USER MOD reduce.3.24.130724 H: found=0, std=0, add=386, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 394 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 195 ASN : amide:sc= 0.0175 K(o=-0.55,f=-1.7!) USER MOD Set 1.2: A 203 ASN : amide:sc= -0.568 K(o=-0.55,f=-1.7) USER MOD Single : A 188 SER OG : rot 180:sc= 0 USER MOD Single : A 191 SER OG : rot -15:sc= 0.754 USER MOD Single : A 194 ASN : amide:sc= -0.0275 K(o=-0.027,f=-1.5!) USER MOD Single : A 198 ASN : amide:sc= -0.277 K(o=-0.28,f=-2.3!) USER MOD Single : A 202 THR OG1 : rot 180:sc= -0.761 USER MOD Single : A 204 SER OG : rot 180:sc= 0 USER MOD Single : A 212 SER OG : rot 180:sc= 0 USER MOD Single : A 213 ASN : amide:sc= -0.0134 K(o=-0.013,f=-1.7!) USER MOD Single : A 216 SER OG : rot 180:sc= 0 USER MOD Single : A 218 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 219 THR OG1 : rot 80:sc= 0.0533 USER MOD Single : A 220 SER OG : rot 180:sc= 0 USER MOD Single : A 224 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 225 HIS : no HD1:sc= -6.04! C(o=-6!,f=-18!) USER MOD Single : A 229 LYS NZ :NH3+ 159:sc=-0.00129 (180deg=-0.273) USER MOD Single : A 230 THR OG1 : rot 180:sc= 0 USER MOD Single : A 231 LYS NZ :NH3+ -169:sc= -3.67! (180deg=-4.23!) USER MOD Single : A 233 GLN : amide:sc= -4.05 K(o=-4,f=-7.6!) USER MOD Single : A 235 THR OG1 : rot 23:sc= 0.114 USER MOD Single : A 241 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 243 HIS : no HD1:sc= -0.801 K(o=-0.8,f=-1.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 187 22.300 6.361 10.239 1.00 0.00 N ATOM 2 CA GLY A 187 21.323 5.497 10.960 1.00 0.00 C ATOM 3 C GLY A 187 20.386 4.832 9.948 1.00 0.00 C ATOM 4 O GLY A 187 19.229 5.183 9.834 1.00 0.00 O ATOM 0 HA2 GLY A 187 21.850 4.737 11.538 1.00 0.00 H new ATOM 0 HA3 GLY A 187 20.747 6.093 11.668 1.00 0.00 H new ATOM 7 N SER A 188 20.881 3.875 9.212 1.00 0.00 N ATOM 8 CA SER A 188 20.025 3.188 8.203 1.00 0.00 C ATOM 9 C SER A 188 18.965 2.343 8.914 1.00 0.00 C ATOM 10 O SER A 188 19.029 2.124 10.109 1.00 0.00 O ATOM 11 CB SER A 188 20.897 2.284 7.329 1.00 0.00 C ATOM 12 OG SER A 188 21.343 1.175 8.098 1.00 0.00 O ATOM 0 H SER A 188 21.842 3.539 9.266 1.00 0.00 H new ATOM 0 HA SER A 188 19.531 3.934 7.580 1.00 0.00 H new ATOM 0 HB2 SER A 188 20.330 1.937 6.465 1.00 0.00 H new ATOM 0 HB3 SER A 188 21.751 2.843 6.946 1.00 0.00 H new ATOM 0 HG SER A 188 21.900 0.593 7.540 1.00 0.00 H new ATOM 18 N CYS A 189 17.987 1.868 8.188 1.00 0.00 N ATOM 19 CA CYS A 189 16.919 1.036 8.817 1.00 0.00 C ATOM 20 C CYS A 189 16.165 1.867 9.860 1.00 0.00 C ATOM 21 O CYS A 189 15.276 1.378 10.529 1.00 0.00 O ATOM 22 CB CYS A 189 17.548 -0.188 9.490 1.00 0.00 C ATOM 23 SG CYS A 189 17.258 -1.658 8.472 1.00 0.00 S ATOM 0 H CYS A 189 17.882 2.021 7.185 1.00 0.00 H new ATOM 0 HA CYS A 189 16.221 0.705 8.048 1.00 0.00 H new ATOM 0 HB2 CYS A 189 18.618 -0.032 9.624 1.00 0.00 H new ATOM 0 HB3 CYS A 189 17.120 -0.330 10.482 1.00 0.00 H new ATOM 28 N ALA A 190 16.507 3.120 10.003 1.00 0.00 N ATOM 29 CA ALA A 190 15.802 3.974 11.001 1.00 0.00 C ATOM 30 C ALA A 190 14.329 4.111 10.606 1.00 0.00 C ATOM 31 O ALA A 190 13.444 4.046 11.438 1.00 0.00 O ATOM 32 CB ALA A 190 16.450 5.360 11.037 1.00 0.00 C ATOM 0 H ALA A 190 17.242 3.587 9.473 1.00 0.00 H new ATOM 0 HA ALA A 190 15.874 3.514 11.986 1.00 0.00 H new ATOM 0 HB1 ALA A 190 15.934 5.984 11.767 1.00 0.00 H new ATOM 0 HB2 ALA A 190 17.499 5.264 11.318 1.00 0.00 H new ATOM 0 HB3 ALA A 190 16.379 5.820 10.052 1.00 0.00 H new ATOM 38 N SER A 191 14.056 4.289 9.342 1.00 0.00 N ATOM 39 CA SER A 191 12.639 4.417 8.896 1.00 0.00 C ATOM 40 C SER A 191 12.041 3.018 8.752 1.00 0.00 C ATOM 41 O SER A 191 10.868 2.852 8.478 1.00 0.00 O ATOM 42 CB SER A 191 12.591 5.137 7.547 1.00 0.00 C ATOM 43 OG SER A 191 13.061 4.263 6.529 1.00 0.00 O ATOM 0 H SER A 191 14.752 4.351 8.599 1.00 0.00 H new ATOM 0 HA SER A 191 12.069 4.990 9.627 1.00 0.00 H new ATOM 0 HB2 SER A 191 11.571 5.454 7.327 1.00 0.00 H new ATOM 0 HB3 SER A 191 13.205 6.037 7.581 1.00 0.00 H new ATOM 0 HG SER A 191 13.523 3.502 6.939 1.00 0.00 H new ATOM 49 N CYS A 192 12.849 2.012 8.934 1.00 0.00 N ATOM 50 CA CYS A 192 12.356 0.614 8.812 1.00 0.00 C ATOM 51 C CYS A 192 12.760 -0.165 10.070 1.00 0.00 C ATOM 52 O CYS A 192 13.766 -0.841 10.095 1.00 0.00 O ATOM 53 CB CYS A 192 12.985 -0.023 7.566 1.00 0.00 C ATOM 54 SG CYS A 192 13.768 1.272 6.569 1.00 0.00 S ATOM 0 H CYS A 192 13.839 2.100 9.164 1.00 0.00 H new ATOM 0 HA CYS A 192 11.271 0.596 8.715 1.00 0.00 H new ATOM 0 HB2 CYS A 192 13.723 -0.771 7.858 1.00 0.00 H new ATOM 0 HB3 CYS A 192 12.223 -0.538 6.982 1.00 0.00 H new ATOM 59 N PRO A 193 11.987 -0.049 11.116 1.00 0.00 N ATOM 60 CA PRO A 193 12.274 -0.734 12.412 1.00 0.00 C ATOM 61 C PRO A 193 12.237 -2.264 12.297 1.00 0.00 C ATOM 62 O PRO A 193 13.260 -2.913 12.221 1.00 0.00 O ATOM 63 CB PRO A 193 11.169 -0.242 13.359 1.00 0.00 C ATOM 64 CG PRO A 193 10.515 0.918 12.674 1.00 0.00 C ATOM 65 CD PRO A 193 10.755 0.744 11.177 1.00 0.00 C ATOM 0 HA PRO A 193 13.279 -0.500 12.762 1.00 0.00 H new ATOM 0 HB2 PRO A 193 10.447 -1.034 13.558 1.00 0.00 H new ATOM 0 HB3 PRO A 193 11.586 0.059 14.320 1.00 0.00 H new ATOM 0 HG2 PRO A 193 9.448 0.944 12.893 1.00 0.00 H new ATOM 0 HG3 PRO A 193 10.935 1.860 13.025 1.00 0.00 H new ATOM 0 HD2 PRO A 193 9.923 0.231 10.694 1.00 0.00 H new ATOM 0 HD3 PRO A 193 10.871 1.705 10.675 1.00 0.00 H new ATOM 73 N ASN A 194 11.067 -2.843 12.289 1.00 0.00 N ATOM 74 CA ASN A 194 10.972 -4.328 12.185 1.00 0.00 C ATOM 75 C ASN A 194 10.898 -4.733 10.713 1.00 0.00 C ATOM 76 O ASN A 194 10.718 -5.889 10.385 1.00 0.00 O ATOM 77 CB ASN A 194 9.709 -4.808 12.905 1.00 0.00 C ATOM 78 CG ASN A 194 9.768 -4.399 14.376 1.00 0.00 C ATOM 79 OD1 ASN A 194 10.815 -4.038 14.877 1.00 0.00 O ATOM 80 ND2 ASN A 194 8.681 -4.442 15.097 1.00 0.00 N ATOM 0 H ASN A 194 10.174 -2.353 12.350 1.00 0.00 H new ATOM 0 HA ASN A 194 11.851 -4.781 12.644 1.00 0.00 H new ATOM 0 HB2 ASN A 194 8.825 -4.379 12.434 1.00 0.00 H new ATOM 0 HB3 ASN A 194 9.621 -5.891 12.822 1.00 0.00 H new ATOM 0 HD21 ASN A 194 8.710 -4.173 16.080 1.00 0.00 H new ATOM 0 HD22 ASN A 194 7.802 -4.745 14.677 1.00 0.00 H new ATOM 87 N ASN A 195 11.021 -3.789 9.824 1.00 0.00 N ATOM 88 CA ASN A 195 10.945 -4.115 8.374 1.00 0.00 C ATOM 89 C ASN A 195 12.339 -4.446 7.832 1.00 0.00 C ATOM 90 O ASN A 195 12.519 -4.646 6.647 1.00 0.00 O ATOM 91 CB ASN A 195 10.375 -2.914 7.623 1.00 0.00 C ATOM 92 CG ASN A 195 8.956 -2.630 8.119 1.00 0.00 C ATOM 93 OD1 ASN A 195 8.337 -3.471 8.741 1.00 0.00 O ATOM 94 ND2 ASN A 195 8.412 -1.470 7.872 1.00 0.00 N ATOM 0 H ASN A 195 11.171 -2.803 10.039 1.00 0.00 H new ATOM 0 HA ASN A 195 10.300 -4.982 8.233 1.00 0.00 H new ATOM 0 HB2 ASN A 195 11.008 -2.040 7.779 1.00 0.00 H new ATOM 0 HB3 ASN A 195 10.364 -3.113 6.551 1.00 0.00 H new ATOM 0 HD21 ASN A 195 7.468 -1.269 8.201 1.00 0.00 H new ATOM 0 HD22 ASN A 195 8.931 -0.764 7.350 1.00 0.00 H new ATOM 101 N CYS A 196 13.328 -4.505 8.682 1.00 0.00 N ATOM 102 CA CYS A 196 14.701 -4.824 8.195 1.00 0.00 C ATOM 103 C CYS A 196 14.897 -6.342 8.172 1.00 0.00 C ATOM 104 O CYS A 196 15.427 -6.922 9.101 1.00 0.00 O ATOM 105 CB CYS A 196 15.737 -4.196 9.129 1.00 0.00 C ATOM 106 SG CYS A 196 15.512 -2.402 9.165 1.00 0.00 S ATOM 0 H CYS A 196 13.246 -4.347 9.686 1.00 0.00 H new ATOM 0 HA CYS A 196 14.827 -4.423 7.189 1.00 0.00 H new ATOM 0 HB2 CYS A 196 15.632 -4.606 10.133 1.00 0.00 H new ATOM 0 HB3 CYS A 196 16.743 -4.440 8.789 1.00 0.00 H new ATOM 111 N GLU A 197 14.483 -6.993 7.117 1.00 0.00 N ATOM 112 CA GLU A 197 14.659 -8.471 7.044 1.00 0.00 C ATOM 113 C GLU A 197 16.153 -8.798 7.045 1.00 0.00 C ATOM 114 O GLU A 197 16.579 -9.812 7.564 1.00 0.00 O ATOM 115 CB GLU A 197 14.020 -9.005 5.758 1.00 0.00 C ATOM 116 CG GLU A 197 14.051 -10.536 5.773 1.00 0.00 C ATOM 117 CD GLU A 197 13.516 -11.072 4.444 1.00 0.00 C ATOM 118 OE1 GLU A 197 13.204 -10.266 3.585 1.00 0.00 O ATOM 119 OE2 GLU A 197 13.426 -12.281 4.310 1.00 0.00 O ATOM 0 H GLU A 197 14.033 -6.567 6.307 1.00 0.00 H new ATOM 0 HA GLU A 197 14.178 -8.938 7.903 1.00 0.00 H new ATOM 0 HB2 GLU A 197 12.992 -8.652 5.676 1.00 0.00 H new ATOM 0 HB3 GLU A 197 14.557 -8.628 4.888 1.00 0.00 H new ATOM 0 HG2 GLU A 197 15.070 -10.888 5.935 1.00 0.00 H new ATOM 0 HG3 GLU A 197 13.448 -10.914 6.599 1.00 0.00 H new ATOM 127 N ASN A 198 16.951 -7.944 6.467 1.00 0.00 N ATOM 128 CA ASN A 198 18.419 -8.194 6.426 1.00 0.00 C ATOM 129 C ASN A 198 19.145 -6.882 6.130 1.00 0.00 C ATOM 130 O ASN A 198 20.043 -6.827 5.314 1.00 0.00 O ATOM 131 CB ASN A 198 18.729 -9.208 5.323 1.00 0.00 C ATOM 132 CG ASN A 198 20.171 -9.692 5.465 1.00 0.00 C ATOM 133 OD1 ASN A 198 20.812 -9.444 6.467 1.00 0.00 O ATOM 134 ND2 ASN A 198 20.712 -10.378 4.496 1.00 0.00 N ATOM 0 H ASN A 198 16.648 -7.079 6.019 1.00 0.00 H new ATOM 0 HA ASN A 198 18.752 -8.588 7.386 1.00 0.00 H new ATOM 0 HB2 ASN A 198 18.043 -10.053 5.388 1.00 0.00 H new ATOM 0 HB3 ASN A 198 18.582 -8.752 4.344 1.00 0.00 H new ATOM 0 HD21 ASN A 198 21.674 -10.707 4.579 1.00 0.00 H new ATOM 0 HD22 ASN A 198 20.173 -10.586 3.655 1.00 0.00 H new ATOM 141 N GLY A 199 18.753 -5.821 6.779 1.00 0.00 N ATOM 142 CA GLY A 199 19.409 -4.510 6.526 1.00 0.00 C ATOM 143 C GLY A 199 18.643 -3.788 5.419 1.00 0.00 C ATOM 144 O GLY A 199 18.913 -2.647 5.097 1.00 0.00 O ATOM 0 H GLY A 199 18.006 -5.806 7.474 1.00 0.00 H new ATOM 0 HA2 GLY A 199 19.416 -3.909 7.435 1.00 0.00 H new ATOM 0 HA3 GLY A 199 20.448 -4.657 6.233 1.00 0.00 H new ATOM 148 N LEU A 200 17.683 -4.452 4.836 1.00 0.00 N ATOM 149 CA LEU A 200 16.882 -3.827 3.750 1.00 0.00 C ATOM 150 C LEU A 200 15.469 -3.553 4.261 1.00 0.00 C ATOM 151 O LEU A 200 14.889 -4.356 4.963 1.00 0.00 O ATOM 152 CB LEU A 200 16.812 -4.789 2.565 1.00 0.00 C ATOM 153 CG LEU A 200 18.226 -5.108 2.080 1.00 0.00 C ATOM 154 CD1 LEU A 200 18.152 -6.071 0.893 1.00 0.00 C ATOM 155 CD2 LEU A 200 18.916 -3.814 1.642 1.00 0.00 C ATOM 0 H LEU A 200 17.418 -5.409 5.069 1.00 0.00 H new ATOM 0 HA LEU A 200 17.347 -2.891 3.439 1.00 0.00 H new ATOM 0 HB2 LEU A 200 16.301 -5.706 2.858 1.00 0.00 H new ATOM 0 HB3 LEU A 200 16.231 -4.345 1.757 1.00 0.00 H new ATOM 0 HG LEU A 200 18.793 -5.569 2.888 1.00 0.00 H new ATOM 0 HD11 LEU A 200 19.160 -6.299 0.546 1.00 0.00 H new ATOM 0 HD12 LEU A 200 17.657 -6.992 1.202 1.00 0.00 H new ATOM 0 HD13 LEU A 200 17.586 -5.609 0.084 1.00 0.00 H new ATOM 0 HD21 LEU A 200 19.925 -4.039 1.296 1.00 0.00 H new ATOM 0 HD22 LEU A 200 18.348 -3.355 0.833 1.00 0.00 H new ATOM 0 HD23 LEU A 200 18.967 -3.125 2.485 1.00 0.00 H new ATOM 167 N CYS A 201 14.906 -2.431 3.915 1.00 0.00 N ATOM 168 CA CYS A 201 13.530 -2.117 4.386 1.00 0.00 C ATOM 169 C CYS A 201 12.519 -2.891 3.537 1.00 0.00 C ATOM 170 O CYS A 201 12.724 -3.117 2.361 1.00 0.00 O ATOM 171 CB CYS A 201 13.281 -0.616 4.245 1.00 0.00 C ATOM 172 SG CYS A 201 14.637 0.289 5.032 1.00 0.00 S ATOM 0 H CYS A 201 15.338 -1.718 3.327 1.00 0.00 H new ATOM 0 HA CYS A 201 13.420 -2.405 5.431 1.00 0.00 H new ATOM 0 HB2 CYS A 201 13.210 -0.344 3.192 1.00 0.00 H new ATOM 0 HB3 CYS A 201 12.332 -0.348 4.708 1.00 0.00 H new ATOM 177 N THR A 202 11.428 -3.304 4.125 1.00 0.00 N ATOM 178 CA THR A 202 10.405 -4.067 3.355 1.00 0.00 C ATOM 179 C THR A 202 9.203 -3.167 3.066 1.00 0.00 C ATOM 180 O THR A 202 8.074 -3.614 3.026 1.00 0.00 O ATOM 181 CB THR A 202 9.951 -5.284 4.165 1.00 0.00 C ATOM 182 OG1 THR A 202 9.434 -4.854 5.417 1.00 0.00 O ATOM 183 CG2 THR A 202 11.141 -6.218 4.392 1.00 0.00 C ATOM 0 H THR A 202 11.201 -3.145 5.107 1.00 0.00 H new ATOM 0 HA THR A 202 10.840 -4.403 2.414 1.00 0.00 H new ATOM 0 HB THR A 202 9.173 -5.817 3.618 1.00 0.00 H new ATOM 0 HG1 THR A 202 9.142 -5.633 5.935 1.00 0.00 H new ATOM 0 HG21 THR A 202 10.818 -7.085 4.969 1.00 0.00 H new ATOM 0 HG22 THR A 202 11.533 -6.548 3.430 1.00 0.00 H new ATOM 0 HG23 THR A 202 11.920 -5.688 4.939 1.00 0.00 H new ATOM 191 N ASN A 203 9.437 -1.899 2.866 1.00 0.00 N ATOM 192 CA ASN A 203 8.311 -0.967 2.579 1.00 0.00 C ATOM 193 C ASN A 203 7.917 -1.094 1.106 1.00 0.00 C ATOM 194 O ASN A 203 7.115 -0.335 0.599 1.00 0.00 O ATOM 195 CB ASN A 203 8.760 0.468 2.861 1.00 0.00 C ATOM 196 CG ASN A 203 9.270 0.570 4.298 1.00 0.00 C ATOM 197 OD1 ASN A 203 8.640 0.089 5.217 1.00 0.00 O ATOM 198 ND2 ASN A 203 10.403 1.175 4.528 1.00 0.00 N ATOM 0 H ASN A 203 10.361 -1.468 2.889 1.00 0.00 H new ATOM 0 HA ASN A 203 7.457 -1.214 3.210 1.00 0.00 H new ATOM 0 HB2 ASN A 203 9.546 0.758 2.164 1.00 0.00 H new ATOM 0 HB3 ASN A 203 7.929 1.157 2.709 1.00 0.00 H new ATOM 0 HD21 ASN A 203 10.760 1.244 5.481 1.00 0.00 H new ATOM 0 HD22 ASN A 203 10.932 1.579 3.755 1.00 0.00 H new ATOM 205 N SER A 204 8.474 -2.051 0.417 1.00 0.00 N ATOM 206 CA SER A 204 8.132 -2.232 -1.021 1.00 0.00 C ATOM 207 C SER A 204 7.084 -3.336 -1.146 1.00 0.00 C ATOM 208 O SER A 204 7.113 -4.315 -0.425 1.00 0.00 O ATOM 209 CB SER A 204 9.388 -2.625 -1.801 1.00 0.00 C ATOM 210 OG SER A 204 9.083 -2.683 -3.189 1.00 0.00 O ATOM 0 H SER A 204 9.152 -2.716 0.788 1.00 0.00 H new ATOM 0 HA SER A 204 7.736 -1.301 -1.427 1.00 0.00 H new ATOM 0 HB2 SER A 204 10.182 -1.900 -1.622 1.00 0.00 H new ATOM 0 HB3 SER A 204 9.755 -3.592 -1.457 1.00 0.00 H new ATOM 0 HG SER A 204 9.887 -2.933 -3.690 1.00 0.00 H new ATOM 216 N CYS A 205 6.152 -3.188 -2.045 1.00 0.00 N ATOM 217 CA CYS A 205 5.099 -4.230 -2.199 1.00 0.00 C ATOM 218 C CYS A 205 4.670 -4.311 -3.667 1.00 0.00 C ATOM 219 O CYS A 205 5.090 -3.522 -4.490 1.00 0.00 O ATOM 220 CB CYS A 205 3.909 -3.854 -1.311 1.00 0.00 C ATOM 221 SG CYS A 205 2.353 -4.315 -2.114 1.00 0.00 S ATOM 0 H CYS A 205 6.074 -2.393 -2.679 1.00 0.00 H new ATOM 0 HA CYS A 205 5.482 -5.205 -1.898 1.00 0.00 H new ATOM 0 HB2 CYS A 205 3.992 -4.358 -0.348 1.00 0.00 H new ATOM 0 HB3 CYS A 205 3.920 -2.782 -1.112 1.00 0.00 H new ATOM 226 N ASP A 206 3.840 -5.261 -4.004 1.00 0.00 N ATOM 227 CA ASP A 206 3.390 -5.394 -5.418 1.00 0.00 C ATOM 228 C ASP A 206 2.889 -4.040 -5.924 1.00 0.00 C ATOM 229 O ASP A 206 3.051 -3.698 -7.079 1.00 0.00 O ATOM 230 CB ASP A 206 2.255 -6.418 -5.498 1.00 0.00 C ATOM 231 CG ASP A 206 2.804 -7.818 -5.218 1.00 0.00 C ATOM 232 OD1 ASP A 206 4.014 -7.959 -5.159 1.00 0.00 O ATOM 233 OD2 ASP A 206 2.004 -8.727 -5.068 1.00 0.00 O ATOM 0 H ASP A 206 3.454 -5.951 -3.360 1.00 0.00 H new ATOM 0 HA ASP A 206 4.225 -5.727 -6.034 1.00 0.00 H new ATOM 0 HB2 ASP A 206 1.477 -6.171 -4.776 1.00 0.00 H new ATOM 0 HB3 ASP A 206 1.794 -6.388 -6.485 1.00 0.00 H new ATOM 239 N PHE A 207 2.283 -3.266 -5.068 1.00 0.00 N ATOM 240 CA PHE A 207 1.769 -1.933 -5.492 1.00 0.00 C ATOM 241 C PHE A 207 2.525 -0.829 -4.759 1.00 0.00 C ATOM 242 O PHE A 207 3.102 -1.045 -3.712 1.00 0.00 O ATOM 243 CB PHE A 207 0.290 -1.815 -5.135 1.00 0.00 C ATOM 244 CG PHE A 207 -0.556 -2.509 -6.167 1.00 0.00 C ATOM 245 CD1 PHE A 207 -0.546 -2.059 -7.488 1.00 0.00 C ATOM 246 CD2 PHE A 207 -1.356 -3.594 -5.798 1.00 0.00 C ATOM 247 CE1 PHE A 207 -1.340 -2.697 -8.449 1.00 0.00 C ATOM 248 CE2 PHE A 207 -2.150 -4.232 -6.755 1.00 0.00 C ATOM 249 CZ PHE A 207 -2.142 -3.785 -8.083 1.00 0.00 C ATOM 0 H PHE A 207 2.121 -3.500 -4.089 1.00 0.00 H new ATOM 0 HA PHE A 207 1.908 -1.832 -6.568 1.00 0.00 H new ATOM 0 HB2 PHE A 207 0.110 -2.254 -4.154 1.00 0.00 H new ATOM 0 HB3 PHE A 207 0.008 -0.764 -5.071 1.00 0.00 H new ATOM 0 HD1 PHE A 207 0.073 -1.220 -7.769 1.00 0.00 H new ATOM 0 HD2 PHE A 207 -1.361 -3.939 -4.775 1.00 0.00 H new ATOM 0 HE1 PHE A 207 -1.334 -2.350 -9.472 1.00 0.00 H new ATOM 0 HE2 PHE A 207 -2.770 -5.070 -6.471 1.00 0.00 H new ATOM 0 HZ PHE A 207 -2.754 -4.279 -8.823 1.00 0.00 H new ATOM 259 N GLU A 208 2.503 0.359 -5.293 1.00 0.00 N ATOM 260 CA GLU A 208 3.195 1.488 -4.618 1.00 0.00 C ATOM 261 C GLU A 208 2.286 2.717 -4.665 1.00 0.00 C ATOM 262 O GLU A 208 1.724 3.042 -5.692 1.00 0.00 O ATOM 263 CB GLU A 208 4.511 1.797 -5.336 1.00 0.00 C ATOM 264 CG GLU A 208 5.388 0.542 -5.369 1.00 0.00 C ATOM 265 CD GLU A 208 5.055 -0.286 -6.612 1.00 0.00 C ATOM 266 OE1 GLU A 208 4.163 0.110 -7.345 1.00 0.00 O ATOM 267 OE2 GLU A 208 5.700 -1.302 -6.812 1.00 0.00 O ATOM 0 H GLU A 208 2.035 0.596 -6.168 1.00 0.00 H new ATOM 0 HA GLU A 208 3.412 1.221 -3.584 1.00 0.00 H new ATOM 0 HB2 GLU A 208 4.311 2.139 -6.351 1.00 0.00 H new ATOM 0 HB3 GLU A 208 5.034 2.605 -4.825 1.00 0.00 H new ATOM 0 HG2 GLU A 208 6.441 0.823 -5.378 1.00 0.00 H new ATOM 0 HG3 GLU A 208 5.224 -0.052 -4.470 1.00 0.00 H new ATOM 275 N ASP A 209 2.134 3.407 -3.569 1.00 0.00 N ATOM 276 CA ASP A 209 1.260 4.610 -3.584 1.00 0.00 C ATOM 277 C ASP A 209 1.982 5.723 -4.340 1.00 0.00 C ATOM 278 O ASP A 209 2.906 6.330 -3.838 1.00 0.00 O ATOM 279 CB ASP A 209 0.972 5.066 -2.151 1.00 0.00 C ATOM 280 CG ASP A 209 0.210 3.970 -1.404 1.00 0.00 C ATOM 281 OD1 ASP A 209 -0.337 3.101 -2.063 1.00 0.00 O ATOM 282 OD2 ASP A 209 0.185 4.018 -0.185 1.00 0.00 O ATOM 0 H ASP A 209 2.572 3.192 -2.673 1.00 0.00 H new ATOM 0 HA ASP A 209 0.315 4.374 -4.073 1.00 0.00 H new ATOM 0 HB2 ASP A 209 1.906 5.289 -1.635 1.00 0.00 H new ATOM 0 HB3 ASP A 209 0.387 5.986 -2.162 1.00 0.00 H new ATOM 288 N LEU A 210 1.567 5.991 -5.544 1.00 0.00 N ATOM 289 CA LEU A 210 2.228 7.060 -6.340 1.00 0.00 C ATOM 290 C LEU A 210 2.120 8.388 -5.587 1.00 0.00 C ATOM 291 O LEU A 210 2.967 9.252 -5.711 1.00 0.00 O ATOM 292 CB LEU A 210 1.544 7.162 -7.705 1.00 0.00 C ATOM 293 CG LEU A 210 1.684 5.829 -8.448 1.00 0.00 C ATOM 294 CD1 LEU A 210 1.046 5.942 -9.834 1.00 0.00 C ATOM 295 CD2 LEU A 210 3.167 5.483 -8.607 1.00 0.00 C ATOM 0 H LEU A 210 0.796 5.515 -6.013 1.00 0.00 H new ATOM 0 HA LEU A 210 3.282 6.824 -6.488 1.00 0.00 H new ATOM 0 HB2 LEU A 210 0.490 7.411 -7.578 1.00 0.00 H new ATOM 0 HB3 LEU A 210 1.993 7.965 -8.289 1.00 0.00 H new ATOM 0 HG LEU A 210 1.183 5.048 -7.877 1.00 0.00 H new ATOM 0 HD11 LEU A 210 1.147 4.993 -10.360 1.00 0.00 H new ATOM 0 HD12 LEU A 210 -0.011 6.188 -9.729 1.00 0.00 H new ATOM 0 HD13 LEU A 210 1.546 6.726 -10.402 1.00 0.00 H new ATOM 0 HD21 LEU A 210 3.265 4.535 -9.136 1.00 0.00 H new ATOM 0 HD22 LEU A 210 3.665 6.268 -9.176 1.00 0.00 H new ATOM 0 HD23 LEU A 210 3.629 5.399 -7.623 1.00 0.00 H new ATOM 307 N LEU A 211 1.093 8.556 -4.798 1.00 0.00 N ATOM 308 CA LEU A 211 0.940 9.823 -4.027 1.00 0.00 C ATOM 309 C LEU A 211 1.181 9.542 -2.543 1.00 0.00 C ATOM 310 O LEU A 211 0.812 8.504 -2.032 1.00 0.00 O ATOM 311 CB LEU A 211 -0.473 10.380 -4.215 1.00 0.00 C ATOM 312 CG LEU A 211 -0.752 10.571 -5.704 1.00 0.00 C ATOM 313 CD1 LEU A 211 -2.166 11.126 -5.894 1.00 0.00 C ATOM 314 CD2 LEU A 211 0.263 11.556 -6.289 1.00 0.00 C ATOM 0 H LEU A 211 0.353 7.869 -4.654 1.00 0.00 H new ATOM 0 HA LEU A 211 1.664 10.554 -4.388 1.00 0.00 H new ATOM 0 HB2 LEU A 211 -1.205 9.698 -3.782 1.00 0.00 H new ATOM 0 HB3 LEU A 211 -0.573 11.330 -3.691 1.00 0.00 H new ATOM 0 HG LEU A 211 -0.667 9.612 -6.215 1.00 0.00 H new ATOM 0 HD11 LEU A 211 -2.364 11.262 -6.957 1.00 0.00 H new ATOM 0 HD12 LEU A 211 -2.890 10.427 -5.477 1.00 0.00 H new ATOM 0 HD13 LEU A 211 -2.252 12.085 -5.384 1.00 0.00 H new ATOM 0 HD21 LEU A 211 0.065 11.694 -7.352 1.00 0.00 H new ATOM 0 HD22 LEU A 211 0.177 12.514 -5.777 1.00 0.00 H new ATOM 0 HD23 LEU A 211 1.271 11.162 -6.155 1.00 0.00 H new ATOM 326 N SER A 212 1.799 10.455 -1.845 1.00 0.00 N ATOM 327 CA SER A 212 2.059 10.228 -0.395 1.00 0.00 C ATOM 328 C SER A 212 0.816 10.593 0.415 1.00 0.00 C ATOM 329 O SER A 212 0.799 10.480 1.624 1.00 0.00 O ATOM 330 CB SER A 212 3.229 11.097 0.056 1.00 0.00 C ATOM 331 OG SER A 212 4.438 10.581 -0.484 1.00 0.00 O ATOM 0 H SER A 212 2.134 11.345 -2.214 1.00 0.00 H new ATOM 0 HA SER A 212 2.301 9.177 -0.234 1.00 0.00 H new ATOM 0 HB2 SER A 212 3.081 12.125 -0.274 1.00 0.00 H new ATOM 0 HB3 SER A 212 3.283 11.116 1.144 1.00 0.00 H new ATOM 0 HG SER A 212 5.190 11.140 -0.196 1.00 0.00 H new ATOM 337 N ASN A 213 -0.226 11.024 -0.239 1.00 0.00 N ATOM 338 CA ASN A 213 -1.467 11.387 0.494 1.00 0.00 C ATOM 339 C ASN A 213 -2.570 10.400 0.122 1.00 0.00 C ATOM 340 O ASN A 213 -3.743 10.676 0.271 1.00 0.00 O ATOM 341 CB ASN A 213 -1.890 12.804 0.113 1.00 0.00 C ATOM 342 CG ASN A 213 -0.853 13.801 0.631 1.00 0.00 C ATOM 343 OD1 ASN A 213 -0.053 13.474 1.484 1.00 0.00 O ATOM 344 ND2 ASN A 213 -0.832 15.012 0.149 1.00 0.00 N ATOM 0 H ASN A 213 -0.270 11.140 -1.251 1.00 0.00 H new ATOM 0 HA ASN A 213 -1.288 11.347 1.568 1.00 0.00 H new ATOM 0 HB2 ASN A 213 -1.983 12.889 -0.970 1.00 0.00 H new ATOM 0 HB3 ASN A 213 -2.869 13.029 0.535 1.00 0.00 H new ATOM 0 HD21 ASN A 213 -0.144 15.684 0.488 1.00 0.00 H new ATOM 0 HD22 ASN A 213 -1.504 15.287 -0.568 1.00 0.00 H new ATOM 351 N CYS A 214 -2.202 9.248 -0.364 1.00 0.00 N ATOM 352 CA CYS A 214 -3.227 8.243 -0.750 1.00 0.00 C ATOM 353 C CYS A 214 -4.149 7.965 0.435 1.00 0.00 C ATOM 354 O CYS A 214 -5.350 7.851 0.281 1.00 0.00 O ATOM 355 CB CYS A 214 -2.535 6.952 -1.176 1.00 0.00 C ATOM 356 SG CYS A 214 -2.110 7.070 -2.927 1.00 0.00 S ATOM 0 H CYS A 214 -1.235 8.960 -0.510 1.00 0.00 H new ATOM 0 HA CYS A 214 -3.819 8.629 -1.580 1.00 0.00 H new ATOM 0 HB2 CYS A 214 -1.637 6.791 -0.580 1.00 0.00 H new ATOM 0 HB3 CYS A 214 -3.190 6.098 -1.003 1.00 0.00 H new ATOM 361 N GLU A 215 -3.612 7.872 1.618 1.00 0.00 N ATOM 362 CA GLU A 215 -4.482 7.623 2.795 1.00 0.00 C ATOM 363 C GLU A 215 -5.497 8.761 2.876 1.00 0.00 C ATOM 364 O GLU A 215 -6.656 8.562 3.183 1.00 0.00 O ATOM 365 CB GLU A 215 -3.633 7.599 4.067 1.00 0.00 C ATOM 366 CG GLU A 215 -4.503 7.187 5.255 1.00 0.00 C ATOM 367 CD GLU A 215 -3.692 7.298 6.548 1.00 0.00 C ATOM 368 OE1 GLU A 215 -2.547 7.713 6.472 1.00 0.00 O ATOM 369 OE2 GLU A 215 -4.229 6.967 7.591 1.00 0.00 O ATOM 0 H GLU A 215 -2.616 7.957 1.819 1.00 0.00 H new ATOM 0 HA GLU A 215 -4.991 6.664 2.697 1.00 0.00 H new ATOM 0 HB2 GLU A 215 -2.804 6.901 3.950 1.00 0.00 H new ATOM 0 HB3 GLU A 215 -3.198 8.583 4.245 1.00 0.00 H new ATOM 0 HG2 GLU A 215 -5.385 7.825 5.311 1.00 0.00 H new ATOM 0 HG3 GLU A 215 -4.857 6.165 5.122 1.00 0.00 H new ATOM 377 N SER A 216 -5.062 9.955 2.584 1.00 0.00 N ATOM 378 CA SER A 216 -5.984 11.120 2.620 1.00 0.00 C ATOM 379 C SER A 216 -7.054 10.948 1.540 1.00 0.00 C ATOM 380 O SER A 216 -8.218 11.221 1.753 1.00 0.00 O ATOM 381 CB SER A 216 -5.187 12.397 2.352 1.00 0.00 C ATOM 382 OG SER A 216 -6.005 13.528 2.623 1.00 0.00 O ATOM 0 H SER A 216 -4.101 10.173 2.321 1.00 0.00 H new ATOM 0 HA SER A 216 -6.462 11.186 3.598 1.00 0.00 H new ATOM 0 HB2 SER A 216 -4.295 12.421 2.978 1.00 0.00 H new ATOM 0 HB3 SER A 216 -4.850 12.418 1.316 1.00 0.00 H new ATOM 0 HG SER A 216 -5.496 14.348 2.453 1.00 0.00 H new ATOM 388 N LEU A 217 -6.661 10.499 0.379 1.00 0.00 N ATOM 389 CA LEU A 217 -7.645 10.310 -0.724 1.00 0.00 C ATOM 390 C LEU A 217 -8.616 9.182 -0.370 1.00 0.00 C ATOM 391 O LEU A 217 -9.789 9.245 -0.677 1.00 0.00 O ATOM 392 CB LEU A 217 -6.905 9.955 -2.017 1.00 0.00 C ATOM 393 CG LEU A 217 -5.922 11.074 -2.374 1.00 0.00 C ATOM 394 CD1 LEU A 217 -5.236 10.746 -3.701 1.00 0.00 C ATOM 395 CD2 LEU A 217 -6.679 12.398 -2.513 1.00 0.00 C ATOM 0 H LEU A 217 -5.698 10.254 0.147 1.00 0.00 H new ATOM 0 HA LEU A 217 -8.204 11.235 -0.864 1.00 0.00 H new ATOM 0 HB2 LEU A 217 -6.370 9.013 -1.894 1.00 0.00 H new ATOM 0 HB3 LEU A 217 -7.619 9.812 -2.828 1.00 0.00 H new ATOM 0 HG LEU A 217 -5.175 11.162 -1.585 1.00 0.00 H new ATOM 0 HD11 LEU A 217 -4.536 11.542 -3.955 1.00 0.00 H new ATOM 0 HD12 LEU A 217 -4.696 9.804 -3.608 1.00 0.00 H new ATOM 0 HD13 LEU A 217 -5.987 10.658 -4.487 1.00 0.00 H new ATOM 0 HD21 LEU A 217 -5.978 13.193 -2.767 1.00 0.00 H new ATOM 0 HD22 LEU A 217 -7.427 12.308 -3.301 1.00 0.00 H new ATOM 0 HD23 LEU A 217 -7.172 12.636 -1.570 1.00 0.00 H new ATOM 407 N LYS A 218 -8.142 8.148 0.270 1.00 0.00 N ATOM 408 CA LYS A 218 -9.051 7.024 0.631 1.00 0.00 C ATOM 409 C LYS A 218 -10.182 7.557 1.510 1.00 0.00 C ATOM 410 O LYS A 218 -11.332 7.200 1.348 1.00 0.00 O ATOM 411 CB LYS A 218 -8.275 5.963 1.404 1.00 0.00 C ATOM 412 CG LYS A 218 -8.919 4.590 1.174 1.00 0.00 C ATOM 413 CD LYS A 218 -9.280 3.964 2.518 1.00 0.00 C ATOM 414 CE LYS A 218 -8.054 3.975 3.425 1.00 0.00 C ATOM 415 NZ LYS A 218 -7.887 2.635 4.053 1.00 0.00 N ATOM 0 H LYS A 218 -7.170 8.033 0.557 1.00 0.00 H new ATOM 0 HA LYS A 218 -9.461 6.583 -0.278 1.00 0.00 H new ATOM 0 HB2 LYS A 218 -7.235 5.948 1.078 1.00 0.00 H new ATOM 0 HB3 LYS A 218 -8.272 6.202 2.468 1.00 0.00 H new ATOM 0 HG2 LYS A 218 -9.812 4.694 0.558 1.00 0.00 H new ATOM 0 HG3 LYS A 218 -8.232 3.941 0.632 1.00 0.00 H new ATOM 0 HD2 LYS A 218 -10.095 4.518 2.983 1.00 0.00 H new ATOM 0 HD3 LYS A 218 -9.631 2.942 2.374 1.00 0.00 H new ATOM 0 HE2 LYS A 218 -7.165 4.231 2.849 1.00 0.00 H new ATOM 0 HE3 LYS A 218 -8.166 4.738 4.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 218 -7.051 2.643 4.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 218 -8.732 2.408 4.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 218 -7.762 1.917 3.311 1.00 0.00 H new ATOM 429 N THR A 219 -9.860 8.411 2.439 1.00 0.00 N ATOM 430 CA THR A 219 -10.905 8.977 3.336 1.00 0.00 C ATOM 431 C THR A 219 -11.884 9.830 2.523 1.00 0.00 C ATOM 432 O THR A 219 -13.060 9.893 2.823 1.00 0.00 O ATOM 433 CB THR A 219 -10.238 9.845 4.404 1.00 0.00 C ATOM 434 OG1 THR A 219 -9.239 9.085 5.070 1.00 0.00 O ATOM 435 CG2 THR A 219 -11.286 10.309 5.416 1.00 0.00 C ATOM 0 H THR A 219 -8.912 8.744 2.617 1.00 0.00 H new ATOM 0 HA THR A 219 -11.451 8.162 3.812 1.00 0.00 H new ATOM 0 HB THR A 219 -9.782 10.716 3.933 1.00 0.00 H new ATOM 0 HG1 THR A 219 -8.429 9.055 4.519 1.00 0.00 H new ATOM 0 HG21 THR A 219 -10.809 10.927 6.176 1.00 0.00 H new ATOM 0 HG22 THR A 219 -12.053 10.890 4.905 1.00 0.00 H new ATOM 0 HG23 THR A 219 -11.744 9.441 5.890 1.00 0.00 H new ATOM 443 N SER A 220 -11.407 10.500 1.507 1.00 0.00 N ATOM 444 CA SER A 220 -12.315 11.360 0.693 1.00 0.00 C ATOM 445 C SER A 220 -12.780 10.608 -0.558 1.00 0.00 C ATOM 446 O SER A 220 -13.962 10.487 -0.814 1.00 0.00 O ATOM 447 CB SER A 220 -11.569 12.628 0.274 1.00 0.00 C ATOM 448 OG SER A 220 -11.795 13.648 1.238 1.00 0.00 O ATOM 0 H SER A 220 -10.432 10.489 1.207 1.00 0.00 H new ATOM 0 HA SER A 220 -13.187 11.622 1.292 1.00 0.00 H new ATOM 0 HB2 SER A 220 -10.502 12.424 0.188 1.00 0.00 H new ATOM 0 HB3 SER A 220 -11.911 12.957 -0.707 1.00 0.00 H new ATOM 0 HG SER A 220 -11.316 14.461 0.972 1.00 0.00 H new ATOM 454 N ALA A 221 -11.865 10.109 -1.345 1.00 0.00 N ATOM 455 CA ALA A 221 -12.270 9.379 -2.581 1.00 0.00 C ATOM 456 C ALA A 221 -12.775 7.984 -2.216 1.00 0.00 C ATOM 457 O ALA A 221 -13.964 7.740 -2.155 1.00 0.00 O ATOM 458 CB ALA A 221 -11.070 9.257 -3.523 1.00 0.00 C ATOM 0 H ALA A 221 -10.859 10.175 -1.187 1.00 0.00 H new ATOM 0 HA ALA A 221 -13.067 9.932 -3.078 1.00 0.00 H new ATOM 0 HB1 ALA A 221 -11.369 8.723 -4.425 1.00 0.00 H new ATOM 0 HB2 ALA A 221 -10.715 10.252 -3.791 1.00 0.00 H new ATOM 0 HB3 ALA A 221 -10.271 8.709 -3.025 1.00 0.00 H new ATOM 464 N GLY A 222 -11.881 7.065 -1.970 1.00 0.00 N ATOM 465 CA GLY A 222 -12.310 5.685 -1.605 1.00 0.00 C ATOM 466 C GLY A 222 -11.550 4.660 -2.452 1.00 0.00 C ATOM 467 O GLY A 222 -11.262 4.887 -3.610 1.00 0.00 O ATOM 0 H GLY A 222 -10.872 7.210 -2.006 1.00 0.00 H new ATOM 0 HA2 GLY A 222 -12.123 5.505 -0.546 1.00 0.00 H new ATOM 0 HA3 GLY A 222 -13.383 5.575 -1.762 1.00 0.00 H new ATOM 471 N CYS A 223 -11.227 3.531 -1.882 1.00 0.00 N ATOM 472 CA CYS A 223 -10.489 2.487 -2.650 1.00 0.00 C ATOM 473 C CYS A 223 -11.308 2.068 -3.870 1.00 0.00 C ATOM 474 O CYS A 223 -10.778 1.836 -4.939 1.00 0.00 O ATOM 475 CB CYS A 223 -10.262 1.274 -1.749 1.00 0.00 C ATOM 476 SG CYS A 223 -9.087 1.713 -0.450 1.00 0.00 S ATOM 0 H CYS A 223 -11.443 3.286 -0.916 1.00 0.00 H new ATOM 0 HA CYS A 223 -9.531 2.887 -2.982 1.00 0.00 H new ATOM 0 HB2 CYS A 223 -11.205 0.951 -1.309 1.00 0.00 H new ATOM 0 HB3 CYS A 223 -9.880 0.437 -2.334 1.00 0.00 H new ATOM 481 N LYS A 224 -12.598 1.973 -3.718 1.00 0.00 N ATOM 482 CA LYS A 224 -13.457 1.575 -4.866 1.00 0.00 C ATOM 483 C LYS A 224 -13.296 2.598 -5.992 1.00 0.00 C ATOM 484 O LYS A 224 -13.579 2.321 -7.141 1.00 0.00 O ATOM 485 CB LYS A 224 -14.918 1.528 -4.414 1.00 0.00 C ATOM 486 CG LYS A 224 -15.088 0.431 -3.359 1.00 0.00 C ATOM 487 CD LYS A 224 -16.564 0.310 -2.973 1.00 0.00 C ATOM 488 CE LYS A 224 -16.711 -0.701 -1.835 1.00 0.00 C ATOM 489 NZ LYS A 224 -16.597 0.002 -0.526 1.00 0.00 N ATOM 0 H LYS A 224 -13.096 2.154 -2.846 1.00 0.00 H new ATOM 0 HA LYS A 224 -13.161 0.590 -5.226 1.00 0.00 H new ATOM 0 HB2 LYS A 224 -15.214 2.493 -4.003 1.00 0.00 H new ATOM 0 HB3 LYS A 224 -15.568 1.332 -5.267 1.00 0.00 H new ATOM 0 HG2 LYS A 224 -14.725 -0.520 -3.748 1.00 0.00 H new ATOM 0 HG3 LYS A 224 -14.490 0.664 -2.478 1.00 0.00 H new ATOM 0 HD2 LYS A 224 -16.951 1.281 -2.664 1.00 0.00 H new ATOM 0 HD3 LYS A 224 -17.152 -0.008 -3.834 1.00 0.00 H new ATOM 0 HE2 LYS A 224 -17.674 -1.206 -1.906 1.00 0.00 H new ATOM 0 HE3 LYS A 224 -15.942 -1.469 -1.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 224 -16.697 -0.686 0.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 224 -15.668 0.464 -0.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 224 -17.347 0.719 -0.451 1.00 0.00 H new ATOM 503 N HIS A 225 -12.850 3.779 -5.669 1.00 0.00 N ATOM 504 CA HIS A 225 -12.677 4.823 -6.715 1.00 0.00 C ATOM 505 C HIS A 225 -11.565 4.400 -7.676 1.00 0.00 C ATOM 506 O HIS A 225 -10.524 3.924 -7.269 1.00 0.00 O ATOM 507 CB HIS A 225 -12.300 6.146 -6.050 1.00 0.00 C ATOM 508 CG HIS A 225 -12.417 7.258 -7.053 1.00 0.00 C ATOM 509 ND1 HIS A 225 -12.006 7.112 -8.370 1.00 0.00 N ATOM 510 CD2 HIS A 225 -12.908 8.538 -6.954 1.00 0.00 C ATOM 511 CE1 HIS A 225 -12.255 8.270 -9.006 1.00 0.00 C ATOM 512 NE2 HIS A 225 -12.805 9.170 -8.188 1.00 0.00 N ATOM 0 H HIS A 225 -12.597 4.067 -4.724 1.00 0.00 H new ATOM 0 HA HIS A 225 -13.608 4.945 -7.269 1.00 0.00 H new ATOM 0 HB2 HIS A 225 -12.954 6.338 -5.199 1.00 0.00 H new ATOM 0 HB3 HIS A 225 -11.282 6.095 -5.664 1.00 0.00 H new ATOM 0 HD2 HIS A 225 -13.311 8.984 -6.057 1.00 0.00 H new ATOM 0 HE1 HIS A 225 -12.037 8.450 -10.048 1.00 0.00 H new ATOM 0 HE2 HIS A 225 -13.090 10.122 -8.420 1.00 0.00 H new ATOM 521 N GLU A 226 -11.783 4.567 -8.951 1.00 0.00 N ATOM 522 CA GLU A 226 -10.747 4.173 -9.945 1.00 0.00 C ATOM 523 C GLU A 226 -9.475 5.002 -9.736 1.00 0.00 C ATOM 524 O GLU A 226 -8.377 4.529 -9.943 1.00 0.00 O ATOM 525 CB GLU A 226 -11.283 4.417 -11.358 1.00 0.00 C ATOM 526 CG GLU A 226 -12.474 3.491 -11.621 1.00 0.00 C ATOM 527 CD GLU A 226 -12.013 2.033 -11.560 1.00 0.00 C ATOM 528 OE1 GLU A 226 -10.820 1.805 -11.664 1.00 0.00 O ATOM 529 OE2 GLU A 226 -12.864 1.170 -11.411 1.00 0.00 O ATOM 0 H GLU A 226 -12.636 4.960 -9.348 1.00 0.00 H new ATOM 0 HA GLU A 226 -10.511 3.117 -9.815 1.00 0.00 H new ATOM 0 HB2 GLU A 226 -11.587 5.458 -11.468 1.00 0.00 H new ATOM 0 HB3 GLU A 226 -10.498 4.235 -12.092 1.00 0.00 H new ATOM 0 HG2 GLU A 226 -13.255 3.667 -10.881 1.00 0.00 H new ATOM 0 HG3 GLU A 226 -12.906 3.706 -12.598 1.00 0.00 H new ATOM 537 N LEU A 227 -9.615 6.237 -9.334 1.00 0.00 N ATOM 538 CA LEU A 227 -8.411 7.090 -9.123 1.00 0.00 C ATOM 539 C LEU A 227 -7.428 6.396 -8.177 1.00 0.00 C ATOM 540 O LEU A 227 -6.256 6.285 -8.469 1.00 0.00 O ATOM 541 CB LEU A 227 -8.837 8.432 -8.527 1.00 0.00 C ATOM 542 CG LEU A 227 -9.247 9.376 -9.659 1.00 0.00 C ATOM 543 CD1 LEU A 227 -10.041 10.549 -9.086 1.00 0.00 C ATOM 544 CD2 LEU A 227 -7.996 9.904 -10.367 1.00 0.00 C ATOM 0 H LEU A 227 -10.509 6.690 -9.143 1.00 0.00 H new ATOM 0 HA LEU A 227 -7.919 7.254 -10.082 1.00 0.00 H new ATOM 0 HB2 LEU A 227 -9.668 8.290 -7.837 1.00 0.00 H new ATOM 0 HB3 LEU A 227 -8.018 8.866 -7.954 1.00 0.00 H new ATOM 0 HG LEU A 227 -9.866 8.833 -10.374 1.00 0.00 H new ATOM 0 HD11 LEU A 227 -10.332 11.220 -9.894 1.00 0.00 H new ATOM 0 HD12 LEU A 227 -10.934 10.174 -8.586 1.00 0.00 H new ATOM 0 HD13 LEU A 227 -9.424 11.090 -8.369 1.00 0.00 H new ATOM 0 HD21 LEU A 227 -8.290 10.576 -11.173 1.00 0.00 H new ATOM 0 HD22 LEU A 227 -7.374 10.444 -9.653 1.00 0.00 H new ATOM 0 HD23 LEU A 227 -7.431 9.068 -10.780 1.00 0.00 H new ATOM 556 N LEU A 228 -7.889 5.918 -7.056 1.00 0.00 N ATOM 557 CA LEU A 228 -6.971 5.225 -6.110 1.00 0.00 C ATOM 558 C LEU A 228 -6.457 3.948 -6.763 1.00 0.00 C ATOM 559 O LEU A 228 -5.400 3.447 -6.437 1.00 0.00 O ATOM 560 CB LEU A 228 -7.719 4.875 -4.819 1.00 0.00 C ATOM 561 CG LEU A 228 -7.747 6.092 -3.888 1.00 0.00 C ATOM 562 CD1 LEU A 228 -8.868 7.041 -4.312 1.00 0.00 C ATOM 563 CD2 LEU A 228 -7.994 5.626 -2.450 1.00 0.00 C ATOM 0 H LEU A 228 -8.861 5.977 -6.754 1.00 0.00 H new ATOM 0 HA LEU A 228 -6.134 5.881 -5.869 1.00 0.00 H new ATOM 0 HB2 LEU A 228 -8.736 4.560 -5.051 1.00 0.00 H new ATOM 0 HB3 LEU A 228 -7.232 4.036 -4.322 1.00 0.00 H new ATOM 0 HG LEU A 228 -6.791 6.613 -3.947 1.00 0.00 H new ATOM 0 HD11 LEU A 228 -8.884 7.905 -3.647 1.00 0.00 H new ATOM 0 HD12 LEU A 228 -8.695 7.374 -5.335 1.00 0.00 H new ATOM 0 HD13 LEU A 228 -9.825 6.522 -4.256 1.00 0.00 H new ATOM 0 HD21 LEU A 228 -8.014 6.490 -1.786 1.00 0.00 H new ATOM 0 HD22 LEU A 228 -8.949 5.104 -2.396 1.00 0.00 H new ATOM 0 HD23 LEU A 228 -7.194 4.952 -2.144 1.00 0.00 H new ATOM 575 N LYS A 229 -7.218 3.410 -7.665 1.00 0.00 N ATOM 576 CA LYS A 229 -6.815 2.149 -8.331 1.00 0.00 C ATOM 577 C LYS A 229 -5.624 2.378 -9.269 1.00 0.00 C ATOM 578 O LYS A 229 -5.123 1.445 -9.859 1.00 0.00 O ATOM 579 CB LYS A 229 -7.994 1.606 -9.136 1.00 0.00 C ATOM 580 CG LYS A 229 -8.013 0.080 -9.050 1.00 0.00 C ATOM 581 CD LYS A 229 -8.355 -0.343 -7.620 1.00 0.00 C ATOM 582 CE LYS A 229 -9.431 -1.429 -7.651 1.00 0.00 C ATOM 583 NZ LYS A 229 -8.925 -2.610 -8.407 1.00 0.00 N ATOM 0 H LYS A 229 -8.112 3.794 -7.973 1.00 0.00 H new ATOM 0 HA LYS A 229 -6.518 1.433 -7.565 1.00 0.00 H new ATOM 0 HB2 LYS A 229 -8.929 2.014 -8.751 1.00 0.00 H new ATOM 0 HB3 LYS A 229 -7.913 1.921 -10.176 1.00 0.00 H new ATOM 0 HG2 LYS A 229 -8.747 -0.326 -9.747 1.00 0.00 H new ATOM 0 HG3 LYS A 229 -7.043 -0.324 -9.338 1.00 0.00 H new ATOM 0 HD2 LYS A 229 -7.463 -0.715 -7.117 1.00 0.00 H new ATOM 0 HD3 LYS A 229 -8.708 0.517 -7.050 1.00 0.00 H new ATOM 0 HE2 LYS A 229 -9.697 -1.721 -6.635 1.00 0.00 H new ATOM 0 HE3 LYS A 229 -10.337 -1.045 -8.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 229 -9.472 -3.453 -8.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 229 -9.028 -2.439 -9.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 229 -7.921 -2.763 -8.181 1.00 0.00 H new ATOM 597 N THR A 230 -5.172 3.596 -9.441 1.00 0.00 N ATOM 598 CA THR A 230 -4.023 3.807 -10.372 1.00 0.00 C ATOM 599 C THR A 230 -2.833 4.466 -9.657 1.00 0.00 C ATOM 600 O THR A 230 -1.697 4.259 -10.034 1.00 0.00 O ATOM 601 CB THR A 230 -4.473 4.652 -11.573 1.00 0.00 C ATOM 602 OG1 THR A 230 -3.643 4.360 -12.688 1.00 0.00 O ATOM 603 CG2 THR A 230 -4.380 6.140 -11.247 1.00 0.00 C ATOM 0 H THR A 230 -5.539 4.434 -8.989 1.00 0.00 H new ATOM 0 HA THR A 230 -3.688 2.833 -10.728 1.00 0.00 H new ATOM 0 HB THR A 230 -5.510 4.410 -11.806 1.00 0.00 H new ATOM 0 HG1 THR A 230 -3.928 4.896 -13.457 1.00 0.00 H new ATOM 0 HG21 THR A 230 -4.703 6.722 -12.110 1.00 0.00 H new ATOM 0 HG22 THR A 230 -5.022 6.367 -10.396 1.00 0.00 H new ATOM 0 HG23 THR A 230 -3.349 6.395 -11.002 1.00 0.00 H new ATOM 611 N LYS A 231 -3.060 5.237 -8.624 1.00 0.00 N ATOM 612 CA LYS A 231 -1.905 5.868 -7.907 1.00 0.00 C ATOM 613 C LYS A 231 -1.926 5.441 -6.435 1.00 0.00 C ATOM 614 O LYS A 231 -0.954 5.594 -5.722 1.00 0.00 O ATOM 615 CB LYS A 231 -1.973 7.399 -7.997 1.00 0.00 C ATOM 616 CG LYS A 231 -3.402 7.853 -8.261 1.00 0.00 C ATOM 617 CD LYS A 231 -4.267 7.478 -7.067 1.00 0.00 C ATOM 618 CE LYS A 231 -5.519 8.358 -7.055 1.00 0.00 C ATOM 619 NZ LYS A 231 -5.196 9.667 -6.417 1.00 0.00 N ATOM 0 H LYS A 231 -3.982 5.456 -8.248 1.00 0.00 H new ATOM 0 HA LYS A 231 -0.980 5.536 -8.379 1.00 0.00 H new ATOM 0 HB2 LYS A 231 -1.610 7.841 -7.069 1.00 0.00 H new ATOM 0 HB3 LYS A 231 -1.319 7.752 -8.795 1.00 0.00 H new ATOM 0 HG2 LYS A 231 -3.431 8.930 -8.424 1.00 0.00 H new ATOM 0 HG3 LYS A 231 -3.786 7.383 -9.167 1.00 0.00 H new ATOM 0 HD2 LYS A 231 -4.548 6.426 -7.123 1.00 0.00 H new ATOM 0 HD3 LYS A 231 -3.707 7.610 -6.141 1.00 0.00 H new ATOM 0 HE2 LYS A 231 -5.877 8.515 -8.073 1.00 0.00 H new ATOM 0 HE3 LYS A 231 -6.321 7.862 -6.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 231 -6.076 10.192 -6.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 231 -4.702 9.502 -5.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 231 -4.585 10.221 -7.051 1.00 0.00 H new ATOM 633 N CYS A 232 -3.024 4.898 -5.978 1.00 0.00 N ATOM 634 CA CYS A 232 -3.108 4.450 -4.554 1.00 0.00 C ATOM 635 C CYS A 232 -3.365 2.947 -4.513 1.00 0.00 C ATOM 636 O CYS A 232 -3.857 2.414 -3.539 1.00 0.00 O ATOM 637 CB CYS A 232 -4.250 5.176 -3.852 1.00 0.00 C ATOM 638 SG CYS A 232 -3.905 6.949 -3.841 1.00 0.00 S ATOM 0 H CYS A 232 -3.868 4.745 -6.530 1.00 0.00 H new ATOM 0 HA CYS A 232 -2.170 4.678 -4.048 1.00 0.00 H new ATOM 0 HB2 CYS A 232 -5.192 4.979 -4.364 1.00 0.00 H new ATOM 0 HB3 CYS A 232 -4.359 4.808 -2.832 1.00 0.00 H new ATOM 643 N GLN A 233 -3.037 2.263 -5.569 1.00 0.00 N ATOM 644 CA GLN A 233 -3.263 0.792 -5.609 1.00 0.00 C ATOM 645 C GLN A 233 -2.645 0.131 -4.376 1.00 0.00 C ATOM 646 O GLN A 233 -3.199 -0.791 -3.816 1.00 0.00 O ATOM 647 CB GLN A 233 -2.598 0.232 -6.865 1.00 0.00 C ATOM 648 CG GLN A 233 -3.318 0.774 -8.098 1.00 0.00 C ATOM 649 CD GLN A 233 -2.533 0.400 -9.357 1.00 0.00 C ATOM 650 OE1 GLN A 233 -1.413 -0.065 -9.274 1.00 0.00 O ATOM 651 NE2 GLN A 233 -3.073 0.593 -10.530 1.00 0.00 N ATOM 0 H GLN A 233 -2.620 2.660 -6.411 1.00 0.00 H new ATOM 0 HA GLN A 233 -4.334 0.588 -5.621 1.00 0.00 H new ATOM 0 HB2 GLN A 233 -1.545 0.514 -6.890 1.00 0.00 H new ATOM 0 HB3 GLN A 233 -2.636 -0.857 -6.856 1.00 0.00 H new ATOM 0 HG2 GLN A 233 -4.327 0.365 -8.151 1.00 0.00 H new ATOM 0 HG3 GLN A 233 -3.417 1.857 -8.027 1.00 0.00 H new ATOM 0 HE21 GLN A 233 -4.013 0.983 -10.601 1.00 0.00 H new ATOM 0 HE22 GLN A 233 -2.555 0.354 -11.375 1.00 0.00 H new ATOM 660 N ALA A 234 -1.500 0.588 -3.949 1.00 0.00 N ATOM 661 CA ALA A 234 -0.855 -0.029 -2.756 1.00 0.00 C ATOM 662 C ALA A 234 -1.599 0.378 -1.487 1.00 0.00 C ATOM 663 O ALA A 234 -1.694 -0.380 -0.542 1.00 0.00 O ATOM 664 CB ALA A 234 0.601 0.431 -2.664 1.00 0.00 C ATOM 0 H ALA A 234 -0.985 1.359 -4.373 1.00 0.00 H new ATOM 0 HA ALA A 234 -0.890 -1.114 -2.856 1.00 0.00 H new ATOM 0 HB1 ALA A 234 1.071 -0.021 -1.791 1.00 0.00 H new ATOM 0 HB2 ALA A 234 1.136 0.126 -3.563 1.00 0.00 H new ATOM 0 HB3 ALA A 234 0.634 1.517 -2.572 1.00 0.00 H new ATOM 670 N THR A 235 -2.126 1.567 -1.452 1.00 0.00 N ATOM 671 CA THR A 235 -2.857 2.013 -0.238 1.00 0.00 C ATOM 672 C THR A 235 -4.095 1.139 -0.041 1.00 0.00 C ATOM 673 O THR A 235 -4.573 0.965 1.063 1.00 0.00 O ATOM 674 CB THR A 235 -3.269 3.477 -0.408 1.00 0.00 C ATOM 675 OG1 THR A 235 -2.290 4.316 0.191 1.00 0.00 O ATOM 676 CG2 THR A 235 -4.628 3.718 0.252 1.00 0.00 C ATOM 0 H THR A 235 -2.082 2.248 -2.210 1.00 0.00 H new ATOM 0 HA THR A 235 -2.214 1.920 0.637 1.00 0.00 H new ATOM 0 HB THR A 235 -3.346 3.707 -1.471 1.00 0.00 H new ATOM 0 HG1 THR A 235 -1.437 3.836 0.246 1.00 0.00 H new ATOM 0 HG21 THR A 235 -4.913 4.762 0.126 1.00 0.00 H new ATOM 0 HG22 THR A 235 -5.377 3.078 -0.214 1.00 0.00 H new ATOM 0 HG23 THR A 235 -4.563 3.485 1.315 1.00 0.00 H new ATOM 684 N CYS A 236 -4.624 0.595 -1.102 1.00 0.00 N ATOM 685 CA CYS A 236 -5.838 -0.259 -0.971 1.00 0.00 C ATOM 686 C CYS A 236 -5.513 -1.718 -1.304 1.00 0.00 C ATOM 687 O CYS A 236 -5.697 -2.600 -0.489 1.00 0.00 O ATOM 688 CB CYS A 236 -6.907 0.257 -1.927 1.00 0.00 C ATOM 689 SG CYS A 236 -7.354 1.943 -1.454 1.00 0.00 S ATOM 0 H CYS A 236 -4.269 0.704 -2.052 1.00 0.00 H new ATOM 0 HA CYS A 236 -6.197 -0.214 0.057 1.00 0.00 H new ATOM 0 HB2 CYS A 236 -6.536 0.239 -2.952 1.00 0.00 H new ATOM 0 HB3 CYS A 236 -7.785 -0.389 -1.894 1.00 0.00 H new ATOM 694 N LEU A 237 -5.050 -1.988 -2.493 1.00 0.00 N ATOM 695 CA LEU A 237 -4.738 -3.399 -2.860 1.00 0.00 C ATOM 696 C LEU A 237 -3.648 -3.948 -1.938 1.00 0.00 C ATOM 697 O LEU A 237 -3.655 -5.110 -1.583 1.00 0.00 O ATOM 698 CB LEU A 237 -4.270 -3.462 -4.317 1.00 0.00 C ATOM 699 CG LEU A 237 -5.346 -2.860 -5.225 1.00 0.00 C ATOM 700 CD1 LEU A 237 -4.966 -3.088 -6.688 1.00 0.00 C ATOM 701 CD2 LEU A 237 -6.693 -3.529 -4.942 1.00 0.00 C ATOM 0 H LEU A 237 -4.875 -1.298 -3.223 1.00 0.00 H new ATOM 0 HA LEU A 237 -5.636 -4.006 -2.746 1.00 0.00 H new ATOM 0 HB2 LEU A 237 -3.334 -2.916 -4.433 1.00 0.00 H new ATOM 0 HB3 LEU A 237 -4.074 -4.495 -4.603 1.00 0.00 H new ATOM 0 HG LEU A 237 -5.424 -1.791 -5.029 1.00 0.00 H new ATOM 0 HD11 LEU A 237 -5.732 -2.659 -7.334 1.00 0.00 H new ATOM 0 HD12 LEU A 237 -4.008 -2.610 -6.894 1.00 0.00 H new ATOM 0 HD13 LEU A 237 -4.886 -4.158 -6.881 1.00 0.00 H new ATOM 0 HD21 LEU A 237 -7.456 -3.098 -5.590 1.00 0.00 H new ATOM 0 HD22 LEU A 237 -6.615 -4.599 -5.134 1.00 0.00 H new ATOM 0 HD23 LEU A 237 -6.968 -3.367 -3.900 1.00 0.00 H new ATOM 713 N CYS A 238 -2.714 -3.128 -1.535 1.00 0.00 N ATOM 714 CA CYS A 238 -1.638 -3.623 -0.629 1.00 0.00 C ATOM 715 C CYS A 238 -1.861 -3.056 0.775 1.00 0.00 C ATOM 716 O CYS A 238 -1.345 -2.014 1.125 1.00 0.00 O ATOM 717 CB CYS A 238 -0.277 -3.170 -1.152 1.00 0.00 C ATOM 718 SG CYS A 238 1.002 -4.331 -0.612 1.00 0.00 S ATOM 0 H CYS A 238 -2.650 -2.143 -1.792 1.00 0.00 H new ATOM 0 HA CYS A 238 -1.664 -4.712 -0.593 1.00 0.00 H new ATOM 0 HB2 CYS A 238 -0.295 -3.115 -2.240 1.00 0.00 H new ATOM 0 HB3 CYS A 238 -0.051 -2.169 -0.786 1.00 0.00 H new ATOM 723 N GLU A 239 -2.624 -3.743 1.578 1.00 0.00 N ATOM 724 CA GLU A 239 -2.890 -3.263 2.964 1.00 0.00 C ATOM 725 C GLU A 239 -3.757 -4.290 3.692 1.00 0.00 C ATOM 726 O GLU A 239 -4.969 -4.267 3.603 1.00 0.00 O ATOM 727 CB GLU A 239 -3.630 -1.922 2.911 1.00 0.00 C ATOM 728 CG GLU A 239 -3.790 -1.367 4.327 1.00 0.00 C ATOM 729 CD GLU A 239 -4.631 -0.089 4.281 1.00 0.00 C ATOM 730 OE1 GLU A 239 -4.831 0.503 5.329 1.00 0.00 O ATOM 731 OE2 GLU A 239 -5.060 0.274 3.199 1.00 0.00 O ATOM 0 H GLU A 239 -3.078 -4.623 1.333 1.00 0.00 H new ATOM 0 HA GLU A 239 -1.946 -3.134 3.493 1.00 0.00 H new ATOM 0 HB2 GLU A 239 -3.077 -1.215 2.293 1.00 0.00 H new ATOM 0 HB3 GLU A 239 -4.608 -2.053 2.448 1.00 0.00 H new ATOM 0 HG2 GLU A 239 -4.269 -2.108 4.968 1.00 0.00 H new ATOM 0 HG3 GLU A 239 -2.812 -1.156 4.759 1.00 0.00 H new ATOM 739 N ASP A 240 -3.150 -5.194 4.410 1.00 0.00 N ATOM 740 CA ASP A 240 -3.948 -6.220 5.139 1.00 0.00 C ATOM 741 C ASP A 240 -4.908 -6.908 4.166 1.00 0.00 C ATOM 742 O ASP A 240 -6.092 -7.012 4.418 1.00 0.00 O ATOM 743 CB ASP A 240 -4.749 -5.547 6.256 1.00 0.00 C ATOM 744 CG ASP A 240 -5.482 -6.614 7.070 1.00 0.00 C ATOM 745 OD1 ASP A 240 -6.293 -6.243 7.903 1.00 0.00 O ATOM 746 OD2 ASP A 240 -5.221 -7.786 6.847 1.00 0.00 O ATOM 0 H ASP A 240 -2.139 -5.267 4.523 1.00 0.00 H new ATOM 0 HA ASP A 240 -3.276 -6.961 5.571 1.00 0.00 H new ATOM 0 HB2 ASP A 240 -4.083 -4.975 6.902 1.00 0.00 H new ATOM 0 HB3 ASP A 240 -5.464 -4.842 5.832 1.00 0.00 H new ATOM 752 N LYS A 241 -4.409 -7.382 3.059 1.00 0.00 N ATOM 753 CA LYS A 241 -5.290 -8.067 2.075 1.00 0.00 C ATOM 754 C LYS A 241 -5.197 -9.577 2.293 1.00 0.00 C ATOM 755 O LYS A 241 -4.121 -10.130 2.390 1.00 0.00 O ATOM 756 CB LYS A 241 -4.833 -7.726 0.656 1.00 0.00 C ATOM 757 CG LYS A 241 -5.839 -8.279 -0.356 1.00 0.00 C ATOM 758 CD LYS A 241 -5.338 -8.001 -1.775 1.00 0.00 C ATOM 759 CE LYS A 241 -6.405 -8.427 -2.784 1.00 0.00 C ATOM 760 NZ LYS A 241 -6.002 -7.982 -4.148 1.00 0.00 N ATOM 0 H LYS A 241 -3.426 -7.324 2.793 1.00 0.00 H new ATOM 0 HA LYS A 241 -6.320 -7.737 2.209 1.00 0.00 H new ATOM 0 HB2 LYS A 241 -4.744 -6.646 0.542 1.00 0.00 H new ATOM 0 HB3 LYS A 241 -3.846 -8.149 0.470 1.00 0.00 H new ATOM 0 HG2 LYS A 241 -5.969 -9.351 -0.208 1.00 0.00 H new ATOM 0 HG3 LYS A 241 -6.814 -7.816 -0.206 1.00 0.00 H new ATOM 0 HD2 LYS A 241 -5.114 -6.941 -1.892 1.00 0.00 H new ATOM 0 HD3 LYS A 241 -4.411 -8.545 -1.958 1.00 0.00 H new ATOM 0 HE2 LYS A 241 -6.528 -9.510 -2.764 1.00 0.00 H new ATOM 0 HE3 LYS A 241 -7.368 -7.992 -2.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 241 -6.727 -8.271 -4.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 241 -5.906 -6.947 -4.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 241 -5.092 -8.418 -4.401 1.00 0.00 H new ATOM 774 N ILE A 242 -6.312 -10.246 2.376 1.00 0.00 N ATOM 775 CA ILE A 242 -6.269 -11.717 2.594 1.00 0.00 C ATOM 776 C ILE A 242 -6.558 -12.440 1.275 1.00 0.00 C ATOM 777 O ILE A 242 -7.500 -12.120 0.577 1.00 0.00 O ATOM 778 CB ILE A 242 -7.322 -12.111 3.631 1.00 0.00 C ATOM 779 CG1 ILE A 242 -7.080 -11.334 4.927 1.00 0.00 C ATOM 780 CG2 ILE A 242 -7.224 -13.612 3.913 1.00 0.00 C ATOM 781 CD1 ILE A 242 -8.227 -11.600 5.905 1.00 0.00 C ATOM 0 H ILE A 242 -7.245 -9.841 2.303 1.00 0.00 H new ATOM 0 HA ILE A 242 -5.280 -12.000 2.954 1.00 0.00 H new ATOM 0 HB ILE A 242 -8.314 -11.876 3.246 1.00 0.00 H new ATOM 0 HG12 ILE A 242 -6.132 -11.635 5.372 1.00 0.00 H new ATOM 0 HG13 ILE A 242 -7.009 -10.267 4.716 1.00 0.00 H new ATOM 0 HG21 ILE A 242 -7.974 -13.893 4.652 1.00 0.00 H new ATOM 0 HG22 ILE A 242 -7.397 -14.167 2.991 1.00 0.00 H new ATOM 0 HG23 ILE A 242 -6.231 -13.846 4.297 1.00 0.00 H new ATOM 0 HD11 ILE A 242 -8.054 -11.046 6.828 1.00 0.00 H new ATOM 0 HD12 ILE A 242 -9.168 -11.277 5.459 1.00 0.00 H new ATOM 0 HD13 ILE A 242 -8.277 -12.666 6.126 1.00 0.00 H new ATOM 793 N HIS A 243 -5.756 -13.413 0.932 1.00 0.00 N ATOM 794 CA HIS A 243 -5.982 -14.159 -0.338 1.00 0.00 C ATOM 795 C HIS A 243 -6.453 -13.194 -1.427 1.00 0.00 C ATOM 796 O HIS A 243 -6.580 -11.996 -1.188 1.00 0.00 O ATOM 797 CB HIS A 243 -7.046 -15.234 -0.117 1.00 0.00 C ATOM 798 CG HIS A 243 -6.557 -16.221 0.908 1.00 0.00 C ATOM 799 ND1 HIS A 243 -7.210 -16.418 2.116 1.00 0.00 N ATOM 800 CD2 HIS A 243 -5.477 -17.071 0.923 1.00 0.00 C ATOM 801 CE1 HIS A 243 -6.524 -17.353 2.801 1.00 0.00 C ATOM 802 NE2 HIS A 243 -5.462 -17.780 2.118 1.00 0.00 N ATOM 0 H HIS A 243 -4.953 -13.723 1.479 1.00 0.00 H new ATOM 0 HA HIS A 243 -5.049 -14.628 -0.650 1.00 0.00 H new ATOM 0 HB2 HIS A 243 -7.977 -14.776 0.218 1.00 0.00 H new ATOM 0 HB3 HIS A 243 -7.262 -15.745 -1.055 1.00 0.00 H new ATOM 0 HD2 HIS A 243 -4.752 -17.172 0.129 1.00 0.00 H new ATOM 0 HE1 HIS A 243 -6.800 -17.712 3.781 1.00 0.00 H new ATOM 0 HE2 HIS A 243 -4.781 -18.480 2.411 1.00 0.00 H new TER 811 HIS A 243