USER MOD reduce.3.24.130724 H: found=0, std=0, add=644, rem=0, adj=15 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 USER MOD Single : A 172 THR OG1 : rot 180:sc= 0 USER MOD Single : A 177 GLN : amide:sc= -3.27! C(o=-3.3!,f=-2.4!) USER MOD Single : A 179 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 181 SER OG : rot 180:sc= 0 USER MOD Single : A 184 SER OG : rot -112:sc= 1.04 USER MOD Single : A 187 SER OG : rot 180:sc= 0 USER MOD Single : A 190 SER OG : rot 180:sc= 0 USER MOD Single : A 191 GLN : amide:sc= 0.266 X(o=0.27,f=-0.064) USER MOD Single : A 194 TYR OH : rot -75:sc= 0.00165 USER MOD Single : A 196 THR OG1 : rot 180:sc= 0 USER MOD Single : A 209 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 213 MET CE :methyl 157:sc= 0 (180deg=-0.76) USER MOD Single : A 214 THR OG1 : rot 141:sc= -0.229 USER MOD Single : A 227 THR OG1 : rot 79:sc= 0.647 USER MOD Single : A 228 GLN : amide:sc= 0.151 K(o=0.15,f=-6.4!) USER MOD Single : A 232 LYS NZ :NH3+ -173:sc= 0.0511 (180deg=0.04) USER MOD Single : A 236 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 238 LYS NZ :NH3+ -156:sc= -0.0621 (180deg=-0.245) USER MOD Single : A 250 TYR OH : rot -84:sc= 0.34 USER MOD Single : A 256 THR OG1 : rot -53:sc= 0.179 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 168 0.570 8.958 -15.019 1.00 10.01 N ATOM 2 CA MET A 168 0.484 7.737 -14.180 1.00 61.53 C ATOM 3 C MET A 168 1.702 6.849 -14.443 1.00 13.14 C ATOM 4 O MET A 168 2.183 6.764 -15.578 1.00 23.14 O ATOM 5 CB MET A 168 -0.835 6.962 -14.459 1.00 31.05 C ATOM 6 CG MET A 168 -2.123 7.766 -14.192 1.00 42.33 C ATOM 7 SD MET A 168 -2.259 9.233 -15.249 1.00 55.41 S ATOM 8 CE MET A 168 -3.734 10.016 -14.611 1.00 60.24 C ATOM 0 HA MET A 168 0.477 8.030 -13.130 1.00 61.53 H new ATOM 0 HB2 MET A 168 -0.836 6.636 -15.499 1.00 31.05 H new ATOM 0 HB3 MET A 168 -0.850 6.063 -13.843 1.00 31.05 H new ATOM 0 HG2 MET A 168 -2.988 7.124 -14.355 1.00 42.33 H new ATOM 0 HG3 MET A 168 -2.146 8.073 -13.146 1.00 42.33 H new ATOM 0 HE1 MET A 168 -3.933 10.929 -15.172 1.00 60.24 H new ATOM 0 HE2 MET A 168 -4.580 9.336 -14.713 1.00 60.24 H new ATOM 0 HE3 MET A 168 -3.590 10.260 -13.559 1.00 60.24 H new ATOM 20 N GLU A 169 2.196 6.193 -13.383 1.00 12.35 N ATOM 21 CA GLU A 169 3.389 5.326 -13.446 1.00 73.34 C ATOM 22 C GLU A 169 3.001 3.899 -13.892 1.00 11.14 C ATOM 23 O GLU A 169 1.821 3.520 -13.843 1.00 55.43 O ATOM 24 CB GLU A 169 4.089 5.321 -12.053 1.00 74.30 C ATOM 25 CG GLU A 169 5.461 4.616 -12.008 1.00 13.21 C ATOM 26 CD GLU A 169 6.153 4.741 -10.649 1.00 21.04 C ATOM 27 OE1 GLU A 169 6.040 3.825 -9.811 1.00 53.41 O ATOM 28 OE2 GLU A 169 6.823 5.764 -10.414 1.00 71.22 O ATOM 0 H GLU A 169 1.780 6.247 -12.453 1.00 12.35 H new ATOM 0 HA GLU A 169 4.088 5.715 -14.187 1.00 73.34 H new ATOM 0 HB2 GLU A 169 4.218 6.353 -11.726 1.00 74.30 H new ATOM 0 HB3 GLU A 169 3.427 4.839 -11.334 1.00 74.30 H new ATOM 0 HG2 GLU A 169 5.329 3.561 -12.247 1.00 13.21 H new ATOM 0 HG3 GLU A 169 6.106 5.039 -12.778 1.00 13.21 H new ATOM 35 N THR A 170 4.010 3.138 -14.346 1.00 21.12 N ATOM 36 CA THR A 170 3.880 1.720 -14.723 1.00 54.35 C ATOM 37 C THR A 170 3.394 0.860 -13.531 1.00 63.32 C ATOM 38 O THR A 170 2.635 -0.100 -13.713 1.00 42.00 O ATOM 39 CB THR A 170 5.253 1.193 -15.243 1.00 4.23 C ATOM 40 OG1 THR A 170 6.248 1.405 -14.231 1.00 13.30 O ATOM 41 CG2 THR A 170 5.691 1.904 -16.544 1.00 54.15 C ATOM 0 H THR A 170 4.957 3.497 -14.464 1.00 21.12 H new ATOM 0 HA THR A 170 3.133 1.641 -15.513 1.00 54.35 H new ATOM 0 HB THR A 170 5.145 0.131 -15.464 1.00 4.23 H new ATOM 0 HG1 THR A 170 7.114 1.075 -14.549 1.00 13.30 H new ATOM 0 HG21 THR A 170 6.652 1.506 -16.870 1.00 54.15 H new ATOM 0 HG22 THR A 170 4.945 1.734 -17.320 1.00 54.15 H new ATOM 0 HG23 THR A 170 5.785 2.974 -16.360 1.00 54.15 H new ATOM 49 N ALA A 171 3.847 1.225 -12.315 1.00 34.12 N ATOM 50 CA ALA A 171 3.334 0.655 -11.060 1.00 13.13 C ATOM 51 C ALA A 171 1.974 1.284 -10.734 1.00 33.42 C ATOM 52 O ALA A 171 1.772 2.486 -10.959 1.00 14.33 O ATOM 53 CB ALA A 171 4.322 0.892 -9.909 1.00 12.33 C ATOM 0 H ALA A 171 4.578 1.923 -12.179 1.00 34.12 H new ATOM 0 HA ALA A 171 3.215 -0.421 -11.183 1.00 13.13 H new ATOM 0 HB1 ALA A 171 3.921 0.462 -8.991 1.00 12.33 H new ATOM 0 HB2 ALA A 171 5.276 0.420 -10.145 1.00 12.33 H new ATOM 0 HB3 ALA A 171 4.472 1.963 -9.773 1.00 12.33 H new ATOM 59 N THR A 172 1.049 0.464 -10.217 1.00 41.12 N ATOM 60 CA THR A 172 -0.306 0.903 -9.849 1.00 11.43 C ATOM 61 C THR A 172 -0.273 1.811 -8.587 1.00 21.43 C ATOM 62 O THR A 172 -1.212 2.565 -8.317 1.00 61.43 O ATOM 63 CB THR A 172 -1.223 -0.349 -9.625 1.00 12.10 C ATOM 64 OG1 THR A 172 -1.059 -1.266 -10.727 1.00 51.42 O ATOM 65 CG2 THR A 172 -2.714 0.022 -9.506 1.00 15.14 C ATOM 0 H THR A 172 1.219 -0.526 -10.041 1.00 41.12 H new ATOM 0 HA THR A 172 -0.720 1.497 -10.664 1.00 11.43 H new ATOM 0 HB THR A 172 -0.918 -0.807 -8.684 1.00 12.10 H new ATOM 0 HG1 THR A 172 -1.630 -2.050 -10.588 1.00 51.42 H new ATOM 0 HG21 THR A 172 -3.303 -0.882 -9.352 1.00 15.14 H new ATOM 0 HG22 THR A 172 -2.855 0.695 -8.660 1.00 15.14 H new ATOM 0 HG23 THR A 172 -3.040 0.516 -10.421 1.00 15.14 H new ATOM 73 N ALA A 173 0.828 1.718 -7.825 1.00 12.41 N ATOM 74 CA ALA A 173 1.062 2.536 -6.620 1.00 34.01 C ATOM 75 C ALA A 173 1.854 3.824 -6.943 1.00 73.51 C ATOM 76 O ALA A 173 2.443 3.953 -8.021 1.00 0.32 O ATOM 77 CB ALA A 173 1.796 1.696 -5.562 1.00 75.20 C ATOM 0 H ALA A 173 1.588 1.069 -8.028 1.00 12.41 H new ATOM 0 HA ALA A 173 0.094 2.848 -6.227 1.00 34.01 H new ATOM 0 HB1 ALA A 173 1.968 2.301 -4.672 1.00 75.20 H new ATOM 0 HB2 ALA A 173 1.189 0.830 -5.300 1.00 75.20 H new ATOM 0 HB3 ALA A 173 2.752 1.360 -5.963 1.00 75.20 H new ATOM 83 N GLY A 174 1.857 4.754 -5.971 1.00 12.33 N ATOM 84 CA GLY A 174 2.584 6.019 -6.056 1.00 33.42 C ATOM 85 C GLY A 174 4.007 5.850 -5.554 1.00 60.23 C ATOM 86 O GLY A 174 4.868 5.381 -6.298 1.00 72.33 O ATOM 0 H GLY A 174 1.346 4.640 -5.096 1.00 12.33 H new ATOM 0 HA2 GLY A 174 2.596 6.370 -7.088 1.00 33.42 H new ATOM 0 HA3 GLY A 174 2.072 6.780 -5.466 1.00 33.42 H new ATOM 90 N GLU A 175 4.246 6.192 -4.280 1.00 32.41 N ATOM 91 CA GLU A 175 5.558 5.993 -3.625 1.00 42.33 C ATOM 92 C GLU A 175 5.360 5.305 -2.268 1.00 63.32 C ATOM 93 O GLU A 175 4.221 5.092 -1.820 1.00 43.32 O ATOM 94 CB GLU A 175 6.290 7.353 -3.423 1.00 35.32 C ATOM 95 CG GLU A 175 5.663 8.257 -2.340 1.00 23.10 C ATOM 96 CD GLU A 175 6.392 9.592 -2.177 1.00 24.32 C ATOM 97 OE1 GLU A 175 7.413 9.646 -1.452 1.00 15.23 O ATOM 98 OE2 GLU A 175 5.943 10.589 -2.771 1.00 34.50 O ATOM 0 H GLU A 175 3.543 6.613 -3.673 1.00 32.41 H new ATOM 0 HA GLU A 175 6.172 5.363 -4.269 1.00 42.33 H new ATOM 0 HB2 GLU A 175 7.329 7.157 -3.159 1.00 35.32 H new ATOM 0 HB3 GLU A 175 6.298 7.892 -4.370 1.00 35.32 H new ATOM 0 HG2 GLU A 175 4.620 8.448 -2.594 1.00 23.10 H new ATOM 0 HG3 GLU A 175 5.668 7.729 -1.387 1.00 23.10 H new ATOM 105 N TRP A 176 6.488 4.973 -1.625 1.00 62.45 N ATOM 106 CA TRP A 176 6.509 4.492 -0.243 1.00 11.25 C ATOM 107 C TRP A 176 6.580 5.682 0.730 1.00 24.51 C ATOM 108 O TRP A 176 5.576 6.031 1.360 1.00 2.31 O ATOM 109 CB TRP A 176 7.686 3.480 -0.037 1.00 11.41 C ATOM 110 CG TRP A 176 7.277 2.050 -0.315 1.00 53.13 C ATOM 111 CD1 TRP A 176 7.108 1.443 -1.530 1.00 14.13 C ATOM 112 CD2 TRP A 176 6.941 1.064 0.666 1.00 24.53 C ATOM 113 NE1 TRP A 176 6.676 0.147 -1.346 1.00 31.15 N ATOM 114 CE2 TRP A 176 6.575 -0.106 -0.015 1.00 72.12 C ATOM 115 CE3 TRP A 176 6.915 1.067 2.057 1.00 60.23 C ATOM 116 CZ2 TRP A 176 6.190 -1.266 0.641 1.00 43.24 C ATOM 117 CZ3 TRP A 176 6.540 -0.084 2.704 1.00 13.53 C ATOM 118 CH2 TRP A 176 6.177 -1.239 1.998 1.00 42.12 C ATOM 0 H TRP A 176 7.412 5.032 -2.053 1.00 62.45 H new ATOM 0 HA TRP A 176 5.585 3.954 -0.030 1.00 11.25 H new ATOM 0 HB2 TRP A 176 8.513 3.752 -0.693 1.00 11.41 H new ATOM 0 HB3 TRP A 176 8.052 3.557 0.987 1.00 11.41 H new ATOM 0 HD1 TRP A 176 7.286 1.909 -2.488 1.00 14.13 H new ATOM 0 HE1 TRP A 176 6.465 -0.517 -2.091 1.00 31.15 H new ATOM 0 HE3 TRP A 176 7.183 1.953 2.614 1.00 60.23 H new ATOM 0 HZ2 TRP A 176 5.912 -2.155 0.094 1.00 43.24 H new ATOM 0 HZ3 TRP A 176 6.524 -0.100 3.784 1.00 13.53 H new ATOM 0 HH2 TRP A 176 5.882 -2.123 2.543 1.00 42.12 H new ATOM 129 N GLN A 177 7.759 6.325 0.806 1.00 61.31 N ATOM 130 CA GLN A 177 8.061 7.347 1.833 1.00 42.32 C ATOM 131 C GLN A 177 9.378 8.069 1.488 1.00 41.32 C ATOM 132 O GLN A 177 10.104 8.537 2.376 1.00 53.13 O ATOM 133 CB GLN A 177 8.160 6.656 3.228 1.00 62.51 C ATOM 134 CG GLN A 177 9.173 5.481 3.284 1.00 32.24 C ATOM 135 CD GLN A 177 9.338 4.835 4.663 1.00 14.10 C ATOM 136 OE1 GLN A 177 10.424 4.360 5.009 1.00 64.52 O ATOM 137 NE2 GLN A 177 8.265 4.761 5.439 1.00 41.04 N ATOM 0 H GLN A 177 8.530 6.154 0.160 1.00 61.31 H new ATOM 0 HA GLN A 177 7.264 8.090 1.859 1.00 42.32 H new ATOM 0 HB2 GLN A 177 8.443 7.401 3.971 1.00 62.51 H new ATOM 0 HB3 GLN A 177 7.174 6.285 3.508 1.00 62.51 H new ATOM 0 HG2 GLN A 177 8.858 4.715 2.576 1.00 32.24 H new ATOM 0 HG3 GLN A 177 10.145 5.843 2.950 1.00 32.24 H new ATOM 0 HE21 GLN A 177 7.381 5.163 5.127 1.00 41.04 H new ATOM 0 HE22 GLN A 177 8.324 4.302 6.348 1.00 41.04 H new ATOM 146 N GLY A 178 9.645 8.209 0.181 1.00 22.35 N ATOM 147 CA GLY A 178 10.946 8.673 -0.299 1.00 20.25 C ATOM 148 C GLY A 178 11.912 7.517 -0.512 1.00 0.40 C ATOM 149 O GLY A 178 12.886 7.352 0.231 1.00 53.13 O ATOM 0 H GLY A 178 8.974 8.006 -0.560 1.00 22.35 H new ATOM 0 HA2 GLY A 178 10.816 9.216 -1.235 1.00 20.25 H new ATOM 0 HA3 GLY A 178 11.370 9.374 0.420 1.00 20.25 H new ATOM 153 N LYS A 179 11.614 6.703 -1.532 1.00 61.43 N ATOM 154 CA LYS A 179 12.427 5.543 -1.944 1.00 1.45 C ATOM 155 C LYS A 179 12.775 5.714 -3.426 1.00 23.25 C ATOM 156 O LYS A 179 11.876 5.682 -4.278 1.00 14.20 O ATOM 157 CB LYS A 179 11.652 4.204 -1.683 1.00 1.31 C ATOM 158 CG LYS A 179 11.910 3.573 -0.292 1.00 61.45 C ATOM 159 CD LYS A 179 13.366 3.059 -0.160 1.00 54.21 C ATOM 160 CE LYS A 179 13.633 2.336 1.167 1.00 22.10 C ATOM 161 NZ LYS A 179 13.547 3.247 2.335 1.00 14.41 N ATOM 0 H LYS A 179 10.783 6.832 -2.109 1.00 61.43 H new ATOM 0 HA LYS A 179 13.345 5.493 -1.358 1.00 1.45 H new ATOM 0 HB2 LYS A 179 10.583 4.391 -1.791 1.00 1.31 H new ATOM 0 HB3 LYS A 179 11.929 3.483 -2.452 1.00 1.31 H new ATOM 0 HG2 LYS A 179 11.712 4.311 0.485 1.00 61.45 H new ATOM 0 HG3 LYS A 179 11.216 2.748 -0.132 1.00 61.45 H new ATOM 0 HD2 LYS A 179 13.581 2.381 -0.986 1.00 54.21 H new ATOM 0 HD3 LYS A 179 14.052 3.901 -0.252 1.00 54.21 H new ATOM 0 HE2 LYS A 179 12.913 1.526 1.288 1.00 22.10 H new ATOM 0 HE3 LYS A 179 14.623 1.881 1.137 1.00 22.10 H new ATOM 0 HZ1 LYS A 179 13.735 2.712 3.207 1.00 14.41 H new ATOM 0 HZ2 LYS A 179 14.251 4.006 2.236 1.00 14.41 H new ATOM 0 HZ3 LYS A 179 12.595 3.662 2.382 1.00 14.41 H new ATOM 175 N GLY A 180 14.078 5.918 -3.720 1.00 3.45 N ATOM 176 CA GLY A 180 14.543 6.292 -5.060 1.00 50.35 C ATOM 177 C GLY A 180 14.322 7.781 -5.318 1.00 10.30 C ATOM 178 O GLY A 180 15.271 8.534 -5.562 1.00 51.30 O ATOM 0 H GLY A 180 14.828 5.827 -3.034 1.00 3.45 H new ATOM 0 HA2 GLY A 180 15.602 6.055 -5.161 1.00 50.35 H new ATOM 0 HA3 GLY A 180 14.012 5.706 -5.810 1.00 50.35 H new ATOM 182 N SER A 181 13.050 8.189 -5.251 1.00 52.22 N ATOM 183 CA SER A 181 12.624 9.588 -5.289 1.00 4.44 C ATOM 184 C SER A 181 11.481 9.785 -4.272 1.00 14.32 C ATOM 185 O SER A 181 10.711 8.848 -3.996 1.00 54.43 O ATOM 186 CB SER A 181 12.164 9.957 -6.721 1.00 62.11 C ATOM 187 OG SER A 181 11.113 9.114 -7.165 1.00 13.31 O ATOM 0 H SER A 181 12.270 7.537 -5.167 1.00 52.22 H new ATOM 0 HA SER A 181 13.453 10.244 -5.023 1.00 4.44 H new ATOM 0 HB2 SER A 181 11.832 10.995 -6.741 1.00 62.11 H new ATOM 0 HB3 SER A 181 13.008 9.879 -7.406 1.00 62.11 H new ATOM 0 HG SER A 181 10.845 9.375 -8.071 1.00 13.31 H new ATOM 193 N GLY A 182 11.390 11.001 -3.716 1.00 52.32 N ATOM 194 CA GLY A 182 10.336 11.374 -2.766 1.00 71.12 C ATOM 195 C GLY A 182 9.526 12.551 -3.284 1.00 24.10 C ATOM 196 O GLY A 182 10.106 13.516 -3.797 1.00 42.35 O ATOM 0 H GLY A 182 12.048 11.755 -3.914 1.00 52.32 H new ATOM 0 HA2 GLY A 182 9.678 10.522 -2.595 1.00 71.12 H new ATOM 0 HA3 GLY A 182 10.782 11.630 -1.805 1.00 71.12 H new ATOM 200 N GLY A 183 8.190 12.471 -3.163 1.00 41.10 N ATOM 201 CA GLY A 183 7.293 13.535 -3.622 1.00 63.44 C ATOM 202 C GLY A 183 7.281 14.719 -2.662 1.00 62.52 C ATOM 203 O GLY A 183 7.626 15.845 -3.046 1.00 52.52 O ATOM 0 H GLY A 183 7.709 11.673 -2.748 1.00 41.10 H new ATOM 0 HA2 GLY A 183 7.605 13.872 -4.611 1.00 63.44 H new ATOM 0 HA3 GLY A 183 6.282 13.140 -3.724 1.00 63.44 H new ATOM 207 N SER A 184 6.906 14.443 -1.403 1.00 22.44 N ATOM 208 CA SER A 184 6.814 15.463 -0.346 1.00 14.20 C ATOM 209 C SER A 184 6.789 14.791 1.040 1.00 51.52 C ATOM 210 O SER A 184 6.299 13.663 1.178 1.00 52.35 O ATOM 211 CB SER A 184 5.553 16.345 -0.554 1.00 33.02 C ATOM 212 OG SER A 184 4.370 15.558 -0.633 1.00 42.24 O ATOM 0 H SER A 184 6.658 13.505 -1.089 1.00 22.44 H new ATOM 0 HA SER A 184 7.692 16.107 -0.401 1.00 14.20 H new ATOM 0 HB2 SER A 184 5.465 17.054 0.269 1.00 33.02 H new ATOM 0 HB3 SER A 184 5.664 16.929 -1.468 1.00 33.02 H new ATOM 0 HG SER A 184 4.006 15.605 -1.542 1.00 42.24 H new ATOM 218 N GLY A 185 7.331 15.489 2.053 1.00 53.43 N ATOM 219 CA GLY A 185 7.364 14.985 3.429 1.00 4.34 C ATOM 220 C GLY A 185 6.162 15.437 4.245 1.00 71.13 C ATOM 221 O GLY A 185 6.311 16.204 5.208 1.00 3.54 O ATOM 0 H GLY A 185 7.754 16.410 1.939 1.00 53.43 H new ATOM 0 HA2 GLY A 185 7.399 13.896 3.413 1.00 4.34 H new ATOM 0 HA3 GLY A 185 8.278 15.326 3.915 1.00 4.34 H new ATOM 225 N GLY A 186 4.968 14.957 3.857 1.00 70.51 N ATOM 226 CA GLY A 186 3.734 15.287 4.564 1.00 42.12 C ATOM 227 C GLY A 186 2.525 14.579 3.970 1.00 14.05 C ATOM 228 O GLY A 186 2.449 14.395 2.747 1.00 75.43 O ATOM 0 H GLY A 186 4.839 14.339 3.056 1.00 70.51 H new ATOM 0 HA2 GLY A 186 3.834 15.012 5.614 1.00 42.12 H new ATOM 0 HA3 GLY A 186 3.575 16.365 4.530 1.00 42.12 H new ATOM 232 N SER A 187 1.584 14.175 4.840 1.00 21.42 N ATOM 233 CA SER A 187 0.357 13.453 4.443 1.00 61.20 C ATOM 234 C SER A 187 -0.869 13.986 5.228 1.00 50.53 C ATOM 235 O SER A 187 -0.769 14.270 6.424 1.00 33.32 O ATOM 236 CB SER A 187 0.537 11.937 4.706 1.00 21.43 C ATOM 237 OG SER A 187 1.592 11.388 3.921 1.00 13.30 O ATOM 0 H SER A 187 1.651 14.340 5.844 1.00 21.42 H new ATOM 0 HA SER A 187 0.182 13.618 3.380 1.00 61.20 H new ATOM 0 HB2 SER A 187 0.747 11.773 5.763 1.00 21.43 H new ATOM 0 HB3 SER A 187 -0.393 11.416 4.481 1.00 21.43 H new ATOM 0 HG SER A 187 1.679 10.431 4.113 1.00 13.30 H new ATOM 243 N GLY A 188 -2.009 14.126 4.533 1.00 63.25 N ATOM 244 CA GLY A 188 -3.269 14.552 5.140 1.00 24.31 C ATOM 245 C GLY A 188 -4.213 15.094 4.082 1.00 5.22 C ATOM 246 O GLY A 188 -4.252 16.309 3.843 1.00 5.43 O ATOM 0 H GLY A 188 -2.077 13.945 3.532 1.00 63.25 H new ATOM 0 HA2 GLY A 188 -3.734 13.711 5.654 1.00 24.31 H new ATOM 0 HA3 GLY A 188 -3.077 15.318 5.891 1.00 24.31 H new ATOM 250 N GLY A 189 -4.940 14.188 3.411 1.00 10.14 N ATOM 251 CA GLY A 189 -5.826 14.563 2.304 1.00 1.05 C ATOM 252 C GLY A 189 -7.307 14.522 2.657 1.00 2.34 C ATOM 253 O GLY A 189 -7.681 14.582 3.835 1.00 54.54 O ATOM 0 H GLY A 189 -4.930 13.189 3.618 1.00 10.14 H new ATOM 0 HA2 GLY A 189 -5.570 15.569 1.971 1.00 1.05 H new ATOM 0 HA3 GLY A 189 -5.644 13.893 1.463 1.00 1.05 H new ATOM 257 N SER A 190 -8.146 14.428 1.615 1.00 1.43 N ATOM 258 CA SER A 190 -9.624 14.459 1.726 1.00 35.50 C ATOM 259 C SER A 190 -10.221 13.277 0.952 1.00 52.52 C ATOM 260 O SER A 190 -9.594 12.811 0.000 1.00 62.12 O ATOM 261 CB SER A 190 -10.165 15.805 1.181 1.00 62.13 C ATOM 262 OG SER A 190 -9.556 16.908 1.837 1.00 3.11 O ATOM 0 H SER A 190 -7.819 14.327 0.654 1.00 1.43 H new ATOM 0 HA SER A 190 -9.915 14.372 2.773 1.00 35.50 H new ATOM 0 HB2 SER A 190 -9.978 15.868 0.109 1.00 62.13 H new ATOM 0 HB3 SER A 190 -11.245 15.848 1.319 1.00 62.13 H new ATOM 0 HG SER A 190 -9.914 17.744 1.472 1.00 3.11 H new ATOM 268 N GLN A 191 -11.425 12.793 1.379 1.00 10.35 N ATOM 269 CA GLN A 191 -12.090 11.573 0.816 1.00 3.54 C ATOM 270 C GLN A 191 -11.183 10.326 0.975 1.00 61.54 C ATOM 271 O GLN A 191 -11.352 9.306 0.278 1.00 50.15 O ATOM 272 CB GLN A 191 -12.462 11.797 -0.677 1.00 11.35 C ATOM 273 CG GLN A 191 -13.489 12.924 -0.953 1.00 30.40 C ATOM 274 CD GLN A 191 -13.553 13.359 -2.423 1.00 42.32 C ATOM 275 OE1 GLN A 191 -13.834 14.520 -2.734 1.00 44.50 O ATOM 276 NE2 GLN A 191 -13.336 12.437 -3.339 1.00 0.22 N ATOM 0 H GLN A 191 -11.963 13.237 2.123 1.00 10.35 H new ATOM 0 HA GLN A 191 -13.008 11.395 1.376 1.00 3.54 H new ATOM 0 HB2 GLN A 191 -11.549 12.019 -1.230 1.00 11.35 H new ATOM 0 HB3 GLN A 191 -12.858 10.864 -1.077 1.00 11.35 H new ATOM 0 HG2 GLN A 191 -14.477 12.586 -0.641 1.00 30.40 H new ATOM 0 HG3 GLN A 191 -13.239 13.789 -0.339 1.00 30.40 H new ATOM 0 HE21 GLN A 191 -13.105 11.484 -3.059 1.00 0.22 H new ATOM 0 HE22 GLN A 191 -13.399 12.676 -4.329 1.00 0.22 H new ATOM 285 N ASP A 192 -10.239 10.434 1.928 1.00 32.23 N ATOM 286 CA ASP A 192 -9.139 9.492 2.104 1.00 40.50 C ATOM 287 C ASP A 192 -9.588 8.190 2.778 1.00 41.23 C ATOM 288 O ASP A 192 -10.587 8.160 3.499 1.00 43.31 O ATOM 289 CB ASP A 192 -7.975 10.154 2.890 1.00 44.34 C ATOM 290 CG ASP A 192 -8.366 10.683 4.280 1.00 51.34 C ATOM 291 OD1 ASP A 192 -8.021 10.054 5.300 1.00 30.21 O ATOM 292 OD2 ASP A 192 -9.030 11.737 4.359 1.00 31.52 O ATOM 0 H ASP A 192 -10.227 11.196 2.606 1.00 32.23 H new ATOM 0 HA ASP A 192 -8.781 9.223 1.110 1.00 40.50 H new ATOM 0 HB2 ASP A 192 -7.171 9.427 3.004 1.00 44.34 H new ATOM 0 HB3 ASP A 192 -7.577 10.979 2.299 1.00 44.34 H new ATOM 297 N LEU A 193 -8.836 7.117 2.510 1.00 61.44 N ATOM 298 CA LEU A 193 -9.071 5.779 3.068 1.00 43.44 C ATOM 299 C LEU A 193 -7.881 5.369 3.935 1.00 11.20 C ATOM 300 O LEU A 193 -6.737 5.738 3.648 1.00 70.14 O ATOM 301 CB LEU A 193 -9.253 4.740 1.930 1.00 32.13 C ATOM 302 CG LEU A 193 -10.534 4.856 1.065 1.00 1.03 C ATOM 303 CD1 LEU A 193 -10.523 3.802 -0.061 1.00 2.45 C ATOM 304 CD2 LEU A 193 -11.798 4.727 1.931 1.00 53.11 C ATOM 0 H LEU A 193 -8.030 7.154 1.886 1.00 61.44 H new ATOM 0 HA LEU A 193 -9.978 5.809 3.671 1.00 43.44 H new ATOM 0 HB2 LEU A 193 -8.390 4.810 1.267 1.00 32.13 H new ATOM 0 HB3 LEU A 193 -9.234 3.745 2.374 1.00 32.13 H new ATOM 0 HG LEU A 193 -10.548 5.844 0.606 1.00 1.03 H new ATOM 0 HD11 LEU A 193 -11.430 3.898 -0.658 1.00 2.45 H new ATOM 0 HD12 LEU A 193 -9.652 3.958 -0.697 1.00 2.45 H new ATOM 0 HD13 LEU A 193 -10.480 2.804 0.375 1.00 2.45 H new ATOM 0 HD21 LEU A 193 -12.682 4.812 1.299 1.00 53.11 H new ATOM 0 HD22 LEU A 193 -11.800 3.758 2.430 1.00 53.11 H new ATOM 0 HD23 LEU A 193 -11.809 5.520 2.679 1.00 53.11 H new ATOM 316 N TYR A 194 -8.162 4.602 4.985 1.00 3.41 N ATOM 317 CA TYR A 194 -7.150 3.977 5.831 1.00 60.24 C ATOM 318 C TYR A 194 -7.277 2.458 5.685 1.00 10.05 C ATOM 319 O TYR A 194 -8.320 1.891 6.018 1.00 51.42 O ATOM 320 CB TYR A 194 -7.328 4.418 7.305 1.00 64.11 C ATOM 321 CG TYR A 194 -6.293 3.827 8.284 1.00 71.44 C ATOM 322 CD1 TYR A 194 -4.935 3.740 7.940 1.00 11.32 C ATOM 323 CD2 TYR A 194 -6.665 3.376 9.555 1.00 31.23 C ATOM 324 CE1 TYR A 194 -4.002 3.226 8.819 1.00 54.31 C ATOM 325 CE2 TYR A 194 -5.731 2.861 10.435 1.00 54.04 C ATOM 326 CZ TYR A 194 -4.403 2.788 10.064 1.00 5.22 C ATOM 327 OH TYR A 194 -3.476 2.268 10.941 1.00 53.33 O ATOM 0 H TYR A 194 -9.117 4.394 5.277 1.00 3.41 H new ATOM 0 HA TYR A 194 -6.153 4.289 5.521 1.00 60.24 H new ATOM 0 HB2 TYR A 194 -7.274 5.506 7.354 1.00 64.11 H new ATOM 0 HB3 TYR A 194 -8.326 4.133 7.637 1.00 64.11 H new ATOM 0 HD1 TYR A 194 -4.613 4.082 6.968 1.00 11.32 H new ATOM 0 HD2 TYR A 194 -7.701 3.431 9.854 1.00 31.23 H new ATOM 0 HE1 TYR A 194 -2.962 3.167 8.533 1.00 54.31 H new ATOM 0 HE2 TYR A 194 -6.040 2.516 11.411 1.00 54.04 H new ATOM 0 HH TYR A 194 -3.226 1.364 10.655 1.00 53.33 H new ATOM 337 N ALA A 195 -6.219 1.816 5.176 1.00 10.43 N ATOM 338 CA ALA A 195 -6.180 0.354 4.958 1.00 21.43 C ATOM 339 C ALA A 195 -4.894 -0.231 5.565 1.00 65.31 C ATOM 340 O ALA A 195 -4.173 0.466 6.287 1.00 70.11 O ATOM 341 CB ALA A 195 -6.321 0.024 3.456 1.00 73.22 C ATOM 0 H ALA A 195 -5.360 2.292 4.901 1.00 10.43 H new ATOM 0 HA ALA A 195 -7.026 -0.110 5.465 1.00 21.43 H new ATOM 0 HB1 ALA A 195 -6.290 -1.057 3.316 1.00 73.22 H new ATOM 0 HB2 ALA A 195 -7.271 0.411 3.086 1.00 73.22 H new ATOM 0 HB3 ALA A 195 -5.502 0.485 2.904 1.00 73.22 H new ATOM 347 N THR A 196 -4.644 -1.530 5.336 1.00 71.02 N ATOM 348 CA THR A 196 -3.426 -2.217 5.802 1.00 23.40 C ATOM 349 C THR A 196 -2.693 -2.877 4.611 1.00 63.24 C ATOM 350 O THR A 196 -3.278 -3.715 3.911 1.00 54.24 O ATOM 351 CB THR A 196 -3.796 -3.295 6.881 1.00 43.23 C ATOM 352 OG1 THR A 196 -4.470 -2.656 7.981 1.00 63.22 O ATOM 353 CG2 THR A 196 -2.561 -4.052 7.410 1.00 34.40 C ATOM 0 H THR A 196 -5.282 -2.136 4.821 1.00 71.02 H new ATOM 0 HA THR A 196 -2.759 -1.483 6.254 1.00 23.40 H new ATOM 0 HB THR A 196 -4.446 -4.027 6.401 1.00 43.23 H new ATOM 0 HG1 THR A 196 -4.704 -3.327 8.656 1.00 63.22 H new ATOM 0 HG21 THR A 196 -2.874 -4.785 8.153 1.00 34.40 H new ATOM 0 HG22 THR A 196 -2.065 -4.562 6.584 1.00 34.40 H new ATOM 0 HG23 THR A 196 -1.869 -3.345 7.867 1.00 34.40 H new ATOM 361 N LEU A 197 -1.425 -2.481 4.372 1.00 35.31 N ATOM 362 CA LEU A 197 -0.559 -3.141 3.383 1.00 30.45 C ATOM 363 C LEU A 197 -0.022 -4.435 4.011 1.00 54.13 C ATOM 364 O LEU A 197 0.833 -4.386 4.901 1.00 11.32 O ATOM 365 CB LEU A 197 0.622 -2.225 2.947 1.00 12.43 C ATOM 366 CG LEU A 197 1.379 -2.656 1.648 1.00 21.42 C ATOM 367 CD1 LEU A 197 0.424 -2.721 0.443 1.00 43.12 C ATOM 368 CD2 LEU A 197 2.564 -1.720 1.363 1.00 23.02 C ATOM 0 H LEU A 197 -0.980 -1.702 4.856 1.00 35.31 H new ATOM 0 HA LEU A 197 -1.140 -3.358 2.487 1.00 30.45 H new ATOM 0 HB2 LEU A 197 0.238 -1.215 2.802 1.00 12.43 H new ATOM 0 HB3 LEU A 197 1.341 -2.179 3.765 1.00 12.43 H new ATOM 0 HG LEU A 197 1.776 -3.658 1.812 1.00 21.42 H new ATOM 0 HD11 LEU A 197 0.979 -3.023 -0.445 1.00 43.12 H new ATOM 0 HD12 LEU A 197 -0.365 -3.447 0.642 1.00 43.12 H new ATOM 0 HD13 LEU A 197 -0.020 -1.739 0.277 1.00 43.12 H new ATOM 0 HD21 LEU A 197 3.072 -2.043 0.454 1.00 23.02 H new ATOM 0 HD22 LEU A 197 2.200 -0.701 1.232 1.00 23.02 H new ATOM 0 HD23 LEU A 197 3.262 -1.751 2.200 1.00 23.02 H new ATOM 380 N ASP A 198 -0.555 -5.581 3.580 1.00 33.21 N ATOM 381 CA ASP A 198 -0.207 -6.889 4.163 1.00 3.05 C ATOM 382 C ASP A 198 1.049 -7.427 3.458 1.00 41.53 C ATOM 383 O ASP A 198 0.968 -7.909 2.321 1.00 50.24 O ATOM 384 CB ASP A 198 -1.408 -7.869 4.005 1.00 51.12 C ATOM 385 CG ASP A 198 -1.241 -9.186 4.793 1.00 43.33 C ATOM 386 OD1 ASP A 198 -0.864 -10.222 4.206 1.00 2.34 O ATOM 387 OD2 ASP A 198 -1.504 -9.183 6.011 1.00 61.42 O ATOM 0 H ASP A 198 -1.236 -5.634 2.822 1.00 33.21 H new ATOM 0 HA ASP A 198 0.005 -6.787 5.227 1.00 3.05 H new ATOM 0 HB2 ASP A 198 -2.319 -7.370 4.337 1.00 51.12 H new ATOM 0 HB3 ASP A 198 -1.539 -8.102 2.948 1.00 51.12 H new ATOM 392 N VAL A 199 2.216 -7.288 4.114 1.00 41.42 N ATOM 393 CA VAL A 199 3.506 -7.739 3.572 1.00 34.34 C ATOM 394 C VAL A 199 4.021 -8.908 4.423 1.00 11.12 C ATOM 395 O VAL A 199 4.331 -8.696 5.586 1.00 20.15 O ATOM 396 CB VAL A 199 4.595 -6.591 3.576 1.00 25.43 C ATOM 397 CG1 VAL A 199 5.852 -7.019 2.796 1.00 54.53 C ATOM 398 CG2 VAL A 199 4.049 -5.248 3.057 1.00 63.24 C ATOM 0 H VAL A 199 2.288 -6.859 5.036 1.00 41.42 H new ATOM 0 HA VAL A 199 3.343 -8.041 2.538 1.00 34.34 H new ATOM 0 HB VAL A 199 4.874 -6.429 4.617 1.00 25.43 H new ATOM 0 HG11 VAL A 199 6.584 -6.212 2.815 1.00 54.53 H new ATOM 0 HG12 VAL A 199 6.281 -7.909 3.257 1.00 54.53 H new ATOM 0 HG13 VAL A 199 5.582 -7.240 1.763 1.00 54.53 H new ATOM 0 HG21 VAL A 199 4.840 -4.499 3.083 1.00 63.24 H new ATOM 0 HG22 VAL A 199 3.698 -5.370 2.032 1.00 63.24 H new ATOM 0 HG23 VAL A 199 3.222 -4.923 3.688 1.00 63.24 H new ATOM 408 N PRO A 200 4.123 -10.156 3.877 1.00 72.35 N ATOM 409 CA PRO A 200 4.772 -11.264 4.599 1.00 61.53 C ATOM 410 C PRO A 200 6.274 -10.991 4.773 1.00 34.34 C ATOM 411 O PRO A 200 6.883 -10.300 3.940 1.00 53.05 O ATOM 412 CB PRO A 200 4.484 -12.504 3.717 1.00 10.24 C ATOM 413 CG PRO A 200 4.215 -11.958 2.352 1.00 4.03 C ATOM 414 CD PRO A 200 3.626 -10.572 2.544 1.00 31.03 C ATOM 0 HA PRO A 200 4.396 -11.402 5.613 1.00 61.53 H new ATOM 0 HB2 PRO A 200 5.333 -13.187 3.708 1.00 10.24 H new ATOM 0 HB3 PRO A 200 3.628 -13.065 4.093 1.00 10.24 H new ATOM 0 HG2 PRO A 200 5.133 -11.910 1.767 1.00 4.03 H new ATOM 0 HG3 PRO A 200 3.523 -12.601 1.808 1.00 4.03 H new ATOM 0 HD2 PRO A 200 3.955 -9.886 1.763 1.00 31.03 H new ATOM 0 HD3 PRO A 200 2.537 -10.593 2.512 1.00 31.03 H new ATOM 422 N ALA A 201 6.848 -11.545 5.861 1.00 62.44 N ATOM 423 CA ALA A 201 8.273 -11.383 6.207 1.00 51.13 C ATOM 424 C ALA A 201 9.233 -11.766 5.040 1.00 74.33 C ATOM 425 O ALA A 201 10.172 -11.006 4.789 1.00 24.43 O ATOM 426 CB ALA A 201 8.609 -12.166 7.494 1.00 65.33 C ATOM 0 H ALA A 201 6.332 -12.120 6.527 1.00 62.44 H new ATOM 0 HA ALA A 201 8.436 -10.321 6.391 1.00 51.13 H new ATOM 0 HB1 ALA A 201 9.664 -12.035 7.734 1.00 65.33 H new ATOM 0 HB2 ALA A 201 8.000 -11.792 8.317 1.00 65.33 H new ATOM 0 HB3 ALA A 201 8.400 -13.225 7.341 1.00 65.33 H new ATOM 432 N PRO A 202 9.016 -12.916 4.282 1.00 32.15 N ATOM 433 CA PRO A 202 9.841 -13.244 3.083 1.00 30.12 C ATOM 434 C PRO A 202 9.853 -12.108 2.027 1.00 51.34 C ATOM 435 O PRO A 202 10.930 -11.663 1.629 1.00 65.22 O ATOM 436 CB PRO A 202 9.196 -14.548 2.528 1.00 45.44 C ATOM 437 CG PRO A 202 7.854 -14.652 3.197 1.00 71.25 C ATOM 438 CD PRO A 202 8.024 -14.008 4.548 1.00 32.11 C ATOM 0 HA PRO A 202 10.893 -13.370 3.339 1.00 30.12 H new ATOM 0 HB2 PRO A 202 9.091 -14.503 1.444 1.00 45.44 H new ATOM 0 HB3 PRO A 202 9.814 -15.417 2.752 1.00 45.44 H new ATOM 0 HG2 PRO A 202 7.085 -14.144 2.615 1.00 71.25 H new ATOM 0 HG3 PRO A 202 7.544 -15.693 3.295 1.00 71.25 H new ATOM 0 HD2 PRO A 202 7.082 -13.613 4.928 1.00 32.11 H new ATOM 0 HD3 PRO A 202 8.394 -14.717 5.289 1.00 32.11 H new ATOM 446 N ILE A 203 8.650 -11.622 1.620 1.00 54.44 N ATOM 447 CA ILE A 203 8.512 -10.538 0.612 1.00 45.43 C ATOM 448 C ILE A 203 9.131 -9.223 1.126 1.00 2.52 C ATOM 449 O ILE A 203 9.725 -8.467 0.351 1.00 53.23 O ATOM 450 CB ILE A 203 6.998 -10.316 0.190 1.00 13.11 C ATOM 451 CG1 ILE A 203 6.481 -11.545 -0.632 1.00 12.35 C ATOM 452 CG2 ILE A 203 6.786 -8.993 -0.593 1.00 75.11 C ATOM 453 CD1 ILE A 203 5.059 -11.416 -1.173 1.00 75.02 C ATOM 0 H ILE A 203 7.759 -11.966 1.977 1.00 54.44 H new ATOM 0 HA ILE A 203 9.060 -10.852 -0.277 1.00 45.43 H new ATOM 0 HB ILE A 203 6.414 -10.230 1.106 1.00 13.11 H new ATOM 0 HG12 ILE A 203 7.157 -11.711 -1.470 1.00 12.35 H new ATOM 0 HG13 ILE A 203 6.533 -12.432 -0.000 1.00 12.35 H new ATOM 0 HG21 ILE A 203 5.733 -8.891 -0.857 1.00 75.11 H new ATOM 0 HG22 ILE A 203 7.087 -8.150 0.029 1.00 75.11 H new ATOM 0 HG23 ILE A 203 7.388 -9.007 -1.501 1.00 75.11 H new ATOM 0 HD11 ILE A 203 4.797 -12.318 -1.726 1.00 75.02 H new ATOM 0 HD12 ILE A 203 4.365 -11.285 -0.343 1.00 75.02 H new ATOM 0 HD13 ILE A 203 4.999 -10.553 -1.836 1.00 75.02 H new ATOM 465 N ALA A 204 9.014 -8.988 2.442 1.00 43.44 N ATOM 466 CA ALA A 204 9.557 -7.787 3.087 1.00 35.14 C ATOM 467 C ALA A 204 11.087 -7.757 2.994 1.00 42.13 C ATOM 468 O ALA A 204 11.655 -6.736 2.624 1.00 3.22 O ATOM 469 CB ALA A 204 9.097 -7.713 4.543 1.00 33.22 C ATOM 0 H ALA A 204 8.542 -9.624 3.085 1.00 43.44 H new ATOM 0 HA ALA A 204 9.176 -6.912 2.560 1.00 35.14 H new ATOM 0 HB1 ALA A 204 9.507 -6.817 5.009 1.00 33.22 H new ATOM 0 HB2 ALA A 204 8.008 -7.675 4.579 1.00 33.22 H new ATOM 0 HB3 ALA A 204 9.447 -8.594 5.080 1.00 33.22 H new ATOM 475 N VAL A 205 11.721 -8.909 3.286 1.00 40.34 N ATOM 476 CA VAL A 205 13.188 -9.055 3.311 1.00 52.33 C ATOM 477 C VAL A 205 13.789 -9.047 1.892 1.00 70.30 C ATOM 478 O VAL A 205 14.725 -8.289 1.626 1.00 32.54 O ATOM 479 CB VAL A 205 13.604 -10.361 4.087 1.00 23.32 C ATOM 480 CG1 VAL A 205 15.120 -10.639 3.976 1.00 71.02 C ATOM 481 CG2 VAL A 205 13.171 -10.274 5.572 1.00 4.41 C ATOM 0 H VAL A 205 11.225 -9.771 3.513 1.00 40.34 H new ATOM 0 HA VAL A 205 13.593 -8.193 3.840 1.00 52.33 H new ATOM 0 HB VAL A 205 13.085 -11.198 3.620 1.00 23.32 H new ATOM 0 HG11 VAL A 205 15.364 -11.548 4.525 1.00 71.02 H new ATOM 0 HG12 VAL A 205 15.391 -10.764 2.928 1.00 71.02 H new ATOM 0 HG13 VAL A 205 15.675 -9.801 4.397 1.00 71.02 H new ATOM 0 HG21 VAL A 205 13.467 -11.185 6.091 1.00 4.41 H new ATOM 0 HG22 VAL A 205 13.652 -9.416 6.042 1.00 4.41 H new ATOM 0 HG23 VAL A 205 12.089 -10.159 5.629 1.00 4.41 H new ATOM 491 N VAL A 206 13.225 -9.854 0.979 1.00 23.30 N ATOM 492 CA VAL A 206 13.780 -10.016 -0.388 1.00 42.41 C ATOM 493 C VAL A 206 13.386 -8.820 -1.283 1.00 51.12 C ATOM 494 O VAL A 206 14.093 -8.494 -2.245 1.00 21.35 O ATOM 495 CB VAL A 206 13.313 -11.378 -1.050 1.00 33.13 C ATOM 496 CG1 VAL A 206 11.816 -11.361 -1.442 1.00 75.10 C ATOM 497 CG2 VAL A 206 14.208 -11.758 -2.256 1.00 65.20 C ATOM 0 H VAL A 206 12.386 -10.407 1.156 1.00 23.30 H new ATOM 0 HA VAL A 206 14.866 -10.044 -0.299 1.00 42.41 H new ATOM 0 HB VAL A 206 13.430 -12.151 -0.291 1.00 33.13 H new ATOM 0 HG11 VAL A 206 11.547 -12.317 -1.891 1.00 75.10 H new ATOM 0 HG12 VAL A 206 11.209 -11.194 -0.552 1.00 75.10 H new ATOM 0 HG13 VAL A 206 11.637 -10.560 -2.159 1.00 75.10 H new ATOM 0 HG21 VAL A 206 13.860 -12.697 -2.686 1.00 65.20 H new ATOM 0 HG22 VAL A 206 14.156 -10.972 -3.010 1.00 65.20 H new ATOM 0 HG23 VAL A 206 15.239 -11.872 -1.922 1.00 65.20 H new ATOM 507 N GLY A 207 12.270 -8.158 -0.924 1.00 75.24 N ATOM 508 CA GLY A 207 11.748 -7.033 -1.686 1.00 34.24 C ATOM 509 C GLY A 207 10.966 -7.492 -2.904 1.00 62.21 C ATOM 510 O GLY A 207 11.469 -7.418 -4.031 1.00 73.11 O ATOM 0 H GLY A 207 11.716 -8.394 -0.101 1.00 75.24 H new ATOM 0 HA2 GLY A 207 11.104 -6.429 -1.047 1.00 34.24 H new ATOM 0 HA3 GLY A 207 12.573 -6.394 -2.003 1.00 34.24 H new ATOM 514 N GLY A 208 9.733 -7.974 -2.669 1.00 14.42 N ATOM 515 CA GLY A 208 8.859 -8.486 -3.740 1.00 42.14 C ATOM 516 C GLY A 208 7.695 -7.535 -3.990 1.00 55.55 C ATOM 517 O GLY A 208 7.867 -6.327 -3.884 1.00 65.25 O ATOM 0 H GLY A 208 9.316 -8.020 -1.739 1.00 14.42 H new ATOM 0 HA2 GLY A 208 9.435 -8.612 -4.657 1.00 42.14 H new ATOM 0 HA3 GLY A 208 8.478 -9.470 -3.466 1.00 42.14 H new ATOM 521 N LYS A 209 6.510 -8.062 -4.320 1.00 44.33 N ATOM 522 CA LYS A 209 5.281 -7.247 -4.472 1.00 34.20 C ATOM 523 C LYS A 209 4.185 -7.741 -3.533 1.00 2.53 C ATOM 524 O LYS A 209 4.115 -8.932 -3.220 1.00 32.22 O ATOM 525 CB LYS A 209 4.759 -7.247 -5.948 1.00 52.05 C ATOM 526 CG LYS A 209 5.106 -5.979 -6.753 1.00 44.14 C ATOM 527 CD LYS A 209 4.439 -5.975 -8.142 1.00 0.44 C ATOM 528 CE LYS A 209 5.010 -7.046 -9.080 1.00 14.35 C ATOM 529 NZ LYS A 209 4.188 -7.184 -10.315 1.00 13.53 N ATOM 0 H LYS A 209 6.368 -9.058 -4.490 1.00 44.33 H new ATOM 0 HA LYS A 209 5.542 -6.222 -4.208 1.00 34.20 H new ATOM 0 HB2 LYS A 209 5.171 -8.113 -6.465 1.00 52.05 H new ATOM 0 HB3 LYS A 209 3.676 -7.369 -5.936 1.00 52.05 H new ATOM 0 HG2 LYS A 209 4.788 -5.098 -6.196 1.00 44.14 H new ATOM 0 HG3 LYS A 209 6.187 -5.909 -6.870 1.00 44.14 H new ATOM 0 HD2 LYS A 209 3.367 -6.135 -8.025 1.00 0.44 H new ATOM 0 HD3 LYS A 209 4.567 -4.993 -8.598 1.00 0.44 H new ATOM 0 HE2 LYS A 209 6.034 -6.786 -9.350 1.00 14.35 H new ATOM 0 HE3 LYS A 209 5.050 -8.003 -8.560 1.00 14.35 H new ATOM 0 HZ1 LYS A 209 4.601 -7.916 -10.927 1.00 13.53 H new ATOM 0 HZ2 LYS A 209 3.218 -7.455 -10.058 1.00 13.53 H new ATOM 0 HZ3 LYS A 209 4.170 -6.277 -10.823 1.00 13.53 H new ATOM 543 N VAL A 210 3.315 -6.804 -3.121 1.00 1.12 N ATOM 544 CA VAL A 210 2.100 -7.104 -2.328 1.00 21.04 C ATOM 545 C VAL A 210 0.936 -6.223 -2.799 1.00 62.52 C ATOM 546 O VAL A 210 1.157 -5.089 -3.244 1.00 63.14 O ATOM 547 CB VAL A 210 2.297 -6.891 -0.780 1.00 21.24 C ATOM 548 CG1 VAL A 210 3.295 -7.898 -0.183 1.00 75.24 C ATOM 549 CG2 VAL A 210 2.707 -5.442 -0.462 1.00 3.12 C ATOM 0 H VAL A 210 3.431 -5.812 -3.327 1.00 1.12 H new ATOM 0 HA VAL A 210 1.884 -8.160 -2.491 1.00 21.04 H new ATOM 0 HB VAL A 210 1.333 -7.076 -0.306 1.00 21.24 H new ATOM 0 HG11 VAL A 210 3.401 -7.715 0.886 1.00 75.24 H new ATOM 0 HG12 VAL A 210 2.929 -8.912 -0.343 1.00 75.24 H new ATOM 0 HG13 VAL A 210 4.264 -7.781 -0.669 1.00 75.24 H new ATOM 0 HG21 VAL A 210 2.835 -5.328 0.614 1.00 3.12 H new ATOM 0 HG22 VAL A 210 3.646 -5.211 -0.966 1.00 3.12 H new ATOM 0 HG23 VAL A 210 1.931 -4.760 -0.809 1.00 3.12 H new ATOM 559 N ARG A 211 -0.292 -6.746 -2.689 1.00 41.34 N ATOM 560 CA ARG A 211 -1.512 -6.005 -3.044 1.00 64.22 C ATOM 561 C ARG A 211 -1.838 -4.930 -1.985 1.00 65.40 C ATOM 562 O ARG A 211 -1.624 -5.127 -0.782 1.00 35.11 O ATOM 563 CB ARG A 211 -2.715 -6.969 -3.194 1.00 40.32 C ATOM 564 CG ARG A 211 -4.032 -6.275 -3.625 1.00 23.25 C ATOM 565 CD ARG A 211 -5.274 -7.148 -3.425 1.00 1.42 C ATOM 566 NE ARG A 211 -5.222 -8.393 -4.216 1.00 20.00 N ATOM 567 CZ ARG A 211 -6.285 -9.081 -4.665 1.00 34.51 C ATOM 568 NH1 ARG A 211 -7.530 -8.662 -4.425 1.00 71.22 N ATOM 569 NH2 ARG A 211 -6.085 -10.191 -5.369 1.00 44.42 N ATOM 0 H ARG A 211 -0.469 -7.692 -2.352 1.00 41.34 H new ATOM 0 HA ARG A 211 -1.330 -5.511 -3.998 1.00 64.22 H new ATOM 0 HB2 ARG A 211 -2.464 -7.735 -3.928 1.00 40.32 H new ATOM 0 HB3 ARG A 211 -2.879 -7.478 -2.244 1.00 40.32 H new ATOM 0 HG2 ARG A 211 -4.150 -5.352 -3.057 1.00 23.25 H new ATOM 0 HG3 ARG A 211 -3.959 -5.995 -4.676 1.00 23.25 H new ATOM 0 HD2 ARG A 211 -5.373 -7.396 -2.368 1.00 1.42 H new ATOM 0 HD3 ARG A 211 -6.162 -6.581 -3.704 1.00 1.42 H new ATOM 0 HE ARG A 211 -4.299 -8.763 -4.441 1.00 20.00 H new ATOM 0 HH11 ARG A 211 -7.686 -7.806 -3.893 1.00 71.22 H new ATOM 0 HH12 ARG A 211 -8.325 -9.198 -4.774 1.00 71.22 H new ATOM 0 HH21 ARG A 211 -5.135 -10.509 -5.561 1.00 44.42 H new ATOM 0 HH22 ARG A 211 -6.882 -10.725 -5.717 1.00 44.42 H new ATOM 583 N ALA A 212 -2.377 -3.814 -2.479 1.00 22.45 N ATOM 584 CA ALA A 212 -2.880 -2.701 -1.686 1.00 2.22 C ATOM 585 C ALA A 212 -4.377 -2.541 -2.019 1.00 74.02 C ATOM 586 O ALA A 212 -4.726 -2.276 -3.176 1.00 23.52 O ATOM 587 CB ALA A 212 -2.072 -1.442 -2.034 1.00 75.12 C ATOM 0 H ALA A 212 -2.477 -3.659 -3.482 1.00 22.45 H new ATOM 0 HA ALA A 212 -2.772 -2.874 -0.615 1.00 2.22 H new ATOM 0 HB1 ALA A 212 -2.439 -0.600 -1.447 1.00 75.12 H new ATOM 0 HB2 ALA A 212 -1.019 -1.611 -1.808 1.00 75.12 H new ATOM 0 HB3 ALA A 212 -2.184 -1.220 -3.095 1.00 75.12 H new ATOM 593 N MET A 213 -5.252 -2.757 -1.014 1.00 42.23 N ATOM 594 CA MET A 213 -6.724 -2.713 -1.193 1.00 62.33 C ATOM 595 C MET A 213 -7.206 -1.296 -1.592 1.00 51.13 C ATOM 596 O MET A 213 -6.838 -0.299 -0.956 1.00 12.33 O ATOM 597 CB MET A 213 -7.450 -3.179 0.109 1.00 75.01 C ATOM 598 CG MET A 213 -8.993 -3.117 0.036 1.00 43.42 C ATOM 599 SD MET A 213 -9.675 -4.114 -1.313 1.00 13.50 S ATOM 600 CE MET A 213 -11.421 -3.694 -1.264 1.00 43.04 C ATOM 0 H MET A 213 -4.962 -2.966 -0.059 1.00 42.23 H new ATOM 0 HA MET A 213 -6.976 -3.396 -2.004 1.00 62.33 H new ATOM 0 HB2 MET A 213 -7.150 -4.203 0.331 1.00 75.01 H new ATOM 0 HB3 MET A 213 -7.112 -2.560 0.940 1.00 75.01 H new ATOM 0 HG2 MET A 213 -9.411 -3.461 0.982 1.00 43.42 H new ATOM 0 HG3 MET A 213 -9.304 -2.080 -0.092 1.00 43.42 H new ATOM 0 HE1 MET A 213 -11.870 -3.890 -2.238 1.00 43.04 H new ATOM 0 HE2 MET A 213 -11.920 -4.299 -0.507 1.00 43.04 H new ATOM 0 HE3 MET A 213 -11.534 -2.638 -1.018 1.00 43.04 H new ATOM 610 N THR A 214 -8.033 -1.251 -2.649 1.00 2.33 N ATOM 611 CA THR A 214 -8.611 -0.020 -3.225 1.00 60.32 C ATOM 612 C THR A 214 -10.127 -0.206 -3.433 1.00 15.45 C ATOM 613 O THR A 214 -10.699 -1.207 -3.001 1.00 23.01 O ATOM 614 CB THR A 214 -7.897 0.358 -4.593 1.00 64.52 C ATOM 615 OG1 THR A 214 -6.985 -0.682 -4.984 1.00 44.03 O ATOM 616 CG2 THR A 214 -7.124 1.680 -4.513 1.00 73.52 C ATOM 0 H THR A 214 -8.328 -2.093 -3.143 1.00 2.33 H new ATOM 0 HA THR A 214 -8.447 0.803 -2.529 1.00 60.32 H new ATOM 0 HB THR A 214 -8.691 0.472 -5.331 1.00 64.52 H new ATOM 0 HG1 THR A 214 -7.031 -0.809 -5.955 1.00 44.03 H new ATOM 0 HG21 THR A 214 -6.657 1.887 -5.476 1.00 73.52 H new ATOM 0 HG22 THR A 214 -7.811 2.488 -4.261 1.00 73.52 H new ATOM 0 HG23 THR A 214 -6.354 1.605 -3.745 1.00 73.52 H new ATOM 624 N LEU A 215 -10.755 0.774 -4.095 1.00 4.41 N ATOM 625 CA LEU A 215 -12.210 0.799 -4.318 1.00 35.22 C ATOM 626 C LEU A 215 -12.638 -0.356 -5.240 1.00 60.01 C ATOM 627 O LEU A 215 -13.271 -1.324 -4.823 1.00 61.01 O ATOM 628 CB LEU A 215 -12.594 2.128 -5.028 1.00 1.04 C ATOM 629 CG LEU A 215 -11.883 3.398 -4.522 1.00 42.02 C ATOM 630 CD1 LEU A 215 -12.027 4.528 -5.543 1.00 52.23 C ATOM 631 CD2 LEU A 215 -12.398 3.784 -3.135 1.00 54.55 C ATOM 0 H LEU A 215 -10.268 1.577 -4.494 1.00 4.41 H new ATOM 0 HA LEU A 215 -12.705 0.706 -3.351 1.00 35.22 H new ATOM 0 HB2 LEU A 215 -12.387 2.020 -6.093 1.00 1.04 H new ATOM 0 HB3 LEU A 215 -13.669 2.273 -4.926 1.00 1.04 H new ATOM 0 HG LEU A 215 -10.817 3.198 -4.416 1.00 42.02 H new ATOM 0 HD11 LEU A 215 -11.520 5.419 -5.173 1.00 52.23 H new ATOM 0 HD12 LEU A 215 -11.580 4.223 -6.489 1.00 52.23 H new ATOM 0 HD13 LEU A 215 -13.084 4.748 -5.695 1.00 52.23 H new ATOM 0 HD21 LEU A 215 -11.885 4.683 -2.794 1.00 54.55 H new ATOM 0 HD22 LEU A 215 -13.470 3.975 -3.185 1.00 54.55 H new ATOM 0 HD23 LEU A 215 -12.207 2.970 -2.436 1.00 54.55 H new ATOM 643 N GLU A 216 -12.237 -0.205 -6.515 1.00 52.31 N ATOM 644 CA GLU A 216 -12.689 -1.038 -7.631 1.00 75.13 C ATOM 645 C GLU A 216 -11.531 -1.859 -8.223 1.00 21.43 C ATOM 646 O GLU A 216 -11.701 -3.038 -8.557 1.00 21.53 O ATOM 647 CB GLU A 216 -13.329 -0.107 -8.697 1.00 43.41 C ATOM 648 CG GLU A 216 -14.654 0.551 -8.240 1.00 52.43 C ATOM 649 CD GLU A 216 -15.202 1.569 -9.249 1.00 0.11 C ATOM 650 OE1 GLU A 216 -15.893 1.170 -10.208 1.00 21.11 O ATOM 651 OE2 GLU A 216 -14.933 2.777 -9.093 1.00 3.52 O ATOM 0 H GLU A 216 -11.575 0.517 -6.799 1.00 52.31 H new ATOM 0 HA GLU A 216 -13.427 -1.759 -7.280 1.00 75.13 H new ATOM 0 HB2 GLU A 216 -12.616 0.676 -8.956 1.00 43.41 H new ATOM 0 HB3 GLU A 216 -13.514 -0.683 -9.604 1.00 43.41 H new ATOM 0 HG2 GLU A 216 -15.400 -0.226 -8.076 1.00 52.43 H new ATOM 0 HG3 GLU A 216 -14.495 1.047 -7.283 1.00 52.43 H new ATOM 658 N GLY A 217 -10.355 -1.211 -8.356 1.00 22.12 N ATOM 659 CA GLY A 217 -9.184 -1.816 -8.995 1.00 13.20 C ATOM 660 C GLY A 217 -8.029 -1.978 -8.014 1.00 12.21 C ATOM 661 O GLY A 217 -7.359 -0.980 -7.722 1.00 2.44 O ATOM 0 H GLY A 217 -10.198 -0.260 -8.023 1.00 22.12 H new ATOM 0 HA2 GLY A 217 -9.454 -2.790 -9.403 1.00 13.20 H new ATOM 0 HA3 GLY A 217 -8.866 -1.196 -9.833 1.00 13.20 H new ATOM 665 N PRO A 218 -7.764 -3.227 -7.490 1.00 51.15 N ATOM 666 CA PRO A 218 -6.698 -3.480 -6.487 1.00 3.14 C ATOM 667 C PRO A 218 -5.293 -3.108 -7.007 1.00 4.14 C ATOM 668 O PRO A 218 -4.927 -3.407 -8.152 1.00 51.25 O ATOM 669 CB PRO A 218 -6.812 -4.999 -6.202 1.00 23.34 C ATOM 670 CG PRO A 218 -7.498 -5.560 -7.410 1.00 71.41 C ATOM 671 CD PRO A 218 -8.479 -4.493 -7.835 1.00 20.34 C ATOM 0 HA PRO A 218 -6.826 -2.867 -5.595 1.00 3.14 H new ATOM 0 HB2 PRO A 218 -5.830 -5.450 -6.058 1.00 23.34 H new ATOM 0 HB3 PRO A 218 -7.386 -5.190 -5.295 1.00 23.34 H new ATOM 0 HG2 PRO A 218 -6.783 -5.778 -8.204 1.00 71.41 H new ATOM 0 HG3 PRO A 218 -8.008 -6.494 -7.176 1.00 71.41 H new ATOM 0 HD2 PRO A 218 -8.705 -4.552 -8.900 1.00 20.34 H new ATOM 0 HD3 PRO A 218 -9.426 -4.580 -7.303 1.00 20.34 H new ATOM 679 N VAL A 219 -4.521 -2.480 -6.126 1.00 23.11 N ATOM 680 CA VAL A 219 -3.171 -1.990 -6.409 1.00 74.01 C ATOM 681 C VAL A 219 -2.157 -3.096 -6.071 1.00 35.14 C ATOM 682 O VAL A 219 -2.507 -4.062 -5.401 1.00 52.24 O ATOM 683 CB VAL A 219 -2.902 -0.677 -5.566 1.00 40.30 C ATOM 684 CG1 VAL A 219 -1.466 -0.135 -5.701 1.00 32.31 C ATOM 685 CG2 VAL A 219 -3.917 0.422 -5.940 1.00 41.14 C ATOM 0 H VAL A 219 -4.822 -2.292 -5.170 1.00 23.11 H new ATOM 0 HA VAL A 219 -3.067 -1.739 -7.465 1.00 74.01 H new ATOM 0 HB VAL A 219 -3.028 -0.962 -4.521 1.00 40.30 H new ATOM 0 HG11 VAL A 219 -1.358 0.765 -5.095 1.00 32.31 H new ATOM 0 HG12 VAL A 219 -0.758 -0.890 -5.358 1.00 32.31 H new ATOM 0 HG13 VAL A 219 -1.264 0.104 -6.745 1.00 32.31 H new ATOM 0 HG21 VAL A 219 -3.717 1.317 -5.351 1.00 41.14 H new ATOM 0 HG22 VAL A 219 -3.825 0.657 -7.000 1.00 41.14 H new ATOM 0 HG23 VAL A 219 -4.928 0.070 -5.733 1.00 41.14 H new ATOM 695 N GLU A 220 -0.928 -2.970 -6.570 1.00 32.14 N ATOM 696 CA GLU A 220 0.184 -3.834 -6.167 1.00 60.23 C ATOM 697 C GLU A 220 1.465 -2.991 -6.199 1.00 42.25 C ATOM 698 O GLU A 220 1.745 -2.321 -7.205 1.00 65.31 O ATOM 699 CB GLU A 220 0.302 -5.086 -7.093 1.00 33.21 C ATOM 700 CG GLU A 220 0.920 -6.320 -6.395 1.00 65.12 C ATOM 701 CD GLU A 220 0.902 -7.600 -7.247 1.00 23.13 C ATOM 702 OE1 GLU A 220 1.539 -7.627 -8.322 1.00 23.11 O ATOM 703 OE2 GLU A 220 0.268 -8.593 -6.839 1.00 33.55 O ATOM 0 H GLU A 220 -0.674 -2.267 -7.264 1.00 32.14 H new ATOM 0 HA GLU A 220 0.012 -4.216 -5.161 1.00 60.23 H new ATOM 0 HB2 GLU A 220 -0.689 -5.348 -7.463 1.00 33.21 H new ATOM 0 HB3 GLU A 220 0.909 -4.829 -7.961 1.00 33.21 H new ATOM 0 HG2 GLU A 220 1.951 -6.092 -6.124 1.00 65.12 H new ATOM 0 HG3 GLU A 220 0.380 -6.507 -5.467 1.00 65.12 H new ATOM 710 N VAL A 221 2.210 -3.006 -5.095 1.00 64.14 N ATOM 711 CA VAL A 221 3.400 -2.174 -4.906 1.00 10.41 C ATOM 712 C VAL A 221 4.646 -3.056 -4.748 1.00 31.31 C ATOM 713 O VAL A 221 4.587 -4.128 -4.120 1.00 54.02 O ATOM 714 CB VAL A 221 3.239 -1.252 -3.640 1.00 0.31 C ATOM 715 CG1 VAL A 221 3.153 -2.077 -2.332 1.00 13.45 C ATOM 716 CG2 VAL A 221 4.363 -0.190 -3.574 1.00 44.00 C ATOM 0 H VAL A 221 2.002 -3.604 -4.295 1.00 64.14 H new ATOM 0 HA VAL A 221 3.517 -1.543 -5.787 1.00 10.41 H new ATOM 0 HB VAL A 221 2.292 -0.722 -3.742 1.00 0.31 H new ATOM 0 HG11 VAL A 221 3.043 -1.402 -1.483 1.00 13.45 H new ATOM 0 HG12 VAL A 221 2.293 -2.745 -2.379 1.00 13.45 H new ATOM 0 HG13 VAL A 221 4.063 -2.665 -2.212 1.00 13.45 H new ATOM 0 HG21 VAL A 221 4.225 0.431 -2.689 1.00 44.00 H new ATOM 0 HG22 VAL A 221 5.331 -0.688 -3.520 1.00 44.00 H new ATOM 0 HG23 VAL A 221 4.326 0.435 -4.466 1.00 44.00 H new ATOM 726 N ALA A 222 5.756 -2.603 -5.348 1.00 23.41 N ATOM 727 CA ALA A 222 7.076 -3.197 -5.144 1.00 63.20 C ATOM 728 C ALA A 222 7.595 -2.802 -3.748 1.00 43.34 C ATOM 729 O ALA A 222 7.916 -1.630 -3.509 1.00 11.10 O ATOM 730 CB ALA A 222 8.036 -2.724 -6.246 1.00 1.14 C ATOM 0 H ALA A 222 5.759 -1.811 -5.990 1.00 23.41 H new ATOM 0 HA ALA A 222 7.010 -4.284 -5.199 1.00 63.20 H new ATOM 0 HB1 ALA A 222 9.018 -3.170 -6.089 1.00 1.14 H new ATOM 0 HB2 ALA A 222 7.651 -3.028 -7.219 1.00 1.14 H new ATOM 0 HB3 ALA A 222 8.121 -1.638 -6.213 1.00 1.14 H new ATOM 736 N VAL A 223 7.592 -3.776 -2.823 1.00 22.41 N ATOM 737 CA VAL A 223 8.166 -3.628 -1.483 1.00 52.42 C ATOM 738 C VAL A 223 9.709 -3.528 -1.596 1.00 50.24 C ATOM 739 O VAL A 223 10.306 -4.350 -2.294 1.00 45.24 O ATOM 740 CB VAL A 223 7.762 -4.854 -0.565 1.00 74.21 C ATOM 741 CG1 VAL A 223 8.404 -4.769 0.838 1.00 3.33 C ATOM 742 CG2 VAL A 223 6.226 -4.972 -0.449 1.00 5.10 C ATOM 0 H VAL A 223 7.186 -4.697 -2.990 1.00 22.41 H new ATOM 0 HA VAL A 223 7.775 -2.719 -1.026 1.00 52.42 H new ATOM 0 HB VAL A 223 8.148 -5.752 -1.047 1.00 74.21 H new ATOM 0 HG11 VAL A 223 8.098 -5.631 1.431 1.00 3.33 H new ATOM 0 HG12 VAL A 223 9.490 -4.762 0.741 1.00 3.33 H new ATOM 0 HG13 VAL A 223 8.078 -3.854 1.333 1.00 3.33 H new ATOM 0 HG21 VAL A 223 5.973 -5.821 0.186 1.00 5.10 H new ATOM 0 HG22 VAL A 223 5.823 -4.059 -0.011 1.00 5.10 H new ATOM 0 HG23 VAL A 223 5.797 -5.120 -1.440 1.00 5.10 H new ATOM 752 N PRO A 224 10.372 -2.490 -0.977 1.00 24.34 N ATOM 753 CA PRO A 224 11.850 -2.433 -0.858 1.00 65.34 C ATOM 754 C PRO A 224 12.415 -3.648 -0.089 1.00 64.35 C ATOM 755 O PRO A 224 11.722 -4.203 0.775 1.00 15.11 O ATOM 756 CB PRO A 224 12.110 -1.104 -0.087 1.00 12.01 C ATOM 757 CG PRO A 224 10.880 -0.284 -0.328 1.00 41.31 C ATOM 758 CD PRO A 224 9.748 -1.281 -0.391 1.00 55.31 C ATOM 0 HA PRO A 224 12.343 -2.463 -1.829 1.00 65.34 H new ATOM 0 HB2 PRO A 224 12.264 -1.286 0.977 1.00 12.01 H new ATOM 0 HB3 PRO A 224 13.002 -0.599 -0.456 1.00 12.01 H new ATOM 0 HG2 PRO A 224 10.725 0.438 0.473 1.00 41.31 H new ATOM 0 HG3 PRO A 224 10.959 0.282 -1.256 1.00 41.31 H new ATOM 0 HD2 PRO A 224 9.337 -1.483 0.598 1.00 55.31 H new ATOM 0 HD3 PRO A 224 8.927 -0.916 -1.008 1.00 55.31 H new ATOM 766 N PRO A 225 13.667 -4.105 -0.397 1.00 3.14 N ATOM 767 CA PRO A 225 14.317 -5.176 0.384 1.00 33.51 C ATOM 768 C PRO A 225 14.509 -4.743 1.852 1.00 60.42 C ATOM 769 O PRO A 225 14.985 -3.632 2.114 1.00 42.44 O ATOM 770 CB PRO A 225 15.660 -5.405 -0.346 1.00 44.35 C ATOM 771 CG PRO A 225 15.905 -4.151 -1.131 1.00 70.41 C ATOM 772 CD PRO A 225 14.538 -3.640 -1.521 1.00 10.24 C ATOM 0 HA PRO A 225 13.727 -6.091 0.437 1.00 33.51 H new ATOM 0 HB2 PRO A 225 16.467 -5.588 0.364 1.00 44.35 H new ATOM 0 HB3 PRO A 225 15.608 -6.275 -1.001 1.00 44.35 H new ATOM 0 HG2 PRO A 225 16.443 -3.414 -0.534 1.00 70.41 H new ATOM 0 HG3 PRO A 225 16.514 -4.353 -2.012 1.00 70.41 H new ATOM 0 HD2 PRO A 225 14.526 -2.554 -1.617 1.00 10.24 H new ATOM 0 HD3 PRO A 225 14.213 -4.048 -2.478 1.00 10.24 H new ATOM 780 N ARG A 226 14.120 -5.638 2.769 1.00 2.12 N ATOM 781 CA ARG A 226 14.086 -5.407 4.219 1.00 53.44 C ATOM 782 C ARG A 226 13.295 -4.137 4.601 1.00 22.43 C ATOM 783 O ARG A 226 13.862 -3.105 4.984 1.00 62.31 O ATOM 784 CB ARG A 226 15.516 -5.459 4.780 1.00 64.43 C ATOM 785 CG ARG A 226 16.117 -6.884 4.739 1.00 21.52 C ATOM 786 CD ARG A 226 17.632 -6.877 4.857 1.00 51.25 C ATOM 787 NE ARG A 226 18.096 -6.147 6.052 1.00 1.32 N ATOM 788 CZ ARG A 226 19.374 -5.948 6.400 1.00 25.21 C ATOM 789 NH1 ARG A 226 20.372 -6.433 5.660 1.00 43.31 N ATOM 790 NH2 ARG A 226 19.652 -5.230 7.480 1.00 10.14 N ATOM 0 H ARG A 226 13.810 -6.575 2.513 1.00 2.12 H new ATOM 0 HA ARG A 226 13.524 -6.210 4.696 1.00 53.44 H new ATOM 0 HB2 ARG A 226 16.152 -4.783 4.208 1.00 64.43 H new ATOM 0 HB3 ARG A 226 15.513 -5.099 5.809 1.00 64.43 H new ATOM 0 HG2 ARG A 226 15.695 -7.477 5.550 1.00 21.52 H new ATOM 0 HG3 ARG A 226 15.830 -7.370 3.806 1.00 21.52 H new ATOM 0 HD2 ARG A 226 17.996 -7.904 4.897 1.00 51.25 H new ATOM 0 HD3 ARG A 226 18.062 -6.421 3.965 1.00 51.25 H new ATOM 0 HE ARG A 226 17.381 -5.760 6.667 1.00 1.32 H new ATOM 0 HH11 ARG A 226 20.168 -6.965 4.814 1.00 43.31 H new ATOM 0 HH12 ARG A 226 21.339 -6.272 5.940 1.00 43.31 H new ATOM 0 HH21 ARG A 226 18.895 -4.834 8.038 1.00 10.14 H new ATOM 0 HH22 ARG A 226 20.622 -5.073 7.752 1.00 10.14 H new ATOM 804 N THR A 227 11.971 -4.234 4.407 1.00 61.41 N ATOM 805 CA THR A 227 10.997 -3.246 4.888 1.00 12.34 C ATOM 806 C THR A 227 10.478 -3.648 6.283 1.00 32.13 C ATOM 807 O THR A 227 10.235 -4.829 6.547 1.00 45.41 O ATOM 808 CB THR A 227 9.806 -3.129 3.884 1.00 61.01 C ATOM 809 OG1 THR A 227 10.266 -2.549 2.653 1.00 43.22 O ATOM 810 CG2 THR A 227 8.637 -2.297 4.436 1.00 41.11 C ATOM 0 H THR A 227 11.542 -5.012 3.905 1.00 61.41 H new ATOM 0 HA THR A 227 11.489 -2.276 4.962 1.00 12.34 H new ATOM 0 HB THR A 227 9.432 -4.139 3.716 1.00 61.01 H new ATOM 0 HG1 THR A 227 10.725 -3.232 2.121 1.00 43.22 H new ATOM 0 HG21 THR A 227 7.840 -2.252 3.694 1.00 41.11 H new ATOM 0 HG22 THR A 227 8.258 -2.761 5.347 1.00 41.11 H new ATOM 0 HG23 THR A 227 8.982 -1.288 4.660 1.00 41.11 H new ATOM 818 N GLN A 228 10.343 -2.653 7.179 1.00 42.01 N ATOM 819 CA GLN A 228 9.792 -2.846 8.539 1.00 65.44 C ATOM 820 C GLN A 228 8.352 -2.332 8.627 1.00 1.35 C ATOM 821 O GLN A 228 7.892 -1.552 7.782 1.00 74.21 O ATOM 822 CB GLN A 228 10.673 -2.140 9.607 1.00 53.43 C ATOM 823 CG GLN A 228 12.093 -2.682 9.710 1.00 14.51 C ATOM 824 CD GLN A 228 12.953 -2.280 8.526 1.00 3.44 C ATOM 825 OE1 GLN A 228 12.873 -1.149 8.029 1.00 24.13 O ATOM 826 NE2 GLN A 228 13.625 -3.232 7.963 1.00 72.42 N ATOM 0 H GLN A 228 10.613 -1.689 6.983 1.00 42.01 H new ATOM 0 HA GLN A 228 9.793 -3.917 8.742 1.00 65.44 H new ATOM 0 HB2 GLN A 228 10.719 -1.076 9.376 1.00 53.43 H new ATOM 0 HB3 GLN A 228 10.190 -2.235 10.579 1.00 53.43 H new ATOM 0 HG2 GLN A 228 12.552 -2.318 10.629 1.00 14.51 H new ATOM 0 HG3 GLN A 228 12.060 -3.769 9.779 1.00 14.51 H new ATOM 0 HE21 GLN A 228 13.670 -4.152 8.400 1.00 72.42 H new ATOM 0 HE22 GLN A 228 14.110 -3.062 7.082 1.00 72.42 H new ATOM 835 N ALA A 229 7.670 -2.794 9.676 1.00 4.22 N ATOM 836 CA ALA A 229 6.261 -2.459 9.956 1.00 43.23 C ATOM 837 C ALA A 229 6.130 -1.113 10.678 1.00 74.30 C ATOM 838 O ALA A 229 7.059 -0.677 11.357 1.00 5.34 O ATOM 839 CB ALA A 229 5.615 -3.572 10.777 1.00 52.24 C ATOM 0 H ALA A 229 8.081 -3.420 10.368 1.00 4.22 H new ATOM 0 HA ALA A 229 5.741 -2.368 9.002 1.00 43.23 H new ATOM 0 HB1 ALA A 229 4.575 -3.318 10.980 1.00 52.24 H new ATOM 0 HB2 ALA A 229 5.658 -4.507 10.219 1.00 52.24 H new ATOM 0 HB3 ALA A 229 6.151 -3.687 11.719 1.00 52.24 H new ATOM 845 N GLY A 230 4.953 -0.478 10.541 1.00 71.23 N ATOM 846 CA GLY A 230 4.726 0.881 11.065 1.00 70.20 C ATOM 847 C GLY A 230 4.838 1.936 9.972 1.00 71.40 C ATOM 848 O GLY A 230 4.527 3.109 10.197 1.00 14.52 O ATOM 0 H GLY A 230 4.144 -0.884 10.072 1.00 71.23 H new ATOM 0 HA2 GLY A 230 3.737 0.934 11.521 1.00 70.20 H new ATOM 0 HA3 GLY A 230 5.451 1.093 11.851 1.00 70.20 H new ATOM 852 N ARG A 231 5.322 1.501 8.791 1.00 31.21 N ATOM 853 CA ARG A 231 5.279 2.283 7.543 1.00 62.11 C ATOM 854 C ARG A 231 3.841 2.346 7.002 1.00 53.03 C ATOM 855 O ARG A 231 2.913 1.778 7.603 1.00 5.13 O ATOM 856 CB ARG A 231 6.203 1.621 6.480 1.00 53.11 C ATOM 857 CG ARG A 231 7.710 1.806 6.699 1.00 41.43 C ATOM 858 CD ARG A 231 8.547 1.085 5.637 1.00 12.10 C ATOM 859 NE ARG A 231 9.927 1.589 5.569 1.00 22.10 N ATOM 860 CZ ARG A 231 10.938 1.252 6.379 1.00 55.44 C ATOM 861 NH1 ARG A 231 10.801 0.383 7.368 1.00 34.24 N ATOM 862 NH2 ARG A 231 12.121 1.805 6.189 1.00 1.41 N ATOM 0 H ARG A 231 5.758 0.586 8.678 1.00 31.21 H new ATOM 0 HA ARG A 231 5.625 3.296 7.751 1.00 62.11 H new ATOM 0 HB2 ARG A 231 5.987 0.553 6.453 1.00 53.11 H new ATOM 0 HB3 ARG A 231 5.945 2.023 5.500 1.00 53.11 H new ATOM 0 HG2 ARG A 231 7.949 2.869 6.685 1.00 41.43 H new ATOM 0 HG3 ARG A 231 7.980 1.431 7.686 1.00 41.43 H new ATOM 0 HD2 ARG A 231 8.564 0.017 5.856 1.00 12.10 H new ATOM 0 HD3 ARG A 231 8.072 1.203 4.663 1.00 12.10 H new ATOM 0 HE ARG A 231 10.134 2.262 4.831 1.00 22.10 H new ATOM 0 HH11 ARG A 231 9.897 -0.059 7.537 1.00 34.24 H new ATOM 0 HH12 ARG A 231 11.599 0.155 7.961 1.00 34.24 H new ATOM 0 HH21 ARG A 231 12.254 2.478 5.434 1.00 1.41 H new ATOM 0 HH22 ARG A 231 12.902 1.560 6.797 1.00 1.41 H new ATOM 876 N LYS A 232 3.674 3.031 5.850 1.00 74.45 N ATOM 877 CA LYS A 232 2.408 3.036 5.088 1.00 52.20 C ATOM 878 C LYS A 232 2.637 3.647 3.697 1.00 65.11 C ATOM 879 O LYS A 232 3.567 4.440 3.518 1.00 53.12 O ATOM 880 CB LYS A 232 1.275 3.775 5.876 1.00 23.42 C ATOM 881 CG LYS A 232 1.195 5.315 5.775 1.00 13.20 C ATOM 882 CD LYS A 232 0.462 5.954 6.989 1.00 64.24 C ATOM 883 CE LYS A 232 -0.858 5.242 7.357 1.00 2.10 C ATOM 884 NZ LYS A 232 -1.448 5.788 8.612 1.00 41.51 N ATOM 0 H LYS A 232 4.410 3.594 5.424 1.00 74.45 H new ATOM 0 HA LYS A 232 2.073 2.008 4.953 1.00 52.20 H new ATOM 0 HB2 LYS A 232 0.320 3.370 5.542 1.00 23.42 H new ATOM 0 HB3 LYS A 232 1.380 3.516 6.930 1.00 23.42 H new ATOM 0 HG2 LYS A 232 2.203 5.724 5.707 1.00 13.20 H new ATOM 0 HG3 LYS A 232 0.677 5.589 4.856 1.00 13.20 H new ATOM 0 HD2 LYS A 232 1.126 5.939 7.853 1.00 64.24 H new ATOM 0 HD3 LYS A 232 0.251 7.000 6.766 1.00 64.24 H new ATOM 0 HE2 LYS A 232 -1.572 5.354 6.541 1.00 2.10 H new ATOM 0 HE3 LYS A 232 -0.675 4.174 7.476 1.00 2.10 H new ATOM 0 HZ1 LYS A 232 -2.266 5.210 8.891 1.00 41.51 H new ATOM 0 HZ2 LYS A 232 -0.735 5.767 9.369 1.00 41.51 H new ATOM 0 HZ3 LYS A 232 -1.755 6.769 8.453 1.00 41.51 H new ATOM 898 N LEU A 233 1.818 3.260 2.698 1.00 42.13 N ATOM 899 CA LEU A 233 1.810 3.956 1.392 1.00 30.21 C ATOM 900 C LEU A 233 0.914 5.184 1.480 1.00 5.01 C ATOM 901 O LEU A 233 -0.045 5.204 2.266 1.00 61.45 O ATOM 902 CB LEU A 233 1.289 3.077 0.226 1.00 22.53 C ATOM 903 CG LEU A 233 2.095 1.799 -0.124 1.00 3.24 C ATOM 904 CD1 LEU A 233 1.453 1.071 -1.329 1.00 12.41 C ATOM 905 CD2 LEU A 233 3.571 2.123 -0.388 1.00 52.04 C ATOM 0 H LEU A 233 1.162 2.482 2.766 1.00 42.13 H new ATOM 0 HA LEU A 233 2.847 4.216 1.180 1.00 30.21 H new ATOM 0 HB2 LEU A 233 0.268 2.777 0.462 1.00 22.53 H new ATOM 0 HB3 LEU A 233 1.240 3.699 -0.668 1.00 22.53 H new ATOM 0 HG LEU A 233 2.062 1.130 0.736 1.00 3.24 H new ATOM 0 HD11 LEU A 233 2.030 0.176 -1.563 1.00 12.41 H new ATOM 0 HD12 LEU A 233 0.430 0.789 -1.081 1.00 12.41 H new ATOM 0 HD13 LEU A 233 1.446 1.735 -2.194 1.00 12.41 H new ATOM 0 HD21 LEU A 233 4.107 1.205 -0.630 1.00 52.04 H new ATOM 0 HD22 LEU A 233 3.647 2.819 -1.223 1.00 52.04 H new ATOM 0 HD23 LEU A 233 4.009 2.575 0.502 1.00 52.04 H new ATOM 917 N ARG A 234 1.238 6.175 0.648 1.00 32.23 N ATOM 918 CA ARG A 234 0.393 7.334 0.393 1.00 33.41 C ATOM 919 C ARG A 234 0.035 7.329 -1.108 1.00 54.45 C ATOM 920 O ARG A 234 0.898 7.492 -1.988 1.00 41.13 O ATOM 921 CB ARG A 234 1.106 8.639 0.846 1.00 11.02 C ATOM 922 CG ARG A 234 2.439 8.967 0.131 1.00 30.34 C ATOM 923 CD ARG A 234 3.115 10.238 0.677 1.00 4.21 C ATOM 924 NE ARG A 234 3.852 10.953 -0.377 1.00 54.24 N ATOM 925 CZ ARG A 234 3.959 12.281 -0.485 1.00 2.03 C ATOM 926 NH1 ARG A 234 3.385 13.095 0.405 1.00 63.32 N ATOM 927 NH2 ARG A 234 4.610 12.795 -1.506 1.00 2.33 N ATOM 0 H ARG A 234 2.113 6.191 0.124 1.00 32.23 H new ATOM 0 HA ARG A 234 -0.529 7.287 0.972 1.00 33.41 H new ATOM 0 HB2 ARG A 234 0.422 9.474 0.697 1.00 11.02 H new ATOM 0 HB3 ARG A 234 1.298 8.572 1.917 1.00 11.02 H new ATOM 0 HG2 ARG A 234 3.121 8.124 0.240 1.00 30.34 H new ATOM 0 HG3 ARG A 234 2.252 9.090 -0.936 1.00 30.34 H new ATOM 0 HD2 ARG A 234 2.360 10.897 1.106 1.00 4.21 H new ATOM 0 HD3 ARG A 234 3.799 9.970 1.483 1.00 4.21 H new ATOM 0 HE ARG A 234 4.321 10.388 -1.085 1.00 54.24 H new ATOM 0 HH11 ARG A 234 2.854 12.706 1.184 1.00 63.32 H new ATOM 0 HH12 ARG A 234 3.478 14.106 0.306 1.00 63.32 H new ATOM 0 HH21 ARG A 234 5.027 12.181 -2.206 1.00 2.33 H new ATOM 0 HH22 ARG A 234 4.697 13.807 -1.598 1.00 2.33 H new ATOM 941 N LEU A 235 -1.237 7.052 -1.399 1.00 23.23 N ATOM 942 CA LEU A 235 -1.720 6.830 -2.767 1.00 20.24 C ATOM 943 C LEU A 235 -2.736 7.899 -3.142 1.00 14.12 C ATOM 944 O LEU A 235 -3.803 7.971 -2.544 1.00 74.01 O ATOM 945 CB LEU A 235 -2.367 5.426 -2.902 1.00 73.31 C ATOM 946 CG LEU A 235 -1.458 4.199 -2.592 1.00 34.44 C ATOM 947 CD1 LEU A 235 -2.189 2.875 -2.902 1.00 31.34 C ATOM 948 CD2 LEU A 235 -0.135 4.302 -3.361 1.00 42.33 C ATOM 0 H LEU A 235 -1.966 6.974 -0.690 1.00 23.23 H new ATOM 0 HA LEU A 235 -0.867 6.888 -3.443 1.00 20.24 H new ATOM 0 HB2 LEU A 235 -3.231 5.385 -2.238 1.00 73.31 H new ATOM 0 HB3 LEU A 235 -2.742 5.322 -3.920 1.00 73.31 H new ATOM 0 HG LEU A 235 -1.228 4.203 -1.526 1.00 34.44 H new ATOM 0 HD11 LEU A 235 -1.532 2.035 -2.677 1.00 31.34 H new ATOM 0 HD12 LEU A 235 -3.089 2.805 -2.292 1.00 31.34 H new ATOM 0 HD13 LEU A 235 -2.463 2.849 -3.957 1.00 31.34 H new ATOM 0 HD21 LEU A 235 0.487 3.437 -3.132 1.00 42.33 H new ATOM 0 HD22 LEU A 235 -0.338 4.330 -4.432 1.00 42.33 H new ATOM 0 HD23 LEU A 235 0.387 5.212 -3.066 1.00 42.33 H new ATOM 960 N LYS A 236 -2.418 8.692 -4.161 1.00 21.43 N ATOM 961 CA LYS A 236 -3.279 9.805 -4.596 1.00 13.23 C ATOM 962 C LYS A 236 -4.217 9.328 -5.705 1.00 43.22 C ATOM 963 O LYS A 236 -3.779 8.656 -6.649 1.00 11.21 O ATOM 964 CB LYS A 236 -2.443 11.054 -5.044 1.00 74.13 C ATOM 965 CG LYS A 236 -1.816 11.853 -3.869 1.00 74.20 C ATOM 966 CD LYS A 236 -2.873 12.222 -2.801 1.00 22.44 C ATOM 967 CE LYS A 236 -2.345 13.092 -1.654 1.00 54.21 C ATOM 968 NZ LYS A 236 -2.169 14.515 -2.050 1.00 65.22 N ATOM 0 H LYS A 236 -1.564 8.589 -4.710 1.00 21.43 H new ATOM 0 HA LYS A 236 -3.879 10.128 -3.745 1.00 13.23 H new ATOM 0 HB2 LYS A 236 -1.646 10.724 -5.711 1.00 74.13 H new ATOM 0 HB3 LYS A 236 -3.085 11.720 -5.620 1.00 74.13 H new ATOM 0 HG2 LYS A 236 -1.024 11.262 -3.409 1.00 74.20 H new ATOM 0 HG3 LYS A 236 -1.353 12.762 -4.253 1.00 74.20 H new ATOM 0 HD2 LYS A 236 -3.695 12.746 -3.288 1.00 22.44 H new ATOM 0 HD3 LYS A 236 -3.284 11.303 -2.383 1.00 22.44 H new ATOM 0 HE2 LYS A 236 -3.036 13.036 -0.812 1.00 54.21 H new ATOM 0 HE3 LYS A 236 -1.390 12.694 -1.310 1.00 54.21 H new ATOM 0 HZ1 LYS A 236 -1.811 15.059 -1.239 1.00 65.22 H new ATOM 0 HZ2 LYS A 236 -1.490 14.575 -2.835 1.00 65.22 H new ATOM 0 HZ3 LYS A 236 -3.084 14.907 -2.353 1.00 65.22 H new ATOM 982 N GLY A 237 -5.507 9.665 -5.552 1.00 54.33 N ATOM 983 CA GLY A 237 -6.560 9.218 -6.464 1.00 25.40 C ATOM 984 C GLY A 237 -6.985 7.775 -6.218 1.00 24.01 C ATOM 985 O GLY A 237 -7.542 7.127 -7.114 1.00 31.15 O ATOM 0 H GLY A 237 -5.845 10.255 -4.792 1.00 54.33 H new ATOM 0 HA2 GLY A 237 -7.427 9.870 -6.357 1.00 25.40 H new ATOM 0 HA3 GLY A 237 -6.210 9.318 -7.492 1.00 25.40 H new ATOM 989 N LYS A 238 -6.703 7.254 -5.003 1.00 43.30 N ATOM 990 CA LYS A 238 -7.048 5.862 -4.631 1.00 32.45 C ATOM 991 C LYS A 238 -8.057 5.777 -3.470 1.00 41.12 C ATOM 992 O LYS A 238 -8.500 4.675 -3.119 1.00 23.32 O ATOM 993 CB LYS A 238 -5.748 5.082 -4.328 1.00 54.05 C ATOM 994 CG LYS A 238 -4.797 5.001 -5.543 1.00 1.42 C ATOM 995 CD LYS A 238 -5.388 4.157 -6.700 1.00 24.20 C ATOM 996 CE LYS A 238 -4.725 4.459 -8.048 1.00 14.25 C ATOM 997 NZ LYS A 238 -3.259 4.248 -8.025 1.00 74.42 N ATOM 0 H LYS A 238 -6.237 7.777 -4.262 1.00 43.30 H new ATOM 0 HA LYS A 238 -7.556 5.401 -5.478 1.00 32.45 H new ATOM 0 HB2 LYS A 238 -5.228 5.561 -3.498 1.00 54.05 H new ATOM 0 HB3 LYS A 238 -6.003 4.073 -4.005 1.00 54.05 H new ATOM 0 HG2 LYS A 238 -4.585 6.008 -5.903 1.00 1.42 H new ATOM 0 HG3 LYS A 238 -3.847 4.568 -5.229 1.00 1.42 H new ATOM 0 HD2 LYS A 238 -5.269 3.098 -6.470 1.00 24.20 H new ATOM 0 HD3 LYS A 238 -6.458 4.349 -6.775 1.00 24.20 H new ATOM 0 HE2 LYS A 238 -5.167 3.824 -8.816 1.00 14.25 H new ATOM 0 HE3 LYS A 238 -4.935 5.491 -8.328 1.00 14.25 H new ATOM 0 HZ1 LYS A 238 -2.814 4.823 -8.769 1.00 74.42 H new ATOM 0 HZ2 LYS A 238 -2.882 4.530 -7.097 1.00 74.42 H new ATOM 0 HZ3 LYS A 238 -3.050 3.243 -8.193 1.00 74.42 H new ATOM 1011 N GLY A 239 -8.402 6.933 -2.877 1.00 42.04 N ATOM 1012 CA GLY A 239 -9.553 7.035 -1.967 1.00 2.30 C ATOM 1013 C GLY A 239 -10.868 7.182 -2.720 1.00 53.04 C ATOM 1014 O GLY A 239 -10.881 7.107 -3.957 1.00 43.15 O ATOM 0 H GLY A 239 -7.899 7.810 -3.013 1.00 42.04 H new ATOM 0 HA2 GLY A 239 -9.595 6.148 -1.335 1.00 2.30 H new ATOM 0 HA3 GLY A 239 -9.417 7.891 -1.306 1.00 2.30 H new ATOM 1018 N PHE A 240 -11.969 7.444 -1.978 1.00 13.40 N ATOM 1019 CA PHE A 240 -13.337 7.485 -2.547 1.00 43.32 C ATOM 1020 C PHE A 240 -13.460 8.544 -3.672 1.00 31.13 C ATOM 1021 O PHE A 240 -12.892 9.626 -3.546 1.00 30.02 O ATOM 1022 CB PHE A 240 -14.389 7.752 -1.433 1.00 73.14 C ATOM 1023 CG PHE A 240 -14.726 6.550 -0.540 1.00 44.41 C ATOM 1024 CD1 PHE A 240 -14.828 5.256 -1.075 1.00 10.31 C ATOM 1025 CD2 PHE A 240 -14.973 6.718 0.822 1.00 74.43 C ATOM 1026 CE1 PHE A 240 -15.179 4.183 -0.276 1.00 13.14 C ATOM 1027 CE2 PHE A 240 -15.319 5.644 1.619 1.00 14.34 C ATOM 1028 CZ PHE A 240 -15.414 4.375 1.074 1.00 21.00 C ATOM 0 H PHE A 240 -11.936 7.632 -0.976 1.00 13.40 H new ATOM 0 HA PHE A 240 -13.534 6.508 -2.989 1.00 43.32 H new ATOM 0 HB2 PHE A 240 -14.025 8.562 -0.800 1.00 73.14 H new ATOM 0 HB3 PHE A 240 -15.308 8.103 -1.902 1.00 73.14 H new ATOM 0 HD1 PHE A 240 -14.630 5.096 -2.125 1.00 10.31 H new ATOM 0 HD2 PHE A 240 -14.893 7.702 1.260 1.00 74.43 H new ATOM 0 HE1 PHE A 240 -15.270 3.196 -0.705 1.00 13.14 H new ATOM 0 HE2 PHE A 240 -15.516 5.795 2.670 1.00 14.34 H new ATOM 0 HZ PHE A 240 -15.671 3.535 1.702 1.00 21.00 H new ATOM 1038 N PRO A 241 -14.183 8.239 -4.803 1.00 61.22 N ATOM 1039 CA PRO A 241 -14.316 9.170 -5.940 1.00 42.14 C ATOM 1040 C PRO A 241 -15.318 10.293 -5.634 1.00 70.04 C ATOM 1041 O PRO A 241 -16.398 10.042 -5.090 1.00 42.53 O ATOM 1042 CB PRO A 241 -14.780 8.262 -7.120 1.00 45.55 C ATOM 1043 CG PRO A 241 -14.816 6.852 -6.576 1.00 45.01 C ATOM 1044 CD PRO A 241 -14.932 6.985 -5.073 1.00 31.45 C ATOM 0 HA PRO A 241 -13.387 9.691 -6.170 1.00 42.14 H new ATOM 0 HB2 PRO A 241 -15.762 8.565 -7.482 1.00 45.55 H new ATOM 0 HB3 PRO A 241 -14.093 8.337 -7.963 1.00 45.55 H new ATOM 0 HG2 PRO A 241 -15.661 6.298 -6.985 1.00 45.01 H new ATOM 0 HG3 PRO A 241 -13.914 6.305 -6.850 1.00 45.01 H new ATOM 0 HD2 PRO A 241 -15.971 7.055 -4.751 1.00 31.45 H new ATOM 0 HD3 PRO A 241 -14.495 6.131 -4.555 1.00 31.45 H new ATOM 1052 N GLY A 242 -14.951 11.519 -6.005 1.00 3.05 N ATOM 1053 CA GLY A 242 -15.688 12.718 -5.610 1.00 45.31 C ATOM 1054 C GLY A 242 -15.988 13.641 -6.787 1.00 54.14 C ATOM 1055 O GLY A 242 -15.448 13.436 -7.886 1.00 33.42 O ATOM 0 H GLY A 242 -14.135 11.709 -6.587 1.00 3.05 H new ATOM 0 HA2 GLY A 242 -16.625 12.424 -5.137 1.00 45.31 H new ATOM 0 HA3 GLY A 242 -15.111 13.264 -4.863 1.00 45.31 H new ATOM 1059 N PRO A 243 -16.846 14.688 -6.580 1.00 1.34 N ATOM 1060 CA PRO A 243 -17.187 15.671 -7.637 1.00 24.32 C ATOM 1061 C PRO A 243 -16.002 16.601 -7.975 1.00 63.23 C ATOM 1062 O PRO A 243 -15.882 17.077 -9.105 1.00 35.03 O ATOM 1063 CB PRO A 243 -18.382 16.445 -7.027 1.00 22.32 C ATOM 1064 CG PRO A 243 -18.195 16.335 -5.541 1.00 5.34 C ATOM 1065 CD PRO A 243 -17.562 14.980 -5.299 1.00 71.43 C ATOM 0 HA PRO A 243 -17.430 15.200 -8.589 1.00 24.32 H new ATOM 0 HB2 PRO A 243 -18.384 17.486 -7.349 1.00 22.32 H new ATOM 0 HB3 PRO A 243 -19.333 16.013 -7.339 1.00 22.32 H new ATOM 0 HG2 PRO A 243 -17.557 17.136 -5.168 1.00 5.34 H new ATOM 0 HG3 PRO A 243 -19.149 16.419 -5.020 1.00 5.34 H new ATOM 0 HD2 PRO A 243 -16.875 15.005 -4.453 1.00 71.43 H new ATOM 0 HD3 PRO A 243 -18.313 14.221 -5.078 1.00 71.43 H new ATOM 1073 N ALA A 244 -15.127 16.843 -6.982 1.00 42.02 N ATOM 1074 CA ALA A 244 -13.920 17.685 -7.134 1.00 2.33 C ATOM 1075 C ALA A 244 -12.661 16.812 -7.318 1.00 21.24 C ATOM 1076 O ALA A 244 -11.535 17.271 -7.087 1.00 3.33 O ATOM 1077 CB ALA A 244 -13.786 18.606 -5.903 1.00 72.03 C ATOM 0 H ALA A 244 -15.236 16.458 -6.044 1.00 42.02 H new ATOM 0 HA ALA A 244 -14.019 18.301 -8.028 1.00 2.33 H new ATOM 0 HB1 ALA A 244 -12.898 19.229 -6.010 1.00 72.03 H new ATOM 0 HB2 ALA A 244 -14.668 19.242 -5.826 1.00 72.03 H new ATOM 0 HB3 ALA A 244 -13.697 17.999 -5.002 1.00 72.03 H new ATOM 1083 N GLY A 245 -12.864 15.560 -7.768 1.00 52.33 N ATOM 1084 CA GLY A 245 -11.789 14.574 -7.891 1.00 72.32 C ATOM 1085 C GLY A 245 -11.866 13.542 -6.785 1.00 31.21 C ATOM 1086 O GLY A 245 -12.628 13.714 -5.833 1.00 32.33 O ATOM 0 H GLY A 245 -13.778 15.210 -8.055 1.00 52.33 H new ATOM 0 HA2 GLY A 245 -11.855 14.079 -8.860 1.00 72.32 H new ATOM 0 HA3 GLY A 245 -10.823 15.078 -7.856 1.00 72.32 H new ATOM 1090 N ARG A 246 -11.075 12.469 -6.913 1.00 4.25 N ATOM 1091 CA ARG A 246 -11.029 11.382 -5.920 1.00 40.24 C ATOM 1092 C ARG A 246 -10.291 11.799 -4.649 1.00 73.14 C ATOM 1093 O ARG A 246 -9.713 12.892 -4.560 1.00 0.43 O ATOM 1094 CB ARG A 246 -10.321 10.131 -6.500 1.00 34.31 C ATOM 1095 CG ARG A 246 -11.082 9.406 -7.619 1.00 63.14 C ATOM 1096 CD ARG A 246 -10.271 8.232 -8.169 1.00 1.02 C ATOM 1097 NE ARG A 246 -10.976 7.453 -9.191 1.00 62.25 N ATOM 1098 CZ ARG A 246 -10.582 6.241 -9.612 1.00 1.04 C ATOM 1099 NH1 ARG A 246 -9.490 5.662 -9.095 1.00 35.11 N ATOM 1100 NH2 ARG A 246 -11.263 5.626 -10.561 1.00 14.11 N ATOM 0 H ARG A 246 -10.449 12.328 -7.706 1.00 4.25 H new ATOM 0 HA ARG A 246 -12.065 11.150 -5.673 1.00 40.24 H new ATOM 0 HB2 ARG A 246 -9.345 10.431 -6.882 1.00 34.31 H new ATOM 0 HB3 ARG A 246 -10.143 9.426 -5.688 1.00 34.31 H new ATOM 0 HG2 ARG A 246 -12.037 9.045 -7.238 1.00 63.14 H new ATOM 0 HG3 ARG A 246 -11.305 10.106 -8.424 1.00 63.14 H new ATOM 0 HD2 ARG A 246 -9.341 8.612 -8.592 1.00 1.02 H new ATOM 0 HD3 ARG A 246 -10.000 7.572 -7.345 1.00 1.02 H new ATOM 0 HE ARG A 246 -11.816 7.856 -9.607 1.00 62.25 H new ATOM 0 HH11 ARG A 246 -8.950 6.143 -8.375 1.00 35.11 H new ATOM 0 HH12 ARG A 246 -9.198 4.741 -9.421 1.00 35.11 H new ATOM 0 HH21 ARG A 246 -12.084 6.072 -10.970 1.00 14.11 H new ATOM 0 HH22 ARG A 246 -10.968 4.705 -10.885 1.00 14.11 H new ATOM 1114 N GLY A 247 -10.312 10.883 -3.679 1.00 63.43 N ATOM 1115 CA GLY A 247 -9.533 11.013 -2.474 1.00 11.43 C ATOM 1116 C GLY A 247 -8.237 10.263 -2.555 1.00 24.50 C ATOM 1117 O GLY A 247 -7.837 9.785 -3.620 1.00 43.20 O ATOM 0 H GLY A 247 -10.875 10.033 -3.719 1.00 63.43 H new ATOM 0 HA2 GLY A 247 -9.330 12.067 -2.286 1.00 11.43 H new ATOM 0 HA3 GLY A 247 -10.112 10.644 -1.627 1.00 11.43 H new ATOM 1121 N ASP A 248 -7.597 10.121 -1.414 1.00 74.31 N ATOM 1122 CA ASP A 248 -6.289 9.459 -1.289 1.00 0.31 C ATOM 1123 C ASP A 248 -6.396 8.234 -0.380 1.00 71.34 C ATOM 1124 O ASP A 248 -7.459 7.925 0.131 1.00 61.22 O ATOM 1125 CB ASP A 248 -5.216 10.467 -0.805 1.00 65.53 C ATOM 1126 CG ASP A 248 -5.675 11.380 0.337 1.00 2.34 C ATOM 1127 OD1 ASP A 248 -6.507 12.279 0.082 1.00 55.31 O ATOM 1128 OD2 ASP A 248 -5.211 11.225 1.472 1.00 72.45 O ATOM 0 H ASP A 248 -7.965 10.463 -0.526 1.00 74.31 H new ATOM 0 HA ASP A 248 -5.971 9.102 -2.269 1.00 0.31 H new ATOM 0 HB2 ASP A 248 -4.335 9.913 -0.480 1.00 65.53 H new ATOM 0 HB3 ASP A 248 -4.910 11.086 -1.648 1.00 65.53 H new ATOM 1133 N LEU A 249 -5.295 7.506 -0.232 1.00 74.12 N ATOM 1134 CA LEU A 249 -5.283 6.212 0.456 1.00 74.32 C ATOM 1135 C LEU A 249 -3.960 6.002 1.210 1.00 43.10 C ATOM 1136 O LEU A 249 -2.900 5.828 0.605 1.00 73.25 O ATOM 1137 CB LEU A 249 -5.546 5.108 -0.604 1.00 22.23 C ATOM 1138 CG LEU A 249 -5.361 3.620 -0.180 1.00 10.30 C ATOM 1139 CD1 LEU A 249 -6.194 3.228 1.054 1.00 43.23 C ATOM 1140 CD2 LEU A 249 -5.668 2.693 -1.372 1.00 1.11 C ATOM 0 H LEU A 249 -4.382 7.793 -0.585 1.00 74.12 H new ATOM 0 HA LEU A 249 -6.065 6.171 1.214 1.00 74.32 H new ATOM 0 HB2 LEU A 249 -6.569 5.227 -0.962 1.00 22.23 H new ATOM 0 HB3 LEU A 249 -4.887 5.297 -1.452 1.00 22.23 H new ATOM 0 HG LEU A 249 -4.319 3.500 0.116 1.00 10.30 H new ATOM 0 HD11 LEU A 249 -6.018 2.180 1.294 1.00 43.23 H new ATOM 0 HD12 LEU A 249 -5.903 3.848 1.902 1.00 43.23 H new ATOM 0 HD13 LEU A 249 -7.252 3.378 0.841 1.00 43.23 H new ATOM 0 HD21 LEU A 249 -5.537 1.654 -1.068 1.00 1.11 H new ATOM 0 HD22 LEU A 249 -6.696 2.848 -1.698 1.00 1.11 H new ATOM 0 HD23 LEU A 249 -4.988 2.920 -2.194 1.00 1.11 H new ATOM 1152 N TYR A 250 -4.044 6.050 2.546 1.00 62.35 N ATOM 1153 CA TYR A 250 -2.922 5.754 3.441 1.00 51.42 C ATOM 1154 C TYR A 250 -3.111 4.341 4.005 1.00 33.21 C ATOM 1155 O TYR A 250 -4.098 4.079 4.707 1.00 3.54 O ATOM 1156 CB TYR A 250 -2.833 6.818 4.572 1.00 14.34 C ATOM 1157 CG TYR A 250 -2.742 8.281 4.074 1.00 44.33 C ATOM 1158 CD1 TYR A 250 -3.372 9.331 4.758 1.00 53.32 C ATOM 1159 CD2 TYR A 250 -2.051 8.604 2.904 1.00 64.45 C ATOM 1160 CE1 TYR A 250 -3.308 10.631 4.292 1.00 62.31 C ATOM 1161 CE2 TYR A 250 -1.981 9.900 2.441 1.00 33.11 C ATOM 1162 CZ TYR A 250 -2.612 10.905 3.132 1.00 52.34 C ATOM 1163 OH TYR A 250 -2.573 12.196 2.643 1.00 14.53 O ATOM 0 H TYR A 250 -4.902 6.298 3.039 1.00 62.35 H new ATOM 0 HA TYR A 250 -1.981 5.794 2.893 1.00 51.42 H new ATOM 0 HB2 TYR A 250 -3.708 6.720 5.214 1.00 14.34 H new ATOM 0 HB3 TYR A 250 -1.960 6.603 5.188 1.00 14.34 H new ATOM 0 HD1 TYR A 250 -3.917 9.120 5.666 1.00 53.32 H new ATOM 0 HD2 TYR A 250 -1.560 7.819 2.349 1.00 64.45 H new ATOM 0 HE1 TYR A 250 -3.799 11.427 4.832 1.00 62.31 H new ATOM 0 HE2 TYR A 250 -1.432 10.124 1.538 1.00 33.11 H new ATOM 0 HH TYR A 250 -3.373 12.366 2.103 1.00 14.53 H new ATOM 1173 N LEU A 251 -2.194 3.409 3.687 1.00 12.23 N ATOM 1174 CA LEU A 251 -2.367 1.997 4.107 1.00 32.41 C ATOM 1175 C LEU A 251 -1.140 1.430 4.840 1.00 34.51 C ATOM 1176 O LEU A 251 -0.059 1.283 4.273 1.00 31.55 O ATOM 1177 CB LEU A 251 -2.872 1.109 2.925 1.00 2.44 C ATOM 1178 CG LEU A 251 -2.221 1.289 1.519 1.00 41.25 C ATOM 1179 CD1 LEU A 251 -0.902 0.537 1.401 1.00 31.50 C ATOM 1180 CD2 LEU A 251 -3.181 0.844 0.410 1.00 54.02 C ATOM 0 H LEU A 251 -1.344 3.596 3.154 1.00 12.23 H new ATOM 0 HA LEU A 251 -3.156 1.977 4.858 1.00 32.41 H new ATOM 0 HB2 LEU A 251 -2.744 0.067 3.217 1.00 2.44 H new ATOM 0 HB3 LEU A 251 -3.943 1.281 2.817 1.00 2.44 H new ATOM 0 HG LEU A 251 -2.011 2.352 1.400 1.00 41.25 H new ATOM 0 HD11 LEU A 251 -0.484 0.690 0.406 1.00 31.50 H new ATOM 0 HD12 LEU A 251 -0.203 0.909 2.150 1.00 31.50 H new ATOM 0 HD13 LEU A 251 -1.074 -0.527 1.562 1.00 31.50 H new ATOM 0 HD21 LEU A 251 -2.704 0.979 -0.560 1.00 54.02 H new ATOM 0 HD22 LEU A 251 -3.433 -0.208 0.547 1.00 54.02 H new ATOM 0 HD23 LEU A 251 -4.090 1.443 0.454 1.00 54.02 H new ATOM 1192 N GLU A 252 -1.368 1.109 6.122 1.00 63.31 N ATOM 1193 CA GLU A 252 -0.341 0.739 7.100 1.00 4.43 C ATOM 1194 C GLU A 252 0.316 -0.623 6.793 1.00 23.01 C ATOM 1195 O GLU A 252 -0.342 -1.664 6.767 1.00 72.21 O ATOM 1196 CB GLU A 252 -0.977 0.731 8.512 1.00 43.53 C ATOM 1197 CG GLU A 252 -0.075 0.157 9.623 1.00 33.22 C ATOM 1198 CD GLU A 252 -0.686 0.292 11.022 1.00 65.42 C ATOM 1199 OE1 GLU A 252 -0.159 1.057 11.854 1.00 14.22 O ATOM 1200 OE2 GLU A 252 -1.711 -0.362 11.289 1.00 72.44 O ATOM 0 H GLU A 252 -2.308 1.100 6.518 1.00 63.31 H new ATOM 0 HA GLU A 252 0.458 1.479 7.047 1.00 4.43 H new ATOM 0 HB2 GLU A 252 -1.252 1.752 8.777 1.00 43.53 H new ATOM 0 HB3 GLU A 252 -1.900 0.152 8.477 1.00 43.53 H new ATOM 0 HG2 GLU A 252 0.119 -0.896 9.418 1.00 33.22 H new ATOM 0 HG3 GLU A 252 0.887 0.669 9.602 1.00 33.22 H new ATOM 1207 N VAL A 253 1.631 -0.569 6.582 1.00 72.13 N ATOM 1208 CA VAL A 253 2.482 -1.732 6.332 1.00 44.02 C ATOM 1209 C VAL A 253 2.647 -2.579 7.601 1.00 31.12 C ATOM 1210 O VAL A 253 3.118 -2.084 8.641 1.00 15.32 O ATOM 1211 CB VAL A 253 3.892 -1.281 5.819 1.00 21.13 C ATOM 1212 CG1 VAL A 253 4.804 -2.490 5.500 1.00 70.12 C ATOM 1213 CG2 VAL A 253 3.728 -0.354 4.601 1.00 65.00 C ATOM 0 H VAL A 253 2.148 0.310 6.580 1.00 72.13 H new ATOM 0 HA VAL A 253 1.996 -2.338 5.567 1.00 44.02 H new ATOM 0 HB VAL A 253 4.388 -0.726 6.615 1.00 21.13 H new ATOM 0 HG11 VAL A 253 5.772 -2.133 5.148 1.00 70.12 H new ATOM 0 HG12 VAL A 253 4.944 -3.088 6.401 1.00 70.12 H new ATOM 0 HG13 VAL A 253 4.340 -3.102 4.727 1.00 70.12 H new ATOM 0 HG21 VAL A 253 4.710 -0.042 4.246 1.00 65.00 H new ATOM 0 HG22 VAL A 253 3.208 -0.887 3.805 1.00 65.00 H new ATOM 0 HG23 VAL A 253 3.150 0.524 4.888 1.00 65.00 H new ATOM 1223 N ARG A 254 2.233 -3.842 7.503 1.00 53.14 N ATOM 1224 CA ARG A 254 2.462 -4.864 8.508 1.00 63.51 C ATOM 1225 C ARG A 254 3.396 -5.923 7.932 1.00 21.12 C ATOM 1226 O ARG A 254 3.150 -6.426 6.831 1.00 51.45 O ATOM 1227 CB ARG A 254 1.117 -5.510 8.907 1.00 30.31 C ATOM 1228 CG ARG A 254 0.133 -4.571 9.643 1.00 31.02 C ATOM 1229 CD ARG A 254 0.755 -3.864 10.861 1.00 4.24 C ATOM 1230 NE ARG A 254 -0.223 -3.035 11.589 1.00 11.34 N ATOM 1231 CZ ARG A 254 -0.439 -3.060 12.913 1.00 51.44 C ATOM 1232 NH1 ARG A 254 0.243 -3.882 13.710 1.00 42.45 N ATOM 1233 NH2 ARG A 254 -1.325 -2.231 13.438 1.00 11.45 N ATOM 0 H ARG A 254 1.714 -4.186 6.695 1.00 53.14 H new ATOM 0 HA ARG A 254 2.916 -4.418 9.393 1.00 63.51 H new ATOM 0 HB2 ARG A 254 0.631 -5.887 8.007 1.00 30.31 H new ATOM 0 HB3 ARG A 254 1.320 -6.371 9.544 1.00 30.31 H new ATOM 0 HG2 ARG A 254 -0.232 -3.819 8.943 1.00 31.02 H new ATOM 0 HG3 ARG A 254 -0.732 -5.148 9.970 1.00 31.02 H new ATOM 0 HD2 ARG A 254 1.170 -4.610 11.538 1.00 4.24 H new ATOM 0 HD3 ARG A 254 1.584 -3.238 10.530 1.00 4.24 H new ATOM 0 HE ARG A 254 -0.784 -2.386 11.038 1.00 11.34 H new ATOM 0 HH11 ARG A 254 0.945 -4.508 13.316 1.00 42.45 H new ATOM 0 HH12 ARG A 254 0.063 -3.885 14.714 1.00 42.45 H new ATOM 0 HH21 ARG A 254 -1.835 -1.583 12.838 1.00 11.45 H new ATOM 0 HH22 ARG A 254 -1.499 -2.240 14.443 1.00 11.45 H new ATOM 1247 N ILE A 255 4.468 -6.248 8.670 1.00 12.01 N ATOM 1248 CA ILE A 255 5.375 -7.340 8.319 1.00 41.52 C ATOM 1249 C ILE A 255 4.919 -8.584 9.081 1.00 63.03 C ATOM 1250 O ILE A 255 5.174 -8.730 10.278 1.00 45.41 O ATOM 1251 CB ILE A 255 6.879 -6.996 8.627 1.00 2.21 C ATOM 1252 CG1 ILE A 255 7.278 -5.650 7.947 1.00 73.32 C ATOM 1253 CG2 ILE A 255 7.828 -8.145 8.188 1.00 55.32 C ATOM 1254 CD1 ILE A 255 6.967 -5.543 6.459 1.00 44.01 C ATOM 0 H ILE A 255 4.727 -5.758 9.526 1.00 12.01 H new ATOM 0 HA ILE A 255 5.332 -7.514 7.244 1.00 41.52 H new ATOM 0 HB ILE A 255 6.984 -6.883 9.706 1.00 2.21 H new ATOM 0 HG12 ILE A 255 6.769 -4.838 8.465 1.00 73.32 H new ATOM 0 HG13 ILE A 255 8.348 -5.496 8.088 1.00 73.32 H new ATOM 0 HG21 ILE A 255 8.859 -7.873 8.416 1.00 55.32 H new ATOM 0 HG22 ILE A 255 7.567 -9.058 8.724 1.00 55.32 H new ATOM 0 HG23 ILE A 255 7.726 -8.312 7.116 1.00 55.32 H new ATOM 0 HD11 ILE A 255 7.285 -4.568 6.090 1.00 44.01 H new ATOM 0 HD12 ILE A 255 7.498 -6.327 5.919 1.00 44.01 H new ATOM 0 HD13 ILE A 255 5.894 -5.658 6.302 1.00 44.01 H new ATOM 1266 N THR A 256 4.197 -9.439 8.376 1.00 14.31 N ATOM 1267 CA THR A 256 3.513 -10.604 8.925 1.00 24.34 C ATOM 1268 C THR A 256 3.975 -11.862 8.137 1.00 11.31 C ATOM 1269 O THR A 256 5.157 -12.235 8.287 1.00 73.11 O ATOM 1270 CB THR A 256 1.954 -10.334 8.889 1.00 43.21 C ATOM 1271 OG1 THR A 256 1.212 -11.535 9.142 1.00 60.00 O ATOM 1272 CG2 THR A 256 1.498 -9.698 7.553 1.00 1.11 C ATOM 1273 OXT THR A 256 3.201 -12.457 7.355 1.00 37.49 O ATOM 0 H THR A 256 4.065 -9.340 7.369 1.00 14.31 H new ATOM 0 HA THR A 256 3.765 -10.789 9.969 1.00 24.34 H new ATOM 0 HB THR A 256 1.746 -9.618 9.684 1.00 43.21 H new ATOM 0 HG1 THR A 256 1.513 -12.240 8.532 1.00 60.00 H new ATOM 0 HG21 THR A 256 0.421 -9.532 7.578 1.00 1.11 H new ATOM 0 HG22 THR A 256 2.008 -8.745 7.411 1.00 1.11 H new ATOM 0 HG23 THR A 256 1.743 -10.368 6.729 1.00 1.11 H new TER 1281 THR A 256