USER MOD reduce.3.24.130724 H: found=0, std=0, add=644, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 647 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 168 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 170 THR OG1 : rot 180:sc= 0.00528 USER MOD Single : A 172 THR OG1 : rot 180:sc= 0 USER MOD Single : A 177 GLN : amide:sc= -1.7 X(o=-1.7,f=-2.1!) USER MOD Single : A 179 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.044) USER MOD Single : A 181 SER OG : rot 180:sc= 0 USER MOD Single : A 184 SER OG : rot 42:sc= 0.193 USER MOD Single : A 187 SER OG : rot 180:sc= 0 USER MOD Single : A 190 SER OG : rot 5:sc= 0.357 USER MOD Single : A 191 GLN : amide:sc= -1.64 K(o=-1.6,f=-0.97) USER MOD Single : A 194 TYR OH : rot -92:sc= 0.0654 USER MOD Single : A 196 THR OG1 : rot 180:sc= 0 USER MOD Single : A 209 LYS NZ :NH3+ 176:sc= 0.322 (180deg=0.315) USER MOD Single : A 213 MET CE :methyl 163:sc=-0.00452 (180deg=-0.529) USER MOD Single : A 214 THR OG1 : rot 127:sc= -1.59! USER MOD Single : A 227 THR OG1 : rot 78:sc= 0.529 USER MOD Single : A 228 GLN : amide:sc= -0.184 K(o=-0.18,f=-1.2) USER MOD Single : A 232 LYS NZ :NH3+ -169:sc= 0.00649 (180deg=0.000709) USER MOD Single : A 236 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 238 LYS NZ :NH3+ 178:sc= 0.585 (180deg=0.579) USER MOD Single : A 250 TYR OH : rot 180:sc= 0.24 USER MOD Single : A 256 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 168 1.696 9.128 -15.250 1.00 10.01 N ATOM 2 CA MET A 168 1.858 8.180 -14.117 1.00 61.53 C ATOM 3 C MET A 168 2.867 7.088 -14.488 1.00 13.14 C ATOM 4 O MET A 168 3.149 6.868 -15.674 1.00 23.14 O ATOM 5 CB MET A 168 0.487 7.553 -13.720 1.00 31.05 C ATOM 6 CG MET A 168 -0.543 8.558 -13.175 1.00 42.33 C ATOM 7 SD MET A 168 -0.997 9.831 -14.380 1.00 55.41 S ATOM 8 CE MET A 168 -2.091 10.873 -13.415 1.00 60.24 C ATOM 0 HA MET A 168 2.237 8.728 -13.255 1.00 61.53 H new ATOM 0 HB2 MET A 168 0.063 7.056 -14.593 1.00 31.05 H new ATOM 0 HB3 MET A 168 0.658 6.784 -12.967 1.00 31.05 H new ATOM 0 HG2 MET A 168 -1.440 8.020 -12.868 1.00 42.33 H new ATOM 0 HG3 MET A 168 -0.138 9.037 -12.284 1.00 42.33 H new ATOM 0 HE1 MET A 168 -2.446 11.698 -14.032 1.00 60.24 H new ATOM 0 HE2 MET A 168 -2.942 10.286 -13.070 1.00 60.24 H new ATOM 0 HE3 MET A 168 -1.551 11.269 -12.555 1.00 60.24 H new ATOM 20 N GLU A 169 3.421 6.417 -13.461 1.00 12.35 N ATOM 21 CA GLU A 169 4.357 5.291 -13.638 1.00 73.34 C ATOM 22 C GLU A 169 3.575 3.996 -13.974 1.00 11.14 C ATOM 23 O GLU A 169 2.356 3.921 -13.760 1.00 55.43 O ATOM 24 CB GLU A 169 5.213 5.124 -12.344 1.00 74.30 C ATOM 25 CG GLU A 169 6.330 4.056 -12.422 1.00 13.21 C ATOM 26 CD GLU A 169 7.155 3.936 -11.132 1.00 21.04 C ATOM 27 OE1 GLU A 169 8.145 4.683 -10.973 1.00 53.41 O ATOM 28 OE2 GLU A 169 6.824 3.094 -10.271 1.00 71.22 O ATOM 0 H GLU A 169 3.232 6.641 -12.484 1.00 12.35 H new ATOM 0 HA GLU A 169 5.029 5.495 -14.471 1.00 73.34 H new ATOM 0 HB2 GLU A 169 5.668 6.085 -12.103 1.00 74.30 H new ATOM 0 HB3 GLU A 169 4.548 4.870 -11.519 1.00 74.30 H new ATOM 0 HG2 GLU A 169 5.881 3.089 -12.648 1.00 13.21 H new ATOM 0 HG3 GLU A 169 6.997 4.299 -13.249 1.00 13.21 H new ATOM 35 N THR A 170 4.292 3.000 -14.517 1.00 21.12 N ATOM 36 CA THR A 170 3.750 1.672 -14.849 1.00 54.35 C ATOM 37 C THR A 170 3.136 0.958 -13.615 1.00 63.32 C ATOM 38 O THR A 170 2.166 0.198 -13.747 1.00 42.00 O ATOM 39 CB THR A 170 4.886 0.801 -15.475 1.00 4.23 C ATOM 40 OG1 THR A 170 6.059 0.879 -14.640 1.00 13.30 O ATOM 41 CG2 THR A 170 5.251 1.263 -16.899 1.00 54.15 C ATOM 0 H THR A 170 5.282 3.096 -14.742 1.00 21.12 H new ATOM 0 HA THR A 170 2.940 1.806 -15.566 1.00 54.35 H new ATOM 0 HB THR A 170 4.522 -0.225 -15.538 1.00 4.23 H new ATOM 0 HG1 THR A 170 6.774 0.332 -15.028 1.00 13.30 H new ATOM 0 HG21 THR A 170 6.045 0.629 -17.295 1.00 54.15 H new ATOM 0 HG22 THR A 170 4.374 1.190 -17.541 1.00 54.15 H new ATOM 0 HG23 THR A 170 5.593 2.297 -16.869 1.00 54.15 H new ATOM 49 N ALA A 171 3.716 1.208 -12.426 1.00 34.12 N ATOM 50 CA ALA A 171 3.219 0.661 -11.146 1.00 13.13 C ATOM 51 C ALA A 171 1.868 1.299 -10.760 1.00 33.42 C ATOM 52 O ALA A 171 1.651 2.499 -10.983 1.00 14.33 O ATOM 53 CB ALA A 171 4.263 0.877 -10.035 1.00 12.33 C ATOM 0 H ALA A 171 4.544 1.796 -12.324 1.00 34.12 H new ATOM 0 HA ALA A 171 3.058 -0.410 -11.269 1.00 13.13 H new ATOM 0 HB1 ALA A 171 3.886 0.470 -9.097 1.00 12.33 H new ATOM 0 HB2 ALA A 171 5.190 0.370 -10.303 1.00 12.33 H new ATOM 0 HB3 ALA A 171 4.453 1.944 -9.917 1.00 12.33 H new ATOM 59 N THR A 172 0.974 0.481 -10.170 1.00 41.12 N ATOM 60 CA THR A 172 -0.367 0.915 -9.730 1.00 11.43 C ATOM 61 C THR A 172 -0.279 1.761 -8.426 1.00 21.43 C ATOM 62 O THR A 172 -1.257 2.372 -7.987 1.00 61.43 O ATOM 63 CB THR A 172 -1.291 -0.337 -9.522 1.00 12.10 C ATOM 64 OG1 THR A 172 -1.174 -1.212 -10.656 1.00 51.42 O ATOM 65 CG2 THR A 172 -2.771 0.039 -9.340 1.00 15.14 C ATOM 0 H THR A 172 1.163 -0.504 -9.984 1.00 41.12 H new ATOM 0 HA THR A 172 -0.801 1.547 -10.505 1.00 11.43 H new ATOM 0 HB THR A 172 -0.958 -0.830 -8.608 1.00 12.10 H new ATOM 0 HG1 THR A 172 -1.749 -1.995 -10.526 1.00 51.42 H new ATOM 0 HG21 THR A 172 -3.362 -0.866 -9.200 1.00 15.14 H new ATOM 0 HG22 THR A 172 -2.878 0.681 -8.466 1.00 15.14 H new ATOM 0 HG23 THR A 172 -3.123 0.569 -10.225 1.00 15.14 H new ATOM 73 N ALA A 173 0.905 1.768 -7.810 1.00 12.41 N ATOM 74 CA ALA A 173 1.194 2.568 -6.608 1.00 34.01 C ATOM 75 C ALA A 173 2.199 3.688 -6.930 1.00 73.51 C ATOM 76 O ALA A 173 3.015 3.547 -7.854 1.00 0.32 O ATOM 77 CB ALA A 173 1.736 1.657 -5.499 1.00 75.20 C ATOM 0 H ALA A 173 1.700 1.215 -8.131 1.00 12.41 H new ATOM 0 HA ALA A 173 0.271 3.034 -6.263 1.00 34.01 H new ATOM 0 HB1 ALA A 173 1.949 2.252 -4.611 1.00 75.20 H new ATOM 0 HB2 ALA A 173 0.993 0.897 -5.257 1.00 75.20 H new ATOM 0 HB3 ALA A 173 2.652 1.174 -5.840 1.00 75.20 H new ATOM 83 N GLY A 174 2.113 4.800 -6.172 1.00 12.33 N ATOM 84 CA GLY A 174 3.114 5.864 -6.199 1.00 33.42 C ATOM 85 C GLY A 174 4.403 5.445 -5.495 1.00 60.23 C ATOM 86 O GLY A 174 5.101 4.529 -5.953 1.00 72.33 O ATOM 0 H GLY A 174 1.344 4.977 -5.526 1.00 12.33 H new ATOM 0 HA2 GLY A 174 3.334 6.130 -7.233 1.00 33.42 H new ATOM 0 HA3 GLY A 174 2.710 6.756 -5.719 1.00 33.42 H new ATOM 90 N GLU A 175 4.706 6.096 -4.369 1.00 32.41 N ATOM 91 CA GLU A 175 5.885 5.787 -3.548 1.00 42.33 C ATOM 92 C GLU A 175 5.447 5.197 -2.198 1.00 63.32 C ATOM 93 O GLU A 175 4.241 5.084 -1.906 1.00 43.32 O ATOM 94 CB GLU A 175 6.723 7.070 -3.304 1.00 35.32 C ATOM 95 CG GLU A 175 6.006 8.133 -2.445 1.00 23.10 C ATOM 96 CD GLU A 175 6.897 9.301 -2.030 1.00 24.32 C ATOM 97 OE1 GLU A 175 7.959 9.060 -1.437 1.00 15.23 O ATOM 98 OE2 GLU A 175 6.508 10.473 -2.221 1.00 34.50 O ATOM 0 H GLU A 175 4.138 6.857 -3.997 1.00 32.41 H new ATOM 0 HA GLU A 175 6.496 5.058 -4.080 1.00 42.33 H new ATOM 0 HB2 GLU A 175 7.658 6.794 -2.817 1.00 35.32 H new ATOM 0 HB3 GLU A 175 6.983 7.510 -4.267 1.00 35.32 H new ATOM 0 HG2 GLU A 175 5.153 8.520 -3.002 1.00 23.10 H new ATOM 0 HG3 GLU A 175 5.611 7.655 -1.549 1.00 23.10 H new ATOM 105 N TRP A 176 6.446 4.832 -1.385 1.00 62.45 N ATOM 106 CA TRP A 176 6.244 4.442 0.014 1.00 11.25 C ATOM 107 C TRP A 176 6.225 5.697 0.906 1.00 24.51 C ATOM 108 O TRP A 176 5.154 6.170 1.309 1.00 2.31 O ATOM 109 CB TRP A 176 7.339 3.421 0.450 1.00 11.41 C ATOM 110 CG TRP A 176 7.025 2.004 0.039 1.00 53.13 C ATOM 111 CD1 TRP A 176 6.890 1.512 -1.231 1.00 14.13 C ATOM 112 CD2 TRP A 176 6.778 0.904 0.916 1.00 24.53 C ATOM 113 NE1 TRP A 176 6.553 0.181 -1.182 1.00 31.15 N ATOM 114 CE2 TRP A 176 6.489 -0.214 0.118 1.00 72.12 C ATOM 115 CE3 TRP A 176 6.777 0.762 2.299 1.00 60.23 C ATOM 116 CZ2 TRP A 176 6.200 -1.459 0.658 1.00 43.24 C ATOM 117 CZ3 TRP A 176 6.492 -0.474 2.829 1.00 13.53 C ATOM 118 CH2 TRP A 176 6.208 -1.575 2.012 1.00 42.12 C ATOM 0 H TRP A 176 7.421 4.799 -1.682 1.00 62.45 H new ATOM 0 HA TRP A 176 5.280 3.946 0.125 1.00 11.25 H new ATOM 0 HB2 TRP A 176 8.295 3.715 0.016 1.00 11.41 H new ATOM 0 HB3 TRP A 176 7.454 3.462 1.533 1.00 11.41 H new ATOM 0 HD1 TRP A 176 7.028 2.084 -2.136 1.00 14.13 H new ATOM 0 HE1 TRP A 176 6.379 -0.415 -1.991 1.00 31.15 H new ATOM 0 HE3 TRP A 176 6.995 1.602 2.941 1.00 60.23 H new ATOM 0 HZ2 TRP A 176 5.977 -2.305 0.025 1.00 43.24 H new ATOM 0 HZ3 TRP A 176 6.487 -0.599 3.902 1.00 13.53 H new ATOM 0 HH2 TRP A 176 5.992 -2.531 2.465 1.00 42.12 H new ATOM 129 N GLN A 177 7.423 6.254 1.153 1.00 61.31 N ATOM 130 CA GLN A 177 7.633 7.395 2.072 1.00 42.32 C ATOM 131 C GLN A 177 9.066 7.932 1.890 1.00 41.32 C ATOM 132 O GLN A 177 9.699 8.423 2.831 1.00 53.13 O ATOM 133 CB GLN A 177 7.360 6.957 3.543 1.00 62.51 C ATOM 134 CG GLN A 177 8.214 5.767 4.048 1.00 32.24 C ATOM 135 CD GLN A 177 7.861 5.310 5.470 1.00 14.10 C ATOM 136 OE1 GLN A 177 8.731 4.884 6.228 1.00 64.52 O ATOM 137 NE2 GLN A 177 6.581 5.341 5.833 1.00 41.04 N ATOM 0 H GLN A 177 8.284 5.924 0.717 1.00 61.31 H new ATOM 0 HA GLN A 177 6.934 8.198 1.839 1.00 42.32 H new ATOM 0 HB2 GLN A 177 7.534 7.811 4.197 1.00 62.51 H new ATOM 0 HB3 GLN A 177 6.307 6.693 3.637 1.00 62.51 H new ATOM 0 HG2 GLN A 177 8.089 4.927 3.365 1.00 32.24 H new ATOM 0 HG3 GLN A 177 9.267 6.049 4.018 1.00 32.24 H new ATOM 0 HE21 GLN A 177 5.876 5.699 5.188 1.00 41.04 H new ATOM 0 HE22 GLN A 177 6.305 5.007 6.756 1.00 41.04 H new ATOM 146 N GLY A 178 9.543 7.874 0.639 1.00 22.35 N ATOM 147 CA GLY A 178 10.926 8.189 0.276 1.00 20.25 C ATOM 148 C GLY A 178 11.471 7.135 -0.671 1.00 0.40 C ATOM 149 O GLY A 178 12.171 7.454 -1.641 1.00 53.13 O ATOM 0 H GLY A 178 8.968 7.603 -0.159 1.00 22.35 H new ATOM 0 HA2 GLY A 178 10.972 9.171 -0.195 1.00 20.25 H new ATOM 0 HA3 GLY A 178 11.543 8.237 1.173 1.00 20.25 H new ATOM 153 N LYS A 179 11.135 5.860 -0.372 1.00 61.43 N ATOM 154 CA LYS A 179 11.495 4.700 -1.206 1.00 1.45 C ATOM 155 C LYS A 179 10.828 4.777 -2.593 1.00 23.25 C ATOM 156 O LYS A 179 9.660 5.190 -2.716 1.00 14.20 O ATOM 157 CB LYS A 179 11.123 3.378 -0.481 1.00 1.31 C ATOM 158 CG LYS A 179 12.026 3.022 0.724 1.00 61.45 C ATOM 159 CD LYS A 179 13.502 2.818 0.303 1.00 54.21 C ATOM 160 CE LYS A 179 14.397 2.356 1.457 1.00 22.10 C ATOM 161 NZ LYS A 179 14.375 3.314 2.591 1.00 14.41 N ATOM 0 H LYS A 179 10.603 5.610 0.461 1.00 61.43 H new ATOM 0 HA LYS A 179 12.574 4.716 -1.362 1.00 1.45 H new ATOM 0 HB2 LYS A 179 10.091 3.447 -0.136 1.00 1.31 H new ATOM 0 HB3 LYS A 179 11.164 2.561 -1.201 1.00 1.31 H new ATOM 0 HG2 LYS A 179 11.968 3.817 1.468 1.00 61.45 H new ATOM 0 HG3 LYS A 179 11.656 2.113 1.199 1.00 61.45 H new ATOM 0 HD2 LYS A 179 13.546 2.083 -0.500 1.00 54.21 H new ATOM 0 HD3 LYS A 179 13.892 3.753 -0.099 1.00 54.21 H new ATOM 0 HE2 LYS A 179 14.067 1.376 1.803 1.00 22.10 H new ATOM 0 HE3 LYS A 179 15.420 2.240 1.099 1.00 22.10 H new ATOM 0 HZ1 LYS A 179 15.057 3.010 3.315 1.00 14.41 H new ATOM 0 HZ2 LYS A 179 14.632 4.262 2.250 1.00 14.41 H new ATOM 0 HZ3 LYS A 179 13.421 3.342 3.003 1.00 14.41 H new ATOM 175 N GLY A 180 11.590 4.364 -3.627 1.00 3.45 N ATOM 176 CA GLY A 180 11.236 4.586 -5.029 1.00 50.35 C ATOM 177 C GLY A 180 11.731 5.954 -5.478 1.00 10.30 C ATOM 178 O GLY A 180 12.696 6.065 -6.247 1.00 51.30 O ATOM 0 H GLY A 180 12.471 3.865 -3.503 1.00 3.45 H new ATOM 0 HA2 GLY A 180 11.677 3.808 -5.652 1.00 50.35 H new ATOM 0 HA3 GLY A 180 10.155 4.521 -5.155 1.00 50.35 H new ATOM 182 N SER A 181 11.084 6.988 -4.937 1.00 52.22 N ATOM 183 CA SER A 181 11.435 8.397 -5.155 1.00 4.44 C ATOM 184 C SER A 181 10.697 9.252 -4.123 1.00 14.32 C ATOM 185 O SER A 181 9.528 8.985 -3.844 1.00 54.43 O ATOM 186 CB SER A 181 11.045 8.845 -6.588 1.00 62.11 C ATOM 187 OG SER A 181 9.667 8.595 -6.860 1.00 13.31 O ATOM 0 H SER A 181 10.281 6.868 -4.319 1.00 52.22 H new ATOM 0 HA SER A 181 12.512 8.521 -5.043 1.00 4.44 H new ATOM 0 HB2 SER A 181 11.253 9.908 -6.706 1.00 62.11 H new ATOM 0 HB3 SER A 181 11.662 8.317 -7.315 1.00 62.11 H new ATOM 0 HG SER A 181 9.454 8.890 -7.770 1.00 13.31 H new ATOM 193 N GLY A 182 11.381 10.269 -3.567 1.00 52.32 N ATOM 194 CA GLY A 182 10.740 11.259 -2.699 1.00 71.12 C ATOM 195 C GLY A 182 9.854 12.198 -3.515 1.00 24.10 C ATOM 196 O GLY A 182 10.265 13.319 -3.852 1.00 42.35 O ATOM 0 H GLY A 182 12.380 10.422 -3.707 1.00 52.32 H new ATOM 0 HA2 GLY A 182 10.142 10.753 -1.941 1.00 71.12 H new ATOM 0 HA3 GLY A 182 11.501 11.835 -2.172 1.00 71.12 H new ATOM 200 N GLY A 183 8.645 11.708 -3.860 1.00 41.10 N ATOM 201 CA GLY A 183 7.705 12.423 -4.723 1.00 63.44 C ATOM 202 C GLY A 183 7.150 13.674 -4.054 1.00 62.52 C ATOM 203 O GLY A 183 7.332 14.789 -4.557 1.00 52.52 O ATOM 0 H GLY A 183 8.300 10.802 -3.543 1.00 41.10 H new ATOM 0 HA2 GLY A 183 8.205 12.700 -5.651 1.00 63.44 H new ATOM 0 HA3 GLY A 183 6.882 11.760 -4.990 1.00 63.44 H new ATOM 207 N SER A 184 6.510 13.474 -2.887 1.00 22.44 N ATOM 208 CA SER A 184 5.888 14.552 -2.106 1.00 14.20 C ATOM 209 C SER A 184 5.590 14.055 -0.676 1.00 51.52 C ATOM 210 O SER A 184 4.612 13.325 -0.447 1.00 52.35 O ATOM 211 CB SER A 184 4.602 15.068 -2.814 1.00 33.02 C ATOM 212 OG SER A 184 3.735 14.002 -3.149 1.00 42.24 O ATOM 0 H SER A 184 6.411 12.553 -2.459 1.00 22.44 H new ATOM 0 HA SER A 184 6.579 15.392 -2.037 1.00 14.20 H new ATOM 0 HB2 SER A 184 4.083 15.770 -2.162 1.00 33.02 H new ATOM 0 HB3 SER A 184 4.876 15.614 -3.717 1.00 33.02 H new ATOM 0 HG SER A 184 3.700 13.363 -2.407 1.00 42.24 H new ATOM 218 N GLY A 185 6.481 14.416 0.269 1.00 53.43 N ATOM 219 CA GLY A 185 6.331 14.083 1.686 1.00 4.34 C ATOM 220 C GLY A 185 5.308 14.971 2.381 1.00 71.13 C ATOM 221 O GLY A 185 5.669 15.970 3.020 1.00 3.54 O ATOM 0 H GLY A 185 7.326 14.949 0.062 1.00 53.43 H new ATOM 0 HA2 GLY A 185 6.029 13.040 1.782 1.00 4.34 H new ATOM 0 HA3 GLY A 185 7.295 14.183 2.185 1.00 4.34 H new ATOM 225 N GLY A 186 4.022 14.615 2.218 1.00 70.51 N ATOM 226 CA GLY A 186 2.916 15.371 2.802 1.00 42.12 C ATOM 227 C GLY A 186 1.652 14.526 2.955 1.00 14.05 C ATOM 228 O GLY A 186 0.938 14.282 1.970 1.00 75.43 O ATOM 0 H GLY A 186 3.728 13.800 1.680 1.00 70.51 H new ATOM 0 HA2 GLY A 186 3.215 15.753 3.778 1.00 42.12 H new ATOM 0 HA3 GLY A 186 2.699 16.235 2.175 1.00 42.12 H new ATOM 232 N SER A 187 1.393 14.058 4.192 1.00 21.42 N ATOM 233 CA SER A 187 0.179 13.299 4.538 1.00 61.20 C ATOM 234 C SER A 187 -0.930 14.270 4.995 1.00 50.53 C ATOM 235 O SER A 187 -0.886 14.812 6.107 1.00 33.32 O ATOM 236 CB SER A 187 0.490 12.263 5.641 1.00 21.43 C ATOM 237 OG SER A 187 1.471 11.339 5.205 1.00 13.30 O ATOM 0 H SER A 187 2.024 14.197 4.981 1.00 21.42 H new ATOM 0 HA SER A 187 -0.170 12.760 3.657 1.00 61.20 H new ATOM 0 HB2 SER A 187 0.840 12.775 6.538 1.00 21.43 H new ATOM 0 HB3 SER A 187 -0.421 11.731 5.913 1.00 21.43 H new ATOM 0 HG SER A 187 1.653 10.694 5.920 1.00 13.30 H new ATOM 243 N GLY A 188 -1.877 14.517 4.087 1.00 63.25 N ATOM 244 CA GLY A 188 -3.048 15.351 4.346 1.00 24.31 C ATOM 245 C GLY A 188 -3.858 15.541 3.069 1.00 5.22 C ATOM 246 O GLY A 188 -3.275 15.667 1.981 1.00 5.43 O ATOM 0 H GLY A 188 -1.850 14.138 3.140 1.00 63.25 H new ATOM 0 HA2 GLY A 188 -3.669 14.888 5.113 1.00 24.31 H new ATOM 0 HA3 GLY A 188 -2.734 16.320 4.732 1.00 24.31 H new ATOM 250 N GLY A 189 -5.193 15.547 3.189 1.00 10.14 N ATOM 251 CA GLY A 189 -6.077 15.694 2.033 1.00 1.05 C ATOM 252 C GLY A 189 -7.541 15.584 2.427 1.00 2.34 C ATOM 253 O GLY A 189 -7.926 16.055 3.500 1.00 54.54 O ATOM 0 H GLY A 189 -5.682 15.451 4.079 1.00 10.14 H new ATOM 0 HA2 GLY A 189 -5.899 16.660 1.559 1.00 1.05 H new ATOM 0 HA3 GLY A 189 -5.840 14.928 1.294 1.00 1.05 H new ATOM 257 N SER A 190 -8.350 14.973 1.548 1.00 1.43 N ATOM 258 CA SER A 190 -9.808 14.769 1.737 1.00 35.50 C ATOM 259 C SER A 190 -10.270 13.600 0.853 1.00 52.52 C ATOM 260 O SER A 190 -9.514 13.158 -0.022 1.00 62.12 O ATOM 261 CB SER A 190 -10.614 16.052 1.393 1.00 62.13 C ATOM 262 OG SER A 190 -10.307 17.127 2.271 1.00 3.11 O ATOM 0 H SER A 190 -8.008 14.596 0.664 1.00 1.43 H new ATOM 0 HA SER A 190 -9.993 14.539 2.786 1.00 35.50 H new ATOM 0 HB2 SER A 190 -10.400 16.350 0.367 1.00 62.13 H new ATOM 0 HB3 SER A 190 -11.681 15.835 1.446 1.00 62.13 H new ATOM 0 HG SER A 190 -9.588 16.857 2.879 1.00 3.11 H new ATOM 268 N GLN A 191 -11.519 13.112 1.092 1.00 10.35 N ATOM 269 CA GLN A 191 -12.088 11.915 0.410 1.00 3.54 C ATOM 270 C GLN A 191 -11.205 10.669 0.664 1.00 61.54 C ATOM 271 O GLN A 191 -11.230 9.698 -0.102 1.00 50.15 O ATOM 272 CB GLN A 191 -12.266 12.174 -1.116 1.00 11.35 C ATOM 273 CG GLN A 191 -13.313 13.244 -1.496 1.00 30.40 C ATOM 274 CD GLN A 191 -13.356 13.567 -2.998 1.00 42.32 C ATOM 275 OE1 GLN A 191 -13.661 14.694 -3.403 1.00 44.50 O ATOM 276 NE2 GLN A 191 -13.084 12.583 -3.845 1.00 0.22 N ATOM 0 H GLN A 191 -12.159 13.537 1.763 1.00 10.35 H new ATOM 0 HA GLN A 191 -13.074 11.721 0.831 1.00 3.54 H new ATOM 0 HB2 GLN A 191 -11.303 12.472 -1.530 1.00 11.35 H new ATOM 0 HB3 GLN A 191 -12.543 11.235 -1.595 1.00 11.35 H new ATOM 0 HG2 GLN A 191 -14.299 12.903 -1.179 1.00 30.40 H new ATOM 0 HG3 GLN A 191 -13.100 14.159 -0.943 1.00 30.40 H new ATOM 0 HE21 GLN A 191 -12.834 11.660 -3.491 1.00 0.22 H new ATOM 0 HE22 GLN A 191 -13.125 12.750 -4.850 1.00 0.22 H new ATOM 285 N ASP A 192 -10.456 10.706 1.781 1.00 32.23 N ATOM 286 CA ASP A 192 -9.355 9.775 2.052 1.00 40.50 C ATOM 287 C ASP A 192 -9.839 8.413 2.575 1.00 41.23 C ATOM 288 O ASP A 192 -10.983 8.259 3.023 1.00 43.31 O ATOM 289 CB ASP A 192 -8.337 10.415 3.034 1.00 44.34 C ATOM 290 CG ASP A 192 -8.947 10.825 4.388 1.00 51.34 C ATOM 291 OD1 ASP A 192 -8.847 10.056 5.370 1.00 30.21 O ATOM 292 OD2 ASP A 192 -9.551 11.921 4.468 1.00 31.52 O ATOM 0 H ASP A 192 -10.602 11.389 2.524 1.00 32.23 H new ATOM 0 HA ASP A 192 -8.860 9.581 1.100 1.00 40.50 H new ATOM 0 HB2 ASP A 192 -7.525 9.709 3.211 1.00 44.34 H new ATOM 0 HB3 ASP A 192 -7.897 11.295 2.564 1.00 44.34 H new ATOM 297 N LEU A 193 -8.931 7.434 2.505 1.00 61.44 N ATOM 298 CA LEU A 193 -9.148 6.059 2.978 1.00 43.44 C ATOM 299 C LEU A 193 -7.979 5.614 3.860 1.00 11.20 C ATOM 300 O LEU A 193 -6.831 6.026 3.651 1.00 70.14 O ATOM 301 CB LEU A 193 -9.333 5.078 1.771 1.00 32.13 C ATOM 302 CG LEU A 193 -10.783 4.619 1.463 1.00 1.03 C ATOM 303 CD1 LEU A 193 -10.810 3.712 0.220 1.00 2.45 C ATOM 304 CD2 LEU A 193 -11.395 3.906 2.694 1.00 53.11 C ATOM 0 H LEU A 193 -8.002 7.577 2.109 1.00 61.44 H new ATOM 0 HA LEU A 193 -10.062 6.038 3.572 1.00 43.44 H new ATOM 0 HB2 LEU A 193 -8.931 5.557 0.878 1.00 32.13 H new ATOM 0 HB3 LEU A 193 -8.727 4.191 1.957 1.00 32.13 H new ATOM 0 HG LEU A 193 -11.391 5.498 1.247 1.00 1.03 H new ATOM 0 HD11 LEU A 193 -11.835 3.400 0.019 1.00 2.45 H new ATOM 0 HD12 LEU A 193 -10.423 4.260 -0.639 1.00 2.45 H new ATOM 0 HD13 LEU A 193 -10.191 2.832 0.398 1.00 2.45 H new ATOM 0 HD21 LEU A 193 -12.412 3.590 2.463 1.00 53.11 H new ATOM 0 HD22 LEU A 193 -10.792 3.034 2.946 1.00 53.11 H new ATOM 0 HD23 LEU A 193 -11.412 4.592 3.541 1.00 53.11 H new ATOM 316 N TYR A 194 -8.294 4.772 4.852 1.00 3.41 N ATOM 317 CA TYR A 194 -7.293 4.071 5.654 1.00 60.24 C ATOM 318 C TYR A 194 -7.417 2.568 5.385 1.00 10.05 C ATOM 319 O TYR A 194 -8.496 1.992 5.565 1.00 51.42 O ATOM 320 CB TYR A 194 -7.478 4.385 7.159 1.00 64.11 C ATOM 321 CG TYR A 194 -6.414 3.748 8.077 1.00 71.44 C ATOM 322 CD1 TYR A 194 -5.058 3.758 7.723 1.00 11.32 C ATOM 323 CD2 TYR A 194 -6.756 3.161 9.301 1.00 31.23 C ATOM 324 CE1 TYR A 194 -4.094 3.214 8.547 1.00 54.31 C ATOM 325 CE2 TYR A 194 -5.788 2.611 10.125 1.00 54.04 C ATOM 326 CZ TYR A 194 -4.463 2.643 9.742 1.00 5.22 C ATOM 327 OH TYR A 194 -3.497 2.108 10.565 1.00 53.33 O ATOM 0 H TYR A 194 -9.255 4.559 5.119 1.00 3.41 H new ATOM 0 HA TYR A 194 -6.295 4.408 5.375 1.00 60.24 H new ATOM 0 HB2 TYR A 194 -7.460 5.466 7.297 1.00 64.11 H new ATOM 0 HB3 TYR A 194 -8.464 4.040 7.471 1.00 64.11 H new ATOM 0 HD1 TYR A 194 -4.761 4.201 6.784 1.00 11.32 H new ATOM 0 HD2 TYR A 194 -7.791 3.137 9.608 1.00 31.23 H new ATOM 0 HE1 TYR A 194 -3.055 3.237 8.255 1.00 54.31 H new ATOM 0 HE2 TYR A 194 -6.070 2.159 11.064 1.00 54.04 H new ATOM 0 HH TYR A 194 -3.385 1.156 10.362 1.00 53.33 H new ATOM 337 N ALA A 195 -6.314 1.952 4.939 1.00 10.43 N ATOM 338 CA ALA A 195 -6.269 0.506 4.626 1.00 21.43 C ATOM 339 C ALA A 195 -5.019 -0.142 5.247 1.00 65.31 C ATOM 340 O ALA A 195 -4.319 0.488 6.048 1.00 70.11 O ATOM 341 CB ALA A 195 -6.347 0.277 3.101 1.00 73.22 C ATOM 0 H ALA A 195 -5.429 2.434 4.784 1.00 10.43 H new ATOM 0 HA ALA A 195 -7.139 0.021 5.069 1.00 21.43 H new ATOM 0 HB1 ALA A 195 -6.312 -0.792 2.891 1.00 73.22 H new ATOM 0 HB2 ALA A 195 -7.279 0.692 2.718 1.00 73.22 H new ATOM 0 HB3 ALA A 195 -5.504 0.769 2.616 1.00 73.22 H new ATOM 347 N THR A 196 -4.784 -1.425 4.920 1.00 71.02 N ATOM 348 CA THR A 196 -3.610 -2.187 5.382 1.00 23.40 C ATOM 349 C THR A 196 -2.828 -2.751 4.168 1.00 63.24 C ATOM 350 O THR A 196 -3.438 -3.267 3.221 1.00 54.24 O ATOM 351 CB THR A 196 -4.078 -3.369 6.301 1.00 43.23 C ATOM 352 OG1 THR A 196 -4.958 -2.870 7.319 1.00 63.22 O ATOM 353 CG2 THR A 196 -2.897 -4.097 6.968 1.00 34.40 C ATOM 0 H THR A 196 -5.409 -1.967 4.323 1.00 71.02 H new ATOM 0 HA THR A 196 -2.956 -1.523 5.947 1.00 23.40 H new ATOM 0 HB THR A 196 -4.595 -4.087 5.665 1.00 43.23 H new ATOM 0 HG1 THR A 196 -5.250 -3.610 7.891 1.00 63.22 H new ATOM 0 HG21 THR A 196 -3.275 -4.906 7.593 1.00 34.40 H new ATOM 0 HG22 THR A 196 -2.242 -4.508 6.200 1.00 34.40 H new ATOM 0 HG23 THR A 196 -2.337 -3.393 7.584 1.00 34.40 H new ATOM 361 N LEU A 197 -1.488 -2.636 4.201 1.00 35.31 N ATOM 362 CA LEU A 197 -0.602 -3.298 3.230 1.00 30.45 C ATOM 363 C LEU A 197 -0.121 -4.610 3.856 1.00 54.13 C ATOM 364 O LEU A 197 0.652 -4.585 4.820 1.00 11.32 O ATOM 365 CB LEU A 197 0.621 -2.400 2.878 1.00 12.43 C ATOM 366 CG LEU A 197 1.388 -2.777 1.571 1.00 21.42 C ATOM 367 CD1 LEU A 197 0.448 -2.776 0.355 1.00 43.12 C ATOM 368 CD2 LEU A 197 2.584 -1.842 1.343 1.00 23.02 C ATOM 0 H LEU A 197 -0.991 -2.083 4.900 1.00 35.31 H new ATOM 0 HA LEU A 197 -1.148 -3.484 2.305 1.00 30.45 H new ATOM 0 HB2 LEU A 197 0.278 -1.369 2.791 1.00 12.43 H new ATOM 0 HB3 LEU A 197 1.323 -2.433 3.711 1.00 12.43 H new ATOM 0 HG LEU A 197 1.773 -3.789 1.693 1.00 21.42 H new ATOM 0 HD11 LEU A 197 1.011 -3.042 -0.540 1.00 43.12 H new ATOM 0 HD12 LEU A 197 -0.350 -3.502 0.511 1.00 43.12 H new ATOM 0 HD13 LEU A 197 0.016 -1.783 0.230 1.00 43.12 H new ATOM 0 HD21 LEU A 197 3.100 -2.128 0.426 1.00 23.02 H new ATOM 0 HD22 LEU A 197 2.231 -0.814 1.256 1.00 23.02 H new ATOM 0 HD23 LEU A 197 3.272 -1.919 2.185 1.00 23.02 H new ATOM 380 N ASP A 198 -0.606 -5.742 3.341 1.00 33.21 N ATOM 381 CA ASP A 198 -0.223 -7.057 3.866 1.00 3.05 C ATOM 382 C ASP A 198 1.081 -7.496 3.187 1.00 41.53 C ATOM 383 O ASP A 198 1.064 -7.953 2.038 1.00 50.24 O ATOM 384 CB ASP A 198 -1.352 -8.095 3.623 1.00 51.12 C ATOM 385 CG ASP A 198 -1.058 -9.452 4.293 1.00 43.33 C ATOM 386 OD1 ASP A 198 -0.568 -10.388 3.620 1.00 2.34 O ATOM 387 OD2 ASP A 198 -1.312 -9.583 5.507 1.00 61.42 O ATOM 0 H ASP A 198 -1.264 -5.776 2.562 1.00 33.21 H new ATOM 0 HA ASP A 198 -0.067 -6.992 4.943 1.00 3.05 H new ATOM 0 HB2 ASP A 198 -2.293 -7.700 4.006 1.00 51.12 H new ATOM 0 HB3 ASP A 198 -1.481 -8.243 2.551 1.00 51.12 H new ATOM 392 N VAL A 199 2.211 -7.313 3.891 1.00 41.42 N ATOM 393 CA VAL A 199 3.532 -7.723 3.410 1.00 34.34 C ATOM 394 C VAL A 199 4.016 -8.883 4.287 1.00 11.12 C ATOM 395 O VAL A 199 4.264 -8.673 5.469 1.00 20.15 O ATOM 396 CB VAL A 199 4.605 -6.562 3.457 1.00 25.43 C ATOM 397 CG1 VAL A 199 5.899 -6.981 2.734 1.00 54.53 C ATOM 398 CG2 VAL A 199 4.070 -5.230 2.904 1.00 63.24 C ATOM 0 H VAL A 199 2.229 -6.875 4.812 1.00 41.42 H new ATOM 0 HA VAL A 199 3.428 -8.012 2.364 1.00 34.34 H new ATOM 0 HB VAL A 199 4.833 -6.390 4.509 1.00 25.43 H new ATOM 0 HG11 VAL A 199 6.622 -6.166 2.780 1.00 54.53 H new ATOM 0 HG12 VAL A 199 6.317 -7.864 3.218 1.00 54.53 H new ATOM 0 HG13 VAL A 199 5.676 -7.210 1.692 1.00 54.53 H new ATOM 0 HG21 VAL A 199 4.851 -4.472 2.962 1.00 63.24 H new ATOM 0 HG22 VAL A 199 3.769 -5.362 1.865 1.00 63.24 H new ATOM 0 HG23 VAL A 199 3.210 -4.911 3.493 1.00 63.24 H new ATOM 408 N PRO A 200 4.139 -10.129 3.752 1.00 72.35 N ATOM 409 CA PRO A 200 4.758 -11.233 4.505 1.00 61.53 C ATOM 410 C PRO A 200 6.261 -10.970 4.720 1.00 34.34 C ATOM 411 O PRO A 200 6.897 -10.293 3.898 1.00 53.05 O ATOM 412 CB PRO A 200 4.495 -12.467 3.615 1.00 10.24 C ATOM 413 CG PRO A 200 4.343 -11.917 2.236 1.00 4.03 C ATOM 414 CD PRO A 200 3.695 -10.559 2.400 1.00 31.03 C ATOM 0 HA PRO A 200 4.351 -11.361 5.508 1.00 61.53 H new ATOM 0 HB2 PRO A 200 5.320 -13.177 3.669 1.00 10.24 H new ATOM 0 HB3 PRO A 200 3.597 -12.998 3.930 1.00 10.24 H new ATOM 0 HG2 PRO A 200 5.310 -11.831 1.741 1.00 4.03 H new ATOM 0 HG3 PRO A 200 3.727 -12.572 1.620 1.00 4.03 H new ATOM 0 HD2 PRO A 200 4.022 -9.862 1.629 1.00 31.03 H new ATOM 0 HD3 PRO A 200 2.609 -10.621 2.334 1.00 31.03 H new ATOM 422 N ALA A 201 6.809 -11.520 5.824 1.00 62.44 N ATOM 423 CA ALA A 201 8.232 -11.383 6.188 1.00 51.13 C ATOM 424 C ALA A 201 9.203 -11.794 5.038 1.00 74.33 C ATOM 425 O ALA A 201 10.182 -11.072 4.808 1.00 24.43 O ATOM 426 CB ALA A 201 8.537 -12.155 7.491 1.00 65.33 C ATOM 0 H ALA A 201 6.272 -12.075 6.491 1.00 62.44 H new ATOM 0 HA ALA A 201 8.412 -10.322 6.362 1.00 51.13 H new ATOM 0 HB1 ALA A 201 9.591 -12.042 7.743 1.00 65.33 H new ATOM 0 HB2 ALA A 201 7.926 -11.757 8.301 1.00 65.33 H new ATOM 0 HB3 ALA A 201 8.309 -13.212 7.350 1.00 65.33 H new ATOM 432 N PRO A 202 8.959 -12.926 4.266 1.00 32.15 N ATOM 433 CA PRO A 202 9.775 -13.252 3.062 1.00 30.12 C ATOM 434 C PRO A 202 9.826 -12.102 2.003 1.00 51.34 C ATOM 435 O PRO A 202 10.918 -11.622 1.675 1.00 65.22 O ATOM 436 CB PRO A 202 9.114 -14.542 2.491 1.00 45.44 C ATOM 437 CG PRO A 202 7.782 -14.658 3.177 1.00 71.25 C ATOM 438 CD PRO A 202 7.955 -14.012 4.530 1.00 32.11 C ATOM 0 HA PRO A 202 10.823 -13.393 3.325 1.00 30.12 H new ATOM 0 HB2 PRO A 202 8.992 -14.473 1.410 1.00 45.44 H new ATOM 0 HB3 PRO A 202 9.732 -15.418 2.687 1.00 45.44 H new ATOM 0 HG2 PRO A 202 7.002 -14.158 2.603 1.00 71.25 H new ATOM 0 HG3 PRO A 202 7.484 -15.702 3.278 1.00 71.25 H new ATOM 0 HD2 PRO A 202 7.015 -13.609 4.907 1.00 32.11 H new ATOM 0 HD3 PRO A 202 8.317 -14.723 5.272 1.00 32.11 H new ATOM 446 N ILE A 203 8.642 -11.642 1.510 1.00 54.44 N ATOM 447 CA ILE A 203 8.555 -10.562 0.484 1.00 45.43 C ATOM 448 C ILE A 203 9.140 -9.238 1.023 1.00 2.52 C ATOM 449 O ILE A 203 9.728 -8.448 0.264 1.00 53.23 O ATOM 450 CB ILE A 203 7.070 -10.349 -0.026 1.00 13.11 C ATOM 451 CG1 ILE A 203 6.571 -11.610 -0.812 1.00 12.35 C ATOM 452 CG2 ILE A 203 6.920 -9.061 -0.885 1.00 75.11 C ATOM 453 CD1 ILE A 203 5.151 -11.509 -1.365 1.00 75.02 C ATOM 0 H ILE A 203 7.735 -12.002 1.806 1.00 54.44 H new ATOM 0 HA ILE A 203 9.152 -10.882 -0.370 1.00 45.43 H new ATOM 0 HB ILE A 203 6.441 -10.216 0.855 1.00 13.11 H new ATOM 0 HG12 ILE A 203 7.254 -11.796 -1.640 1.00 12.35 H new ATOM 0 HG13 ILE A 203 6.626 -12.476 -0.152 1.00 12.35 H new ATOM 0 HG21 ILE A 203 5.885 -8.959 -1.211 1.00 75.11 H new ATOM 0 HG22 ILE A 203 7.200 -8.192 -0.290 1.00 75.11 H new ATOM 0 HG23 ILE A 203 7.570 -9.128 -1.757 1.00 75.11 H new ATOM 0 HD11 ILE A 203 4.899 -12.430 -1.891 1.00 75.02 H new ATOM 0 HD12 ILE A 203 4.451 -11.357 -0.544 1.00 75.02 H new ATOM 0 HD13 ILE A 203 5.088 -10.668 -2.055 1.00 75.02 H new ATOM 465 N ALA A 204 9.013 -9.031 2.343 1.00 43.44 N ATOM 466 CA ALA A 204 9.545 -7.844 3.017 1.00 35.14 C ATOM 467 C ALA A 204 11.082 -7.814 2.952 1.00 42.13 C ATOM 468 O ALA A 204 11.660 -6.777 2.615 1.00 3.22 O ATOM 469 CB ALA A 204 9.045 -7.789 4.463 1.00 33.22 C ATOM 0 H ALA A 204 8.539 -9.682 2.969 1.00 43.44 H new ATOM 0 HA ALA A 204 9.182 -6.957 2.498 1.00 35.14 H new ATOM 0 HB1 ALA A 204 9.447 -6.903 4.954 1.00 33.22 H new ATOM 0 HB2 ALA A 204 7.956 -7.745 4.470 1.00 33.22 H new ATOM 0 HB3 ALA A 204 9.376 -8.680 4.996 1.00 33.22 H new ATOM 475 N VAL A 205 11.719 -8.972 3.255 1.00 40.34 N ATOM 476 CA VAL A 205 13.195 -9.131 3.258 1.00 52.33 C ATOM 477 C VAL A 205 13.785 -9.015 1.842 1.00 70.30 C ATOM 478 O VAL A 205 14.709 -8.223 1.621 1.00 32.54 O ATOM 479 CB VAL A 205 13.622 -10.501 3.923 1.00 23.32 C ATOM 480 CG1 VAL A 205 15.120 -10.830 3.701 1.00 71.02 C ATOM 481 CG2 VAL A 205 13.289 -10.495 5.431 1.00 4.41 C ATOM 0 H VAL A 205 11.221 -9.826 3.505 1.00 40.34 H new ATOM 0 HA VAL A 205 13.601 -8.316 3.857 1.00 52.33 H new ATOM 0 HB VAL A 205 13.048 -11.286 3.430 1.00 23.32 H new ATOM 0 HG11 VAL A 205 15.358 -11.781 4.178 1.00 71.02 H new ATOM 0 HG12 VAL A 205 15.323 -10.900 2.632 1.00 71.02 H new ATOM 0 HG13 VAL A 205 15.734 -10.042 4.136 1.00 71.02 H new ATOM 0 HG21 VAL A 205 13.589 -11.445 5.874 1.00 4.41 H new ATOM 0 HG22 VAL A 205 13.826 -9.682 5.919 1.00 4.41 H new ATOM 0 HG23 VAL A 205 12.217 -10.354 5.566 1.00 4.41 H new ATOM 491 N VAL A 206 13.221 -9.768 0.884 1.00 23.30 N ATOM 492 CA VAL A 206 13.789 -9.865 -0.478 1.00 42.41 C ATOM 493 C VAL A 206 13.410 -8.627 -1.317 1.00 51.12 C ATOM 494 O VAL A 206 14.143 -8.235 -2.239 1.00 21.35 O ATOM 495 CB VAL A 206 13.323 -11.186 -1.203 1.00 33.13 C ATOM 496 CG1 VAL A 206 11.802 -11.191 -1.490 1.00 75.10 C ATOM 497 CG2 VAL A 206 14.151 -11.445 -2.485 1.00 65.20 C ATOM 0 H VAL A 206 12.374 -10.319 1.023 1.00 23.30 H new ATOM 0 HA VAL A 206 14.874 -9.901 -0.381 1.00 42.41 H new ATOM 0 HB VAL A 206 13.512 -12.012 -0.517 1.00 33.13 H new ATOM 0 HG11 VAL A 206 11.529 -12.120 -1.990 1.00 75.10 H new ATOM 0 HG12 VAL A 206 11.254 -11.110 -0.551 1.00 75.10 H new ATOM 0 HG13 VAL A 206 11.550 -10.347 -2.131 1.00 75.10 H new ATOM 0 HG21 VAL A 206 13.806 -12.362 -2.962 1.00 65.20 H new ATOM 0 HG22 VAL A 206 14.027 -10.609 -3.174 1.00 65.20 H new ATOM 0 HG23 VAL A 206 15.204 -11.546 -2.224 1.00 65.20 H new ATOM 507 N GLY A 207 12.283 -7.996 -0.955 1.00 75.24 N ATOM 508 CA GLY A 207 11.770 -6.848 -1.685 1.00 34.24 C ATOM 509 C GLY A 207 11.086 -7.262 -2.980 1.00 62.21 C ATOM 510 O GLY A 207 11.645 -7.078 -4.073 1.00 73.11 O ATOM 0 H GLY A 207 11.713 -8.271 -0.155 1.00 75.24 H new ATOM 0 HA2 GLY A 207 11.063 -6.305 -1.058 1.00 34.24 H new ATOM 0 HA3 GLY A 207 12.589 -6.164 -1.909 1.00 34.24 H new ATOM 514 N GLY A 208 9.887 -7.853 -2.843 1.00 14.42 N ATOM 515 CA GLY A 208 9.098 -8.317 -3.988 1.00 42.14 C ATOM 516 C GLY A 208 7.937 -7.379 -4.285 1.00 55.55 C ATOM 517 O GLY A 208 8.138 -6.165 -4.392 1.00 65.25 O ATOM 0 H GLY A 208 9.443 -8.020 -1.940 1.00 14.42 H new ATOM 0 HA2 GLY A 208 9.739 -8.392 -4.866 1.00 42.14 H new ATOM 0 HA3 GLY A 208 8.716 -9.318 -3.786 1.00 42.14 H new ATOM 521 N LYS A 209 6.722 -7.932 -4.431 1.00 44.33 N ATOM 522 CA LYS A 209 5.480 -7.147 -4.560 1.00 34.20 C ATOM 523 C LYS A 209 4.415 -7.693 -3.617 1.00 2.53 C ATOM 524 O LYS A 209 4.450 -8.866 -3.244 1.00 32.22 O ATOM 525 CB LYS A 209 4.929 -7.138 -6.023 1.00 52.05 C ATOM 526 CG LYS A 209 5.243 -5.863 -6.826 1.00 44.14 C ATOM 527 CD LYS A 209 4.439 -5.800 -8.133 1.00 0.44 C ATOM 528 CE LYS A 209 4.847 -6.882 -9.132 1.00 14.35 C ATOM 529 NZ LYS A 209 3.904 -6.936 -10.280 1.00 13.53 N ATOM 0 H LYS A 209 6.571 -8.940 -4.463 1.00 44.33 H new ATOM 0 HA LYS A 209 5.723 -6.119 -4.293 1.00 34.20 H new ATOM 0 HB2 LYS A 209 5.340 -7.996 -6.556 1.00 52.05 H new ATOM 0 HB3 LYS A 209 3.848 -7.272 -5.989 1.00 52.05 H new ATOM 0 HG2 LYS A 209 5.019 -4.986 -6.218 1.00 44.14 H new ATOM 0 HG3 LYS A 209 6.309 -5.829 -7.053 1.00 44.14 H new ATOM 0 HD2 LYS A 209 3.378 -5.903 -7.907 1.00 0.44 H new ATOM 0 HD3 LYS A 209 4.574 -4.820 -8.590 1.00 0.44 H new ATOM 0 HE2 LYS A 209 5.855 -6.684 -9.495 1.00 14.35 H new ATOM 0 HE3 LYS A 209 4.873 -7.851 -8.633 1.00 14.35 H new ATOM 0 HZ1 LYS A 209 4.242 -7.632 -10.975 1.00 13.53 H new ATOM 0 HZ2 LYS A 209 2.961 -7.215 -9.942 1.00 13.53 H new ATOM 0 HZ3 LYS A 209 3.848 -5.999 -10.728 1.00 13.53 H new ATOM 543 N VAL A 210 3.458 -6.819 -3.263 1.00 1.12 N ATOM 544 CA VAL A 210 2.261 -7.185 -2.465 1.00 21.04 C ATOM 545 C VAL A 210 1.047 -6.371 -2.930 1.00 62.52 C ATOM 546 O VAL A 210 1.199 -5.286 -3.504 1.00 63.14 O ATOM 547 CB VAL A 210 2.446 -6.949 -0.920 1.00 21.24 C ATOM 548 CG1 VAL A 210 3.506 -7.884 -0.317 1.00 75.24 C ATOM 549 CG2 VAL A 210 2.758 -5.473 -0.620 1.00 3.12 C ATOM 0 H VAL A 210 3.487 -5.832 -3.520 1.00 1.12 H new ATOM 0 HA VAL A 210 2.109 -8.252 -2.627 1.00 21.04 H new ATOM 0 HB VAL A 210 1.499 -7.195 -0.439 1.00 21.24 H new ATOM 0 HG11 VAL A 210 3.601 -7.686 0.751 1.00 75.24 H new ATOM 0 HG12 VAL A 210 3.205 -8.921 -0.469 1.00 75.24 H new ATOM 0 HG13 VAL A 210 4.465 -7.709 -0.805 1.00 75.24 H new ATOM 0 HG21 VAL A 210 2.881 -5.338 0.455 1.00 3.12 H new ATOM 0 HG22 VAL A 210 3.677 -5.185 -1.129 1.00 3.12 H new ATOM 0 HG23 VAL A 210 1.937 -4.849 -0.972 1.00 3.12 H new ATOM 559 N ARG A 211 -0.149 -6.900 -2.638 1.00 41.34 N ATOM 560 CA ARG A 211 -1.427 -6.238 -2.941 1.00 64.22 C ATOM 561 C ARG A 211 -1.773 -5.184 -1.867 1.00 65.40 C ATOM 562 O ARG A 211 -1.459 -5.353 -0.683 1.00 35.11 O ATOM 563 CB ARG A 211 -2.562 -7.295 -3.014 1.00 40.32 C ATOM 564 CG ARG A 211 -3.952 -6.706 -3.346 1.00 23.25 C ATOM 565 CD ARG A 211 -5.097 -7.699 -3.148 1.00 1.42 C ATOM 566 NE ARG A 211 -4.967 -8.879 -4.029 1.00 20.00 N ATOM 567 CZ ARG A 211 -5.621 -10.043 -3.870 1.00 34.51 C ATOM 568 NH1 ARG A 211 -6.473 -10.220 -2.859 1.00 71.22 N ATOM 569 NH2 ARG A 211 -5.420 -11.027 -4.744 1.00 44.42 N ATOM 0 H ARG A 211 -0.259 -7.806 -2.182 1.00 41.34 H new ATOM 0 HA ARG A 211 -1.330 -5.734 -3.902 1.00 64.22 H new ATOM 0 HB2 ARG A 211 -2.304 -8.038 -3.769 1.00 40.32 H new ATOM 0 HB3 ARG A 211 -2.619 -7.818 -2.059 1.00 40.32 H new ATOM 0 HG2 ARG A 211 -4.127 -5.832 -2.719 1.00 23.25 H new ATOM 0 HG3 ARG A 211 -3.955 -6.362 -4.380 1.00 23.25 H new ATOM 0 HD2 ARG A 211 -5.119 -8.024 -2.108 1.00 1.42 H new ATOM 0 HD3 ARG A 211 -6.046 -7.202 -3.346 1.00 1.42 H new ATOM 0 HE ARG A 211 -4.330 -8.804 -4.822 1.00 20.00 H new ATOM 0 HH11 ARG A 211 -6.637 -9.466 -2.192 1.00 71.22 H new ATOM 0 HH12 ARG A 211 -6.961 -11.109 -2.753 1.00 71.22 H new ATOM 0 HH21 ARG A 211 -4.776 -10.893 -5.523 1.00 44.42 H new ATOM 0 HH22 ARG A 211 -5.910 -11.915 -4.634 1.00 44.42 H new ATOM 583 N ALA A 212 -2.432 -4.108 -2.316 1.00 22.45 N ATOM 584 CA ALA A 212 -3.035 -3.081 -1.461 1.00 2.22 C ATOM 585 C ALA A 212 -4.539 -3.004 -1.783 1.00 74.02 C ATOM 586 O ALA A 212 -4.911 -2.870 -2.956 1.00 23.52 O ATOM 587 CB ALA A 212 -2.351 -1.729 -1.715 1.00 75.12 C ATOM 0 H ALA A 212 -2.563 -3.924 -3.311 1.00 22.45 H new ATOM 0 HA ALA A 212 -2.903 -3.333 -0.409 1.00 2.22 H new ATOM 0 HB1 ALA A 212 -2.802 -0.968 -1.078 1.00 75.12 H new ATOM 0 HB2 ALA A 212 -1.288 -1.810 -1.487 1.00 75.12 H new ATOM 0 HB3 ALA A 212 -2.477 -1.448 -2.761 1.00 75.12 H new ATOM 593 N MET A 213 -5.394 -3.141 -0.755 1.00 42.23 N ATOM 594 CA MET A 213 -6.859 -2.985 -0.900 1.00 62.33 C ATOM 595 C MET A 213 -7.222 -1.533 -1.305 1.00 51.13 C ATOM 596 O MET A 213 -6.729 -0.564 -0.710 1.00 12.33 O ATOM 597 CB MET A 213 -7.582 -3.385 0.419 1.00 75.01 C ATOM 598 CG MET A 213 -9.109 -3.180 0.388 1.00 43.42 C ATOM 599 SD MET A 213 -9.896 -4.013 -1.015 1.00 13.50 S ATOM 600 CE MET A 213 -11.593 -3.439 -0.887 1.00 43.04 C ATOM 0 H MET A 213 -5.096 -3.361 0.195 1.00 42.23 H new ATOM 0 HA MET A 213 -7.197 -3.651 -1.694 1.00 62.33 H new ATOM 0 HB2 MET A 213 -7.371 -4.433 0.632 1.00 75.01 H new ATOM 0 HB3 MET A 213 -7.165 -2.802 1.240 1.00 75.01 H new ATOM 0 HG2 MET A 213 -9.541 -3.554 1.316 1.00 43.42 H new ATOM 0 HG3 MET A 213 -9.328 -2.113 0.342 1.00 43.42 H new ATOM 0 HE1 MET A 213 -12.110 -3.617 -1.830 1.00 43.04 H new ATOM 0 HE2 MET A 213 -12.100 -3.979 -0.088 1.00 43.04 H new ATOM 0 HE3 MET A 213 -11.600 -2.372 -0.665 1.00 43.04 H new ATOM 610 N THR A 214 -8.075 -1.420 -2.340 1.00 2.33 N ATOM 611 CA THR A 214 -8.513 -0.139 -2.937 1.00 60.32 C ATOM 612 C THR A 214 -10.046 -0.190 -3.166 1.00 15.45 C ATOM 613 O THR A 214 -10.710 -1.119 -2.719 1.00 23.01 O ATOM 614 CB THR A 214 -7.757 0.149 -4.297 1.00 64.52 C ATOM 615 OG1 THR A 214 -6.549 -0.631 -4.368 1.00 44.03 O ATOM 616 CG2 THR A 214 -7.398 1.639 -4.477 1.00 73.52 C ATOM 0 H THR A 214 -8.489 -2.233 -2.796 1.00 2.33 H new ATOM 0 HA THR A 214 -8.270 0.674 -2.253 1.00 60.32 H new ATOM 0 HB THR A 214 -8.442 -0.130 -5.097 1.00 64.52 H new ATOM 0 HG1 THR A 214 -6.537 -1.139 -5.206 1.00 44.03 H new ATOM 0 HG21 THR A 214 -6.881 1.777 -5.427 1.00 73.52 H new ATOM 0 HG22 THR A 214 -8.310 2.236 -4.470 1.00 73.52 H new ATOM 0 HG23 THR A 214 -6.749 1.958 -3.661 1.00 73.52 H new ATOM 624 N LEU A 215 -10.580 0.811 -3.873 1.00 4.41 N ATOM 625 CA LEU A 215 -12.035 1.021 -4.055 1.00 35.22 C ATOM 626 C LEU A 215 -12.692 -0.144 -4.824 1.00 60.01 C ATOM 627 O LEU A 215 -13.441 -0.960 -4.276 1.00 61.01 O ATOM 628 CB LEU A 215 -12.241 2.310 -4.901 1.00 1.04 C ATOM 629 CG LEU A 215 -11.301 3.483 -4.579 1.00 42.02 C ATOM 630 CD1 LEU A 215 -11.316 4.511 -5.716 1.00 52.23 C ATOM 631 CD2 LEU A 215 -11.637 4.073 -3.210 1.00 54.55 C ATOM 0 H LEU A 215 -10.011 1.514 -4.346 1.00 4.41 H new ATOM 0 HA LEU A 215 -12.490 1.094 -3.067 1.00 35.22 H new ATOM 0 HB2 LEU A 215 -12.122 2.053 -5.954 1.00 1.04 H new ATOM 0 HB3 LEU A 215 -13.269 2.647 -4.769 1.00 1.04 H new ATOM 0 HG LEU A 215 -10.274 3.124 -4.511 1.00 42.02 H new ATOM 0 HD11 LEU A 215 -10.645 5.334 -5.471 1.00 52.23 H new ATOM 0 HD12 LEU A 215 -10.986 4.036 -6.640 1.00 52.23 H new ATOM 0 HD13 LEU A 215 -12.328 4.894 -5.847 1.00 52.23 H new ATOM 0 HD21 LEU A 215 -10.963 4.903 -2.996 1.00 54.55 H new ATOM 0 HD22 LEU A 215 -12.666 4.433 -3.211 1.00 54.55 H new ATOM 0 HD23 LEU A 215 -11.522 3.305 -2.445 1.00 54.55 H new ATOM 643 N GLU A 216 -12.312 -0.197 -6.101 1.00 52.31 N ATOM 644 CA GLU A 216 -12.984 -0.948 -7.169 1.00 75.13 C ATOM 645 C GLU A 216 -12.271 -2.291 -7.369 1.00 21.43 C ATOM 646 O GLU A 216 -12.902 -3.344 -7.557 1.00 21.53 O ATOM 647 CB GLU A 216 -12.904 -0.071 -8.454 1.00 43.41 C ATOM 648 CG GLU A 216 -13.585 1.317 -8.331 1.00 52.43 C ATOM 649 CD GLU A 216 -13.183 2.290 -9.455 1.00 0.11 C ATOM 650 OE1 GLU A 216 -11.978 2.614 -9.560 1.00 21.11 O ATOM 651 OE2 GLU A 216 -14.052 2.748 -10.227 1.00 3.52 O ATOM 0 H GLU A 216 -11.490 0.305 -6.437 1.00 52.31 H new ATOM 0 HA GLU A 216 -14.025 -1.160 -6.925 1.00 75.13 H new ATOM 0 HB2 GLU A 216 -11.856 0.075 -8.714 1.00 43.41 H new ATOM 0 HB3 GLU A 216 -13.364 -0.615 -9.279 1.00 43.41 H new ATOM 0 HG2 GLU A 216 -14.667 1.186 -8.342 1.00 52.43 H new ATOM 0 HG3 GLU A 216 -13.327 1.757 -7.368 1.00 52.43 H new ATOM 658 N GLY A 217 -10.938 -2.216 -7.289 1.00 22.12 N ATOM 659 CA GLY A 217 -10.054 -3.359 -7.467 1.00 13.20 C ATOM 660 C GLY A 217 -8.812 -3.245 -6.599 1.00 12.21 C ATOM 661 O GLY A 217 -8.798 -2.449 -5.658 1.00 2.44 O ATOM 0 H GLY A 217 -10.442 -1.346 -7.096 1.00 22.12 H new ATOM 0 HA2 GLY A 217 -10.589 -4.276 -7.219 1.00 13.20 H new ATOM 0 HA3 GLY A 217 -9.761 -3.434 -8.514 1.00 13.20 H new ATOM 665 N PRO A 218 -7.754 -4.063 -6.863 1.00 51.15 N ATOM 666 CA PRO A 218 -6.502 -4.014 -6.097 1.00 3.14 C ATOM 667 C PRO A 218 -5.373 -3.170 -6.744 1.00 4.14 C ATOM 668 O PRO A 218 -5.299 -3.000 -7.967 1.00 51.25 O ATOM 669 CB PRO A 218 -6.126 -5.505 -6.044 1.00 23.34 C ATOM 670 CG PRO A 218 -6.649 -6.111 -7.332 1.00 71.41 C ATOM 671 CD PRO A 218 -7.717 -5.158 -7.874 1.00 20.34 C ATOM 0 HA PRO A 218 -6.630 -3.525 -5.131 1.00 3.14 H new ATOM 0 HB2 PRO A 218 -5.047 -5.633 -5.962 1.00 23.34 H new ATOM 0 HB3 PRO A 218 -6.571 -5.990 -5.175 1.00 23.34 H new ATOM 0 HG2 PRO A 218 -5.842 -6.237 -8.054 1.00 71.41 H new ATOM 0 HG3 PRO A 218 -7.071 -7.099 -7.150 1.00 71.41 H new ATOM 0 HD2 PRO A 218 -7.455 -4.782 -8.863 1.00 20.34 H new ATOM 0 HD3 PRO A 218 -8.685 -5.651 -7.967 1.00 20.34 H new ATOM 679 N VAL A 219 -4.521 -2.631 -5.867 1.00 23.11 N ATOM 680 CA VAL A 219 -3.207 -2.052 -6.214 1.00 74.01 C ATOM 681 C VAL A 219 -2.136 -3.129 -5.936 1.00 35.14 C ATOM 682 O VAL A 219 -2.412 -4.116 -5.252 1.00 52.24 O ATOM 683 CB VAL A 219 -2.931 -0.729 -5.371 1.00 40.30 C ATOM 684 CG1 VAL A 219 -1.482 -0.204 -5.472 1.00 32.31 C ATOM 685 CG2 VAL A 219 -3.907 0.402 -5.756 1.00 41.14 C ATOM 0 H VAL A 219 -4.725 -2.581 -4.869 1.00 23.11 H new ATOM 0 HA VAL A 219 -3.182 -1.764 -7.265 1.00 74.01 H new ATOM 0 HB VAL A 219 -3.093 -1.027 -4.335 1.00 40.30 H new ATOM 0 HG11 VAL A 219 -1.379 0.698 -4.869 1.00 32.31 H new ATOM 0 HG12 VAL A 219 -0.793 -0.965 -5.106 1.00 32.31 H new ATOM 0 HG13 VAL A 219 -1.250 0.026 -6.512 1.00 32.31 H new ATOM 0 HG21 VAL A 219 -3.689 1.289 -5.161 1.00 41.14 H new ATOM 0 HG22 VAL A 219 -3.792 0.638 -6.814 1.00 41.14 H new ATOM 0 HG23 VAL A 219 -4.931 0.080 -5.565 1.00 41.14 H new ATOM 695 N GLU A 220 -0.937 -2.954 -6.499 1.00 32.14 N ATOM 696 CA GLU A 220 0.216 -3.825 -6.227 1.00 60.23 C ATOM 697 C GLU A 220 1.488 -2.957 -6.242 1.00 42.25 C ATOM 698 O GLU A 220 1.790 -2.311 -7.256 1.00 65.31 O ATOM 699 CB GLU A 220 0.295 -4.986 -7.272 1.00 33.21 C ATOM 700 CG GLU A 220 0.694 -6.356 -6.681 1.00 65.12 C ATOM 701 CD GLU A 220 0.609 -7.496 -7.708 1.00 23.13 C ATOM 702 OE1 GLU A 220 1.592 -7.723 -8.451 1.00 23.11 O ATOM 703 OE2 GLU A 220 -0.452 -8.158 -7.794 1.00 33.55 O ATOM 0 H GLU A 220 -0.735 -2.203 -7.159 1.00 32.14 H new ATOM 0 HA GLU A 220 0.111 -4.294 -5.249 1.00 60.23 H new ATOM 0 HB2 GLU A 220 -0.674 -5.084 -7.761 1.00 33.21 H new ATOM 0 HB3 GLU A 220 1.015 -4.714 -8.044 1.00 33.21 H new ATOM 0 HG2 GLU A 220 1.711 -6.297 -6.294 1.00 65.12 H new ATOM 0 HG3 GLU A 220 0.044 -6.585 -5.836 1.00 65.12 H new ATOM 710 N VAL A 221 2.190 -2.923 -5.104 1.00 64.14 N ATOM 711 CA VAL A 221 3.387 -2.094 -4.913 1.00 10.41 C ATOM 712 C VAL A 221 4.628 -2.980 -4.780 1.00 31.31 C ATOM 713 O VAL A 221 4.566 -4.072 -4.190 1.00 54.02 O ATOM 714 CB VAL A 221 3.255 -1.185 -3.635 1.00 0.31 C ATOM 715 CG1 VAL A 221 3.203 -2.012 -2.325 1.00 13.45 C ATOM 716 CG2 VAL A 221 4.374 -0.118 -3.599 1.00 44.00 C ATOM 0 H VAL A 221 1.942 -3.474 -4.282 1.00 64.14 H new ATOM 0 HA VAL A 221 3.487 -1.451 -5.787 1.00 10.41 H new ATOM 0 HB VAL A 221 2.300 -0.665 -3.705 1.00 0.31 H new ATOM 0 HG11 VAL A 221 3.112 -1.338 -1.473 1.00 13.45 H new ATOM 0 HG12 VAL A 221 2.344 -2.682 -2.352 1.00 13.45 H new ATOM 0 HG13 VAL A 221 4.117 -2.598 -2.228 1.00 13.45 H new ATOM 0 HG21 VAL A 221 4.261 0.498 -2.707 1.00 44.00 H new ATOM 0 HG22 VAL A 221 5.346 -0.611 -3.579 1.00 44.00 H new ATOM 0 HG23 VAL A 221 4.304 0.512 -4.486 1.00 44.00 H new ATOM 726 N ALA A 222 5.743 -2.510 -5.351 1.00 23.41 N ATOM 727 CA ALA A 222 7.054 -3.119 -5.152 1.00 63.20 C ATOM 728 C ALA A 222 7.555 -2.768 -3.742 1.00 43.34 C ATOM 729 O ALA A 222 7.782 -1.588 -3.435 1.00 11.10 O ATOM 730 CB ALA A 222 8.028 -2.623 -6.225 1.00 1.14 C ATOM 0 H ALA A 222 5.757 -1.695 -5.964 1.00 23.41 H new ATOM 0 HA ALA A 222 6.983 -4.203 -5.242 1.00 63.20 H new ATOM 0 HB1 ALA A 222 9.005 -3.082 -6.070 1.00 1.14 H new ATOM 0 HB2 ALA A 222 7.652 -2.895 -7.211 1.00 1.14 H new ATOM 0 HB3 ALA A 222 8.122 -1.539 -6.158 1.00 1.14 H new ATOM 736 N VAL A 223 7.650 -3.785 -2.872 1.00 22.41 N ATOM 737 CA VAL A 223 8.205 -3.640 -1.523 1.00 52.42 C ATOM 738 C VAL A 223 9.747 -3.483 -1.619 1.00 50.24 C ATOM 739 O VAL A 223 10.366 -4.205 -2.394 1.00 45.24 O ATOM 740 CB VAL A 223 7.812 -4.879 -0.621 1.00 74.21 C ATOM 741 CG1 VAL A 223 8.412 -4.783 0.802 1.00 3.33 C ATOM 742 CG2 VAL A 223 6.273 -5.033 -0.550 1.00 5.10 C ATOM 0 H VAL A 223 7.342 -4.733 -3.088 1.00 22.41 H new ATOM 0 HA VAL A 223 7.788 -2.749 -1.053 1.00 52.42 H new ATOM 0 HB VAL A 223 8.237 -5.766 -1.091 1.00 74.21 H new ATOM 0 HG11 VAL A 223 8.114 -5.656 1.382 1.00 3.33 H new ATOM 0 HG12 VAL A 223 9.499 -4.745 0.737 1.00 3.33 H new ATOM 0 HG13 VAL A 223 8.046 -3.880 1.291 1.00 3.33 H new ATOM 0 HG21 VAL A 223 6.022 -5.890 0.075 1.00 5.10 H new ATOM 0 HG22 VAL A 223 5.836 -4.131 -0.121 1.00 5.10 H new ATOM 0 HG23 VAL A 223 5.876 -5.186 -1.553 1.00 5.10 H new ATOM 752 N PRO A 224 10.377 -2.491 -0.905 1.00 24.34 N ATOM 753 CA PRO A 224 11.857 -2.381 -0.792 1.00 65.34 C ATOM 754 C PRO A 224 12.443 -3.542 0.047 1.00 64.35 C ATOM 755 O PRO A 224 11.711 -4.161 0.832 1.00 15.11 O ATOM 756 CB PRO A 224 12.071 -0.992 -0.109 1.00 12.01 C ATOM 757 CG PRO A 224 10.749 -0.296 -0.222 1.00 41.31 C ATOM 758 CD PRO A 224 9.719 -1.386 -0.181 1.00 55.31 C ATOM 0 HA PRO A 224 12.366 -2.450 -1.753 1.00 65.34 H new ATOM 0 HB2 PRO A 224 12.369 -1.106 0.933 1.00 12.01 H new ATOM 0 HB3 PRO A 224 12.859 -0.425 -0.605 1.00 12.01 H new ATOM 0 HG2 PRO A 224 10.606 0.410 0.596 1.00 41.31 H new ATOM 0 HG3 PRO A 224 10.682 0.272 -1.150 1.00 41.31 H new ATOM 0 HD2 PRO A 224 9.468 -1.666 0.842 1.00 55.31 H new ATOM 0 HD3 PRO A 224 8.791 -1.083 -0.665 1.00 55.31 H new ATOM 766 N PRO A 225 13.760 -3.881 -0.114 1.00 3.14 N ATOM 767 CA PRO A 225 14.386 -4.970 0.658 1.00 33.51 C ATOM 768 C PRO A 225 14.451 -4.648 2.171 1.00 60.42 C ATOM 769 O PRO A 225 14.808 -3.529 2.565 1.00 42.44 O ATOM 770 CB PRO A 225 15.797 -5.121 0.030 1.00 44.35 C ATOM 771 CG PRO A 225 15.760 -4.341 -1.259 1.00 70.41 C ATOM 772 CD PRO A 225 14.738 -3.253 -1.043 1.00 10.24 C ATOM 0 HA PRO A 225 13.812 -5.895 0.605 1.00 33.51 H new ATOM 0 HB2 PRO A 225 16.566 -4.734 0.699 1.00 44.35 H new ATOM 0 HB3 PRO A 225 16.033 -6.169 -0.154 1.00 44.35 H new ATOM 0 HG2 PRO A 225 16.738 -3.920 -1.491 1.00 70.41 H new ATOM 0 HG3 PRO A 225 15.481 -4.980 -2.097 1.00 70.41 H new ATOM 0 HD2 PRO A 225 15.187 -2.359 -0.610 1.00 10.24 H new ATOM 0 HD3 PRO A 225 14.267 -2.952 -1.979 1.00 10.24 H new ATOM 780 N ARG A 226 14.085 -5.656 2.970 1.00 2.12 N ATOM 781 CA ARG A 226 14.042 -5.620 4.437 1.00 53.44 C ATOM 782 C ARG A 226 13.220 -4.445 4.994 1.00 22.43 C ATOM 783 O ARG A 226 13.746 -3.529 5.627 1.00 62.31 O ATOM 784 CB ARG A 226 15.476 -5.702 4.986 1.00 64.43 C ATOM 785 CG ARG A 226 16.151 -7.064 4.687 1.00 21.52 C ATOM 786 CD ARG A 226 17.666 -6.985 4.752 1.00 51.25 C ATOM 787 NE ARG A 226 18.136 -6.426 6.035 1.00 1.32 N ATOM 788 CZ ARG A 226 18.822 -5.277 6.177 1.00 25.21 C ATOM 789 NH1 ARG A 226 19.146 -4.541 5.113 1.00 43.31 N ATOM 790 NH2 ARG A 226 19.149 -4.854 7.390 1.00 10.14 N ATOM 0 H ARG A 226 13.798 -6.560 2.595 1.00 2.12 H new ATOM 0 HA ARG A 226 13.497 -6.494 4.794 1.00 53.44 H new ATOM 0 HB2 ARG A 226 16.074 -4.901 4.551 1.00 64.43 H new ATOM 0 HB3 ARG A 226 15.459 -5.538 6.063 1.00 64.43 H new ATOM 0 HG2 ARG A 226 15.797 -7.807 5.402 1.00 21.52 H new ATOM 0 HG3 ARG A 226 15.850 -7.406 3.697 1.00 21.52 H new ATOM 0 HD2 ARG A 226 18.087 -7.981 4.614 1.00 51.25 H new ATOM 0 HD3 ARG A 226 18.032 -6.368 3.932 1.00 51.25 H new ATOM 0 HE ARG A 226 17.924 -6.953 6.882 1.00 1.32 H new ATOM 0 HH11 ARG A 226 18.874 -4.847 4.179 1.00 43.31 H new ATOM 0 HH12 ARG A 226 19.666 -3.672 5.233 1.00 43.31 H new ATOM 0 HH21 ARG A 226 18.881 -5.399 8.210 1.00 10.14 H new ATOM 0 HH22 ARG A 226 19.669 -3.984 7.504 1.00 10.14 H new ATOM 804 N THR A 227 11.909 -4.492 4.716 1.00 61.41 N ATOM 805 CA THR A 227 10.932 -3.504 5.217 1.00 12.34 C ATOM 806 C THR A 227 10.373 -3.904 6.602 1.00 32.13 C ATOM 807 O THR A 227 10.119 -5.085 6.858 1.00 45.41 O ATOM 808 CB THR A 227 9.764 -3.345 4.189 1.00 61.01 C ATOM 809 OG1 THR A 227 10.284 -2.829 2.949 1.00 43.22 O ATOM 810 CG2 THR A 227 8.651 -2.414 4.691 1.00 41.11 C ATOM 0 H THR A 227 11.491 -5.218 4.135 1.00 61.41 H new ATOM 0 HA THR A 227 11.448 -2.551 5.333 1.00 12.34 H new ATOM 0 HB THR A 227 9.326 -4.333 4.048 1.00 61.01 H new ATOM 0 HG1 THR A 227 10.721 -3.552 2.452 1.00 43.22 H new ATOM 0 HG21 THR A 227 7.868 -2.342 3.936 1.00 41.11 H new ATOM 0 HG22 THR A 227 8.230 -2.815 5.613 1.00 41.11 H new ATOM 0 HG23 THR A 227 9.064 -1.423 4.881 1.00 41.11 H new ATOM 818 N GLN A 228 10.224 -2.904 7.501 1.00 42.01 N ATOM 819 CA GLN A 228 9.568 -3.066 8.819 1.00 65.44 C ATOM 820 C GLN A 228 8.160 -2.447 8.788 1.00 1.35 C ATOM 821 O GLN A 228 7.856 -1.590 7.944 1.00 74.21 O ATOM 822 CB GLN A 228 10.409 -2.426 9.970 1.00 53.43 C ATOM 823 CG GLN A 228 11.776 -3.074 10.193 1.00 14.51 C ATOM 824 CD GLN A 228 12.771 -2.756 9.088 1.00 3.44 C ATOM 825 OE1 GLN A 228 12.896 -1.602 8.647 1.00 24.13 O ATOM 826 NE2 GLN A 228 13.335 -3.773 8.518 1.00 72.42 N ATOM 0 H GLN A 228 10.558 -1.955 7.331 1.00 42.01 H new ATOM 0 HA GLN A 228 9.492 -4.135 9.020 1.00 65.44 H new ATOM 0 HB2 GLN A 228 10.554 -1.368 9.752 1.00 53.43 H new ATOM 0 HB3 GLN A 228 9.838 -2.485 10.896 1.00 53.43 H new ATOM 0 HG2 GLN A 228 12.181 -2.736 11.147 1.00 14.51 H new ATOM 0 HG3 GLN A 228 11.653 -4.155 10.263 1.00 14.51 H new ATOM 0 HE21 GLN A 228 13.212 -4.708 8.906 1.00 72.42 H new ATOM 0 HE22 GLN A 228 13.902 -3.639 7.681 1.00 72.42 H new ATOM 835 N ALA A 229 7.323 -2.896 9.726 1.00 4.22 N ATOM 836 CA ALA A 229 5.913 -2.475 9.839 1.00 43.23 C ATOM 837 C ALA A 229 5.776 -1.193 10.662 1.00 74.30 C ATOM 838 O ALA A 229 6.589 -0.930 11.552 1.00 5.34 O ATOM 839 CB ALA A 229 5.082 -3.597 10.453 1.00 52.24 C ATOM 0 H ALA A 229 7.602 -3.570 10.439 1.00 4.22 H new ATOM 0 HA ALA A 229 5.541 -2.263 8.837 1.00 43.23 H new ATOM 0 HB1 ALA A 229 4.043 -3.278 10.533 1.00 52.24 H new ATOM 0 HB2 ALA A 229 5.142 -4.483 9.820 1.00 52.24 H new ATOM 0 HB3 ALA A 229 5.466 -3.833 11.445 1.00 52.24 H new ATOM 845 N GLY A 230 4.719 -0.421 10.373 1.00 71.23 N ATOM 846 CA GLY A 230 4.555 0.932 10.929 1.00 70.20 C ATOM 847 C GLY A 230 4.726 2.003 9.864 1.00 71.40 C ATOM 848 O GLY A 230 4.381 3.168 10.082 1.00 14.52 O ATOM 0 H GLY A 230 3.961 -0.711 9.755 1.00 71.23 H new ATOM 0 HA2 GLY A 230 3.567 1.022 11.380 1.00 70.20 H new ATOM 0 HA3 GLY A 230 5.284 1.090 11.724 1.00 70.20 H new ATOM 852 N ARG A 231 5.297 1.597 8.713 1.00 31.21 N ATOM 853 CA ARG A 231 5.291 2.387 7.466 1.00 62.11 C ATOM 854 C ARG A 231 3.860 2.437 6.886 1.00 53.03 C ATOM 855 O ARG A 231 2.942 1.814 7.435 1.00 5.13 O ATOM 856 CB ARG A 231 6.248 1.725 6.432 1.00 53.11 C ATOM 857 CG ARG A 231 7.748 1.780 6.792 1.00 41.43 C ATOM 858 CD ARG A 231 8.625 1.052 5.761 1.00 12.10 C ATOM 859 NE ARG A 231 10.079 1.249 5.975 1.00 22.10 N ATOM 860 CZ ARG A 231 10.800 0.790 7.018 1.00 55.44 C ATOM 861 NH1 ARG A 231 10.242 0.105 7.995 1.00 34.24 N ATOM 862 NH2 ARG A 231 12.100 1.028 7.066 1.00 1.41 N ATOM 0 H ARG A 231 5.780 0.703 8.622 1.00 31.21 H new ATOM 0 HA ARG A 231 5.627 3.402 7.679 1.00 62.11 H new ATOM 0 HB2 ARG A 231 5.959 0.681 6.310 1.00 53.11 H new ATOM 0 HB3 ARG A 231 6.105 2.210 5.467 1.00 53.11 H new ATOM 0 HG2 ARG A 231 8.064 2.821 6.863 1.00 41.43 H new ATOM 0 HG3 ARG A 231 7.900 1.333 7.774 1.00 41.43 H new ATOM 0 HD2 ARG A 231 8.402 -0.014 5.795 1.00 12.10 H new ATOM 0 HD3 ARG A 231 8.363 1.401 4.762 1.00 12.10 H new ATOM 0 HE ARG A 231 10.582 1.783 5.266 1.00 22.10 H new ATOM 0 HH11 ARG A 231 9.241 -0.090 7.974 1.00 34.24 H new ATOM 0 HH12 ARG A 231 10.811 -0.231 8.772 1.00 34.24 H new ATOM 0 HH21 ARG A 231 12.550 1.555 6.318 1.00 1.41 H new ATOM 0 HH22 ARG A 231 12.653 0.684 7.851 1.00 1.41 H new ATOM 876 N LYS A 232 3.684 3.140 5.746 1.00 74.45 N ATOM 877 CA LYS A 232 2.407 3.121 4.997 1.00 52.20 C ATOM 878 C LYS A 232 2.614 3.715 3.593 1.00 65.11 C ATOM 879 O LYS A 232 3.578 4.460 3.375 1.00 53.12 O ATOM 880 CB LYS A 232 1.267 3.848 5.796 1.00 23.42 C ATOM 881 CG LYS A 232 1.161 5.382 5.688 1.00 13.20 C ATOM 882 CD LYS A 232 0.393 6.011 6.887 1.00 64.24 C ATOM 883 CE LYS A 232 -0.954 5.322 7.184 1.00 2.10 C ATOM 884 NZ LYS A 232 -1.684 5.985 8.303 1.00 41.51 N ATOM 0 H LYS A 232 4.406 3.725 5.325 1.00 74.45 H new ATOM 0 HA LYS A 232 2.082 2.088 4.875 1.00 52.20 H new ATOM 0 HB2 LYS A 232 0.315 3.426 5.475 1.00 23.42 H new ATOM 0 HB3 LYS A 232 1.388 3.597 6.850 1.00 23.42 H new ATOM 0 HG2 LYS A 232 2.162 5.810 5.637 1.00 13.20 H new ATOM 0 HG3 LYS A 232 0.655 5.644 4.759 1.00 13.20 H new ATOM 0 HD2 LYS A 232 1.021 5.962 7.776 1.00 64.24 H new ATOM 0 HD3 LYS A 232 0.215 7.066 6.681 1.00 64.24 H new ATOM 0 HE2 LYS A 232 -1.574 5.336 6.288 1.00 2.10 H new ATOM 0 HE3 LYS A 232 -0.779 4.276 7.434 1.00 2.10 H new ATOM 0 HZ1 LYS A 232 -2.486 5.390 8.595 1.00 41.51 H new ATOM 0 HZ2 LYS A 232 -1.039 6.117 9.108 1.00 41.51 H new ATOM 0 HZ3 LYS A 232 -2.037 6.911 7.987 1.00 41.51 H new ATOM 898 N LEU A 233 1.753 3.340 2.623 1.00 42.13 N ATOM 899 CA LEU A 233 1.740 3.997 1.296 1.00 30.21 C ATOM 900 C LEU A 233 0.884 5.262 1.358 1.00 5.01 C ATOM 901 O LEU A 233 -0.110 5.309 2.101 1.00 61.45 O ATOM 902 CB LEU A 233 1.175 3.085 0.170 1.00 22.53 C ATOM 903 CG LEU A 233 1.963 1.787 -0.168 1.00 3.24 C ATOM 904 CD1 LEU A 233 1.290 1.030 -1.340 1.00 12.41 C ATOM 905 CD2 LEU A 233 3.433 2.087 -0.473 1.00 52.04 C ATOM 0 H LEU A 233 1.065 2.595 2.730 1.00 42.13 H new ATOM 0 HA LEU A 233 2.778 4.227 1.055 1.00 30.21 H new ATOM 0 HB2 LEU A 233 0.160 2.800 0.446 1.00 22.53 H new ATOM 0 HB3 LEU A 233 1.102 3.681 -0.740 1.00 22.53 H new ATOM 0 HG LEU A 233 1.940 1.143 0.711 1.00 3.24 H new ATOM 0 HD11 LEU A 233 1.856 0.125 -1.561 1.00 12.41 H new ATOM 0 HD12 LEU A 233 0.271 0.762 -1.062 1.00 12.41 H new ATOM 0 HD13 LEU A 233 1.269 1.670 -2.222 1.00 12.41 H new ATOM 0 HD21 LEU A 233 3.953 1.158 -0.705 1.00 52.04 H new ATOM 0 HD22 LEU A 233 3.497 2.762 -1.327 1.00 52.04 H new ATOM 0 HD23 LEU A 233 3.896 2.556 0.395 1.00 52.04 H new ATOM 917 N ARG A 234 1.291 6.262 0.567 1.00 32.23 N ATOM 918 CA ARG A 234 0.495 7.454 0.275 1.00 33.41 C ATOM 919 C ARG A 234 0.143 7.434 -1.221 1.00 54.45 C ATOM 920 O ARG A 234 1.007 7.617 -2.085 1.00 41.13 O ATOM 921 CB ARG A 234 1.265 8.747 0.686 1.00 11.02 C ATOM 922 CG ARG A 234 2.737 8.854 0.207 1.00 30.34 C ATOM 923 CD ARG A 234 3.382 10.181 0.645 1.00 4.21 C ATOM 924 NE ARG A 234 4.822 10.258 0.350 1.00 54.24 N ATOM 925 CZ ARG A 234 5.782 10.554 1.242 1.00 2.03 C ATOM 926 NH1 ARG A 234 5.484 10.791 2.516 1.00 63.32 N ATOM 927 NH2 ARG A 234 7.041 10.644 0.846 1.00 2.33 N ATOM 0 H ARG A 234 2.200 6.263 0.105 1.00 32.23 H new ATOM 0 HA ARG A 234 -0.427 7.453 0.857 1.00 33.41 H new ATOM 0 HB2 ARG A 234 0.717 9.608 0.302 1.00 11.02 H new ATOM 0 HB3 ARG A 234 1.253 8.821 1.773 1.00 11.02 H new ATOM 0 HG2 ARG A 234 3.312 8.020 0.609 1.00 30.34 H new ATOM 0 HG3 ARG A 234 2.773 8.773 -0.879 1.00 30.34 H new ATOM 0 HD2 ARG A 234 2.872 11.006 0.147 1.00 4.21 H new ATOM 0 HD3 ARG A 234 3.231 10.313 1.716 1.00 4.21 H new ATOM 0 HE ARG A 234 5.115 10.072 -0.609 1.00 54.24 H new ATOM 0 HH11 ARG A 234 4.514 10.749 2.829 1.00 63.32 H new ATOM 0 HH12 ARG A 234 6.225 11.014 3.180 1.00 63.32 H new ATOM 0 HH21 ARG A 234 7.280 10.489 -0.133 1.00 2.33 H new ATOM 0 HH22 ARG A 234 7.773 10.869 1.520 1.00 2.33 H new ATOM 941 N LEU A 235 -1.133 7.151 -1.526 1.00 23.23 N ATOM 942 CA LEU A 235 -1.601 6.951 -2.910 1.00 20.24 C ATOM 943 C LEU A 235 -2.619 8.021 -3.300 1.00 14.12 C ATOM 944 O LEU A 235 -3.701 8.098 -2.720 1.00 74.01 O ATOM 945 CB LEU A 235 -2.232 5.547 -3.072 1.00 73.31 C ATOM 946 CG LEU A 235 -1.311 4.329 -2.775 1.00 34.44 C ATOM 947 CD1 LEU A 235 -2.032 3.000 -3.095 1.00 31.34 C ATOM 948 CD2 LEU A 235 0.015 4.449 -3.541 1.00 42.33 C ATOM 0 H LEU A 235 -1.868 7.054 -0.825 1.00 23.23 H new ATOM 0 HA LEU A 235 -0.737 7.032 -3.570 1.00 20.24 H new ATOM 0 HB2 LEU A 235 -3.100 5.486 -2.415 1.00 73.31 H new ATOM 0 HB3 LEU A 235 -2.599 5.455 -4.094 1.00 73.31 H new ATOM 0 HG LEU A 235 -1.079 4.328 -1.710 1.00 34.44 H new ATOM 0 HD11 LEU A 235 -1.367 2.164 -2.879 1.00 31.34 H new ATOM 0 HD12 LEU A 235 -2.930 2.917 -2.483 1.00 31.34 H new ATOM 0 HD13 LEU A 235 -2.308 2.981 -4.149 1.00 31.34 H new ATOM 0 HD21 LEU A 235 0.643 3.587 -3.318 1.00 42.33 H new ATOM 0 HD22 LEU A 235 -0.185 4.485 -4.612 1.00 42.33 H new ATOM 0 HD23 LEU A 235 0.529 5.361 -3.237 1.00 42.33 H new ATOM 960 N LYS A 236 -2.279 8.811 -4.316 1.00 21.43 N ATOM 961 CA LYS A 236 -3.118 9.932 -4.768 1.00 13.23 C ATOM 962 C LYS A 236 -4.051 9.474 -5.889 1.00 43.22 C ATOM 963 O LYS A 236 -3.599 8.910 -6.896 1.00 11.21 O ATOM 964 CB LYS A 236 -2.237 11.135 -5.208 1.00 74.13 C ATOM 965 CG LYS A 236 -1.530 11.836 -4.027 1.00 74.20 C ATOM 966 CD LYS A 236 -2.529 12.468 -3.032 1.00 22.44 C ATOM 967 CE LYS A 236 -1.853 13.019 -1.767 1.00 54.21 C ATOM 968 NZ LYS A 236 -0.958 14.180 -2.046 1.00 65.22 N ATOM 0 H LYS A 236 -1.418 8.697 -4.851 1.00 21.43 H new ATOM 0 HA LYS A 236 -3.736 10.270 -3.936 1.00 13.23 H new ATOM 0 HB2 LYS A 236 -1.486 10.787 -5.917 1.00 74.13 H new ATOM 0 HB3 LYS A 236 -2.859 11.860 -5.733 1.00 74.13 H new ATOM 0 HG2 LYS A 236 -0.905 11.114 -3.501 1.00 74.20 H new ATOM 0 HG3 LYS A 236 -0.867 12.610 -4.412 1.00 74.20 H new ATOM 0 HD2 LYS A 236 -3.067 13.275 -3.530 1.00 22.44 H new ATOM 0 HD3 LYS A 236 -3.269 11.721 -2.745 1.00 22.44 H new ATOM 0 HE2 LYS A 236 -2.620 13.321 -1.054 1.00 54.21 H new ATOM 0 HE3 LYS A 236 -1.274 12.225 -1.295 1.00 54.21 H new ATOM 0 HZ1 LYS A 236 -0.530 14.510 -1.157 1.00 65.22 H new ATOM 0 HZ2 LYS A 236 -0.208 13.889 -2.705 1.00 65.22 H new ATOM 0 HZ3 LYS A 236 -1.512 14.951 -2.470 1.00 65.22 H new ATOM 982 N GLY A 237 -5.352 9.720 -5.682 1.00 54.33 N ATOM 983 CA GLY A 237 -6.404 9.289 -6.616 1.00 25.40 C ATOM 984 C GLY A 237 -6.868 7.857 -6.372 1.00 24.01 C ATOM 985 O GLY A 237 -7.565 7.274 -7.212 1.00 31.15 O ATOM 0 H GLY A 237 -5.705 10.221 -4.867 1.00 54.33 H new ATOM 0 HA2 GLY A 237 -7.257 9.961 -6.529 1.00 25.40 H new ATOM 0 HA3 GLY A 237 -6.033 9.376 -7.637 1.00 25.40 H new ATOM 989 N LYS A 238 -6.476 7.289 -5.212 1.00 43.30 N ATOM 990 CA LYS A 238 -6.821 5.905 -4.818 1.00 32.45 C ATOM 991 C LYS A 238 -7.743 5.884 -3.588 1.00 41.12 C ATOM 992 O LYS A 238 -8.169 4.809 -3.147 1.00 23.32 O ATOM 993 CB LYS A 238 -5.523 5.087 -4.577 1.00 54.05 C ATOM 994 CG LYS A 238 -4.600 5.023 -5.812 1.00 1.42 C ATOM 995 CD LYS A 238 -5.213 4.212 -6.981 1.00 24.20 C ATOM 996 CE LYS A 238 -4.561 4.541 -8.335 1.00 14.25 C ATOM 997 NZ LYS A 238 -3.096 4.291 -8.350 1.00 74.42 N ATOM 0 H LYS A 238 -5.909 7.778 -4.519 1.00 43.30 H new ATOM 0 HA LYS A 238 -7.375 5.438 -5.632 1.00 32.45 H new ATOM 0 HB2 LYS A 238 -4.974 5.528 -3.745 1.00 54.05 H new ATOM 0 HB3 LYS A 238 -5.791 4.073 -4.280 1.00 54.05 H new ATOM 0 HG2 LYS A 238 -4.386 6.036 -6.152 1.00 1.42 H new ATOM 0 HG3 LYS A 238 -3.648 4.575 -5.525 1.00 1.42 H new ATOM 0 HD2 LYS A 238 -5.101 3.147 -6.777 1.00 24.20 H new ATOM 0 HD3 LYS A 238 -6.282 4.415 -7.038 1.00 24.20 H new ATOM 0 HE2 LYS A 238 -5.034 3.944 -9.114 1.00 14.25 H new ATOM 0 HE3 LYS A 238 -4.748 5.587 -8.577 1.00 14.25 H new ATOM 0 HZ1 LYS A 238 -2.718 4.498 -9.297 1.00 74.42 H new ATOM 0 HZ2 LYS A 238 -2.632 4.905 -7.650 1.00 74.42 H new ATOM 0 HZ3 LYS A 238 -2.911 3.295 -8.114 1.00 74.42 H new ATOM 1011 N GLY A 239 -8.030 7.083 -3.030 1.00 42.04 N ATOM 1012 CA GLY A 239 -9.110 7.257 -2.053 1.00 2.30 C ATOM 1013 C GLY A 239 -10.454 7.371 -2.757 1.00 53.04 C ATOM 1014 O GLY A 239 -10.504 7.289 -3.999 1.00 43.15 O ATOM 0 H GLY A 239 -7.523 7.941 -3.246 1.00 42.04 H new ATOM 0 HA2 GLY A 239 -9.124 6.412 -1.364 1.00 2.30 H new ATOM 0 HA3 GLY A 239 -8.928 8.151 -1.457 1.00 2.30 H new ATOM 1018 N PHE A 240 -11.537 7.590 -1.991 1.00 13.40 N ATOM 1019 CA PHE A 240 -12.916 7.542 -2.517 1.00 43.32 C ATOM 1020 C PHE A 240 -13.147 8.535 -3.687 1.00 31.13 C ATOM 1021 O PHE A 240 -12.588 9.646 -3.681 1.00 30.02 O ATOM 1022 CB PHE A 240 -13.952 7.807 -1.390 1.00 73.14 C ATOM 1023 CG PHE A 240 -14.172 6.632 -0.436 1.00 44.41 C ATOM 1024 CD1 PHE A 240 -14.382 5.337 -0.929 1.00 10.31 C ATOM 1025 CD2 PHE A 240 -14.222 6.828 0.945 1.00 74.43 C ATOM 1026 CE1 PHE A 240 -14.633 4.283 -0.069 1.00 13.14 C ATOM 1027 CE2 PHE A 240 -14.467 5.771 1.799 1.00 14.34 C ATOM 1028 CZ PHE A 240 -14.675 4.502 1.294 1.00 21.00 C ATOM 0 H PHE A 240 -11.484 7.804 -0.995 1.00 13.40 H new ATOM 0 HA PHE A 240 -13.057 6.535 -2.909 1.00 43.32 H new ATOM 0 HB2 PHE A 240 -13.626 8.671 -0.811 1.00 73.14 H new ATOM 0 HB3 PHE A 240 -14.906 8.070 -1.847 1.00 73.14 H new ATOM 0 HD1 PHE A 240 -14.347 5.160 -1.994 1.00 10.31 H new ATOM 0 HD2 PHE A 240 -14.067 7.817 1.350 1.00 74.43 H new ATOM 0 HE1 PHE A 240 -14.796 3.291 -0.463 1.00 13.14 H new ATOM 0 HE2 PHE A 240 -14.496 5.937 2.866 1.00 14.34 H new ATOM 0 HZ PHE A 240 -14.871 3.680 1.966 1.00 21.00 H new ATOM 1038 N PRO A 241 -13.942 8.117 -4.731 1.00 61.22 N ATOM 1039 CA PRO A 241 -14.376 9.017 -5.803 1.00 42.14 C ATOM 1040 C PRO A 241 -15.385 10.044 -5.268 1.00 70.04 C ATOM 1041 O PRO A 241 -16.314 9.697 -4.525 1.00 42.53 O ATOM 1042 CB PRO A 241 -15.013 8.086 -6.874 1.00 45.55 C ATOM 1043 CG PRO A 241 -14.698 6.677 -6.439 1.00 45.01 C ATOM 1044 CD PRO A 241 -14.474 6.744 -4.945 1.00 31.45 C ATOM 0 HA PRO A 241 -13.554 9.598 -6.221 1.00 42.14 H new ATOM 0 HB2 PRO A 241 -16.090 8.243 -6.937 1.00 45.55 H new ATOM 0 HB3 PRO A 241 -14.602 8.290 -7.863 1.00 45.55 H new ATOM 0 HG2 PRO A 241 -15.518 6.001 -6.681 1.00 45.01 H new ATOM 0 HG3 PRO A 241 -13.812 6.299 -6.950 1.00 45.01 H new ATOM 0 HD2 PRO A 241 -15.400 6.583 -4.393 1.00 31.45 H new ATOM 0 HD3 PRO A 241 -13.768 5.984 -4.611 1.00 31.45 H new ATOM 1052 N GLY A 242 -15.158 11.294 -5.640 1.00 3.05 N ATOM 1053 CA GLY A 242 -15.957 12.430 -5.193 1.00 45.31 C ATOM 1054 C GLY A 242 -16.310 13.380 -6.328 1.00 54.14 C ATOM 1055 O GLY A 242 -15.801 13.219 -7.442 1.00 33.42 O ATOM 0 H GLY A 242 -14.401 11.555 -6.272 1.00 3.05 H new ATOM 0 HA2 GLY A 242 -16.874 12.065 -4.731 1.00 45.31 H new ATOM 0 HA3 GLY A 242 -15.409 12.975 -4.425 1.00 45.31 H new ATOM 1059 N PRO A 243 -17.150 14.427 -6.064 1.00 1.34 N ATOM 1060 CA PRO A 243 -17.565 15.406 -7.096 1.00 24.32 C ATOM 1061 C PRO A 243 -16.433 16.392 -7.474 1.00 63.23 C ATOM 1062 O PRO A 243 -16.566 17.145 -8.443 1.00 35.03 O ATOM 1063 CB PRO A 243 -18.766 16.120 -6.431 1.00 22.32 C ATOM 1064 CG PRO A 243 -18.484 16.051 -4.962 1.00 5.34 C ATOM 1065 CD PRO A 243 -17.753 14.739 -4.735 1.00 71.43 C ATOM 0 HA PRO A 243 -17.818 14.935 -8.046 1.00 24.32 H new ATOM 0 HB2 PRO A 243 -18.850 17.153 -6.770 1.00 22.32 H new ATOM 0 HB3 PRO A 243 -19.706 15.626 -6.677 1.00 22.32 H new ATOM 0 HG2 PRO A 243 -17.875 16.897 -4.642 1.00 5.34 H new ATOM 0 HG3 PRO A 243 -19.408 16.087 -4.386 1.00 5.34 H new ATOM 0 HD2 PRO A 243 -16.990 14.836 -3.963 1.00 71.43 H new ATOM 0 HD3 PRO A 243 -18.435 13.953 -4.412 1.00 71.43 H new ATOM 1073 N ALA A 244 -15.325 16.376 -6.695 1.00 42.02 N ATOM 1074 CA ALA A 244 -14.116 17.196 -6.952 1.00 2.33 C ATOM 1075 C ALA A 244 -12.961 16.337 -7.516 1.00 21.24 C ATOM 1076 O ALA A 244 -11.816 16.799 -7.607 1.00 3.33 O ATOM 1077 CB ALA A 244 -13.691 17.910 -5.651 1.00 72.03 C ATOM 0 H ALA A 244 -15.244 15.789 -5.864 1.00 42.02 H new ATOM 0 HA ALA A 244 -14.356 17.945 -7.707 1.00 2.33 H new ATOM 0 HB1 ALA A 244 -12.803 18.512 -5.840 1.00 72.03 H new ATOM 0 HB2 ALA A 244 -14.500 18.555 -5.309 1.00 72.03 H new ATOM 0 HB3 ALA A 244 -13.469 17.168 -4.884 1.00 72.03 H new ATOM 1083 N GLY A 245 -13.273 15.082 -7.901 1.00 52.33 N ATOM 1084 CA GLY A 245 -12.282 14.147 -8.451 1.00 72.32 C ATOM 1085 C GLY A 245 -12.204 12.875 -7.618 1.00 31.21 C ATOM 1086 O GLY A 245 -13.154 12.096 -7.596 1.00 32.33 O ATOM 0 H GLY A 245 -14.214 14.695 -7.838 1.00 52.33 H new ATOM 0 HA2 GLY A 245 -12.546 13.896 -9.479 1.00 72.32 H new ATOM 0 HA3 GLY A 245 -11.303 14.626 -8.481 1.00 72.32 H new ATOM 1090 N ARG A 246 -11.060 12.666 -6.949 1.00 4.25 N ATOM 1091 CA ARG A 246 -10.838 11.547 -6.008 1.00 40.24 C ATOM 1092 C ARG A 246 -9.970 11.995 -4.839 1.00 73.14 C ATOM 1093 O ARG A 246 -9.308 13.041 -4.896 1.00 0.43 O ATOM 1094 CB ARG A 246 -10.169 10.332 -6.708 1.00 34.31 C ATOM 1095 CG ARG A 246 -11.139 9.468 -7.524 1.00 63.14 C ATOM 1096 CD ARG A 246 -10.431 8.369 -8.304 1.00 1.02 C ATOM 1097 NE ARG A 246 -11.386 7.491 -8.978 1.00 62.25 N ATOM 1098 CZ ARG A 246 -11.184 6.200 -9.239 1.00 1.04 C ATOM 1099 NH1 ARG A 246 -10.048 5.603 -8.883 1.00 35.11 N ATOM 1100 NH2 ARG A 246 -12.134 5.506 -9.841 1.00 14.11 N ATOM 0 H ARG A 246 -10.248 13.276 -7.045 1.00 4.25 H new ATOM 0 HA ARG A 246 -11.816 11.238 -5.640 1.00 40.24 H new ATOM 0 HB2 ARG A 246 -9.380 10.695 -7.367 1.00 34.31 H new ATOM 0 HB3 ARG A 246 -9.691 9.708 -5.952 1.00 34.31 H new ATOM 0 HG2 ARG A 246 -11.871 9.018 -6.853 1.00 63.14 H new ATOM 0 HG3 ARG A 246 -11.690 10.103 -8.218 1.00 63.14 H new ATOM 0 HD2 ARG A 246 -9.764 8.816 -9.041 1.00 1.02 H new ATOM 0 HD3 ARG A 246 -9.811 7.782 -7.627 1.00 1.02 H new ATOM 0 HE ARG A 246 -12.275 7.898 -9.271 1.00 62.25 H new ATOM 0 HH11 ARG A 246 -9.321 6.135 -8.405 1.00 35.11 H new ATOM 0 HH12 ARG A 246 -9.905 4.614 -9.088 1.00 35.11 H new ATOM 0 HH21 ARG A 246 -13.010 5.959 -10.101 1.00 14.11 H new ATOM 0 HH22 ARG A 246 -11.991 4.517 -10.046 1.00 14.11 H new ATOM 1114 N GLY A 247 -9.987 11.177 -3.785 1.00 63.43 N ATOM 1115 CA GLY A 247 -9.157 11.398 -2.619 1.00 11.43 C ATOM 1116 C GLY A 247 -7.892 10.572 -2.621 1.00 24.50 C ATOM 1117 O GLY A 247 -7.492 9.995 -3.639 1.00 43.20 O ATOM 0 H GLY A 247 -10.578 10.348 -3.724 1.00 63.43 H new ATOM 0 HA2 GLY A 247 -8.893 12.454 -2.564 1.00 11.43 H new ATOM 0 HA3 GLY A 247 -9.732 11.167 -1.723 1.00 11.43 H new ATOM 1121 N ASP A 248 -7.286 10.488 -1.451 1.00 74.31 N ATOM 1122 CA ASP A 248 -5.992 9.829 -1.238 1.00 0.31 C ATOM 1123 C ASP A 248 -6.150 8.607 -0.320 1.00 71.34 C ATOM 1124 O ASP A 248 -7.137 8.476 0.398 1.00 61.22 O ATOM 1125 CB ASP A 248 -4.980 10.851 -0.663 1.00 65.53 C ATOM 1126 CG ASP A 248 -5.544 11.645 0.534 1.00 2.34 C ATOM 1127 OD1 ASP A 248 -6.285 12.633 0.312 1.00 55.31 O ATOM 1128 OD2 ASP A 248 -5.272 11.280 1.685 1.00 72.45 O ATOM 0 H ASP A 248 -7.681 10.882 -0.597 1.00 74.31 H new ATOM 0 HA ASP A 248 -5.609 9.466 -2.192 1.00 0.31 H new ATOM 0 HB2 ASP A 248 -4.078 10.325 -0.351 1.00 65.53 H new ATOM 0 HB3 ASP A 248 -4.688 11.547 -1.449 1.00 65.53 H new ATOM 1133 N LEU A 249 -5.174 7.699 -0.368 1.00 74.12 N ATOM 1134 CA LEU A 249 -5.245 6.400 0.306 1.00 74.32 C ATOM 1135 C LEU A 249 -3.950 6.157 1.097 1.00 43.10 C ATOM 1136 O LEU A 249 -2.875 5.977 0.517 1.00 73.25 O ATOM 1137 CB LEU A 249 -5.492 5.295 -0.758 1.00 22.23 C ATOM 1138 CG LEU A 249 -5.386 3.807 -0.301 1.00 10.30 C ATOM 1139 CD1 LEU A 249 -6.299 3.470 0.896 1.00 43.23 C ATOM 1140 CD2 LEU A 249 -5.655 2.862 -1.489 1.00 1.11 C ATOM 0 H LEU A 249 -4.304 7.845 -0.880 1.00 74.12 H new ATOM 0 HA LEU A 249 -6.071 6.381 1.017 1.00 74.32 H new ATOM 0 HB2 LEU A 249 -6.488 5.447 -1.174 1.00 22.23 H new ATOM 0 HB3 LEU A 249 -4.781 5.447 -1.570 1.00 22.23 H new ATOM 0 HG LEU A 249 -4.365 3.657 0.051 1.00 10.30 H new ATOM 0 HD11 LEU A 249 -6.177 2.420 1.163 1.00 43.23 H new ATOM 0 HD12 LEU A 249 -6.028 4.095 1.747 1.00 43.23 H new ATOM 0 HD13 LEU A 249 -7.338 3.657 0.625 1.00 43.23 H new ATOM 0 HD21 LEU A 249 -5.578 1.827 -1.155 1.00 1.11 H new ATOM 0 HD22 LEU A 249 -6.657 3.044 -1.879 1.00 1.11 H new ATOM 0 HD23 LEU A 249 -4.921 3.046 -2.274 1.00 1.11 H new ATOM 1152 N TYR A 250 -4.068 6.204 2.433 1.00 62.35 N ATOM 1153 CA TYR A 250 -2.965 5.900 3.352 1.00 51.42 C ATOM 1154 C TYR A 250 -3.180 4.496 3.920 1.00 33.21 C ATOM 1155 O TYR A 250 -4.185 4.241 4.603 1.00 3.54 O ATOM 1156 CB TYR A 250 -2.883 6.971 4.474 1.00 14.34 C ATOM 1157 CG TYR A 250 -2.704 8.415 3.956 1.00 44.33 C ATOM 1158 CD1 TYR A 250 -3.313 9.501 4.597 1.00 53.32 C ATOM 1159 CD2 TYR A 250 -1.947 8.683 2.812 1.00 64.45 C ATOM 1160 CE1 TYR A 250 -3.168 10.786 4.108 1.00 62.31 C ATOM 1161 CE2 TYR A 250 -1.799 9.967 2.329 1.00 33.11 C ATOM 1162 CZ TYR A 250 -2.409 11.008 2.978 1.00 52.34 C ATOM 1163 OH TYR A 250 -2.297 12.288 2.470 1.00 14.53 O ATOM 0 H TYR A 250 -4.936 6.455 2.906 1.00 62.35 H new ATOM 0 HA TYR A 250 -2.013 5.924 2.822 1.00 51.42 H new ATOM 0 HB2 TYR A 250 -3.791 6.922 5.075 1.00 14.34 H new ATOM 0 HB3 TYR A 250 -2.050 6.727 5.134 1.00 14.34 H new ATOM 0 HD1 TYR A 250 -3.904 9.332 5.485 1.00 53.32 H new ATOM 0 HD2 TYR A 250 -1.467 7.866 2.294 1.00 64.45 H new ATOM 0 HE1 TYR A 250 -3.648 11.614 4.609 1.00 62.31 H new ATOM 0 HE2 TYR A 250 -1.206 10.150 1.445 1.00 33.11 H new ATOM 0 HH TYR A 250 -1.727 12.275 1.673 1.00 14.53 H new ATOM 1173 N LEU A 251 -2.260 3.562 3.621 1.00 12.23 N ATOM 1174 CA LEU A 251 -2.457 2.146 4.007 1.00 32.41 C ATOM 1175 C LEU A 251 -1.254 1.575 4.777 1.00 34.51 C ATOM 1176 O LEU A 251 -0.153 1.451 4.244 1.00 31.55 O ATOM 1177 CB LEU A 251 -2.877 1.299 2.763 1.00 2.44 C ATOM 1178 CG LEU A 251 -2.005 1.405 1.472 1.00 41.25 C ATOM 1179 CD1 LEU A 251 -0.902 0.351 1.457 1.00 31.50 C ATOM 1180 CD2 LEU A 251 -2.852 1.295 0.198 1.00 54.02 C ATOM 0 H LEU A 251 -1.390 3.751 3.124 1.00 12.23 H new ATOM 0 HA LEU A 251 -3.282 2.091 4.717 1.00 32.41 H new ATOM 0 HB2 LEU A 251 -2.900 0.252 3.065 1.00 2.44 H new ATOM 0 HB3 LEU A 251 -3.898 1.577 2.500 1.00 2.44 H new ATOM 0 HG LEU A 251 -1.544 2.393 1.488 1.00 41.25 H new ATOM 0 HD11 LEU A 251 -0.314 0.453 0.545 1.00 31.50 H new ATOM 0 HD12 LEU A 251 -0.255 0.489 2.323 1.00 31.50 H new ATOM 0 HD13 LEU A 251 -1.348 -0.643 1.492 1.00 31.50 H new ATOM 0 HD21 LEU A 251 -2.206 1.374 -0.676 1.00 54.02 H new ATOM 0 HD22 LEU A 251 -3.365 0.334 0.184 1.00 54.02 H new ATOM 0 HD23 LEU A 251 -3.587 2.099 0.179 1.00 54.02 H new ATOM 1192 N GLU A 252 -1.507 1.245 6.055 1.00 63.31 N ATOM 1193 CA GLU A 252 -0.489 0.839 7.038 1.00 4.43 C ATOM 1194 C GLU A 252 0.136 -0.537 6.725 1.00 23.01 C ATOM 1195 O GLU A 252 -0.545 -1.567 6.708 1.00 72.21 O ATOM 1196 CB GLU A 252 -1.130 0.835 8.451 1.00 43.53 C ATOM 1197 CG GLU A 252 -0.299 0.137 9.547 1.00 33.22 C ATOM 1198 CD GLU A 252 -0.908 0.273 10.947 1.00 65.42 C ATOM 1199 OE1 GLU A 252 -0.365 1.023 11.786 1.00 14.22 O ATOM 1200 OE2 GLU A 252 -1.946 -0.368 11.207 1.00 72.44 O ATOM 0 H GLU A 252 -2.450 1.254 6.443 1.00 63.31 H new ATOM 0 HA GLU A 252 0.327 1.560 6.991 1.00 4.43 H new ATOM 0 HB2 GLU A 252 -1.309 1.867 8.754 1.00 43.53 H new ATOM 0 HB3 GLU A 252 -2.103 0.348 8.390 1.00 43.53 H new ATOM 0 HG2 GLU A 252 -0.202 -0.921 9.302 1.00 33.22 H new ATOM 0 HG3 GLU A 252 0.707 0.557 9.553 1.00 33.22 H new ATOM 1207 N VAL A 253 1.459 -0.509 6.523 1.00 72.13 N ATOM 1208 CA VAL A 253 2.286 -1.682 6.240 1.00 44.02 C ATOM 1209 C VAL A 253 2.420 -2.571 7.485 1.00 31.12 C ATOM 1210 O VAL A 253 2.786 -2.094 8.571 1.00 15.32 O ATOM 1211 CB VAL A 253 3.709 -1.241 5.745 1.00 21.13 C ATOM 1212 CG1 VAL A 253 4.619 -2.459 5.437 1.00 70.12 C ATOM 1213 CG2 VAL A 253 3.569 -0.311 4.524 1.00 65.00 C ATOM 0 H VAL A 253 1.997 0.357 6.553 1.00 72.13 H new ATOM 0 HA VAL A 253 1.797 -2.257 5.454 1.00 44.02 H new ATOM 0 HB VAL A 253 4.198 -0.690 6.549 1.00 21.13 H new ATOM 0 HG11 VAL A 253 5.594 -2.108 5.098 1.00 70.12 H new ATOM 0 HG12 VAL A 253 4.743 -3.058 6.339 1.00 70.12 H new ATOM 0 HG13 VAL A 253 4.161 -3.068 4.657 1.00 70.12 H new ATOM 0 HG21 VAL A 253 4.559 -0.007 4.183 1.00 65.00 H new ATOM 0 HG22 VAL A 253 3.055 -0.840 3.721 1.00 65.00 H new ATOM 0 HG23 VAL A 253 2.994 0.572 4.803 1.00 65.00 H new ATOM 1223 N ARG A 254 2.078 -3.850 7.299 1.00 53.14 N ATOM 1224 CA ARG A 254 2.237 -4.906 8.283 1.00 63.51 C ATOM 1225 C ARG A 254 3.232 -5.931 7.733 1.00 21.12 C ATOM 1226 O ARG A 254 3.120 -6.330 6.572 1.00 51.45 O ATOM 1227 CB ARG A 254 0.873 -5.585 8.536 1.00 30.31 C ATOM 1228 CG ARG A 254 -0.209 -4.677 9.160 1.00 31.02 C ATOM 1229 CD ARG A 254 0.218 -4.030 10.485 1.00 4.24 C ATOM 1230 NE ARG A 254 -0.870 -3.249 11.101 1.00 11.34 N ATOM 1231 CZ ARG A 254 -1.609 -3.633 12.154 1.00 51.44 C ATOM 1232 NH1 ARG A 254 -1.409 -4.807 12.744 1.00 42.45 N ATOM 1233 NH2 ARG A 254 -2.520 -2.808 12.638 1.00 11.45 N ATOM 0 H ARG A 254 1.669 -4.182 6.425 1.00 53.14 H new ATOM 0 HA ARG A 254 2.606 -4.495 9.223 1.00 63.51 H new ATOM 0 HB2 ARG A 254 0.497 -5.973 7.589 1.00 30.31 H new ATOM 0 HB3 ARG A 254 1.028 -6.442 9.192 1.00 30.31 H new ATOM 0 HG2 ARG A 254 -0.466 -3.892 8.449 1.00 31.02 H new ATOM 0 HG3 ARG A 254 -1.112 -5.264 9.327 1.00 31.02 H new ATOM 0 HD2 ARG A 254 0.543 -4.806 11.178 1.00 4.24 H new ATOM 0 HD3 ARG A 254 1.075 -3.380 10.310 1.00 4.24 H new ATOM 0 HE ARG A 254 -1.079 -2.338 10.692 1.00 11.34 H new ATOM 0 HH11 ARG A 254 -0.683 -5.435 12.398 1.00 42.45 H new ATOM 0 HH12 ARG A 254 -1.981 -5.080 13.543 1.00 42.45 H new ATOM 0 HH21 ARG A 254 -2.655 -1.891 12.212 1.00 11.45 H new ATOM 0 HH22 ARG A 254 -3.088 -3.088 13.438 1.00 11.45 H new ATOM 1247 N ILE A 255 4.202 -6.340 8.566 1.00 12.01 N ATOM 1248 CA ILE A 255 5.171 -7.392 8.222 1.00 41.52 C ATOM 1249 C ILE A 255 4.776 -8.660 8.980 1.00 63.03 C ATOM 1250 O ILE A 255 5.015 -8.783 10.188 1.00 45.41 O ATOM 1251 CB ILE A 255 6.652 -6.974 8.547 1.00 2.21 C ATOM 1252 CG1 ILE A 255 7.009 -5.636 7.837 1.00 73.32 C ATOM 1253 CG2 ILE A 255 7.660 -8.089 8.160 1.00 55.32 C ATOM 1254 CD1 ILE A 255 6.806 -5.603 6.330 1.00 44.01 C ATOM 0 H ILE A 255 4.336 -5.950 9.499 1.00 12.01 H new ATOM 0 HA ILE A 255 5.143 -7.566 7.146 1.00 41.52 H new ATOM 0 HB ILE A 255 6.726 -6.827 9.625 1.00 2.21 H new ATOM 0 HG12 ILE A 255 6.410 -4.841 8.281 1.00 73.32 H new ATOM 0 HG13 ILE A 255 8.053 -5.404 8.048 1.00 73.32 H new ATOM 0 HG21 ILE A 255 8.672 -7.763 8.399 1.00 55.32 H new ATOM 0 HG22 ILE A 255 7.430 -8.997 8.717 1.00 55.32 H new ATOM 0 HG23 ILE A 255 7.587 -8.291 7.091 1.00 55.32 H new ATOM 0 HD11 ILE A 255 7.087 -4.622 5.946 1.00 44.01 H new ATOM 0 HD12 ILE A 255 7.427 -6.367 5.862 1.00 44.01 H new ATOM 0 HD13 ILE A 255 5.758 -5.796 6.100 1.00 44.01 H new ATOM 1266 N THR A 256 4.120 -9.562 8.260 1.00 14.31 N ATOM 1267 CA THR A 256 3.500 -10.762 8.811 1.00 24.34 C ATOM 1268 C THR A 256 4.003 -12.012 8.031 1.00 11.31 C ATOM 1269 O THR A 256 5.176 -12.391 8.233 1.00 73.11 O ATOM 1270 CB THR A 256 1.930 -10.566 8.806 1.00 43.21 C ATOM 1271 OG1 THR A 256 1.250 -11.793 9.105 1.00 60.00 O ATOM 1272 CG2 THR A 256 1.403 -9.969 7.479 1.00 1.11 C ATOM 1273 OXT THR A 256 3.264 -12.607 7.223 1.00 37.49 O ATOM 0 H THR A 256 4.001 -9.477 7.250 1.00 14.31 H new ATOM 0 HA THR A 256 3.787 -10.931 9.849 1.00 24.34 H new ATOM 0 HB THR A 256 1.714 -9.843 9.593 1.00 43.21 H new ATOM 0 HG1 THR A 256 0.282 -11.641 9.096 1.00 60.00 H new ATOM 0 HG21 THR A 256 0.320 -9.858 7.535 1.00 1.11 H new ATOM 0 HG22 THR A 256 1.860 -8.994 7.312 1.00 1.11 H new ATOM 0 HG23 THR A 256 1.657 -10.635 6.654 1.00 1.11 H new TER 1281 THR A 256