 N GLY A 16 -6.678 -4.745 42.848 1.00 0.00 N ATOM 166 CA GLY A 16 -6.869 -4.025 44.093 1.00 0.00 C ATOM 167 C GLY A 16 -6.157 -2.687 44.105 1.00 0.00 C ATOM 168 O GLY A 16 -5.848 -2.149 45.168 1.00 0.00 O ATOM 0 H GLY A 16 -7.347 -4.515 42.113 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -7.935 -3.867 44.258 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -6.505 -4.634 44.921 1.00 0.00 H new ATOM 172 N CYS A 17 -5.894 -2.148 42.919 1.00 0.00 N ATOM 173 CA CYS A 17 -5.211 -0.866 42.796 1.00 0.00 C ATOM 174 C CYS A 17 -6.052 0.123 41.993 1.00 0.00 C ATOM 175 O CYS A 17 -6.522 1.128 42.525 1.00 0.00 O ATOM 176 CB CYS A 17 -3.847 -1.053 42.128 1.00 0.00 C ATOM 177 SG CYS A 17 -3.024 0.507 41.670 1.00 0.00 S ATOM 0 H CYS A 17 -6.144 -2.580 42.029 1.00 0.00 H new ATOM 0 HA CYS A 17 -5.065 -0.462 43.798 1.00 0.00 H new ATOM 0 HB2 CYS A 17 -3.197 -1.610 42.803 1.00 0.00 H new ATOM 0 HB3 CYS A 17 -3.973 -1.662 41.233 1.00 0.00 H new ATOM 182 N ALA A 18 -6.236 -0.171 40.710 1.00 0.00 N ATOM 183 CA ALA A 18 -7.021 0.690 39.835 1.00 0.00 C ATOM 184 C ALA A 18 -6.408 2.083 39.741 1.00 0.00 C ATOM 185 O ALA A 18 -6.505 2.881 40.674 1.00 0.00 O ATOM 186 CB ALA A 18 -8.458 0.776 40.329 1.00 0.00 C ATOM 0 H ALA A 18 -5.852 -0.999 40.254 1.00 0.00 H new ATOM 0 HA ALA A 18 -7.017 0.252 38.837 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -9.033 1.422 39.666 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -8.900 -0.220 40.337 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -8.472 1.187 41.338 1.00 0.00 H new ATOM 192 N THR A 19 -5.776 2.372 38.608 1.00 0.00 N ATOM 193 CA THR A 19 -5.145 3.668 38.393 1.00 0.00 C ATOM 194 C THR A 19 -5.171 4.054 36.918 1.00 0.00 C ATOM 195 O THR A 19 -4.741 3.287 36.056 1.00 0.00 O ATOM 196 CB THR A 19 -3.686 3.671 38.886 1.00 0.00 C ATOM 197 OG1 THR A 19 -3.616 4.226 40.205 1.00 0.00 O ATOM 198 CG2 THR A 19 -2.798 4.472 37.946 1.00 0.00 C ATOM 0 H THR A 19 -5.688 1.725 37.824 1.00 0.00 H new ATOM 0 HA THR A 19 -5.717 4.397 38.967 1.00 0.00 H new ATOM 0 HB THR A 19 -3.330 2.641 38.906 1.00 0.00 H new ATOM 0 HG1 THR A 19 -4.428 3.993 40.701 1.00 0.00 H new ATOM 0 HG21 THR A 19 -1.773 4.459 38.315 1.00 0.00 H new ATOM 0 HG22 THR A 19 -2.830 4.030 36.950 1.00 0.00 H new ATOM 0 HG23 THR A 19 -3.154 5.501 37.898 1.00 0.00 H new ATOM 206 N THR A 20 -5.679 5.249 36.633 1.00 0.00 N ATOM 207 CA THR A 20 -5.762 5.738 35.263 1.00 0.00 C ATOM 208 C THR A 20 -5.620 7.255 35.210 1.00 0.00 C ATOM 209 O THR A 20 -4.630 7.778 34.699 1.00 0.00 O ATOM 210 CB THR A 20 -7.094 5.335 34.602 1.00 0.00 C ATOM 211 OG1 THR A 20 -8.086 5.094 35.607 1.00 0.00 O ATOM 212 CG2 THR A 20 -6.919 4.089 33.747 1.00 0.00 C ATOM 0 H THR A 20 -6.039 5.896 37.334 1.00 0.00 H new ATOM 0 HA THR A 20 -4.939 5.280 34.714 1.00 0.00 H new ATOM 0 HB THR A 20 -7.418 6.154 33.960 1.00 0.00 H new ATOM 0 HG1 THR A 20 -8.930 4.840 35.179 1.00 0.00 H new ATOM 0 HG21 THR A 20 -7.873 3.824 33.291 1.00 0.00 H new ATOM 0 HG22 THR A 20 -6.185 4.284 32.965 1.00 0.00 H new ATOM 0 HG23 THR A 20 -6.574 3.265 34.371 1.00 0.00 H new ATOM 220 N TYR A 21 -6.616 7.956 35.741 1.00 0.00 N ATOM 221 CA TYR A 21 -6.602 9.414 35.753 1.00 0.00 C ATOM 222 C TYR A 21 -7.095 9.952 37.093 1.00 0.00 C ATOM 223 O TYR A 21 -6.536 10.905 37.635 1.00 0.00 O ATOM 224 CB TYR A 21 -7.472 9.962 34.620 1.00 0.00 C ATOM 225 CG TYR A 21 -7.054 11.336 34.147 1.00 0.00 C ATOM 226 CD1 TYR A 21 -5.964 11.500 33.302 1.00 0.00 C ATOM 227 CD2 TYR A 21 -7.751 12.470 34.545 1.00 0.00 C ATOM 228 CE1 TYR A 21 -5.579 12.754 32.868 1.00 0.00 C ATOM 229 CE2 TYR A 21 -7.374 13.728 34.115 1.00 0.00 C ATOM 230 CZ TYR A 21 -6.287 13.864 33.277 1.00 0.00 C ATOM 231 OH TYR A 21 -5.908 15.115 32.846 1.00 0.00 O ATOM 0 H TYR A 21 -7.443 7.538 36.168 1.00 0.00 H new ATOM 0 HA TYR A 21 -5.574 9.744 35.605 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -7.436 9.270 33.778 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -8.508 10.002 34.955 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -5.408 10.633 32.979 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -8.602 12.367 35.202 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -4.728 12.864 32.212 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -7.927 14.599 34.433 1.00 0.00 H new ATOM 0 HH TYR A 21 -6.511 15.788 33.224 1.00 0.00 H new ATOM 241 N ASN A 22 -8.145 9.334 37.622 1.00 0.00 N ATOM 242 CA ASN A 22 -8.714 9.750 38.899 1.00 0.00 C ATOM 243 C ASN A 22 -9.200 11.195 38.833 1.00 0.00 C ATOM 244 O ASN A 22 -10.362 11.457 38.523 1.00 0.00 O ATOM 245 CB ASN A 22 -7.680 9.598 40.015 1.00 0.00 C ATOM 246 CG ASN A 22 -8.138 10.225 41.318 1.00 0.00 C ATOM 247 OD1 ASN A 22 -9.332 10.441 41.529 1.00 0.00 O ATOM 248 ND2 ASN A 22 -7.190 10.520 42.199 1.00 0.00 N ATOM 0 H ASN A 22 -8.620 8.543 37.187 1.00 0.00 H new ATOM 0 HA ASN A 22 -9.568 9.108 39.115 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -7.477 8.539 40.176 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -6.743 10.059 39.703 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -7.439 10.943 43.093 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -6.213 10.323 41.982 1.00 0.00 H new ATOM 255 N LYS A 23 -8.302 12.129 39.126 1.00 0.00 N ATOM 256 CA LYS A 23 -8.636 13.547 39.099 1.00 0.00 C ATOM 257 C LYS A 23 -7.414 14.388 38.742 1.00 0.00 C ATOM 258 O LYS A 23 -7.504 15.329 37.953 1.00 0.00 O ATOM 259 CB LYS A 23 -9.192 13.988 40.456 1.00 0.00 C ATOM 260 CG LYS A 23 -9.630 15.441 40.490 1.00 0.00 C ATOM 261 CD LYS A 23 -10.326 15.783 41.797 1.00 0.00 C ATOM 262 CE LYS A 23 -9.344 15.820 42.958 1.00 0.00 C ATOM 263 NZ LYS A 23 -9.923 16.496 44.152 1.00 0.00 N ATOM 0 H LYS A 23 -7.336 11.929 39.385 1.00 0.00 H new ATOM 0 HA LYS A 23 -9.397 13.700 38.334 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -10.041 13.355 40.714 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -8.431 13.829 41.220 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -8.762 16.087 40.359 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -10.303 15.639 39.656 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -10.819 16.751 41.705 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -11.104 15.047 42.000 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -9.054 14.803 43.221 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -8.437 16.340 42.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -9.223 16.501 44.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -10.176 17.475 43.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -10.774 15.985 44.461 1.00 0.00 H new ATOM 277 N HIS A 24 -6.271 14.041 39.326 1.00 0.00 N ATOM 278 CA HIS A 24 -5.030 14.762 39.068 1.00 0.00 C ATOM 279 C HIS A 24 -3.827 13.831 39.182 1.00 0.00 C ATOM 280 O HIS A 24 -2.704 14.279 39.414 1.00 0.00 O ATOM 281 CB HIS A 24 -4.881 15.929 40.044 1.00 0.00 C ATOM 282 CG HIS A 24 -5.351 17.238 39.488 1.00 0.00 C ATOM 283 ND1 HIS A 24 -5.331 18.413 40.210 1.00 0.00 N ATOM 284 CD2 HIS A 24 -5.855 17.555 38.272 1.00 0.00 C ATOM 285 CE1 HIS A 24 -5.803 19.395 39.463 1.00 0.00 C ATOM 286 NE2 HIS A 24 -6.128 18.900 38.282 1.00 0.00 N ATOM 0 H HIS A 24 -6.179 13.265 39.981 1.00 0.00 H new ATOM 0 HA HIS A 24 -5.070 15.152 38.051 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -5.442 15.707 40.952 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -3.833 16.021 40.331 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -6.013 16.876 37.447 1.00 0.00 H new ATOM 0 HE1 HIS A 24 -5.906 20.427 39.766 1.00 0.00 H new ATOM 0 HE2 HIS A 24 -6.519 19.431 37.504 1.00 0.00 H new ATOM 294 N ILE A 25 -4.070 12.535 39.019 1.00 0.00 N ATOM 295 CA ILE A 25 -3.006 11.542 39.103 1.00 0.00 C ATOM 296 C ILE A 25 -1.890 11.846 38.109 1.00 0.00 C ATOM 297 O ILE A 25 -2.148 12.238 36.972 1.00 0.00 O ATOM 298 CB ILE A 25 -3.540 10.122 38.840 1.00 0.00 C ATOM 299 CG1 ILE A 25 -3.091 9.171 39.953 1.00 0.00 C ATOM 300 CG2 ILE A 25 -3.065 9.620 37.485 1.00 0.00 C ATOM 301 CD1 ILE A 25 -3.920 7.908 40.038 1.00 0.00 C ATOM 0 H ILE A 25 -4.994 12.148 38.828 1.00 0.00 H new ATOM 0 HA ILE A 25 -2.609 11.590 40.117 1.00 0.00 H new ATOM 0 HB ILE A 25 -4.629 10.155 38.832 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -2.048 8.901 39.791 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -3.140 9.693 40.908 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -3.451 8.615 37.314 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -3.428 10.286 36.702 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -1.975 9.598 37.467 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -3.546 7.281 40.848 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -4.961 8.168 40.231 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -3.851 7.364 39.096 1.00 0.00 H new ATOM 313 N ASN A 26 -0.649 11.661 38.546 1.00 0.00 N ATOM 314 CA ASN A 26 0.507 11.914 37.694 1.00 0.00 C ATOM 315 C ASN A 26 1.458 10.720 37.698 1.00 0.00 C ATOM 316 O ASN A 26 2.611 10.831 37.283 1.00 0.00 O ATOM 317 CB ASN A 26 1.246 13.170 38.161 1.00 0.00 C ATOM 318 CG ASN A 26 1.449 13.196 39.664 1.00 0.00 C ATOM 319 OD1 ASN A 26 2.570 13.052 40.152 1.00 0.00 O ATOM 320 ND2 ASN A 26 0.362 13.379 40.404 1.00 0.00 N ATOM 0 H ASN A 26 -0.418 11.337 39.485 1.00 0.00 H new ATOM 0 HA ASN A 26 0.150 12.068 36.676 1.00 0.00 H new ATOM 0 HB2 ASN A 26 2.215 13.223 37.665 1.00 0.00 H new ATOM 0 HB3 ASN A 26 0.684 14.053 37.858 1.00 0.00 H new ATOM 0 HD21 ASN A 26 0.436 13.405 41.421 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -0.547 13.494 39.956 1.00 0.00 H new ATOM 327 N ILE A 27 0.965 9.580 38.170 1.00 0.00 N ATOM 328 CA ILE A 27 1.769 8.366 38.226 1.00 0.00 C ATOM 329 C ILE A 27 2.282 7.982 36.842 1.00 0.00 C ATOM 330 O ILE A 27 1.555 8.070 35.853 1.00 0.00 O ATOM 331 CB ILE A 27 0.969 7.187 38.810 1.00 0.00 C ATOM 332 CG1 ILE A 27 1.348 6.960 40.275 1.00 0.00 C ATOM 333 CG2 ILE A 27 1.211 5.926 37.994 1.00 0.00 C ATOM 334 CD1 ILE A 27 0.528 5.884 40.952 1.00 0.00 C ATOM 0 H ILE A 27 0.013 9.472 38.519 1.00 0.00 H new ATOM 0 HA ILE A 27 2.616 8.578 38.879 1.00 0.00 H new ATOM 0 HB ILE A 27 -0.093 7.429 38.762 1.00 0.00 H new ATOM 0 HG12 ILE A 27 2.403 6.691 40.331 1.00 0.00 H new ATOM 0 HG13 ILE A 27 1.228 7.895 40.822 1.00 0.00 H new ATOM 0 HG21 ILE A 27 0.639 5.102 38.420 1.00 0.00 H new ATOM 0 HG22 ILE A 27 0.896 6.093 36.964 1.00 0.00 H new ATOM 0 HG23 ILE A 27 2.272 5.678 38.013 1.00 0.00 H new ATOM 0 HD11 ILE A 27 0.851 5.778 41.987 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -0.526 6.160 40.928 1.00 0.00 H new ATOM 0 HD13 ILE A 27 0.667 4.938 40.429 1.00 0.00 H new ATOM 346 N SER A 28 3.539 7.553 36.781 1.00 0.00 N ATOM 347 CA SER A 28 4.150 7.157 35.518 1.00 0.00 C ATOM 348 C SER A 28 3.522 5.870 34.990 1.00 0.00 C ATOM 349 O SER A 28 2.843 5.151 35.723 1.00 0.00 O ATOM 350 CB SER A 28 5.658 6.966 35.695 1.00 0.00 C ATOM 351 OG SER A 28 6.236 6.378 34.543 1.00 0.00 O ATOM 0 H SER A 28 4.153 7.471 37.591 1.00 0.00 H new ATOM 0 HA SER A 28 3.973 7.951 34.793 1.00 0.00 H new ATOM 0 HB2 SER A 28 6.129 7.929 35.891 1.00 0.00 H new ATOM 0 HB3 SER A 28 5.848 6.335 36.563 1.00 0.00 H new ATOM 0 HG SER A 28 7.028 5.862 34.802 1.00 0.00 H new ATOM 357 N PHE A 29 3.754 5.587 33.713 1.00 0.00 N ATOM 358 CA PHE A 29 3.210 4.389 33.085 1.00 0.00 C ATOM 359 C PHE A 29 4.328 3.513 32.525 1.00 0.00 C ATOM 360 O PHE A 29 4.934 3.839 31.504 1.00 0.00 O ATOM 361 CB PHE A 29 2.237 4.769 31.967 1.00 0.00 C ATOM 362 CG PHE A 29 2.911 5.356 30.760 1.00 0.00 C ATOM 363 CD1 PHE A 29 3.433 6.638 30.796 1.00 0.00 C ATOM 364 CD2 PHE A 29 3.020 4.624 29.588 1.00 0.00 C ATOM 365 CE1 PHE A 29 4.054 7.181 29.687 1.00 0.00 C ATOM 366 CE2 PHE A 29 3.640 5.161 28.476 1.00 0.00 C ATOM 367 CZ PHE A 29 4.157 6.442 28.524 1.00 0.00 C ATOM 0 H PHE A 29 4.315 6.171 33.093 1.00 0.00 H new ATOM 0 HA PHE A 29 2.674 3.822 33.846 1.00 0.00 H new ATOM 0 HB2 PHE A 29 1.678 3.883 31.666 1.00 0.00 H new ATOM 0 HB3 PHE A 29 1.513 5.486 32.354 1.00 0.00 H new ATOM 0 HD1 PHE A 29 3.354 7.221 31.702 1.00 0.00 H new ATOM 0 HD2 PHE A 29 2.616 3.623 29.543 1.00 0.00 H new ATOM 0 HE1 PHE A 29 4.458 8.182 29.729 1.00 0.00 H new ATOM 0 HE2 PHE A 29 3.721 4.580 27.569 1.00 0.00 H new ATOM 0 HZ PHE A 29 4.640 6.864 27.655 1.00 0.00 H new ATOM 377 N HIS A 30 4.595 2.401 33.202 1.00 0.00 N ATOM 378 CA HIS A 30 5.640 1.478 32.773 1.00 0.00 C ATOM 379 C HIS A 30 5.044 0.135 32.361 1.00 0.00 C ATOM 380 O HIS A 30 4.787 -0.725 33.204 1.00 0.00 O ATOM 381 CB HIS A 30 6.661 1.274 33.892 1.00 0.00 C ATOM 382 CG HIS A 30 7.536 2.466 34.129 1.00 0.00 C ATOM 383 ND1 HIS A 30 8.575 2.816 33.293 1.00 0.00 N ATOM 384 CD2 HIS A 30 7.521 3.393 35.115 1.00 0.00 C ATOM 385 CE1 HIS A 30 9.162 3.905 33.755 1.00 0.00 C ATOM 386 NE2 HIS A 30 8.541 4.276 34.860 1.00 0.00 N ATOM 0 H HIS A 30 4.103 2.117 34.049 1.00 0.00 H new ATOM 0 HA HIS A 30 6.142 1.913 31.909 1.00 0.00 H new ATOM 0 HB2 HIS A 30 6.133 1.032 34.814 1.00 0.00 H new ATOM 0 HB3 HIS A 30 7.288 0.416 33.649 1.00 0.00 H new ATOM 0 HD2 HIS A 30 6.834 3.431 35.948 1.00 0.00 H new ATOM 0 HE1 HIS A 30 10.006 4.407 33.306 1.00 0.00 H new ATOM 0 HE2 HIS A 30 8.780 5.087 35.431 1.00 0.00 H new ATOM 394 N ARG A 31 4.825 -0.037 31.062 1.00 0.00 N ATOM 395 CA ARG A 31 4.256 -1.274 30.540 1.00 0.00 C ATOM 396 C ARG A 31 5.089 -2.478 30.969 1.00 0.00 C ATOM 397 O ARG A 31 6.123 -2.331 31.622 1.00 0.00 O ATOM 398 CB ARG A 31 4.171 -1.216 29.014 1.00 0.00 C ATOM 399 CG ARG A 31 5.486 -1.528 28.318 1.00 0.00 C ATOM 400 CD ARG A 31 6.490 -0.400 28.493 1.00 0.00 C ATOM 401 NE ARG A 31 7.381 -0.277 27.343 1.00 0.00 N ATOM 402 CZ ARG A 31 8.568 0.318 27.393 1.00 0.00 C ATOM 403 NH1 ARG A 31 9.004 0.841 28.530 1.00 0.00 N ATOM 404 NH2 ARG A 31 9.322 0.391 26.303 1.00 0.00 N ATOM 0 H ARG A 31 5.033 0.664 30.351 1.00 0.00 H new ATOM 0 HA ARG A 31 3.252 -1.385 30.949 1.00 0.00 H new ATOM 0 HB2 ARG A 31 3.413 -1.922 28.674 1.00 0.00 H new ATOM 0 HB3 ARG A 31 3.838 -0.222 28.715 1.00 0.00 H new ATOM 0 HG2 ARG A 31 5.901 -2.452 28.720 1.00 0.00 H new ATOM 0 HG3 ARG A 31 5.306 -1.695 27.256 1.00 0.00 H new ATOM 0 HD2 ARG A 31 5.957 0.539 28.641 1.00 0.00 H new ATOM 0 HD3 ARG A 31 7.081 -0.577 29.392 1.00 0.00 H new ATOM 0 HE ARG A 31 7.076 -0.669 26.452 1.00 0.00 H new ATOM 0 HH11 ARG A 31 8.428 0.787 29.370 1.00 0.00 H new ATOM 0 HH12 ARG A 31 9.916 1.297 28.565 1.00 0.00 H new ATOM 0 HH21 ARG A 31 8.990 -0.010 25.426 1.00 0.00 H new ATOM 0 HH22 ARG A 31 10.233 0.848 26.343 1.00 0.00 H new ATOM 418 N PHE A 32 4.632 -3.669 30.597 1.00 0.00 N ATOM 419 CA PHE A 32 5.334 -4.900 30.944 1.00 0.00 C ATOM 420 C PHE A 32 6.622 -5.037 30.138 1.00 0.00 C ATOM 421 O PHE A 32 6.769 -4.473 29.053 1.00 0.00 O ATOM 422 CB PHE A 32 4.434 -6.112 30.699 1.00 0.00 C ATOM 423 CG PHE A 32 3.369 -6.289 31.744 1.00 0.00 C ATOM 424 CD1 PHE A 32 2.506 -5.250 32.055 1.00 0.00 C ATOM 425 CD2 PHE A 32 3.229 -7.494 32.413 1.00 0.00 C ATOM 426 CE1 PHE A 32 1.526 -5.410 33.016 1.00 0.00 C ATOM 427 CE2 PHE A 32 2.251 -7.659 33.375 1.00 0.00 C ATOM 428 CZ PHE A 32 1.397 -6.616 33.676 1.00 0.00 C ATOM 0 H PHE A 32 3.779 -3.808 30.055 1.00 0.00 H new ATOM 0 HA PHE A 32 5.591 -4.856 32.002 1.00 0.00 H new ATOM 0 HB2 PHE A 32 3.960 -6.011 29.722 1.00 0.00 H new ATOM 0 HB3 PHE A 32 5.050 -7.011 30.663 1.00 0.00 H new ATOM 0 HD1 PHE A 32 2.600 -4.305 31.541 1.00 0.00 H new ATOM 0 HD2 PHE A 32 3.892 -8.314 32.180 1.00 0.00 H new ATOM 0 HE1 PHE A 32 0.861 -4.592 33.251 1.00 0.00 H new ATOM 0 HE2 PHE A 32 2.154 -8.603 33.891 1.00 0.00 H new ATOM 0 HZ PHE A 32 0.630 -6.743 34.426 1.00 0.00 H new ATOM 438 N PRO A 33 7.579 -5.806 30.679 1.00 0.00 N ATOM 439 CA PRO A 33 8.872 -6.036 30.027 1.00 0.00 C ATOM 440 C PRO A 33 8.746 -6.902 28.779 1.00 0.00 C ATOM 441 O PRO A 33 7.883 -7.777 28.702 1.00 0.00 O ATOM 442 CB PRO A 33 9.686 -6.761 31.101 1.00 0.00 C ATOM 443 CG PRO A 33 8.669 -7.421 31.967 1.00 0.00 C ATOM 444 CD PRO A 33 7.473 -6.509 31.968 1.00 0.00 C ATOM 0 HA PRO A 33 9.326 -5.107 29.683 1.00 0.00 H new ATOM 0 HB2 PRO A 33 10.363 -7.492 30.658 1.00 0.00 H new ATOM 0 HB3 PRO A 33 10.299 -6.063 31.672 1.00 0.00 H new ATOM 0 HG2 PRO A 33 8.408 -8.407 31.581 1.00 0.00 H new ATOM 0 HG3 PRO A 33 9.051 -7.565 32.978 1.00 0.00 H new ATOM 0 HD2 PRO A 33 6.541 -7.069 32.045 1.00 0.00 H new ATOM 0 HD3 PRO A 33 7.498 -5.814 32.808 1.00 0.00 H new ATOM 452 N LEU A 34 9.611 -6.653 27.802 1.00 0.00 N ATOM 453 CA LEU A 34 9.597 -7.411 26.555 1.00 0.00 C ATOM 454 C LEU A 34 10.213 -8.793 26.751 1.00 0.00 C ATOM 455 O LEU A 34 9.903 -9.732 26.018 1.00 0.00 O ATOM 456 CB LEU A 34 10.354 -6.652 25.465 1.00 0.00 C ATOM 457 CG LEU A 34 9.673 -6.584 24.097 1.00 0.00 C ATOM 458 CD1 LEU A 34 9.856 -7.893 23.345 1.00 0.00 C ATOM 459 CD2 LEU A 34 8.195 -6.258 24.253 1.00 0.00 C ATOM 0 H LEU A 34 10.331 -5.932 27.849 1.00 0.00 H new ATOM 0 HA LEU A 34 8.559 -7.537 26.247 1.00 0.00 H new ATOM 0 HB2 LEU A 34 10.528 -5.634 25.813 1.00 0.00 H new ATOM 0 HB3 LEU A 34 11.332 -7.117 25.339 1.00 0.00 H new ATOM 0 HG LEU A 34 10.141 -5.788 23.518 1.00 0.00 H new ATOM 0 HD11 LEU A 34 9.365 -7.827 22.374 1.00 0.00 H new ATOM 0 HD12 LEU A 34 10.919 -8.085 23.202 1.00 0.00 H new ATOM 0 HD13 LEU A 34 9.415 -8.707 23.920 1.00 0.00 H new ATOM 0 HD21 LEU A 34 7.726 -6.214 23.270 1.00 0.00 H new ATOM 0 HD22 LEU A 34 7.713 -7.032 24.850 1.00 0.00 H new ATOM 0 HD23 LEU A 34 8.085 -5.295 24.751 1.00 0.00 H new ATOM 471 N ASP A 35 11.086 -8.910 27.746 1.00 0.00 N ATOM 472 CA ASP A 35 11.744 -10.177 28.041 1.00 0.00 C ATOM 473 C ASP A 35 10.769 -11.159 28.684 1.00 0.00 C ATOM 474 O ASP A 35 9.861 -10.776 29.421 1.00 0.00 O ATOM 475 CB ASP A 35 12.943 -9.952 28.963 1.00 0.00 C ATOM 476 CG ASP A 35 14.208 -10.602 28.438 1.00 0.00 C ATOM 477 OD1 ASP A 35 14.585 -10.317 27.281 1.00 0.00 O ATOM 478 OD2 ASP A 35 14.821 -11.394 29.183 1.00 0.00 O ATOM 0 H ASP A 35 11.354 -8.142 28.362 1.00 0.00 H new ATOM 0 HA ASP A 35 12.094 -10.603 27.101 1.00 0.00 H new ATOM 0 HB2 ASP A 35 13.110 -8.881 29.081 1.00 0.00 H new ATOM 0 HB3 ASP A 35 12.717 -10.351 29.952 1.00 0.00 H new ATOM 483 N PRO A 36 10.959 -12.455 28.398 1.00 0.00 N ATOM 484 CA PRO A 36 10.107 -13.518 28.939 1.00 0.00 C ATOM 485 C PRO A 36 10.308 -13.718 30.437 1.00 0.00 C ATOM 486 O PRO A 36 9.345 -13.882 31.187 1.00 0.00 O ATOM 487 CB PRO A 36 10.559 -14.761 28.168 1.00 0.00 C ATOM 488 CG PRO A 36 11.962 -14.467 27.764 1.00 0.00 C ATOM 489 CD PRO A 36 12.022 -12.984 27.527 1.00 0.00 C ATOM 0 HA PRO A 36 9.048 -13.289 28.824 1.00 0.00 H new ATOM 0 HB2 PRO A 36 10.505 -15.654 28.790 1.00 0.00 H new ATOM 0 HB3 PRO A 36 9.926 -14.940 27.299 1.00 0.00 H new ATOM 0 HG2 PRO A 36 12.663 -14.766 28.543 1.00 0.00 H new ATOM 0 HG3 PRO A 36 12.232 -15.018 26.863 1.00 0.00 H new ATOM 0 HD2 PRO A 36 12.997 -12.574 27.790 1.00 0.00 H new ATOM 0 HD3 PRO A 36 11.844 -12.737 26.480 1.00 0.00 H new ATOM 497 N LYS A 37 11.565 -13.702 30.868 1.00 0.00 N ATOM 498 CA LYS A 37 11.893 -13.879 32.277 1.00 0.00 C ATOM 499 C LYS A 37 11.079 -12.928 33.149 1.00 0.00 C ATOM 500 O LYS A 37 10.510 -13.334 34.162 1.00 0.00 O ATOM 501 CB LYS A 37 13.388 -13.646 32.507 1.00 0.00 C ATOM 502 CG LYS A 37 14.248 -14.857 32.191 1.00 0.00 C ATOM 503 CD LYS A 37 15.261 -14.552 31.099 1.00 0.00 C ATOM 504 CE LYS A 37 16.229 -15.708 30.898 1.00 0.00 C ATOM 505 NZ LYS A 37 17.587 -15.390 31.418 1.00 0.00 N ATOM 0 H LYS A 37 12.374 -13.568 30.261 1.00 0.00 H new ATOM 0 HA LYS A 37 11.644 -14.903 32.556 1.00 0.00 H new ATOM 0 HB2 LYS A 37 13.715 -12.808 31.892 1.00 0.00 H new ATOM 0 HB3 LYS A 37 13.547 -13.359 33.547 1.00 0.00 H new ATOM 0 HG2 LYS A 37 14.769 -15.179 33.092 1.00 0.00 H new ATOM 0 HG3 LYS A 37 13.612 -15.685 31.877 1.00 0.00 H new ATOM 0 HD2 LYS A 37 14.739 -14.346 30.164 1.00 0.00 H new ATOM 0 HD3 LYS A 37 15.817 -13.651 31.358 1.00 0.00 H new ATOM 0 HE2 LYS A 37 15.845 -16.595 31.402 1.00 0.00 H new ATOM 0 HE3 LYS A 37 16.293 -15.948 29.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 18.217 -16.202 31.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 17.964 -14.559 30.919 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 17.530 -15.186 32.436 1.00 0.00 H new ATOM 519 N ARG A 38 11.028 -11.662 32.748 1.00 0.00 N ATOM 520 CA ARG A 38 10.284 -10.654 33.493 1.00 0.00 C ATOM 521 C ARG A 38 8.804 -10.685 33.120 1.00 0.00 C ATOM 522 O ARG A 38 7.936 -10.769 33.989 1.00 0.00 O ATOM 523 CB ARG A 38 10.860 -9.263 33.226 1.00 0.00 C ATOM 524 CG ARG A 38 12.379 -9.219 33.242 1.00 0.00 C ATOM 525 CD ARG A 38 12.926 -9.365 34.653 1.00 0.00 C ATOM 526 NE ARG A 38 14.371 -9.576 34.661 1.00 0.00 N ATOM 527 CZ ARG A 38 15.045 -10.006 35.722 1.00 0.00 C ATOM 528 NH1 ARG A 38 14.407 -10.271 36.854 1.00 0.00 N ATOM 529 NH2 ARG A 38 16.359 -10.174 35.652 1.00 0.00 N ATOM 0 H ARG A 38 11.493 -11.310 31.911 1.00 0.00 H new ATOM 0 HA ARG A 38 10.378 -10.880 34.555 1.00 0.00 H new ATOM 0 HB2 ARG A 38 10.505 -8.912 32.257 1.00 0.00 H new ATOM 0 HB3 ARG A 38 10.477 -8.571 33.976 1.00 0.00 H new ATOM 0 HG2 ARG A 38 12.774 -10.017 32.613 1.00 0.00 H new ATOM 0 HG3 ARG A 38 12.721 -8.277 32.814 1.00 0.00 H new ATOM 0 HD2 ARG A 38 12.687 -8.471 35.229 1.00 0.00 H new ATOM 0 HD3 ARG A 38 12.435 -10.203 35.147 1.00 0.00 H new ATOM 0 HE ARG A 38 14.891 -9.383 33.805 1.00 0.00 H new ATOM 0 HH11 ARG A 38 13.396 -10.145 36.911 1.00 0.00 H new ATOM 0 HH12 ARG A 38 14.927 -10.601 37.667 1.00 0.00 H new ATOM 0 HH21 ARG A 38 16.853 -9.973 34.783 1.00 0.00 H new ATOM 0 HH22 ARG A 38 16.875 -10.504 36.467 1.00 0.00 H new ATOM 543 N ARG A 39 8.525 -10.615 31.822 1.00 0.00 N ATOM 544 CA ARG A 39 7.152 -10.632 31.334 1.00 0.00 C ATOM 545 C ARG A 39 6.293 -11.583 32.162 1.00 0.00 C ATOM 546 O ARG A 39 5.235 -11.204 32.666 1.00 0.00 O ATOM 547 CB ARG A 39 7.116 -11.047 29.862 1.00 0.00 C ATOM 548 CG ARG A 39 5.712 -11.134 29.287 1.00 0.00 C ATOM 549 CD ARG A 39 5.556 -12.343 28.379 1.00 0.00 C ATOM 550 NE ARG A 39 4.300 -12.310 27.634 1.00 0.00 N ATOM 551 CZ ARG A 39 3.705 -13.393 27.147 1.00 0.00 C ATOM 552 NH1 ARG A 39 4.250 -14.589 27.325 1.00 0.00 N ATOM 553 NH2 ARG A 39 2.564 -13.282 26.480 1.00 0.00 N ATOM 0 H ARG A 39 9.232 -10.546 31.090 1.00 0.00 H new ATOM 0 HA ARG A 39 6.746 -9.625 31.431 1.00 0.00 H new ATOM 0 HB2 ARG A 39 7.695 -10.332 29.278 1.00 0.00 H new ATOM 0 HB3 ARG A 39 7.604 -12.016 29.755 1.00 0.00 H new ATOM 0 HG2 ARG A 39 4.988 -11.192 30.100 1.00 0.00 H new ATOM 0 HG3 ARG A 39 5.490 -10.226 28.727 1.00 0.00 H new ATOM 0 HD2 ARG A 39 6.391 -12.381 27.680 1.00 0.00 H new ATOM 0 HD3 ARG A 39 5.599 -13.253 28.977 1.00 0.00 H new ATOM 0 HE ARG A 39 3.855 -11.405 27.479 1.00 0.00 H new ATOM 0 HH11 ARG A 39 5.128 -14.678 27.837 1.00 0.00 H new ATOM 0 HH12 ARG A 39 3.791 -15.419 26.950 1.00 0.00 H new ATOM 0 HH21 ARG A 39 2.142 -12.364 26.340 1.00 0.00 H new ATOM 0 HH22 ARG A 39 2.108 -14.115 26.107 1.00 0.00 H new ATOM 567 N LYS A 40 6.754 -12.822 32.298 1.00 0.00 N ATOM 568 CA LYS A 40 6.029 -13.829 33.065 1.00 0.00 C ATOM 569 C LYS A 40 5.943 -13.434 34.536 1.00 0.00 C ATOM 570 O LYS A 40 4.918 -13.640 35.184 1.00 0.00 O ATOM 571 CB LYS A 40 6.713 -15.191 32.931 1.00 0.00 C ATOM 572 CG LYS A 40 6.770 -15.705 31.503 1.00 0.00 C ATOM 573 CD LYS A 40 5.485 -15.404 30.750 1.00 0.00 C ATOM 574 CE LYS A 40 4.273 -15.989 31.460 1.00 0.00 C ATOM 575 NZ LYS A 40 3.448 -16.829 30.548 1.00 0.00 N ATOM 0 H LYS A 40 7.627 -13.153 31.887 1.00 0.00 H new ATOM 0 HA LYS A 40 5.017 -13.896 32.665 1.00 0.00 H new ATOM 0 HB2 LYS A 40 7.727 -15.119 33.323 1.00 0.00 H new ATOM 0 HB3 LYS A 40 6.183 -15.916 33.549 1.00 0.00 H new ATOM 0 HG2 LYS A 40 7.612 -15.248 30.984 1.00 0.00 H new ATOM 0 HG3 LYS A 40 6.946 -16.781 31.509 1.00 0.00 H new ATOM 0 HD2 LYS A 40 5.364 -14.325 30.651 1.00 0.00 H new ATOM 0 HD3 LYS A 40 5.549 -15.812 29.741 1.00 0.00 H new ATOM 0 HE2 LYS A 40 4.603 -16.590 32.307 1.00 0.00 H new ATOM 0 HE3 LYS A 40 3.662 -15.181 31.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 2.632 -17.209 31.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 3.111 -16.250 29.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 4.024 -17.615 30.185 1.00 0.00 H new ATOM 589 N GLU A 41 7.027 -12.865 35.056 1.00 0.00 N ATOM 590 CA GLU A 41 7.072 -12.442 36.451 1.00 0.00 C ATOM 591 C GLU A 41 6.007 -11.385 36.733 1.00 0.00 C ATOM 592 O GLU A 41 5.156 -11.565 37.604 1.00 0.00 O ATOM 593 CB GLU A 41 8.457 -11.891 36.795 1.00 0.00 C ATOM 594 CG GLU A 41 9.447 -12.959 37.229 1.00 0.00 C ATOM 595 CD GLU A 41 8.969 -14.362 36.907 1.00 0.00 C ATOM 596 OE1 GLU A 41 9.037 -14.753 35.722 1.00 0.00 O ATOM 597 OE2 GLU A 41 8.528 -15.067 37.837 1.00 0.00 O ATOM 0 H GLU A 41 7.884 -12.687 34.533 1.00 0.00 H new ATOM 0 HA GLU A 41 6.870 -13.312 37.075 1.00 0.00 H new ATOM 0 HB2 GLU A 41 8.857 -11.369 35.926 1.00 0.00 H new ATOM 0 HB3 GLU A 41 8.358 -11.154 37.592 1.00 0.00 H new ATOM 0 HG2 GLU A 41 10.404 -12.783 36.738 1.00 0.00 H new ATOM 0 HG3 GLU A 41 9.619 -12.875 38.302 1.00 0.00 H new ATOM 604 N TRP A 42 6.063 -10.285 35.991 1.00 0.00 N ATOM 605 CA TRP A 42 5.104 -9.199 36.162 1.00 0.00 C ATOM 606 C TRP A 42 3.681 -9.739 36.253 1.00 0.00 C ATOM 607 O TRP A 42 2.865 -9.237 37.027 1.00 0.00 O ATOM 608 CB TRP A 42 5.214 -8.208 35.002 1.00 0.00 C ATOM 609 CG TRP A 42 6.422 -7.326 35.087 1.00 0.00 C ATOM 610 CD1 TRP A 42 7.724 -7.726 35.195 1.00 0.00 C ATOM 611 CD2 TRP A 42 6.441 -5.894 35.074 1.00 0.00 C ATOM 612 NE1 TRP A 42 8.550 -6.629 35.249 1.00 0.00 N ATOM 613 CE2 TRP A 42 7.787 -5.494 35.176 1.00 0.00 C ATOM 614 CE3 TRP A 42 5.451 -4.912 34.984 1.00 0.00 C ATOM 615 CZ2 TRP A 42 8.166 -4.154 35.191 1.00 0.00 C ATOM 616 CZ3 TRP A 42 5.829 -3.582 34.999 1.00 0.00 C ATOM 617 CH2 TRP A 42 7.177 -3.213 35.102 1.00 0.00 C ATOM 0 H TRP A 42 6.761 -10.121 35.266 1.00 0.00 H new ATOM 0 HA TRP A 42 5.337 -8.684 37.094 1.00 0.00 H new ATOM 0 HB2 TRP A 42 5.242 -8.761 34.063 1.00 0.00 H new ATOM 0 HB3 TRP A 42 4.319 -7.586 34.979 1.00 0.00 H new ATOM 0 HD1 TRP A 42 8.055 -8.753 35.232 1.00 0.00 H new ATOM 0 HE1 TRP A 42 9.566 -6.656 35.330 1.00 0.00 H new ATOM 0 HE3 TRP A 42 4.410 -5.187 34.904 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 9.204 -3.868 35.270 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 5.072 -2.814 34.930 1.00 0.00 H new ATOM 0 HH2 TRP A 42 7.440 -2.166 35.111 1.00 0.00 H new ATOM 628 N VAL A 43 3.389 -10.764 35.459 1.00 0.00 N ATOM 629 CA VAL A 43 2.064 -11.372 35.452 1.00 0.00 C ATOM 630 C VAL A 43 1.899 -12.344 36.615 1.00 0.00 C ATOM 631 O VAL A 43 0.787 -12.578 37.088 1.00 0.00 O ATOM 632 CB VAL A 43 1.797 -12.119 34.132 1.00 0.00 C ATOM 633 CG1 VAL A 43 0.328 -12.495 34.019 1.00 0.00 C ATOM 634 CG2 VAL A 43 2.232 -11.274 32.944 1.00 0.00 C ATOM 0 H VAL A 43 4.052 -11.191 34.812 1.00 0.00 H new ATOM 0 HA VAL A 43 1.343 -10.561 35.555 1.00 0.00 H new ATOM 0 HB VAL A 43 2.384 -13.038 34.130 1.00 0.00 H new ATOM 0 HG11 VAL A 43 0.158 -13.022 33.080 1.00 0.00 H new ATOM 0 HG12 VAL A 43 0.053 -13.141 34.853 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -0.282 -11.592 34.043 1.00 0.00 H new ATOM 0 HG21 VAL A 43 2.036 -11.817 32.020 1.00 0.00 H new ATOM 0 HG22 VAL A 43 1.674 -10.338 32.940 1.00 0.00 H new ATOM 0 HG23 VAL A 43 3.298 -11.061 33.020 1.00 0.00 H new ATOM 644 N ARG A 44 3.013 -12.906 37.072 1.00 0.00 N ATOM 645 CA ARG A 44 2.992 -13.854 38.180 1.00 0.00 C ATOM 646 C ARG A 44 2.959 -13.123 39.519 1.00 0.00 C ATOM 647 O ARG A 44 2.553 -13.687 40.536 1.00 0.00 O ATOM 648 CB ARG A 44 4.215 -14.771 38.118 1.00 0.00 C ATOM 649 CG ARG A 44 4.754 -15.161 39.484 1.00 0.00 C ATOM 650 CD ARG A 44 5.676 -16.367 39.396 1.00 0.00 C ATOM 651 NE ARG A 44 6.920 -16.161 40.133 1.00 0.00 N ATOM 652 CZ ARG A 44 6.996 -16.158 41.459 1.00 0.00 C ATOM 653 NH1 ARG A 44 5.907 -16.349 42.190 1.00 0.00 N ATOM 654 NH2 ARG A 44 8.165 -15.963 42.057 1.00 0.00 N ATOM 0 H ARG A 44 3.942 -12.721 36.692 1.00 0.00 H new ATOM 0 HA ARG A 44 2.089 -14.458 38.092 1.00 0.00 H new ATOM 0 HB2 ARG A 44 3.953 -15.675 37.569 1.00 0.00 H new ATOM 0 HB3 ARG A 44 5.004 -14.273 37.554 1.00 0.00 H new ATOM 0 HG2 ARG A 44 5.295 -14.319 39.917 1.00 0.00 H new ATOM 0 HG3 ARG A 44 3.924 -15.385 40.154 1.00 0.00 H new ATOM 0 HD2 ARG A 44 5.163 -17.245 39.789 1.00 0.00 H new ATOM 0 HD3 ARG A 44 5.904 -16.573 38.350 1.00 0.00 H new ATOM 0 HE ARG A 44 7.777 -16.011 39.600 1.00 0.00 H new ATOM 0 HH11 ARG A 44 5.007 -16.499 41.734 1.00 0.00 H new ATOM 0 HH12 ARG A 44 5.969 -16.346 43.208 1.00 0.00 H new ATOM 0 HH21 ARG A 44 9.005 -15.815 41.498 1.00 0.00 H new ATOM 0 HH22 ARG A 44 8.223 -15.961 43.075 1.00 0.00 H new ATOM 668 N LEU A 45 3.389 -11.866 39.512 1.00 0.00 N ATOM 669 CA LEU A 45 3.409 -11.057 40.726 1.00 0.00 C ATOM 670 C LEU A 45 2.078 -10.339 40.924 1.00 0.00 C ATOM 671 O LEU A 45 1.587 -10.218 42.046 1.00 0.00 O ATOM 672 CB LEU A 45 4.548 -10.038 40.665 1.00 0.00 C ATOM 673 CG LEU A 45 5.958 -10.594 40.871 1.00 0.00 C ATOM 674 CD1 LEU A 45 6.969 -9.798 40.060 1.00 0.00 C ATOM 675 CD2 LEU A 45 6.326 -10.579 42.347 1.00 0.00 C ATOM 0 H LEU A 45 3.729 -11.385 38.679 1.00 0.00 H new ATOM 0 HA LEU A 45 3.571 -11.723 41.574 1.00 0.00 H new ATOM 0 HB2 LEU A 45 4.513 -9.541 39.695 1.00 0.00 H new ATOM 0 HB3 LEU A 45 4.366 -9.274 41.421 1.00 0.00 H new ATOM 0 HG LEU A 45 5.976 -11.627 40.523 1.00 0.00 H new ATOM 0 HD11 LEU A 45 7.966 -10.208 40.219 1.00 0.00 H new ATOM 0 HD12 LEU A 45 6.716 -9.860 39.002 1.00 0.00 H new ATOM 0 HD13 LEU A 45 6.950 -8.755 40.377 1.00 0.00 H new ATOM 0 HD21 LEU A 45 7.332 -10.978 42.475 1.00 0.00 H new ATOM 0 HD22 LEU A 45 6.291 -9.556 42.720 1.00 0.00 H new ATOM 0 HD23 LEU A 45 5.619 -11.193 42.905 1.00 0.00 H new ATOM 687 N VAL A 46 1.498 -9.865 39.826 1.00 0.00 N ATOM 688 CA VAL A 46 0.223 -9.161 39.878 1.00 0.00 C ATOM 689 C VAL A 46 -0.906 -10.099 40.292 1.00 0.00 C ATOM 690 O VAL A 46 -1.989 -9.654 40.671 1.00 0.00 O ATOM 691 CB VAL A 46 -0.125 -8.528 38.518 1.00 0.00 C ATOM 692 CG1 VAL A 46 -0.098 -9.577 37.417 1.00 0.00 C ATOM 693 CG2 VAL A 46 -1.482 -7.843 38.580 1.00 0.00 C ATOM 0 H VAL A 46 1.891 -9.956 38.889 1.00 0.00 H new ATOM 0 HA VAL A 46 0.328 -8.371 40.622 1.00 0.00 H new ATOM 0 HB VAL A 46 0.627 -7.774 38.286 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -0.346 -9.110 36.464 1.00 0.00 H new ATOM 0 HG12 VAL A 46 0.898 -10.016 37.357 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -0.826 -10.357 37.640 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -1.711 -7.401 37.610 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -2.248 -8.575 38.835 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -1.460 -7.061 39.339 1.00 0.00 H new ATOM 703 N ARG A 47 -0.644 -11.400 40.218 1.00 0.00 N ATOM 704 CA ARG A 47 -1.638 -12.402 40.584 1.00 0.00 C ATOM 705 C ARG A 47 -2.715 -12.518 39.509 1.00 0.00 C ATOM 706 O ARG A 47 -3.909 -12.529 39.811 1.00 0.00 O ATOM 707 CB ARG A 47 -2.279 -12.047 41.927 1.00 0.00 C ATOM 708 CG ARG A 47 -1.285 -11.547 42.963 1.00 0.00 C ATOM 709 CD ARG A 47 -1.947 -10.611 43.963 1.00 0.00 C ATOM 710 NE ARG A 47 -2.255 -11.285 45.221 1.00 0.00 N ATOM 711 CZ ARG A 47 -1.369 -11.466 46.195 1.00 0.00 C ATOM 712 NH1 ARG A 47 -0.127 -11.024 46.055 1.00 0.00 N ATOM 713 NH2 ARG A 47 -1.726 -12.088 47.311 1.00 0.00 N ATOM 0 H ARG A 47 0.248 -11.785 39.908 1.00 0.00 H new ATOM 0 HA ARG A 47 -1.133 -13.364 40.672 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -3.039 -11.282 41.766 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -2.789 -12.926 42.320 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -0.849 -12.396 43.490 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -0.467 -11.028 42.463 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -1.289 -9.764 44.157 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -2.865 -10.210 43.532 1.00 0.00 H new ATOM 0 HE ARG A 47 -3.202 -11.636 45.360 1.00 0.00 H new ATOM 0 HH11 ARG A 47 0.150 -10.544 45.199 1.00 0.00 H new ATOM 0 HH12 ARG A 47 0.552 -11.164 46.804 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -2.681 -12.428 47.422 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -1.045 -12.226 48.058 1.00 0.00 H new ATOM 727 N ARG A 48 -2.285 -12.603 38.255 1.00 0.00 N ATOM 728 CA ARG A 48 -3.212 -12.716 37.135 1.00 0.00 C ATOM 729 C ARG A 48 -2.594 -13.523 35.997 1.00 0.00 C ATOM 730 O ARG A 48 -2.499 -13.048 34.865 1.00 0.00 O ATOM 731 CB ARG A 48 -3.610 -11.327 36.633 1.00 0.00 C ATOM 732 CG ARG A 48 -4.421 -10.525 37.637 1.00 0.00 C ATOM 733 CD ARG A 48 -5.065 -9.309 36.989 1.00 0.00 C ATOM 734 NE ARG A 48 -6.385 -9.026 37.547 1.00 0.00 N ATOM 735 CZ ARG A 48 -6.960 -7.830 37.502 1.00 0.00 C ATOM 736 NH1 ARG A 48 -6.335 -6.810 36.930 1.00 0.00 N ATOM 737 NH2 ARG A 48 -8.164 -7.651 38.032 1.00 0.00 N ATOM 0 H ARG A 48 -1.300 -12.596 37.988 1.00 0.00 H new ATOM 0 HA ARG A 48 -4.103 -13.237 37.484 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -2.708 -10.770 36.379 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -4.188 -11.434 35.715 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -5.194 -11.159 38.072 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -3.775 -10.204 38.454 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -4.420 -8.441 37.126 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -5.153 -9.474 35.915 1.00 0.00 H new ATOM 0 HE ARG A 48 -6.893 -9.789 37.996 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -5.409 -6.943 36.523 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -6.780 -5.893 36.897 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -8.648 -8.432 38.474 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -8.605 -6.732 37.997 1.00 0.00 H new ATOM 751 N LYS A 49 -2.175 -14.745 36.305 1.00 0.00 N ATOM 752 CA LYS A 49 -1.567 -15.620 35.310 1.00 0.00 C ATOM 753 C LYS A 49 -2.509 -15.840 34.131 1.00 0.00 C ATOM 754 O LYS A 49 -2.068 -16.087 33.009 1.00 0.00 O ATOM 755 CB LYS A 49 -1.199 -16.965 35.940 1.00 0.00 C ATOM 756 CG LYS A 49 -0.756 -16.858 37.389 1.00 0.00 C ATOM 757 CD LYS A 49 0.127 -18.027 37.791 1.00 0.00 C ATOM 758 CE LYS A 49 1.007 -17.677 38.981 1.00 0.00 C ATOM 759 NZ LYS A 49 0.508 -18.295 40.240 1.00 0.00 N ATOM 0 H LYS A 49 -2.245 -15.153 37.237 1.00 0.00 H new ATOM 0 HA LYS A 49 -0.661 -15.137 34.944 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.059 -17.632 35.880 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -0.400 -17.423 35.357 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -0.214 -15.924 37.536 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -1.632 -16.823 38.036 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -0.496 -18.887 38.038 1.00 0.00 H new ATOM 0 HD3 LYS A 49 0.753 -18.319 36.948 1.00 0.00 H new ATOM 0 HE2 LYS A 49 2.026 -18.013 38.790 1.00 0.00 H new ATOM 0 HE3 LYS A 49 1.045 -16.594 39.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 1.135 -18.033 41.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -0.455 -17.955 40.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 0.495 -19.330 40.137 1.00 0.00 H new ATOM 773 N ASN A 50 -3.809 -15.746 34.392 1.00 0.00 N ATOM 774 CA ASN A 50 -4.813 -15.934 33.352 1.00 0.00 C ATOM 775 C ASN A 50 -4.765 -14.796 32.337 1.00 0.00 C ATOM 776 O ASN A 50 -5.315 -14.903 31.241 1.00 0.00 O ATOM 777 CB ASN A 50 -6.210 -16.021 33.971 1.00 0.00 C ATOM 778 CG ASN A 50 -7.265 -16.435 32.963 1.00 0.00 C ATOM 779 OD1 ASN A 50 -6.978 -16.592 31.777 1.00 0.00 O ATOM 780 ND2 ASN A 50 -8.493 -16.615 33.434 1.00 0.00 N ATOM 0 H ASN A 50 -4.191 -15.541 35.315 1.00 0.00 H new ATOM 0 HA ASN A 50 -4.593 -16.868 32.835 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -6.196 -16.737 34.793 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -6.477 -15.053 34.396 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -9.245 -16.895 32.804 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -8.685 -16.473 34.426 1.00 0.00 H new ATOM 787 N PHE A 51 -4.102 -13.706 32.709 1.00 0.00 N ATOM 788 CA PHE A 51 -3.981 -12.547 31.832 1.00 0.00 C ATOM 789 C PHE A 51 -2.588 -12.476 31.214 1.00 0.00 C ATOM 790 O PHE A 51 -1.667 -13.168 31.649 1.00 0.00 O ATOM 791 CB PHE A 51 -4.274 -11.261 32.608 1.00 0.00 C ATOM 792 CG PHE A 51 -3.178 -10.239 32.510 1.00 0.00 C ATOM 793 CD1 PHE A 51 -3.154 -9.328 31.466 1.00 0.00 C ATOM 794 CD2 PHE A 51 -2.172 -10.189 33.461 1.00 0.00 C ATOM 795 CE1 PHE A 51 -2.146 -8.387 31.373 1.00 0.00 C ATOM 796 CE2 PHE A 51 -1.162 -9.250 33.374 1.00 0.00 C ATOM 797 CZ PHE A 51 -1.149 -8.347 32.329 1.00 0.00 C ATOM 0 H PHE A 51 -3.640 -13.601 33.612 1.00 0.00 H new ATOM 0 HA PHE A 51 -4.710 -12.652 31.029 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -5.201 -10.825 32.236 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -4.437 -11.508 33.657 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -3.931 -9.354 30.717 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -2.177 -10.893 34.280 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -2.138 -7.683 30.554 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -0.384 -9.222 34.122 1.00 0.00 H new ATOM 0 HZ PHE A 51 -0.361 -7.611 32.259 1.00 0.00 H new ATOM 807 N VAL A 52 -2.441 -11.634 30.196 1.00 0.00 N ATOM 808 CA VAL A 52 -1.161 -11.470 29.518 1.00 0.00 C ATOM 809 C VAL A 52 -1.098 -10.140 28.775 1.00 0.00 C ATOM 810 O VAL A 52 -2.094 -9.652 28.240 1.00 0.00 O ATOM 811 CB VAL A 52 -0.904 -12.615 28.521 1.00 0.00 C ATOM 812 CG1 VAL A 52 -0.422 -12.064 27.187 1.00 0.00 C ATOM 813 CG2 VAL A 52 0.100 -13.604 29.093 1.00 0.00 C ATOM 0 H VAL A 52 -3.193 -11.055 29.823 1.00 0.00 H new ATOM 0 HA VAL A 52 -0.390 -11.489 30.289 1.00 0.00 H new ATOM 0 HB VAL A 52 -1.842 -13.143 28.351 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -0.246 -12.888 26.495 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -1.180 -11.399 26.773 1.00 0.00 H new ATOM 0 HG13 VAL A 52 0.505 -11.510 27.336 1.00 0.00 H new ATOM 0 HG21 VAL A 52 0.270 -14.406 28.375 1.00 0.00 H new ATOM 0 HG22 VAL A 52 1.041 -13.092 29.294 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -0.290 -14.023 30.020 1.00 0.00 H new ATOM 823 N PRO A 53 0.099 -9.538 28.740 1.00 0.00 N ATOM 824 CA PRO A 53 0.321 -8.256 28.065 1.00 0.00 C ATOM 825 C PRO A 53 0.228 -8.376 26.547 1.00 0.00 C ATOM 826 O PRO A 53 0.332 -9.471 25.994 1.00 0.00 O ATOM 827 CB PRO A 53 1.743 -7.875 28.485 1.00 0.00 C ATOM 828 CG PRO A 53 2.406 -9.172 28.799 1.00 0.00 C ATOM 829 CD PRO A 53 1.330 -10.062 29.357 1.00 0.00 C ATOM 0 HA PRO A 53 -0.431 -7.516 28.338 1.00 0.00 H new ATOM 0 HB2 PRO A 53 2.264 -7.347 27.686 1.00 0.00 H new ATOM 0 HB3 PRO A 53 1.736 -7.214 29.352 1.00 0.00 H new ATOM 0 HG2 PRO A 53 2.850 -9.610 27.905 1.00 0.00 H new ATOM 0 HG3 PRO A 53 3.212 -9.034 29.520 1.00 0.00 H new ATOM 0 HD2 PRO A 53 1.497 -11.107 29.095 1.00 0.00 H new ATOM 0 HD3 PRO A 53 1.288 -10.008 30.445 1.00 0.00 H new ATOM 837 N GLY A 54 0.033 -7.244 25.879 1.00 0.00 N ATOM 838 CA GLY A 54 -0.071 -7.245 24.431 1.00 0.00 C ATOM 839 C GLY A 54 -0.743 -5.996 23.897 1.00 0.00 C ATOM 840 O GLY A 54 -0.387 -5.499 22.828 1.00 0.00 O ATOM 0 H GLY A 54 -0.055 -6.326 26.314 1.00 0.00 H new ATOM 0 HA2 GLY A 54 0.926 -7.331 23.998 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -0.634 -8.122 24.111 1.00 0.00 H new ATOM 844 N LYS A 55 -1.718 -5.486 24.641 1.00 0.00 N ATOM 845 CA LYS A 55 -2.443 -4.287 24.237 1.00 0.00 C ATOM 846 C LYS A 55 -1.787 -3.036 24.810 1.00 0.00 C ATOM 847 O LYS A 55 -0.853 -2.488 24.223 1.00 0.00 O ATOM 848 CB LYS A 55 -3.901 -4.368 24.697 1.00 0.00 C ATOM 849 CG LYS A 55 -4.738 -5.348 23.894 1.00 0.00 C ATOM 850 CD LYS A 55 -6.024 -4.707 23.399 1.00 0.00 C ATOM 851 CE LYS A 55 -6.736 -3.954 24.513 1.00 0.00 C ATOM 852 NZ LYS A 55 -8.180 -4.310 24.589 1.00 0.00 N ATOM 0 H LYS A 55 -2.025 -5.885 25.528 1.00 0.00 H new ATOM 0 HA LYS A 55 -2.415 -4.225 23.149 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -3.926 -4.657 25.748 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -4.351 -3.377 24.628 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -4.160 -5.710 23.044 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -4.976 -6.215 24.510 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -5.799 -4.022 22.581 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -6.684 -5.476 22.998 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -6.256 -4.177 25.466 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -6.635 -2.881 24.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -8.629 -3.776 25.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -8.644 -4.074 23.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -8.277 -5.329 24.771 1.00 0.00 H new ATOM 866 N HIS A 56 -2.279 -2.589 25.961 1.00 0.00 N ATOM 867 CA HIS A 56 -1.738 -1.402 26.615 1.00 0.00 C ATOM 868 C HIS A 56 -1.487 -1.665 28.097 1.00 0.00 C ATOM 869 O HIS A 56 -1.021 -0.788 28.824 1.00 0.00 O ATOM 870 CB HIS A 56 -2.696 -0.222 26.450 1.00 0.00 C ATOM 871 CG HIS A 56 -4.140 -0.603 26.556 1.00 0.00 C ATOM 872 ND1 HIS A 56 -4.577 -1.715 27.245 1.00 0.00 N ATOM 873 CD2 HIS A 56 -5.251 -0.012 26.057 1.00 0.00 C ATOM 874 CE1 HIS A 56 -5.893 -1.793 27.164 1.00 0.00 C ATOM 875 NE2 HIS A 56 -6.327 -0.771 26.448 1.00 0.00 N ATOM 0 H HIS A 56 -3.051 -3.030 26.460 1.00 0.00 H new ATOM 0 HA HIS A 56 -0.787 -1.158 26.141 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -2.470 0.527 27.208 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -2.522 0.244 25.480 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -5.285 0.889 25.462 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -6.509 -2.561 27.607 1.00 0.00 H new ATOM 0 HE2 HIS A 56 -7.303 -0.577 26.222 1.00 0.00 H new ATOM 883 N THR A 57 -1.799 -2.880 28.539 1.00 0.00 N ATOM 884 CA THR A 57 -1.609 -3.258 29.933 1.00 0.00 C ATOM 885 C THR A 57 -0.343 -2.631 30.505 1.00 0.00 C ATOM 886 O THR A 57 0.746 -2.792 29.954 1.00 0.00 O ATOM 887 CB THR A 57 -1.528 -4.788 30.095 1.00 0.00 C ATOM 888 OG1 THR A 57 -2.505 -5.421 29.260 1.00 0.00 O ATOM 889 CG2 THR A 57 -1.754 -5.192 31.544 1.00 0.00 C ATOM 0 H THR A 57 -2.184 -3.619 27.951 1.00 0.00 H new ATOM 0 HA THR A 57 -2.475 -2.887 30.481 1.00 0.00 H new ATOM 0 HB THR A 57 -0.531 -5.111 29.796 1.00 0.00 H new ATOM 0 HG1 THR A 57 -2.177 -6.302 28.983 1.00 0.00 H new ATOM 0 HG21 THR A 57 -1.692 -6.277 31.633 1.00 0.00 H new ATOM 0 HG22 THR A 57 -0.992 -4.732 32.173 1.00 0.00 H new ATOM 0 HG23 THR A 57 -2.740 -4.857 31.865 1.00 0.00 H new ATOM 897 N PHE A 58 -0.492 -1.915 31.615 1.00 0.00 N ATOM 898 CA PHE A 58 0.640 -1.262 32.262 1.00 0.00 C ATOM 899 C PHE A 58 0.523 -1.350 33.781 1.00 0.00 C ATOM 900 O PHE A 58 -0.474 -1.841 34.311 1.00 0.00 O ATOM 901 CB PHE A 58 0.728 0.203 31.829 1.00 0.00 C ATOM 902 CG PHE A 58 0.294 1.169 32.894 1.00 0.00 C ATOM 903 CD1 PHE A 58 -1.045 1.490 33.052 1.00 0.00 C ATOM 904 CD2 PHE A 58 1.224 1.756 33.736 1.00 0.00 C ATOM 905 CE1 PHE A 58 -1.447 2.380 34.030 1.00 0.00 C ATOM 906 CE2 PHE A 58 0.828 2.646 34.717 1.00 0.00 C ATOM 907 CZ PHE A 58 -0.509 2.958 34.864 1.00 0.00 C ATOM 0 H PHE A 58 -1.386 -1.772 32.085 1.00 0.00 H new ATOM 0 HA PHE A 58 1.549 -1.779 31.955 1.00 0.00 H new ATOM 0 HB2 PHE A 58 1.755 0.428 31.542 1.00 0.00 H new ATOM 0 HB3 PHE A 58 0.110 0.350 30.943 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -1.782 1.040 32.404 1.00 0.00 H new ATOM 0 HD2 PHE A 58 2.271 1.516 33.625 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -2.493 2.623 34.142 1.00 0.00 H new ATOM 0 HE2 PHE A 58 1.563 3.096 35.367 1.00 0.00 H new ATOM 0 HZ PHE A 58 -0.821 3.653 35.630 1.00 0.00 H new ATOM 917 N LEU A 59 1.548 -0.869 34.476 1.00 0.00 N ATOM 918 CA LEU A 59 1.562 -0.893 35.934 1.00 0.00 C ATOM 919 C LEU A 59 2.077 0.429 36.495 1.00 0.00 C ATOM 920 O LEU A 59 2.995 1.035 35.942 1.00 0.00 O ATOM 921 CB LEU A 59 2.430 -2.047 36.438 1.00 0.00 C ATOM 922 CG LEU A 59 1.722 -3.390 36.621 1.00 0.00 C ATOM 923 CD1 LEU A 59 2.653 -4.400 37.271 1.00 0.00 C ATOM 924 CD2 LEU A 59 0.457 -3.217 37.449 1.00 0.00 C ATOM 0 H LEU A 59 2.380 -0.458 34.053 1.00 0.00 H new ATOM 0 HA LEU A 59 0.539 -1.040 36.280 1.00 0.00 H new ATOM 0 HB2 LEU A 59 3.255 -2.186 35.740 1.00 0.00 H new ATOM 0 HB3 LEU A 59 2.867 -1.756 37.393 1.00 0.00 H new ATOM 0 HG LEU A 59 1.440 -3.768 35.638 1.00 0.00 H new ATOM 0 HD11 LEU A 59 2.132 -5.349 37.393 1.00 0.00 H new ATOM 0 HD12 LEU A 59 3.529 -4.546 36.640 1.00 0.00 H new ATOM 0 HD13 LEU A 59 2.967 -4.030 38.247 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -0.034 -4.183 37.569 1.00 0.00 H new ATOM 0 HD22 LEU A 59 0.716 -2.817 38.429 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -0.218 -2.527 36.942 1.00 0.00 H new ATOM 936 N CYS A 60 1.482 0.870 37.599 1.00 0.00 N ATOM 937 CA CYS A 60 1.882 2.118 38.237 1.00 0.00 C ATOM 938 C CYS A 60 3.347 2.069 38.658 1.00 0.00 C ATOM 939 O CYS A 60 3.963 1.003 38.679 1.00 0.00 O ATOM 940 CB CYS A 60 0.999 2.398 39.455 1.00 0.00 C ATOM 941 SG CYS A 60 -0.783 2.169 39.150 1.00 0.00 S ATOM 0 H CYS A 60 0.721 0.381 38.070 1.00 0.00 H new ATOM 0 HA CYS A 60 1.757 2.923 37.513 1.00 0.00 H new ATOM 0 HB2 CYS A 60 1.304 1.742 40.270 1.00 0.00 H new ATOM 0 HB3 CYS A 60 1.171 3.422 39.788 1.00 0.00 H new ATOM 946 N SER A 61 3.900 3.231 38.993 1.00 0.00 N ATOM 947 CA SER A 61 5.295 3.321 39.410 1.00 0.00 C ATOM 948 C SER A 61 5.423 3.139 40.920 1.00 0.00 C ATOM 949 O SER A 61 6.404 2.578 41.408 1.00 0.00 O ATOM 950 CB SER A 61 5.886 4.670 38.996 1.00 0.00 C ATOM 951 OG SER A 61 6.249 5.438 40.131 1.00 0.00 O ATOM 0 H SER A 61 3.404 4.122 38.984 1.00 0.00 H new ATOM 0 HA SER A 61 5.849 2.522 38.917 1.00 0.00 H new ATOM 0 HB2 SER A 61 6.761 4.509 38.367 1.00 0.00 H new ATOM 0 HB3 SER A 61 5.160 5.220 38.398 1.00 0.00 H new ATOM 0 HG SER A 61 6.626 6.295 39.840 1.00 0.00 H new ATOM 957 N LYS A 62 4.424 3.617 41.654 1.00 0.00 N ATOM 958 CA LYS A 62 4.422 3.507 43.108 1.00 0.00 C ATOM 959 C LYS A 62 4.847 2.110 43.548 1.00 0.00 C ATOM 960 O LYS A 62 5.617 1.954 44.497 1.00 0.00 O ATOM 961 CB LYS A 62 3.032 3.827 43.662 1.00 0.00 C ATOM 962 CG LYS A 62 2.884 5.261 44.141 1.00 0.00 C ATOM 963 CD LYS A 62 3.119 6.253 43.015 1.00 0.00 C ATOM 964 CE LYS A 62 4.410 7.031 43.218 1.00 0.00 C ATOM 965 NZ LYS A 62 4.264 8.085 44.260 1.00 0.00 N ATOM 0 H LYS A 62 3.605 4.085 41.266 1.00 0.00 H new ATOM 0 HA LYS A 62 5.139 4.227 43.503 1.00 0.00 H new ATOM 0 HB2 LYS A 62 2.288 3.632 42.889 1.00 0.00 H new ATOM 0 HB3 LYS A 62 2.816 3.152 44.490 1.00 0.00 H new ATOM 0 HG2 LYS A 62 1.885 5.407 44.553 1.00 0.00 H new ATOM 0 HG3 LYS A 62 3.592 5.451 44.948 1.00 0.00 H new ATOM 0 HD2 LYS A 62 3.158 5.722 42.064 1.00 0.00 H new ATOM 0 HD3 LYS A 62 2.280 6.947 42.959 1.00 0.00 H new ATOM 0 HE2 LYS A 62 5.207 6.344 43.505 1.00 0.00 H new ATOM 0 HE3 LYS A 62 4.709 7.490 42.276 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 5.165 8.593 44.369 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 3.521 8.755 43.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 4.003 7.644 45.165 1.00 0.00 H new ATOM 979 N HIS A 63 4.341 1.096 42.853 1.00 0.00 N ATOM 980 CA HIS A 63 4.671 -0.289 43.172 1.00 0.00 C ATOM 981 C HIS A 63 6.181 -0.477 43.281 1.00 0.00 C ATOM 982 O HIS A 63 6.689 -0.918 44.312 1.00 0.00 O ATOM 983 CB HIS A 63 4.104 -1.228 42.107 1.00 0.00 C ATOM 984 CG HIS A 63 2.625 -1.090 41.912 1.00 0.00 C ATOM 985 ND1 HIS A 63 1.709 -1.318 42.917 1.00 0.00 N ATOM 986 CD2 HIS A 63 1.905 -0.742 40.821 1.00 0.00 C ATOM 987 CE1 HIS A 63 0.489 -1.119 42.452 1.00 0.00 C ATOM 988 NE2 HIS A 63 0.580 -0.768 41.182 1.00 0.00 N ATOM 0 H HIS A 63 3.702 1.207 42.066 1.00 0.00 H new ATOM 0 HA HIS A 63 4.222 -0.531 44.136 1.00 0.00 H new ATOM 0 HB2 HIS A 63 4.607 -1.035 41.159 1.00 0.00 H new ATOM 0 HB3 HIS A 63 4.331 -2.257 42.384 1.00 0.00 H new ATOM 0 HD1 HIS A 63 1.938 -1.597 43.871 1.00 0.00 H new ATOM 0 HD2 HIS A 63 2.299 -0.491 39.847 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -0.427 -1.225 43.014 1.00 0.00 H new ATOM 996 N PHE A 64 6.893 -0.141 42.211 1.00 0.00 N ATOM 997 CA PHE A 64 8.345 -0.274 42.185 1.00 0.00 C ATOM 998 C PHE A 64 9.003 0.773 43.079 1.00 0.00 C ATOM 999 O PHE A 64 8.557 1.918 43.142 1.00 0.00 O ATOM 1000 CB PHE A 64 8.866 -0.138 40.753 1.00 0.00 C ATOM 1001 CG PHE A 64 8.276 -1.141 39.803 1.00 0.00 C ATOM 1002 CD1 PHE A 64 7.026 -0.933 39.243 1.00 0.00 C ATOM 1003 CD2 PHE A 64 8.971 -2.293 39.470 1.00 0.00 C ATOM 1004 CE1 PHE A 64 6.480 -1.853 38.368 1.00 0.00 C ATOM 1005 CE2 PHE A 64 8.431 -3.216 38.596 1.00 0.00 C ATOM 1006 CZ PHE A 64 7.184 -2.997 38.045 1.00 0.00 C ATOM 0 H PHE A 64 6.488 0.226 41.350 1.00 0.00 H new ATOM 0 HA PHE A 64 8.601 -1.263 42.565 1.00 0.00 H new ATOM 0 HB2 PHE A 64 8.649 0.866 40.390 1.00 0.00 H new ATOM 0 HB3 PHE A 64 9.950 -0.248 40.757 1.00 0.00 H new ATOM 0 HD1 PHE A 64 6.471 -0.041 39.493 1.00 0.00 H new ATOM 0 HD2 PHE A 64 9.946 -2.471 39.899 1.00 0.00 H new ATOM 0 HE1 PHE A 64 5.505 -1.678 37.938 1.00 0.00 H new ATOM 0 HE2 PHE A 64 8.984 -4.109 38.344 1.00 0.00 H new ATOM 0 HZ PHE A 64 6.760 -3.719 37.363 1.00 0.00 H new ATOM 1016 N GLU A 65 10.065 0.370 43.769 1.00 0.00 N ATOM 1017 CA GLU A 65 10.784 1.273 44.661 1.00 0.00 C ATOM 1018 C GLU A 65 11.685 2.216 43.869 1.00 0.00 C ATOM 1019 O GLU A 65 11.233 3.241 43.359 1.00 0.00 O ATOM 1020 CB GLU A 65 11.618 0.476 45.665 1.00 0.00 C ATOM 1021 CG GLU A 65 10.803 -0.109 46.806 1.00 0.00 C ATOM 1022 CD GLU A 65 10.894 0.719 48.073 1.00 0.00 C ATOM 1023 OE1 GLU A 65 10.909 1.963 47.968 1.00 0.00 O ATOM 1024 OE2 GLU A 65 10.952 0.123 49.169 1.00 0.00 O ATOM 0 H GLU A 65 10.447 -0.575 43.728 1.00 0.00 H new ATOM 0 HA GLU A 65 10.050 1.869 45.202 1.00 0.00 H new ATOM 0 HB2 GLU A 65 12.126 -0.333 45.141 1.00 0.00 H new ATOM 0 HB3 GLU A 65 12.391 1.124 46.077 1.00 0.00 H new ATOM 0 HG2 GLU A 65 9.759 -0.185 46.500 1.00 0.00 H new ATOM 0 HG3 GLU A 65 11.149 -1.122 47.013 1.00 0.00 H new ATOM 1031 N ALA A 66 12.962 1.862 43.771 1.00 0.00 N ATOM 1032 CA ALA A 66 13.927 2.675 43.041 1.00 0.00 C ATOM 1033 C ALA A 66 14.918 1.800 42.281 1.00 0.00 C ATOM 1034 O ALA A 66 15.323 2.129 41.166 1.00 0.00 O ATOM 1035 CB ALA A 66 14.663 3.604 43.995 1.00 0.00 C ATOM 0 H ALA A 66 13.353 1.017 44.188 1.00 0.00 H new ATOM 0 HA ALA A 66 13.382 3.277 42.314 1.00 0.00 H new ATOM 0 HB1 ALA A 66 15.380 4.205 43.436 1.00 0.00 H new ATOM 0 HB2 ALA A 66 13.946 4.260 44.489 1.00 0.00 H new ATOM 0 HB3 ALA A 66 15.190 3.013 44.744 1.00 0.00 H new ATOM 1041 N SER A 67 15.307 0.686 42.893 1.00 0.00 N ATOM 1042 CA SER A 67 16.255 -0.234 42.275 1.00 0.00 C ATOM 1043 C SER A 67 15.708 -0.774 40.958 1.00 0.00 C ATOM 1044 O SER A 67 16.452 -1.321 40.142 1.00 0.00 O ATOM 1045 CB SER A 67 16.566 -1.393 43.225 1.00 0.00 C ATOM 1046 OG SER A 67 17.048 -0.917 44.470 1.00 0.00 O ATOM 0 H SER A 67 14.981 0.399 43.816 1.00 0.00 H new ATOM 0 HA SER A 67 17.174 0.314 42.069 1.00 0.00 H new ATOM 0 HB2 SER A 67 15.667 -1.989 43.383 1.00 0.00 H new ATOM 0 HB3 SER A 67 17.308 -2.050 42.771 1.00 0.00 H new ATOM 0 HG SER A 67 17.238 -1.677 45.059 1.00 0.00 H new ATOM 1052 N CYS A 68 14.405 -0.617 40.756 1.00 0.00 N ATOM 1053 CA CYS A 68 13.756 -1.089 39.538 1.00 0.00 C ATOM 1054 C CYS A 68 13.807 -0.024 38.448 1.00 0.00 C ATOM 1055 O CYS A 68 13.425 -0.273 37.304 1.00 0.00 O ATOM 1056 CB CYS A 68 12.304 -1.474 39.825 1.00 0.00 C ATOM 1057 SG CYS A 68 11.962 -1.819 41.567 1.00 0.00 S ATOM 0 H CYS A 68 13.776 -0.166 41.421 1.00 0.00 H new ATOM 0 HA CYS A 68 14.294 -1.969 39.186 1.00 0.00 H new ATOM 0 HB2 CYS A 68 11.652 -0.667 39.491 1.00 0.00 H new ATOM 0 HB3 CYS A 68 12.049 -2.354 39.235 1.00 0.00 H new ATOM 0 HG CYS A 68 11.003 -2.692 41.656 1.00 0.00 H new ATOM 1063 N PHE A 69 14.279 1.164 38.809 1.00 0.00 N ATOM 1064 CA PHE A 69 14.377 2.269 37.862 1.00 0.00 C ATOM 1065 C PHE A 69 15.831 2.691 37.668 1.00 0.00 C ATOM 1066 O PHE A 69 16.732 2.175 38.328 1.00 0.00 O ATOM 1067 CB PHE A 69 13.549 3.460 38.348 1.00 0.00 C ATOM 1068 CG PHE A 69 12.090 3.147 38.516 1.00 0.00 C ATOM 1069 CD1 PHE A 69 11.264 3.018 37.410 1.00 0.00 C ATOM 1070 CD2 PHE A 69 11.544 2.981 39.778 1.00 0.00 C ATOM 1071 CE1 PHE A 69 9.921 2.731 37.562 1.00 0.00 C ATOM 1072 CE2 PHE A 69 10.201 2.693 39.936 1.00 0.00 C ATOM 1073 CZ PHE A 69 9.389 2.567 38.826 1.00 0.00 C ATOM 0 H PHE A 69 14.600 1.387 39.751 1.00 0.00 H new ATOM 0 HA PHE A 69 13.984 1.930 36.904 1.00 0.00 H new ATOM 0 HB2 PHE A 69 13.950 3.807 39.300 1.00 0.00 H new ATOM 0 HB3 PHE A 69 13.657 4.281 37.639 1.00 0.00 H new ATOM 0 HD1 PHE A 69 11.675 3.143 36.419 1.00 0.00 H new ATOM 0 HD2 PHE A 69 12.175 3.078 40.649 1.00 0.00 H new ATOM 0 HE1 PHE A 69 9.287 2.635 36.693 1.00 0.00 H new ATOM 0 HE2 PHE A 69 9.788 2.567 40.926 1.00 0.00 H new ATOM 0 HZ PHE A 69 8.340 2.341 38.946 1.00 0.00 H new ATOM 1083 N ASP A 70 16.050 3.632 36.756 1.00 0.00 N ATOM 1084 CA ASP A 70 17.393 4.125 36.473 1.00 0.00 C ATOM 1085 C ASP A 70 17.606 5.505 37.087 1.00 0.00 C ATOM 1086 O ASP A 70 17.152 6.514 36.545 1.00 0.00 O ATOM 1087 CB ASP A 70 17.631 4.182 34.963 1.00 0.00 C ATOM 1088 CG ASP A 70 19.029 3.737 34.581 1.00 0.00 C ATOM 1089 OD1 ASP A 70 19.476 2.686 35.086 1.00 0.00 O ATOM 1090 OD2 ASP A 70 19.676 4.440 33.776 1.00 0.00 O ATOM 0 H ASP A 70 15.315 4.069 36.200 1.00 0.00 H new ATOM 0 HA ASP A 70 18.108 3.434 36.920 1.00 0.00 H new ATOM 0 HB2 ASP A 70 16.901 3.549 34.459 1.00 0.00 H new ATOM 0 HB3 ASP A 70 17.468 5.200 34.610 1.00 0.00 H new ATOM 1095 N LEU A 71 18.296 5.542 38.221 1.00 0.00 N ATOM 1096 CA LEU A 71 18.569 6.799 38.910 1.00 0.00 C ATOM 1097 C LEU A 71 19.918 7.370 38.487 1.00 0.00 C ATOM 1098 O LEU A 71 19.986 8.390 37.800 1.00 0.00 O ATOM 1099 CB LEU A 71 18.543 6.589 40.425 1.00 0.00 C ATOM 1100 CG LEU A 71 17.575 5.522 40.938 1.00 0.00 C ATOM 1101 CD1 LEU A 71 16.248 5.606 40.201 1.00 0.00 C ATOM 1102 CD2 LEU A 71 18.183 4.135 40.788 1.00 0.00 C ATOM 0 H LEU A 71 18.677 4.716 38.683 1.00 0.00 H new ATOM 0 HA LEU A 71 17.792 7.512 38.635 1.00 0.00 H new ATOM 0 HB2 LEU A 71 19.549 6.326 40.753 1.00 0.00 H new ATOM 0 HB3 LEU A 71 18.291 7.538 40.899 1.00 0.00 H new ATOM 0 HG LEU A 71 17.391 5.705 41.997 1.00 0.00 H new ATOM 0 HD11 LEU A 71 15.572 4.839 40.580 1.00 0.00 H new ATOM 0 HD12 LEU A 71 15.806 6.590 40.359 1.00 0.00 H new ATOM 0 HD13 LEU A 71 16.413 5.450 39.135 1.00 0.00 H new ATOM 0 HD21 LEU A 71 17.481 3.388 41.158 1.00 0.00 H new ATOM 0 HD22 LEU A 71 18.396 3.943 39.736 1.00 0.00 H new ATOM 0 HD23 LEU A 71 19.108 4.079 41.362 1.00 0.00 H new ATOM 1114 N THR A 72 20.993 6.705 38.901 1.00 0.00 N ATOM 1115 CA THR A 72 22.341 7.146 38.565 1.00 0.00 C ATOM 1116 C THR A 72 22.423 8.667 38.504 1.00 0.00 C ATOM 1117 O THR A 72 23.171 9.226 37.703 1.00 0.00 O ATOM 1118 CB THR A 72 22.802 6.563 37.216 1.00 0.00 C ATOM 1119 OG1 THR A 72 24.192 6.842 37.011 1.00 0.00 O ATOM 1120 CG2 THR A 72 21.989 7.145 36.069 1.00 0.00 C ATOM 0 H THR A 72 20.956 5.859 39.470 1.00 0.00 H new ATOM 0 HA THR A 72 22.999 6.782 39.354 1.00 0.00 H new ATOM 0 HB THR A 72 22.648 5.484 37.240 1.00 0.00 H new ATOM 0 HG1 THR A 72 24.363 7.793 37.176 1.00 0.00 H new ATOM 0 HG21 THR A 72 22.332 6.719 35.127 1.00 0.00 H new ATOM 0 HG22 THR A 72 20.935 6.907 36.212 1.00 0.00 H new ATOM 0 HG23 THR A 72 22.116 8.227 36.045 1.00 0.00 H new ATOM 1128 N GLY A 73 21.648 9.332 39.356 1.00 0.00 N ATOM 1129 CA GLY A 73 21.649 10.783 39.382 1.00 0.00 C ATOM 1130 C GLY A 73 21.194 11.387 38.068 1.00 0.00 C ATOM 1131 O GLY A 73 22.015 11.738 37.222 1.00 0.00 O ATOM 0 H GLY A 73 21.020 8.892 40.028 1.00 0.00 H new ATOM 0 HA2 GLY A 73 20.996 11.129 40.183 1.00 0.00 H new ATOM 0 HA3 GLY A 73 22.653 11.138 39.613 1.00 0.00 H new ATOM 1135 N GLN A 74 19.881 11.506 37.898 1.00 0.00 N ATOM 1136 CA GLN A 74 19.318 12.069 36.676 1.00 0.00 C ATOM 1137 C GLN A 74 17.803 11.893 36.644 1.00 0.00 C ATOM 1138 O GLN A 74 17.057 12.753 37.113 1.00 0.00 O ATOM 1139 CB GLN A 74 19.947 11.409 35.448 1.00 0.00 C ATOM 1140 CG GLN A 74 21.042 12.243 34.803 1.00 0.00 C ATOM 1141 CD GLN A 74 22.278 11.429 34.475 1.00 0.00 C ATOM 1142 OE1 GLN A 74 22.564 10.423 35.125 1.00 0.00 O ATOM 1143 NE2 GLN A 74 23.019 11.860 33.461 1.00 0.00 N ATOM 0 H GLN A 74 19.188 11.221 38.590 1.00 0.00 H new ATOM 0 HA GLN A 74 19.542 13.136 36.660 1.00 0.00 H new ATOM 0 HB2 GLN A 74 20.360 10.443 35.737 1.00 0.00 H new ATOM 0 HB3 GLN A 74 19.168 11.215 34.711 1.00 0.00 H new ATOM 0 HG2 GLN A 74 20.658 12.697 33.890 1.00 0.00 H new ATOM 0 HG3 GLN A 74 21.315 13.058 35.473 1.00 0.00 H new ATOM 0 HE21 GLN A 74 22.745 12.699 32.949 1.00 0.00 H new ATOM 0 HE22 GLN A 74 23.862 11.352 33.194 1.00 0.00 H new ATOM 1152 N THR A 75 17.354 10.773 36.086 1.00 0.00 N ATOM 1153 CA THR A 75 15.929 10.484 35.990 1.00 0.00 C ATOM 1154 C THR A 75 15.601 9.125 36.596 1.00 0.00 C ATOM 1155 O THR A 75 16.310 8.641 37.479 1.00 0.00 O ATOM 1156 CB THR A 75 15.447 10.511 34.527 1.00 0.00 C ATOM 1157 OG1 THR A 75 14.016 10.496 34.482 1.00 0.00 O ATOM 1158 CG2 THR A 75 15.996 9.321 33.755 1.00 0.00 C ATOM 0 H THR A 75 17.958 10.051 35.693 1.00 0.00 H new ATOM 0 HA THR A 75 15.411 11.263 36.550 1.00 0.00 H new ATOM 0 HB THR A 75 15.815 11.426 34.063 1.00 0.00 H new ATOM 0 HG1 THR A 75 13.717 9.856 33.803 1.00 0.00 H new ATOM 0 HG21 THR A 75 15.642 9.361 32.725 1.00 0.00 H new ATOM 0 HG22 THR A 75 17.086 9.351 33.766 1.00 0.00 H new ATOM 0 HG23 THR A 75 15.654 8.396 34.220 1.00 0.00 H new ATOM 1166 N ARG A 76 14.523 8.513 36.117 1.00 0.00 N ATOM 1167 CA ARG A 76 14.101 7.208 36.613 1.00 0.00 C ATOM 1168 C ARG A 76 13.376 6.422 35.525 1.00 0.00 C ATOM 1169 O ARG A 76 12.178 6.604 35.307 1.00 0.00 O ATOM 1170 CB ARG A 76 13.191 7.372 37.832 1.00 0.00 C ATOM 1171 CG ARG A 76 13.454 6.354 38.929 1.00 0.00 C ATOM 1172 CD ARG A 76 13.565 7.020 40.292 1.00 0.00 C ATOM 1173 NE ARG A 76 12.464 7.947 40.539 1.00 0.00 N ATOM 1174 CZ ARG A 76 12.362 8.690 41.635 1.00 0.00 C ATOM 1175 NH1 ARG A 76 13.290 8.616 42.579 1.00 0.00 N ATOM 1176 NH2 ARG A 76 11.331 9.511 41.788 1.00 0.00 N ATOM 0 H ARG A 76 13.926 8.900 35.386 1.00 0.00 H new ATOM 0 HA ARG A 76 14.992 6.653 36.906 1.00 0.00 H new ATOM 0 HB2 ARG A 76 13.321 8.375 38.240 1.00 0.00 H new ATOM 0 HB3 ARG A 76 12.152 7.290 37.513 1.00 0.00 H new ATOM 0 HG2 ARG A 76 12.649 5.620 38.946 1.00 0.00 H new ATOM 0 HG3 ARG A 76 14.375 5.812 38.711 1.00 0.00 H new ATOM 0 HD2 ARG A 76 13.577 6.256 41.069 1.00 0.00 H new ATOM 0 HD3 ARG A 76 14.512 7.556 40.358 1.00 0.00 H new ATOM 0 HE ARG A 76 11.734 8.028 39.831 1.00 0.00 H new ATOM 0 HH11 ARG A 76 14.085 7.987 42.465 1.00 0.00 H new ATOM 0 HH12 ARG A 76 13.209 9.188 43.420 1.00 0.00 H new ATOM 0 HH21 ARG A 76 10.616 9.572 41.063 1.00 0.00 H new ATOM 0 HH22 ARG A 76 11.254 10.081 42.630 1.00 0.00 H new ATOM 1190 N ARG A 77 14.110 5.547 34.845 1.00 0.00 N ATOM 1191 CA ARG A 77 13.538 4.734 33.779 1.00 0.00 C ATOM 1192 C ARG A 77 13.427 3.274 34.208 1.00 0.00 C ATOM 1193 O ARG A 77 14.399 2.677 34.673 1.00 0.00 O ATOM 1194 CB ARG A 77 14.390 4.842 32.513 1.00 0.00 C ATOM 1195 CG ARG A 77 14.404 6.235 31.904 1.00 0.00 C ATOM 1196 CD ARG A 77 15.079 6.241 30.542 1.00 0.00 C ATOM 1197 NE ARG A 77 15.837 7.468 30.313 1.00 0.00 N ATOM 1198 CZ ARG A 77 16.964 7.766 30.949 1.00 0.00 C ATOM 1199 NH1 ARG A 77 17.462 6.929 31.849 1.00 0.00 N ATOM 1200 NH2 ARG A 77 17.596 8.902 30.685 1.00 0.00 N ATOM 0 H ARG A 77 15.103 5.383 35.014 1.00 0.00 H new ATOM 0 HA ARG A 77 12.537 5.109 33.568 1.00 0.00 H new ATOM 0 HB2 ARG A 77 15.413 4.547 32.748 1.00 0.00 H new ATOM 0 HB3 ARG A 77 14.016 4.135 31.772 1.00 0.00 H new ATOM 0 HG2 ARG A 77 13.382 6.601 31.806 1.00 0.00 H new ATOM 0 HG3 ARG A 77 14.925 6.920 32.573 1.00 0.00 H new ATOM 0 HD2 ARG A 77 15.746 5.383 30.464 1.00 0.00 H new ATOM 0 HD3 ARG A 77 14.325 6.130 29.763 1.00 0.00 H new ATOM 0 HE ARG A 77 15.481 8.133 29.626 1.00 0.00 H new ATOM 0 HH11 ARG A 77 16.979 6.054 32.054 1.00 0.00 H new ATOM 0 HH12 ARG A 77 18.328 7.160 32.336 1.00 0.00 H new ATOM 0 HH21 ARG A 77 17.216 9.548 29.993 1.00 0.00 H new ATOM 0 HH22 ARG A 77 18.462 9.130 31.174 1.00 0.00 H new ATOM 1214 N LEU A 78 12.238 2.705 34.049 1.00 0.00 N ATOM 1215 CA LEU A 78 11.999 1.314 34.421 1.00 0.00 C ATOM 1216 C LEU A 78 12.790 0.368 33.523 1.00 0.00 C ATOM 1217 O LEU A 78 12.508 0.244 32.331 1.00 0.00 O ATOM 1218 CB LEU A 78 10.507 0.991 34.332 1.00 0.00 C ATOM 1219 CG LEU A 78 10.072 -0.344 34.938 1.00 0.00 C ATOM 1220 CD1 LEU A 78 10.942 -1.476 34.415 1.00 0.00 C ATOM 1221 CD2 LEU A 78 10.129 -0.283 36.458 1.00 0.00 C ATOM 0 H LEU A 78 11.424 3.185 33.665 1.00 0.00 H new ATOM 0 HA LEU A 78 12.334 1.175 35.449 1.00 0.00 H new ATOM 0 HB2 LEU A 78 9.953 1.789 34.826 1.00 0.00 H new ATOM 0 HB3 LEU A 78 10.215 1.003 33.282 1.00 0.00 H new ATOM 0 HG LEU A 78 9.042 -0.538 34.640 1.00 0.00 H new ATOM 0 HD11 LEU A 78 10.618 -2.418 34.857 1.00 0.00 H new ATOM 0 HD12 LEU A 78 10.851 -1.534 33.330 1.00 0.00 H new ATOM 0 HD13 LEU A 78 11.982 -1.289 34.682 1.00 0.00 H new ATOM 0 HD21 LEU A 78 9.816 -1.241 36.873 1.00 0.00 H new ATOM 0 HD22 LEU A 78 11.149 -0.066 36.775 1.00 0.00 H new ATOM 0 HD23 LEU A 78 9.463 0.502 36.816 1.00 0.00 H new ATOM 1233 N LYS A 79 13.781 -0.300 34.104 1.00 0.00 N ATOM 1234 CA LYS A 79 14.612 -1.239 33.360 1.00 0.00 C ATOM 1235 C LYS A 79 13.803 -2.458 32.930 1.00 0.00 C ATOM 1236 O LYS A 79 13.013 -2.995 33.705 1.00 0.00 O ATOM 1237 CB LYS A 79 15.807 -1.679 34.209 1.00 0.00 C ATOM 1238 CG LYS A 79 16.581 -0.522 34.816 1.00 0.00 C ATOM 1239 CD LYS A 79 16.717 -0.671 36.322 1.00 0.00 C ATOM 1240 CE LYS A 79 17.806 -1.667 36.687 1.00 0.00 C ATOM 1241 NZ LYS A 79 19.150 -1.208 36.240 1.00 0.00 N ATOM 0 H LYS A 79 14.028 -0.208 35.089 1.00 0.00 H new ATOM 0 HA LYS A 79 14.977 -0.733 32.466 1.00 0.00 H new ATOM 0 HB2 LYS A 79 15.453 -2.328 35.010 1.00 0.00 H new ATOM 0 HB3 LYS A 79 16.482 -2.272 33.592 1.00 0.00 H new ATOM 0 HG2 LYS A 79 17.571 -0.469 34.364 1.00 0.00 H new ATOM 0 HG3 LYS A 79 16.075 0.416 34.586 1.00 0.00 H new ATOM 0 HD2 LYS A 79 16.945 0.298 36.765 1.00 0.00 H new ATOM 0 HD3 LYS A 79 15.767 -0.998 36.744 1.00 0.00 H new ATOM 0 HE2 LYS A 79 17.814 -1.817 37.767 1.00 0.00 H new ATOM 0 HE3 LYS A 79 17.582 -2.632 36.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 19.884 -1.672 36.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 19.286 -1.455 35.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 19.221 -0.177 36.355 1.00 0.00 H new ATOM 1255 N MET A 80 14.008 -2.892 31.690 1.00 0.00 N ATOM 1256 CA MET A 80 13.299 -4.050 31.159 1.00 0.00 C ATOM 1257 C MET A 80 13.575 -5.290 32.004 1.00 0.00 C ATOM 1258 O MET A 80 12.791 -6.240 32.003 1.00 0.00 O ATOM 1259 CB MET A 80 13.711 -4.306 29.708 1.00 0.00 C ATOM 1260 CG MET A 80 13.392 -3.151 28.773 1.00 0.00 C ATOM 1261 SD MET A 80 11.986 -3.495 27.699 1.00 0.00 S ATOM 1262 CE MET A 80 12.684 -4.739 26.615 1.00 0.00 C ATOM 0 H MET A 80 14.659 -2.459 31.035 1.00 0.00 H new ATOM 0 HA MET A 80 12.230 -3.838 31.194 1.00 0.00 H new ATOM 0 HB2 MET A 80 14.782 -4.506 29.673 1.00 0.00 H new ATOM 0 HB3 MET A 80 13.207 -5.203 29.349 1.00 0.00 H new ATOM 0 HG2 MET A 80 13.184 -2.258 29.363 1.00 0.00 H new ATOM 0 HG3 MET A 80 14.267 -2.932 28.161 1.00 0.00 H new ATOM 0 HE1 MET A 80 12.287 -4.609 25.608 1.00 0.00 H new ATOM 0 HE2 MET A 80 13.769 -4.635 26.593 1.00 0.00 H new ATOM 0 HE3 MET A 80 12.422 -5.731 26.983 1.00 0.00 H new ATOM 1272 N ASP A 81 14.691 -5.274 32.724 1.00 0.00 N ATOM 1273 CA ASP A 81 15.069 -6.398 33.574 1.00 0.00 C ATOM 1274 C ASP A 81 14.629 -6.160 35.015 1.00 0.00 C ATOM 1275 O ASP A 81 15.136 -6.793 35.941 1.00 0.00 O ATOM 1276 CB ASP A 81 16.582 -6.620 33.519 1.00 0.00 C ATOM 1277 CG ASP A 81 17.025 -7.265 32.221 1.00 0.00 C ATOM 1278 OD1 ASP A 81 16.230 -8.029 31.636 1.00 0.00 O ATOM 1279 OD2 ASP A 81 18.168 -7.006 31.791 1.00 0.00 O ATOM 0 H ASP A 81 15.350 -4.496 32.736 1.00 0.00 H new ATOM 0 HA ASP A 81 14.565 -7.290 33.202 1.00 0.00 H new ATOM 0 HB2 ASP A 81 17.091 -5.664 33.639 1.00 0.00 H new ATOM 0 HB3 ASP A 81 16.885 -7.249 34.356 1.00 0.00 H new ATOM 1284 N ALA A 82 13.684 -5.244 35.196 1.00 0.00 N ATOM 1285 CA ALA A 82 13.175 -4.924 36.524 1.00 0.00 C ATOM 1286 C ALA A 82 11.770 -5.483 36.723 1.00 0.00 C ATOM 1287 O ALA A 82 10.898 -5.315 35.871 1.00 0.00 O ATOM 1288 CB ALA A 82 13.182 -3.418 36.743 1.00 0.00 C ATOM 0 H ALA A 82 13.255 -4.710 34.440 1.00 0.00 H new ATOM 0 HA ALA A 82 13.831 -5.390 37.259 1.00 0.00 H new ATOM 0 HB1 ALA A 82 12.799 -3.193 37.739 1.00 0.00 H new ATOM 0 HB2 ALA A 82 14.201 -3.042 36.652 1.00 0.00 H new ATOM 0 HB3 ALA A 82 12.551 -2.939 35.995 1.00 0.00 H new ATOM 1294 N VAL A 83 11.558 -6.149 37.854 1.00 0.00 N ATOM 1295 CA VAL A 83 10.258 -6.732 38.165 1.00 0.00 C ATOM 1296 C VAL A 83 9.704 -6.175 39.471 1.00 0.00 C ATOM 1297 O VAL A 83 10.446 -5.783 40.372 1.00 0.00 O ATOM 1298 CB VAL A 83 10.343 -8.267 38.269 1.00 0.00 C ATOM 1299 CG1 VAL A 83 9.744 -8.920 37.033 1.00 0.00 C ATOM 1300 CG2 VAL A 83 11.785 -8.708 38.470 1.00 0.00 C ATOM 0 H VAL A 83 12.269 -6.298 38.570 1.00 0.00 H new ATOM 0 HA VAL A 83 9.588 -6.467 37.348 1.00 0.00 H new ATOM 0 HB VAL A 83 9.765 -8.588 39.136 1.00 0.00 H new ATOM 0 HG11 VAL A 83 9.813 -10.004 37.125 1.00 0.00 H new ATOM 0 HG12 VAL A 83 8.698 -8.630 36.939 1.00 0.00 H new ATOM 0 HG13 VAL A 83 10.292 -8.595 36.148 1.00 0.00 H new ATOM 0 HG21 VAL A 83 11.826 -9.795 38.541 1.00 0.00 H new ATOM 0 HG22 VAL A 83 12.388 -8.377 37.625 1.00 0.00 H new ATOM 0 HG23 VAL A 83 12.175 -8.269 39.388 1.00 0.00 H new ATOM 1310 N PRO A 84 8.367 -6.137 39.578 1.00 0.00 N ATOM 1311 CA PRO A 84 7.683 -5.630 40.771 1.00 0.00 C ATOM 1312 C PRO A 84 7.851 -6.553 41.972 1.00 0.00 C ATOM 1313 O PRO A 84 6.963 -7.345 42.291 1.00 0.00 O ATOM 1314 CB PRO A 84 6.215 -5.575 40.341 1.00 0.00 C ATOM 1315 CG PRO A 84 6.099 -6.592 39.258 1.00 0.00 C ATOM 1316 CD PRO A 84 7.422 -6.588 38.543 1.00 0.00 C ATOM 0 HA PRO A 84 8.084 -4.669 41.093 1.00 0.00 H new ATOM 0 HB2 PRO A 84 5.550 -5.805 41.173 1.00 0.00 H new ATOM 0 HB3 PRO A 84 5.945 -4.582 39.982 1.00 0.00 H new ATOM 0 HG2 PRO A 84 5.881 -7.577 39.670 1.00 0.00 H new ATOM 0 HG3 PRO A 84 5.286 -6.344 38.576 1.00 0.00 H new ATOM 0 HD2 PRO A 84 7.679 -7.579 38.168 1.00 0.00 H new ATOM 0 HD3 PRO A 84 7.414 -5.915 37.686 1.00 0.00 H new ATOM 1324 N THR A 85 8.997 -6.447 42.639 1.00 0.00 N ATOM 1325 CA THR A 85 9.282 -7.273 43.805 1.00 0.00 C ATOM 1326 C THR A 85 8.784 -6.610 45.084 1.00 0.00 C ATOM 1327 O THR A 85 9.348 -6.812 46.159 1.00 0.00 O ATOM 1328 CB THR A 85 10.791 -7.553 43.940 1.00 0.00 C ATOM 1329 OG1 THR A 85 11.523 -6.322 43.906 1.00 0.00 O ATOM 1330 CG2 THR A 85 11.274 -8.466 42.823 1.00 0.00 C ATOM 0 H THR A 85 9.743 -5.797 42.391 1.00 0.00 H new ATOM 0 HA THR A 85 8.756 -8.217 43.659 1.00 0.00 H new ATOM 0 HB THR A 85 10.961 -8.051 44.895 1.00 0.00 H new ATOM 0 HG1 THR A 85 12.481 -6.509 43.994 1.00 0.00 H new ATOM 0 HG21 THR A 85 12.342 -8.649 42.939 1.00 0.00 H new ATOM 0 HG22 THR A 85 10.736 -9.413 42.869 1.00 0.00 H new ATOM 0 HG23 THR A 85 11.090 -7.991 41.859 1.00 0.00 H new ATOM 1338 N ILE A 86 7.725 -5.817 44.959 1.00 0.00 N ATOM 1339 CA ILE A 86 7.150 -5.126 46.106 1.00 0.00 C ATOM 1340 C ILE A 86 5.649 -5.380 46.206 1.00 0.00 C ATOM 1341 O ILE A 86 5.183 -6.055 47.124 1.00 0.00 O ATOM 1342 CB ILE A 86 7.398 -3.608 46.031 1.00 0.00 C ATOM 1343 CG1 ILE A 86 8.899 -3.316 45.988 1.00 0.00 C ATOM 1344 CG2 ILE A 86 6.750 -2.905 47.215 1.00 0.00 C ATOM 1345 CD1 ILE A 86 9.321 -2.491 44.792 1.00 0.00 C ATOM 0 H ILE A 86 7.248 -5.637 44.075 1.00 0.00 H new ATOM 0 HA ILE A 86 7.643 -5.523 46.993 1.00 0.00 H new ATOM 0 HB ILE A 86 6.946 -3.226 45.116 1.00 0.00 H new ATOM 0 HG12 ILE A 86 9.185 -2.792 46.900 1.00 0.00 H new ATOM 0 HG13 ILE A 86 9.444 -4.260 45.979 1.00 0.00 H new ATOM 0 HG21 ILE A 86 6.935 -1.833 47.147 1.00 0.00 H new ATOM 0 HG22 ILE A 86 5.676 -3.090 47.204 1.00 0.00 H new ATOM 0 HG23 ILE A 86 7.175 -3.288 48.143 1.00 0.00 H new ATOM 0 HD11 ILE A 86 10.397 -2.323 44.827 1.00 0.00 H new ATOM 0 HD12 ILE A 86 9.067 -3.023 43.875 1.00 0.00 H new ATOM 0 HD13 ILE A 86 8.803 -1.532 44.811 1.00 0.00 H new ATOM 1357 N PHE A 87 4.898 -4.836 45.255 1.00 0.00 N ATOM 1358 CA PHE A 87 3.450 -5.004 45.234 1.00 0.00 C ATOM 1359 C PHE A 87 2.867 -4.868 46.638 1.00 0.00 C ATOM 1360 O PHE A 87 2.331 -5.826 47.195 1.00 0.00 O ATOM 1361 CB PHE A 87 3.082 -6.368 44.647 1.00 0.00 C ATOM 1362 CG PHE A 87 2.678 -6.309 43.201 1.00 0.00 C ATOM 1363 CD1 PHE A 87 1.598 -5.540 42.801 1.00 0.00 C ATOM 1364 CD2 PHE A 87 3.380 -7.022 42.243 1.00 0.00 C ATOM 1365 CE1 PHE A 87 1.224 -5.483 41.471 1.00 0.00 C ATOM 1366 CE2 PHE A 87 3.012 -6.969 40.912 1.00 0.00 C ATOM 1367 CZ PHE A 87 1.932 -6.200 40.526 1.00 0.00 C ATOM 0 H PHE A 87 5.268 -4.275 44.488 1.00 0.00 H new ATOM 0 HA PHE A 87 3.027 -4.220 44.606 1.00 0.00 H new ATOM 0 HB2 PHE A 87 3.933 -7.041 44.751 1.00 0.00 H new ATOM 0 HB3 PHE A 87 2.264 -6.796 45.227 1.00 0.00 H new ATOM 0 HD1 PHE A 87 1.041 -4.978 43.536 1.00 0.00 H new ATOM 0 HD2 PHE A 87 4.225 -7.626 42.540 1.00 0.00 H new ATOM 0 HE1 PHE A 87 0.380 -4.879 41.172 1.00 0.00 H new ATOM 0 HE2 PHE A 87 3.568 -7.528 40.175 1.00 0.00 H new ATOM 0 HZ PHE A 87 1.641 -6.159 39.487 1.00 0.00 H new ATOM 1377 N ASP A 88 2.976 -3.671 47.204 1.00 0.00 N ATOM 1378 CA ASP A 88 2.459 -3.408 48.542 1.00 0.00 C ATOM 1379 C ASP A 88 3.153 -4.290 49.575 1.00 0.00 C ATOM 1380 O ASP A 88 4.193 -4.889 49.298 1.00 0.00 O ATOM 1381 CB ASP A 88 0.949 -3.643 48.584 1.00 0.00 C ATOM 1382 CG ASP A 88 0.240 -2.686 49.522 1.00 0.00 C ATOM 1383 OD1 ASP A 88 0.104 -1.497 49.165 1.00 0.00 O ATOM 1384 OD2 ASP A 88 -0.179 -3.125 50.614 1.00 0.00 O ATOM 0 H ASP A 88 3.418 -2.868 46.757 1.00 0.00 H new ATOM 0 HA ASP A 88 2.663 -2.365 48.785 1.00 0.00 H new ATOM 0 HB2 ASP A 88 0.539 -3.533 47.580 1.00 0.00 H new ATOM 0 HB3 ASP A 88 0.752 -4.668 48.899 1.00 0.00 H new ATOM 1389 N PHE A 89 2.572 -4.365 50.768 1.00 0.00 N ATOM 1390 CA PHE A 89 3.135 -5.173 51.844 1.00 0.00 C ATOM 1391 C PHE A 89 2.253 -6.383 52.134 1.00 0.00 C ATOM 1392 O PHE A 89 1.067 -6.396 51.800 1.00 0.00 O ATOM 1393 CB PHE A 89 3.298 -4.330 53.110 1.00 0.00 C ATOM 1394 CG PHE A 89 4.699 -3.835 53.325 1.00 0.00 C ATOM 1395 CD1 PHE A 89 5.511 -3.524 52.246 1.00 0.00 C ATOM 1396 CD2 PHE A 89 5.205 -3.680 54.605 1.00 0.00 C ATOM 1397 CE1 PHE A 89 6.801 -3.068 52.440 1.00 0.00 C ATOM 1398 CE2 PHE A 89 6.495 -3.224 54.806 1.00 0.00 C ATOM 1399 CZ PHE A 89 7.293 -2.917 53.722 1.00 0.00 C ATOM 0 H PHE A 89 1.711 -3.876 51.014 1.00 0.00 H new ATOM 0 HA PHE A 89 4.114 -5.529 51.524 1.00 0.00 H new ATOM 0 HB2 PHE A 89 2.624 -3.475 53.057 1.00 0.00 H new ATOM 0 HB3 PHE A 89 2.994 -4.923 53.973 1.00 0.00 H new ATOM 0 HD1 PHE A 89 5.131 -3.639 51.242 1.00 0.00 H new ATOM 0 HD2 PHE A 89 4.585 -3.918 55.456 1.00 0.00 H new ATOM 0 HE1 PHE A 89 7.424 -2.830 51.590 1.00 0.00 H new ATOM 0 HE2 PHE A 89 6.878 -3.108 55.809 1.00 0.00 H new ATOM 0 HZ PHE A 89 8.300 -2.559 53.876 1.00 0.00 H new ATOM 1409 N CYS A 90 2.839 -7.399 52.757 1.00 0.00 N ATOM 1410 CA CYS A 90 2.108 -8.616 53.092 1.00 0.00 C ATOM 1411 C CYS A 90 2.145 -8.877 54.594 1.00 0.00 C ATOM 1412 O CYS A 90 2.684 -9.887 55.048 1.00 0.00 O ATOM 1413 CB CYS A 90 2.695 -9.812 52.340 1.00 0.00 C ATOM 1414 SG CYS A 90 3.209 -9.439 50.647 1.00 0.00 S ATOM 0 H CYS A 90 3.819 -7.404 53.041 1.00 0.00 H new ATOM 0 HA CYS A 90 1.069 -8.481 52.791 1.00 0.00 H new ATOM 0 HB2 CYS A 90 3.554 -10.190 52.894 1.00 0.00 H new ATOM 0 HB3 CYS A 90 1.954 -10.611 52.316 1.00 0.00 H new ATOM 0 HG CYS A 90 3.694 -10.511 50.094 1.00 0.00 H new ATOM 1420 N THR A 91 1.570 -7.957 55.363 1.00 0.00 N ATOM 1421 CA THR A 91 1.539 -8.086 56.815 1.00 0.00 C ATOM 1422 C THR A 91 0.128 -8.379 57.311 1.00 0.00 C ATOM 1423 O THR A 91 -0.183 -9.505 57.699 1.00 0.00 O ATOM 1424 CB THR A 91 2.058 -6.809 57.503 1.00 0.00 C ATOM 1425 OG1 THR A 91 2.361 -5.812 56.521 1.00 0.00 O ATOM 1426 CG2 THR A 91 3.300 -7.107 58.329 1.00 0.00 C ATOM 0 H THR A 91 1.120 -7.115 55.005 1.00 0.00 H new ATOM 0 HA THR A 91 2.192 -8.920 57.072 1.00 0.00 H new ATOM 0 HB THR A 91 1.278 -6.438 58.168 1.00 0.00 H new ATOM 0 HG1 THR A 91 2.689 -5.003 56.967 1.00 0.00 H new ATOM 0 HG21 THR A 91 3.649 -6.191 58.805 1.00 0.00 H new ATOM 0 HG22 THR A 91 3.060 -7.845 59.094 1.00 0.00 H new ATOM 0 HG23 THR A 91 4.083 -7.499 57.680 1.00 0.00 H new ATOM 1434 N HIS A 92 -0.724 -7.358 57.295 1.00 0.00 N ATOM 1435 CA HIS A 92 -2.104 -7.507 57.743 1.00 0.00 C ATOM 1436 C HIS A 92 -2.896 -8.385 56.779 1.00 0.00 C ATOM 1437 O HIS A 92 -3.436 -9.421 57.169 1.00 0.00 O ATOM 1438 CB HIS A 92 -2.772 -6.137 57.870 1.00 0.00 C ATOM 1439 CG HIS A 92 -4.068 -6.170 58.620 1.00 0.00 C ATOM 1440 ND1 HIS A 92 -4.773 -5.033 58.954 1.00 0.00 N ATOM 1441 CD2 HIS A 92 -4.787 -7.212 59.101 1.00 0.00 C ATOM 1442 CE1 HIS A 92 -5.869 -5.374 59.609 1.00 0.00 C ATOM 1443 NE2 HIS A 92 -5.901 -6.690 59.711 1.00 0.00 N ATOM 0 H HIS A 92 -0.483 -6.419 56.977 1.00 0.00 H new ATOM 0 HA HIS A 92 -2.093 -7.989 58.720 1.00 0.00 H new ATOM 0 HB2 HIS A 92 -2.088 -5.454 58.373 1.00 0.00 H new ATOM 0 HB3 HIS A 92 -2.949 -5.734 56.873 1.00 0.00 H new ATOM 0 HD2 HIS A 92 -4.532 -8.258 59.020 1.00 0.00 H new ATOM 0 HE1 HIS A 92 -6.612 -4.692 59.995 1.00 0.00 H new ATOM 0 HE2 HIS A 92 -6.634 -7.231 60.169 1.00 0.00 H new ATOM 1451 N ILE A 93 -2.962 -7.964 55.521 1.00 0.00 N ATOM 1452 CA ILE A 93 -3.687 -8.713 54.502 1.00 0.00 C ATOM 1453 C ILE A 93 -2.795 -9.767 53.855 1.00 0.00 C ATOM 1454 O ILE A 93 -1.675 -9.475 53.437 1.00 0.00 O ATOM 1455 CB ILE A 93 -4.242 -7.783 53.407 1.00 0.00 C ATOM 1456 CG1 ILE A 93 -5.693 -8.145 53.087 1.00 0.00 C ATOM 1457 CG2 ILE A 93 -3.381 -7.865 52.156 1.00 0.00 C ATOM 1458 CD1 ILE A 93 -6.497 -6.987 52.536 1.00 0.00 C ATOM 0 H ILE A 93 -2.522 -7.108 55.183 1.00 0.00 H new ATOM 0 HA ILE A 93 -4.520 -9.205 55.005 1.00 0.00 H new ATOM 0 HB ILE A 93 -4.216 -6.757 53.775 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -5.705 -8.961 52.365 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -6.175 -8.514 53.992 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -3.786 -7.202 51.391 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -2.362 -7.562 52.395 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -3.377 -8.889 51.783 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -7.516 -7.316 52.332 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -6.516 -6.178 53.266 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -6.038 -6.632 51.613 1.00 0.00 H new ATOM 1470 N SER A 94 -3.301 -10.993 53.772 1.00 0.00 N ATOM 1471 CA SER A 94 -2.550 -12.092 53.177 1.00 0.00 C ATOM 1472 C SER A 94 -3.462 -12.983 52.340 1.00 0.00 C ATOM 1473 O SER A 94 -3.246 -13.162 51.142 1.00 0.00 O ATOM 1474 CB SER A 94 -1.867 -12.921 54.266 1.00 0.00 C ATOM 1475 OG SER A 94 -0.578 -12.412 54.562 1.00 0.00 O ATOM 0 H SER A 94 -4.228 -11.250 54.110 1.00 0.00 H new ATOM 0 HA SER A 94 -1.788 -11.666 52.524 1.00 0.00 H new ATOM 0 HB2 SER A 94 -2.479 -12.917 55.168 1.00 0.00 H new ATOM 0 HB3 SER A 94 -1.786 -13.958 53.941 1.00 0.00 H new ATOM 0 HG SER A 94 -0.163 -12.958 55.262 1.00 0.00 H new ATOM 1481 N GLY A 95 -4.484 -13.542 52.982 1.00 0.00 N ATOM 1482 CA GLY A 95 -5.415 -14.409 52.283 1.00 0.00 C ATOM 1483 C GLY A 95 -6.187 -15.311 53.225 1.00 0.00 C ATOM 1484 O GLY A 95 -6.005 -16.528 53.242 1.00 0.00 O ATOM 0 H GLY A 95 -4.684 -13.410 53.974 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -6.116 -13.799 51.713 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -4.868 -15.021 51.566 1.00 0.00 H new ATOM 1488 N PRO A 96 -7.071 -14.709 54.034 1.00 0.00 N ATOM 1489 CA PRO A 96 -7.890 -15.448 55.000 1.00 0.00 C ATOM 1490 C PRO A 96 -8.949 -16.310 54.322 1.00 0.00 C ATOM 1491 O PRO A 96 -10.037 -15.834 53.997 1.00 0.00 O ATOM 1492 CB PRO A 96 -8.551 -14.340 55.825 1.00 0.00 C ATOM 1493 CG PRO A 96 -8.575 -13.157 54.920 1.00 0.00 C ATOM 1494 CD PRO A 96 -7.340 -13.262 54.068 1.00 0.00 C ATOM 0 HA PRO A 96 -7.294 -16.143 55.592 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -9.557 -14.623 56.133 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -7.986 -14.132 56.734 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -9.475 -13.155 54.305 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -8.577 -12.229 55.491 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -7.506 -12.861 53.068 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -6.506 -12.708 54.499 1.00 0.00 H new ATOM 1502 N SER A 97 -8.625 -17.582 54.112 1.00 0.00 N ATOM 1503 CA SER A 97 -9.547 -18.510 53.469 1.00 0.00 C ATOM 1504 C SER A 97 -9.795 -18.112 52.017 1.00 0.00 C ATOM 1505 O SER A 97 -10.870 -17.621 51.671 1.00 0.00 O ATOM 1506 CB SER A 97 -10.873 -18.554 54.231 1.00 0.00 C ATOM 1507 OG SER A 97 -11.415 -19.864 54.237 1.00 0.00 O ATOM 0 H SER A 97 -7.730 -17.993 54.378 1.00 0.00 H new ATOM 0 HA SER A 97 -9.094 -19.501 53.483 1.00 0.00 H new ATOM 0 HB2 SER A 97 -10.718 -18.216 55.256 1.00 0.00 H new ATOM 0 HB3 SER A 97 -11.583 -17.866 53.772 1.00 0.00 H new ATOM 0 HG SER A 97 -12.261 -19.866 54.732 1.00 0.00 H new ATOM 1513 N SER A 98 -8.792 -18.328 51.172 1.00 0.00 N ATOM 1514 CA SER A 98 -8.899 -17.989 49.757 1.00 0.00 C ATOM 1515 C SER A 98 -9.561 -19.119 48.976 1.00 0.00 C ATOM 1516 O SER A 98 -9.966 -20.130 49.548 1.00 0.00 O ATOM 1517 CB SER A 98 -7.514 -17.695 49.176 1.00 0.00 C ATOM 1518 OG SER A 98 -7.097 -18.731 48.304 1.00 0.00 O ATOM 0 H SER A 98 -7.897 -18.736 51.442 1.00 0.00 H new ATOM 0 HA SER A 98 -9.520 -17.098 49.668 1.00 0.00 H new ATOM 0 HB2 SER A 98 -7.536 -16.748 48.637 1.00 0.00 H new ATOM 0 HB3 SER A 98 -6.793 -17.584 49.985 1.00 0.00 H new ATOM 0 HG SER A 98 -6.210 -18.519 47.945 1.00 0.00 H new ATOM 1524 N GLY A 99 -9.669 -18.938 47.663 1.00 0.00 N ATOM 1525 CA GLY A 99 -10.283 -19.950 46.823 1.00 0.00 C ATOM 1526 C GLY A 99 -9.549 -21.275 46.880 1.00 0.00 C ATOM 1527 O GLY A 99 -8.628 -21.484 46.092 1.00 0.00 O ATOM 0 H GLY A 99 -9.342 -18.109 47.166 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -11.317 -20.097 47.134 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -10.308 -19.596 45.792 1.00 0.00 H new TER 1531 GLY A 99 HETATM 1532 ZN ZN A 401 -1.309 0.070 40.124 1.00 0.00 ZN