USER MOD reduce.3.24.130724 H: found=0, std=0, add=602, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 602 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 173 MET CE :methyl -177:sc= 0 (180deg=-0.00732) USER MOD Single : A 174 ASN : amide:sc= -0.719 X(o=-0.72,f=-0.59) USER MOD Single : A 176 HIS : no HD1:sc= -1.45! C(o=-1.5!,f=-4.5!) USER MOD Single : A 177 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 178 SER OG : rot 49:sc= 0.445 USER MOD Single : A 186 GLN : amide:sc= -0.275 K(o=-0.27,f=-0.9) USER MOD Single : A 192 TYR OH : rot 180:sc= 0 USER MOD Single : A 197 LYS NZ :NH3+ 171:sc= -1.93 (180deg=-2.34) USER MOD Single : A 202 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 203 CYS SG : rot 60:sc= -0.207 USER MOD Single : A 204 TYR OH : rot -143:sc= 0.672 USER MOD Single : A 214 HIS : no HD1:sc= -4.24! C(o=-4.2!,f=-3.2!) USER MOD Single : A 217 SER OG : rot 180:sc= 0 USER MOD Single : A 220 SER OG : rot 180:sc= 0 USER MOD Single : A 223 THR OG1 : rot 180:sc= 0 USER MOD Single : A 229 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 230 GLN : amide:sc= -1.17 K(o=-1.2,f=0) USER MOD Single : A 235 MET CE :methyl -142:sc= -0.379 (180deg=-1.88!) USER MOD Single : A 239 CYS SG : rot 68:sc= -2.98! USER MOD Single : A 244 HIS : no HE2:sc= -1.41 K(o=-1.4,f=-4.7!) USER MOD Single : A 247 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 173 6.854 10.574 14.089 1.00 0.00 N ATOM 2 CA MET A 173 7.088 10.980 12.685 1.00 0.00 C ATOM 3 C MET A 173 8.527 11.500 12.530 1.00 0.00 C ATOM 4 O MET A 173 8.919 11.971 11.478 1.00 0.00 O ATOM 5 CB MET A 173 6.045 12.043 12.292 1.00 0.00 C ATOM 6 CG MET A 173 6.295 13.389 12.983 1.00 0.00 C ATOM 7 SD MET A 173 6.157 13.221 14.788 1.00 0.00 S ATOM 8 CE MET A 173 4.347 13.331 14.936 1.00 0.00 C ATOM 0 HA MET A 173 6.974 10.128 12.015 1.00 0.00 H new ATOM 0 HB2 MET A 173 6.063 12.183 11.211 1.00 0.00 H new ATOM 0 HB3 MET A 173 5.049 11.684 12.551 1.00 0.00 H new ATOM 0 HG2 MET A 173 7.287 13.759 12.722 1.00 0.00 H new ATOM 0 HG3 MET A 173 5.576 14.126 12.625 1.00 0.00 H new ATOM 0 HE1 MET A 173 4.066 13.301 15.989 1.00 0.00 H new ATOM 0 HE2 MET A 173 4.002 14.266 14.495 1.00 0.00 H new ATOM 0 HE3 MET A 173 3.888 12.492 14.414 1.00 0.00 H new ATOM 20 N ASN A 174 9.315 11.440 13.575 1.00 0.00 N ATOM 21 CA ASN A 174 10.733 11.907 13.477 1.00 0.00 C ATOM 22 C ASN A 174 11.438 11.064 12.406 1.00 0.00 C ATOM 23 O ASN A 174 12.366 11.486 11.744 1.00 0.00 O ATOM 24 CB ASN A 174 11.414 11.774 14.848 1.00 0.00 C ATOM 25 CG ASN A 174 10.657 10.780 15.748 1.00 0.00 C ATOM 26 OD1 ASN A 174 10.955 9.597 15.713 1.00 0.00 O ATOM 27 ND2 ASN A 174 9.712 11.194 16.566 1.00 0.00 N ATOM 0 H ASN A 174 9.038 11.088 14.491 1.00 0.00 H new ATOM 0 HA ASN A 174 10.783 12.957 13.189 1.00 0.00 H new ATOM 0 HB2 ASN A 174 12.443 11.439 14.716 1.00 0.00 H new ATOM 0 HB3 ASN A 174 11.456 12.749 15.333 1.00 0.00 H new ATOM 0 HD21 ASN A 174 9.231 10.527 17.169 1.00 0.00 H new ATOM 0 HD22 ASN A 174 9.461 12.182 16.597 1.00 0.00 H new ATOM 34 N VAL A 175 10.990 9.849 12.250 1.00 0.00 N ATOM 35 CA VAL A 175 11.587 8.963 11.225 1.00 0.00 C ATOM 36 C VAL A 175 11.177 9.456 9.842 1.00 0.00 C ATOM 37 O VAL A 175 10.116 10.016 9.666 1.00 0.00 O ATOM 38 CB VAL A 175 11.058 7.553 11.402 1.00 0.00 C ATOM 39 CG1 VAL A 175 11.875 6.593 10.534 1.00 0.00 C ATOM 40 CG2 VAL A 175 11.159 7.135 12.860 1.00 0.00 C ATOM 0 H VAL A 175 10.233 9.435 12.793 1.00 0.00 H new ATOM 0 HA VAL A 175 12.672 8.972 11.329 1.00 0.00 H new ATOM 0 HB VAL A 175 10.012 7.523 11.098 1.00 0.00 H new ATOM 0 HG11 VAL A 175 11.497 5.578 10.659 1.00 0.00 H new ATOM 0 HG12 VAL A 175 11.789 6.886 9.488 1.00 0.00 H new ATOM 0 HG13 VAL A 175 12.922 6.630 10.836 1.00 0.00 H new ATOM 0 HG21 VAL A 175 10.776 6.121 12.975 1.00 0.00 H new ATOM 0 HG22 VAL A 175 12.202 7.168 13.176 1.00 0.00 H new ATOM 0 HG23 VAL A 175 10.572 7.816 13.475 1.00 0.00 H new ATOM 50 N HIS A 176 12.018 9.253 8.872 1.00 0.00 N ATOM 51 CA HIS A 176 11.688 9.688 7.474 1.00 0.00 C ATOM 52 C HIS A 176 10.420 8.979 6.985 1.00 0.00 C ATOM 53 O HIS A 176 10.104 7.872 7.370 1.00 0.00 O ATOM 54 CB HIS A 176 12.906 9.477 6.545 1.00 0.00 C ATOM 55 CG HIS A 176 14.179 9.423 7.355 1.00 0.00 C ATOM 56 ND1 HIS A 176 14.318 10.173 8.503 1.00 0.00 N ATOM 57 CD2 HIS A 176 15.365 8.741 7.197 1.00 0.00 C ATOM 58 CE1 HIS A 176 15.544 9.931 9.006 1.00 0.00 C ATOM 59 NE2 HIS A 176 16.223 9.064 8.249 1.00 0.00 N ATOM 0 H HIS A 176 12.927 8.803 8.979 1.00 0.00 H new ATOM 0 HA HIS A 176 11.471 10.756 7.460 1.00 0.00 H new ATOM 0 HB2 HIS A 176 12.786 8.552 5.981 1.00 0.00 H new ATOM 0 HB3 HIS A 176 12.963 10.288 5.819 1.00 0.00 H new ATOM 0 HD2 HIS A 176 15.595 8.064 6.388 1.00 0.00 H new ATOM 0 HE1 HIS A 176 15.930 10.381 9.908 1.00 0.00 H new ATOM 0 HE2 HIS A 176 17.168 8.713 8.407 1.00 0.00 H new ATOM 67 N LYS A 177 9.630 9.646 6.216 1.00 0.00 N ATOM 68 CA LYS A 177 8.361 9.022 5.756 1.00 0.00 C ATOM 69 C LYS A 177 8.648 7.676 5.067 1.00 0.00 C ATOM 70 O LYS A 177 7.898 6.727 5.166 1.00 0.00 O ATOM 71 CB LYS A 177 7.576 9.963 4.852 1.00 0.00 C ATOM 72 CG LYS A 177 7.868 11.420 5.231 1.00 0.00 C ATOM 73 CD LYS A 177 6.878 12.353 4.509 1.00 0.00 C ATOM 74 CE LYS A 177 5.663 12.664 5.386 1.00 0.00 C ATOM 75 NZ LYS A 177 4.774 13.623 4.640 1.00 0.00 N ATOM 0 H LYS A 177 9.799 10.595 5.882 1.00 0.00 H new ATOM 0 HA LYS A 177 7.736 8.828 6.628 1.00 0.00 H new ATOM 0 HB2 LYS A 177 7.845 9.789 3.810 1.00 0.00 H new ATOM 0 HB3 LYS A 177 6.509 9.762 4.943 1.00 0.00 H new ATOM 0 HG2 LYS A 177 7.783 11.549 6.310 1.00 0.00 H new ATOM 0 HG3 LYS A 177 8.891 11.679 4.958 1.00 0.00 H new ATOM 0 HD2 LYS A 177 7.381 13.282 4.239 1.00 0.00 H new ATOM 0 HD3 LYS A 177 6.549 11.888 3.580 1.00 0.00 H new ATOM 0 HE2 LYS A 177 5.121 11.748 5.622 1.00 0.00 H new ATOM 0 HE3 LYS A 177 5.980 13.099 6.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 177 3.941 13.847 5.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 177 5.300 14.497 4.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 177 4.467 13.188 3.747 1.00 0.00 H new ATOM 89 N SER A 178 9.702 7.634 4.286 1.00 0.00 N ATOM 90 CA SER A 178 10.037 6.381 3.540 1.00 0.00 C ATOM 91 C SER A 178 11.543 6.218 3.432 1.00 0.00 C ATOM 92 O SER A 178 12.191 6.838 2.612 1.00 0.00 O ATOM 93 CB SER A 178 9.432 6.426 2.130 1.00 0.00 C ATOM 94 OG SER A 178 9.778 7.661 1.483 1.00 0.00 O ATOM 0 H SER A 178 10.343 8.413 4.134 1.00 0.00 H new ATOM 0 HA SER A 178 9.621 5.535 4.087 1.00 0.00 H new ATOM 0 HB2 SER A 178 9.797 5.584 1.542 1.00 0.00 H new ATOM 0 HB3 SER A 178 8.348 6.328 2.188 1.00 0.00 H new ATOM 0 HG SER A 178 10.742 7.817 1.569 1.00 0.00 H new ATOM 100 N GLU A 179 12.082 5.357 4.244 1.00 0.00 N ATOM 101 CA GLU A 179 13.538 5.070 4.199 1.00 0.00 C ATOM 102 C GLU A 179 13.826 4.168 2.988 1.00 0.00 C ATOM 103 O GLU A 179 14.934 4.106 2.501 1.00 0.00 O ATOM 104 CB GLU A 179 13.961 4.344 5.488 1.00 0.00 C ATOM 105 CG GLU A 179 13.730 5.248 6.700 1.00 0.00 C ATOM 106 CD GLU A 179 14.097 4.486 7.973 1.00 0.00 C ATOM 107 OE1 GLU A 179 13.404 3.543 8.292 1.00 0.00 O ATOM 108 OE2 GLU A 179 15.067 4.859 8.606 1.00 0.00 O ATOM 0 H GLU A 179 11.565 4.831 4.949 1.00 0.00 H new ATOM 0 HA GLU A 179 14.096 6.002 4.113 1.00 0.00 H new ATOM 0 HB2 GLU A 179 13.391 3.421 5.599 1.00 0.00 H new ATOM 0 HB3 GLU A 179 15.013 4.064 5.429 1.00 0.00 H new ATOM 0 HG2 GLU A 179 14.334 6.151 6.615 1.00 0.00 H new ATOM 0 HG3 GLU A 179 12.688 5.565 6.739 1.00 0.00 H new ATOM 115 N PHE A 180 12.830 3.448 2.514 1.00 0.00 N ATOM 116 CA PHE A 180 13.030 2.522 1.356 1.00 0.00 C ATOM 117 C PHE A 180 12.651 3.204 0.029 1.00 0.00 C ATOM 118 O PHE A 180 12.370 4.383 -0.017 1.00 0.00 O ATOM 119 CB PHE A 180 12.167 1.283 1.574 1.00 0.00 C ATOM 120 CG PHE A 180 12.603 0.580 2.843 1.00 0.00 C ATOM 121 CD1 PHE A 180 12.328 1.149 4.095 1.00 0.00 C ATOM 122 CD2 PHE A 180 13.296 -0.629 2.762 1.00 0.00 C ATOM 123 CE1 PHE A 180 12.748 0.505 5.265 1.00 0.00 C ATOM 124 CE2 PHE A 180 13.718 -1.278 3.929 1.00 0.00 C ATOM 125 CZ PHE A 180 13.445 -0.710 5.184 1.00 0.00 C ATOM 0 H PHE A 180 11.881 3.466 2.886 1.00 0.00 H new ATOM 0 HA PHE A 180 14.082 2.244 1.295 1.00 0.00 H new ATOM 0 HB2 PHE A 180 11.117 1.566 1.645 1.00 0.00 H new ATOM 0 HB3 PHE A 180 12.258 0.609 0.722 1.00 0.00 H new ATOM 0 HD1 PHE A 180 11.792 2.085 4.157 1.00 0.00 H new ATOM 0 HD2 PHE A 180 13.507 -1.065 1.797 1.00 0.00 H new ATOM 0 HE1 PHE A 180 12.536 0.943 6.229 1.00 0.00 H new ATOM 0 HE2 PHE A 180 14.253 -2.214 3.864 1.00 0.00 H new ATOM 0 HZ PHE A 180 13.771 -1.208 6.085 1.00 0.00 H new ATOM 135 N ASP A 181 12.670 2.475 -1.059 1.00 0.00 N ATOM 136 CA ASP A 181 12.329 3.087 -2.376 1.00 0.00 C ATOM 137 C ASP A 181 10.903 3.671 -2.333 1.00 0.00 C ATOM 138 O ASP A 181 9.939 2.961 -2.147 1.00 0.00 O ATOM 139 CB ASP A 181 12.415 1.989 -3.446 1.00 0.00 C ATOM 140 CG ASP A 181 13.857 1.482 -3.531 1.00 0.00 C ATOM 141 OD1 ASP A 181 14.667 2.157 -4.141 1.00 0.00 O ATOM 142 OD2 ASP A 181 14.133 0.438 -2.965 1.00 0.00 O ATOM 0 H ASP A 181 12.907 1.483 -1.090 1.00 0.00 H new ATOM 0 HA ASP A 181 13.023 3.895 -2.608 1.00 0.00 H new ATOM 0 HB2 ASP A 181 11.742 1.168 -3.197 1.00 0.00 H new ATOM 0 HB3 ASP A 181 12.097 2.380 -4.412 1.00 0.00 H new ATOM 147 N GLU A 182 10.769 4.963 -2.508 1.00 0.00 N ATOM 148 CA GLU A 182 9.419 5.608 -2.483 1.00 0.00 C ATOM 149 C GLU A 182 8.532 5.006 -3.580 1.00 0.00 C ATOM 150 O GLU A 182 7.333 4.870 -3.418 1.00 0.00 O ATOM 151 CB GLU A 182 9.562 7.121 -2.711 1.00 0.00 C ATOM 152 CG GLU A 182 10.048 7.393 -4.138 1.00 0.00 C ATOM 153 CD GLU A 182 10.490 8.849 -4.260 1.00 0.00 C ATOM 154 OE1 GLU A 182 9.882 9.679 -3.611 1.00 0.00 O ATOM 155 OE2 GLU A 182 11.423 9.110 -5.005 1.00 0.00 O ATOM 0 H GLU A 182 11.545 5.605 -2.669 1.00 0.00 H new ATOM 0 HA GLU A 182 8.959 5.430 -1.511 1.00 0.00 H new ATOM 0 HB2 GLU A 182 8.604 7.614 -2.544 1.00 0.00 H new ATOM 0 HB3 GLU A 182 10.266 7.540 -1.992 1.00 0.00 H new ATOM 0 HG2 GLU A 182 10.877 6.729 -4.383 1.00 0.00 H new ATOM 0 HG3 GLU A 182 9.250 7.184 -4.851 1.00 0.00 H new ATOM 162 N ASP A 183 9.110 4.656 -4.701 1.00 0.00 N ATOM 163 CA ASP A 183 8.298 4.079 -5.810 1.00 0.00 C ATOM 164 C ASP A 183 7.605 2.794 -5.363 1.00 0.00 C ATOM 165 O ASP A 183 6.459 2.559 -5.696 1.00 0.00 O ATOM 166 CB ASP A 183 9.206 3.772 -7.009 1.00 0.00 C ATOM 167 CG ASP A 183 9.601 5.070 -7.703 1.00 0.00 C ATOM 168 OD1 ASP A 183 8.764 5.629 -8.387 1.00 0.00 O ATOM 169 OD2 ASP A 183 10.740 5.477 -7.547 1.00 0.00 O ATOM 0 H ASP A 183 10.108 4.745 -4.894 1.00 0.00 H new ATOM 0 HA ASP A 183 7.539 4.807 -6.094 1.00 0.00 H new ATOM 0 HB2 ASP A 183 10.098 3.241 -6.675 1.00 0.00 H new ATOM 0 HB3 ASP A 183 8.689 3.117 -7.710 1.00 0.00 H new ATOM 174 N ALA A 184 8.269 1.960 -4.614 1.00 0.00 N ATOM 175 CA ALA A 184 7.611 0.709 -4.180 1.00 0.00 C ATOM 176 C ALA A 184 6.516 1.028 -3.163 1.00 0.00 C ATOM 177 O ALA A 184 5.429 0.504 -3.241 1.00 0.00 O ATOM 178 CB ALA A 184 8.647 -0.220 -3.547 1.00 0.00 C ATOM 0 H ALA A 184 9.227 2.092 -4.289 1.00 0.00 H new ATOM 0 HA ALA A 184 7.164 0.217 -5.044 1.00 0.00 H new ATOM 0 HB1 ALA A 184 8.162 -1.142 -3.227 1.00 0.00 H new ATOM 0 HB2 ALA A 184 9.422 -0.452 -4.278 1.00 0.00 H new ATOM 0 HB3 ALA A 184 9.097 0.271 -2.684 1.00 0.00 H new ATOM 184 N TRP A 185 6.780 1.881 -2.207 1.00 0.00 N ATOM 185 CA TRP A 185 5.722 2.193 -1.205 1.00 0.00 C ATOM 186 C TRP A 185 4.506 2.784 -1.921 1.00 0.00 C ATOM 187 O TRP A 185 3.382 2.397 -1.681 1.00 0.00 O ATOM 188 CB TRP A 185 6.246 3.200 -0.180 1.00 0.00 C ATOM 189 CG TRP A 185 5.152 3.560 0.772 1.00 0.00 C ATOM 190 CD1 TRP A 185 4.622 4.800 0.908 1.00 0.00 C ATOM 191 CD2 TRP A 185 4.443 2.704 1.714 1.00 0.00 C ATOM 192 NE1 TRP A 185 3.628 4.755 1.869 1.00 0.00 N ATOM 193 CE2 TRP A 185 3.481 3.489 2.395 1.00 0.00 C ATOM 194 CE3 TRP A 185 4.535 1.340 2.039 1.00 0.00 C ATOM 195 CZ2 TRP A 185 2.643 2.943 3.359 1.00 0.00 C ATOM 196 CZ3 TRP A 185 3.690 0.793 3.009 1.00 0.00 C ATOM 197 CH2 TRP A 185 2.747 1.588 3.667 1.00 0.00 C ATOM 0 H TRP A 185 7.668 2.367 -2.079 1.00 0.00 H new ATOM 0 HA TRP A 185 5.439 1.276 -0.689 1.00 0.00 H new ATOM 0 HB2 TRP A 185 7.090 2.775 0.364 1.00 0.00 H new ATOM 0 HB3 TRP A 185 6.610 4.094 -0.686 1.00 0.00 H new ATOM 0 HD1 TRP A 185 4.926 5.678 0.357 1.00 0.00 H new ATOM 0 HE1 TRP A 185 3.071 5.561 2.154 1.00 0.00 H new ATOM 0 HE3 TRP A 185 5.259 0.714 1.539 1.00 0.00 H new ATOM 0 HZ2 TRP A 185 1.918 3.563 3.865 1.00 0.00 H new ATOM 0 HZ3 TRP A 185 3.767 -0.256 3.253 1.00 0.00 H new ATOM 0 HH2 TRP A 185 2.100 1.152 4.414 1.00 0.00 H new ATOM 208 N GLN A 186 4.725 3.715 -2.809 1.00 0.00 N ATOM 209 CA GLN A 186 3.590 4.323 -3.556 1.00 0.00 C ATOM 210 C GLN A 186 2.852 3.239 -4.341 1.00 0.00 C ATOM 211 O GLN A 186 1.647 3.247 -4.426 1.00 0.00 O ATOM 212 CB GLN A 186 4.128 5.385 -4.526 1.00 0.00 C ATOM 213 CG GLN A 186 4.579 6.611 -3.733 1.00 0.00 C ATOM 214 CD GLN A 186 3.363 7.329 -3.140 1.00 0.00 C ATOM 215 OE1 GLN A 186 2.356 7.484 -3.798 1.00 0.00 O ATOM 216 NE2 GLN A 186 3.415 7.777 -1.917 1.00 0.00 N ATOM 0 H GLN A 186 5.646 4.082 -3.050 1.00 0.00 H new ATOM 0 HA GLN A 186 2.901 4.789 -2.852 1.00 0.00 H new ATOM 0 HB2 GLN A 186 4.963 4.981 -5.099 1.00 0.00 H new ATOM 0 HB3 GLN A 186 3.355 5.665 -5.242 1.00 0.00 H new ATOM 0 HG2 GLN A 186 5.258 6.309 -2.935 1.00 0.00 H new ATOM 0 HG3 GLN A 186 5.132 7.290 -4.382 1.00 0.00 H new ATOM 0 HE21 GLN A 186 4.261 7.648 -1.362 1.00 0.00 H new ATOM 0 HE22 GLN A 186 2.610 8.257 -1.515 1.00 0.00 H new ATOM 225 N PHE A 187 3.558 2.305 -4.918 1.00 0.00 N ATOM 226 CA PHE A 187 2.864 1.245 -5.706 1.00 0.00 C ATOM 227 C PHE A 187 1.895 0.482 -4.790 1.00 0.00 C ATOM 228 O PHE A 187 0.757 0.235 -5.141 1.00 0.00 O ATOM 229 CB PHE A 187 3.921 0.280 -6.272 1.00 0.00 C ATOM 230 CG PHE A 187 3.286 -0.712 -7.233 1.00 0.00 C ATOM 231 CD1 PHE A 187 2.522 -1.780 -6.743 1.00 0.00 C ATOM 232 CD2 PHE A 187 3.477 -0.572 -8.609 1.00 0.00 C ATOM 233 CE1 PHE A 187 1.944 -2.699 -7.631 1.00 0.00 C ATOM 234 CE2 PHE A 187 2.906 -1.495 -9.495 1.00 0.00 C ATOM 235 CZ PHE A 187 2.139 -2.552 -9.004 1.00 0.00 C ATOM 0 H PHE A 187 4.574 2.229 -4.879 1.00 0.00 H new ATOM 0 HA PHE A 187 2.300 1.692 -6.525 1.00 0.00 H new ATOM 0 HB2 PHE A 187 4.698 0.845 -6.787 1.00 0.00 H new ATOM 0 HB3 PHE A 187 4.405 -0.256 -5.456 1.00 0.00 H new ATOM 0 HD1 PHE A 187 2.378 -1.896 -5.679 1.00 0.00 H new ATOM 0 HD2 PHE A 187 4.066 0.249 -8.991 1.00 0.00 H new ATOM 0 HE1 PHE A 187 1.350 -3.518 -7.253 1.00 0.00 H new ATOM 0 HE2 PHE A 187 3.060 -1.388 -10.559 1.00 0.00 H new ATOM 0 HZ PHE A 187 1.695 -3.259 -9.689 1.00 0.00 H new ATOM 245 N LEU A 188 2.342 0.095 -3.631 1.00 0.00 N ATOM 246 CA LEU A 188 1.466 -0.663 -2.696 1.00 0.00 C ATOM 247 C LEU A 188 0.243 0.176 -2.317 1.00 0.00 C ATOM 248 O LEU A 188 -0.862 -0.326 -2.222 1.00 0.00 O ATOM 249 CB LEU A 188 2.267 -0.980 -1.439 1.00 0.00 C ATOM 250 CG LEU A 188 1.421 -1.763 -0.434 1.00 0.00 C ATOM 251 CD1 LEU A 188 0.972 -3.103 -1.046 1.00 0.00 C ATOM 252 CD2 LEU A 188 2.281 -2.019 0.804 1.00 0.00 C ATOM 0 H LEU A 188 3.286 0.273 -3.287 1.00 0.00 H new ATOM 0 HA LEU A 188 1.126 -1.580 -3.176 1.00 0.00 H new ATOM 0 HB2 LEU A 188 3.152 -1.558 -1.704 1.00 0.00 H new ATOM 0 HB3 LEU A 188 2.616 -0.054 -0.983 1.00 0.00 H new ATOM 0 HG LEU A 188 0.530 -1.194 -0.169 1.00 0.00 H new ATOM 0 HD11 LEU A 188 0.371 -3.651 -0.321 1.00 0.00 H new ATOM 0 HD12 LEU A 188 0.379 -2.914 -1.940 1.00 0.00 H new ATOM 0 HD13 LEU A 188 1.849 -3.694 -1.311 1.00 0.00 H new ATOM 0 HD21 LEU A 188 1.702 -2.577 1.540 1.00 0.00 H new ATOM 0 HD22 LEU A 188 3.162 -2.596 0.522 1.00 0.00 H new ATOM 0 HD23 LEU A 188 2.593 -1.067 1.234 1.00 0.00 H new ATOM 264 N ILE A 189 0.436 1.447 -2.079 1.00 0.00 N ATOM 265 CA ILE A 189 -0.714 2.314 -1.689 1.00 0.00 C ATOM 266 C ILE A 189 -1.758 2.364 -2.816 1.00 0.00 C ATOM 267 O ILE A 189 -2.948 2.332 -2.572 1.00 0.00 O ATOM 268 CB ILE A 189 -0.209 3.742 -1.406 1.00 0.00 C ATOM 269 CG1 ILE A 189 0.730 3.748 -0.177 1.00 0.00 C ATOM 270 CG2 ILE A 189 -1.402 4.674 -1.154 1.00 0.00 C ATOM 271 CD1 ILE A 189 0.022 3.195 1.073 1.00 0.00 C ATOM 0 H ILE A 189 1.337 1.921 -2.138 1.00 0.00 H new ATOM 0 HA ILE A 189 -1.176 1.897 -0.794 1.00 0.00 H new ATOM 0 HB ILE A 189 0.348 4.095 -2.274 1.00 0.00 H new ATOM 0 HG12 ILE A 189 1.615 3.149 -0.391 1.00 0.00 H new ATOM 0 HG13 ILE A 189 1.072 4.765 0.017 1.00 0.00 H new ATOM 0 HG21 ILE A 189 -1.040 5.683 -0.954 1.00 0.00 H new ATOM 0 HG22 ILE A 189 -2.046 4.687 -2.034 1.00 0.00 H new ATOM 0 HG23 ILE A 189 -1.969 4.315 -0.295 1.00 0.00 H new ATOM 0 HD11 ILE A 189 0.710 3.213 1.919 1.00 0.00 H new ATOM 0 HD12 ILE A 189 -0.849 3.810 1.300 1.00 0.00 H new ATOM 0 HD13 ILE A 189 -0.297 2.170 0.887 1.00 0.00 H new ATOM 283 N ALA A 190 -1.335 2.476 -4.042 1.00 0.00 N ATOM 284 CA ALA A 190 -2.320 2.569 -5.159 1.00 0.00 C ATOM 285 C ALA A 190 -3.203 1.320 -5.208 1.00 0.00 C ATOM 286 O ALA A 190 -4.388 1.413 -5.439 1.00 0.00 O ATOM 287 CB ALA A 190 -1.576 2.719 -6.486 1.00 0.00 C ATOM 0 H ALA A 190 -0.354 2.507 -4.321 1.00 0.00 H new ATOM 0 HA ALA A 190 -2.955 3.439 -4.990 1.00 0.00 H new ATOM 0 HB1 ALA A 190 -2.296 2.787 -7.301 1.00 0.00 H new ATOM 0 HB2 ALA A 190 -0.968 3.624 -6.462 1.00 0.00 H new ATOM 0 HB3 ALA A 190 -0.932 1.854 -6.642 1.00 0.00 H new ATOM 293 N ASP A 191 -2.640 0.156 -4.999 1.00 0.00 N ATOM 294 CA ASP A 191 -3.455 -1.095 -5.045 1.00 0.00 C ATOM 295 C ASP A 191 -4.395 -1.170 -3.838 1.00 0.00 C ATOM 296 O ASP A 191 -5.533 -1.585 -3.944 1.00 0.00 O ATOM 297 CB ASP A 191 -2.501 -2.296 -5.012 1.00 0.00 C ATOM 298 CG ASP A 191 -1.724 -2.357 -6.332 1.00 0.00 C ATOM 299 OD1 ASP A 191 -2.362 -2.308 -7.369 1.00 0.00 O ATOM 300 OD2 ASP A 191 -0.511 -2.449 -6.286 1.00 0.00 O ATOM 0 H ASP A 191 -1.649 0.019 -4.798 1.00 0.00 H new ATOM 0 HA ASP A 191 -4.055 -1.101 -5.955 1.00 0.00 H new ATOM 0 HB2 ASP A 191 -1.811 -2.205 -4.173 1.00 0.00 H new ATOM 0 HB3 ASP A 191 -3.063 -3.218 -4.864 1.00 0.00 H new ATOM 305 N TYR A 192 -3.923 -0.781 -2.693 1.00 0.00 N ATOM 306 CA TYR A 192 -4.763 -0.849 -1.470 1.00 0.00 C ATOM 307 C TYR A 192 -6.019 0.005 -1.631 1.00 0.00 C ATOM 308 O TYR A 192 -7.069 -0.322 -1.118 1.00 0.00 O ATOM 309 CB TYR A 192 -3.974 -0.341 -0.269 1.00 0.00 C ATOM 310 CG TYR A 192 -4.685 -0.750 0.992 1.00 0.00 C ATOM 311 CD1 TYR A 192 -4.503 -2.041 1.500 1.00 0.00 C ATOM 312 CD2 TYR A 192 -5.528 0.150 1.649 1.00 0.00 C ATOM 313 CE1 TYR A 192 -5.166 -2.433 2.661 1.00 0.00 C ATOM 314 CE2 TYR A 192 -6.188 -0.245 2.814 1.00 0.00 C ATOM 315 CZ TYR A 192 -6.008 -1.540 3.318 1.00 0.00 C ATOM 316 OH TYR A 192 -6.664 -1.934 4.460 1.00 0.00 O ATOM 0 H TYR A 192 -2.982 -0.415 -2.549 1.00 0.00 H new ATOM 0 HA TYR A 192 -5.052 -1.888 -1.314 1.00 0.00 H new ATOM 0 HB2 TYR A 192 -2.964 -0.750 -0.282 1.00 0.00 H new ATOM 0 HB3 TYR A 192 -3.879 0.744 -0.313 1.00 0.00 H new ATOM 0 HD1 TYR A 192 -3.848 -2.734 0.992 1.00 0.00 H new ATOM 0 HD2 TYR A 192 -5.668 1.147 1.257 1.00 0.00 H new ATOM 0 HE1 TYR A 192 -5.027 -3.430 3.052 1.00 0.00 H new ATOM 0 HE2 TYR A 192 -6.838 0.448 3.327 1.00 0.00 H new ATOM 0 HH TYR A 192 -7.211 -1.193 4.795 1.00 0.00 H new ATOM 326 N LEU A 193 -5.922 1.116 -2.303 1.00 0.00 N ATOM 327 CA LEU A 193 -7.120 1.998 -2.448 1.00 0.00 C ATOM 328 C LEU A 193 -8.050 1.486 -3.553 1.00 0.00 C ATOM 329 O LEU A 193 -9.090 2.056 -3.788 1.00 0.00 O ATOM 330 CB LEU A 193 -6.658 3.411 -2.818 1.00 0.00 C ATOM 331 CG LEU A 193 -5.718 3.951 -1.730 1.00 0.00 C ATOM 332 CD1 LEU A 193 -5.218 5.350 -2.128 1.00 0.00 C ATOM 333 CD2 LEU A 193 -6.460 4.044 -0.387 1.00 0.00 C ATOM 0 H LEU A 193 -5.073 1.453 -2.757 1.00 0.00 H new ATOM 0 HA LEU A 193 -7.662 2.000 -1.502 1.00 0.00 H new ATOM 0 HB2 LEU A 193 -6.146 3.396 -3.780 1.00 0.00 H new ATOM 0 HB3 LEU A 193 -7.520 4.069 -2.926 1.00 0.00 H new ATOM 0 HG LEU A 193 -4.872 3.271 -1.627 1.00 0.00 H new ATOM 0 HD11 LEU A 193 -4.551 5.732 -1.355 1.00 0.00 H new ATOM 0 HD12 LEU A 193 -4.679 5.289 -3.074 1.00 0.00 H new ATOM 0 HD13 LEU A 193 -6.069 6.023 -2.238 1.00 0.00 H new ATOM 0 HD21 LEU A 193 -5.784 4.428 0.377 1.00 0.00 H new ATOM 0 HD22 LEU A 193 -7.312 4.716 -0.488 1.00 0.00 H new ATOM 0 HD23 LEU A 193 -6.811 3.054 -0.096 1.00 0.00 H new ATOM 345 N ARG A 194 -7.698 0.432 -4.243 1.00 0.00 N ATOM 346 CA ARG A 194 -8.602 -0.065 -5.324 1.00 0.00 C ATOM 347 C ARG A 194 -9.760 -0.834 -4.672 1.00 0.00 C ATOM 348 O ARG A 194 -9.524 -1.693 -3.850 1.00 0.00 O ATOM 349 CB ARG A 194 -7.845 -1.012 -6.260 1.00 0.00 C ATOM 350 CG ARG A 194 -6.823 -0.225 -7.077 1.00 0.00 C ATOM 351 CD ARG A 194 -6.298 -1.099 -8.226 1.00 0.00 C ATOM 352 NE ARG A 194 -7.305 -1.136 -9.324 1.00 0.00 N ATOM 353 CZ ARG A 194 -6.949 -1.539 -10.514 1.00 0.00 C ATOM 354 NH1 ARG A 194 -5.700 -1.861 -10.745 1.00 0.00 N ATOM 355 NH2 ARG A 194 -7.827 -1.588 -11.476 1.00 0.00 N ATOM 0 H ARG A 194 -6.838 -0.099 -4.109 1.00 0.00 H new ATOM 0 HA ARG A 194 -8.973 0.781 -5.902 1.00 0.00 H new ATOM 0 HB2 ARG A 194 -7.342 -1.786 -5.680 1.00 0.00 H new ATOM 0 HB3 ARG A 194 -8.545 -1.517 -6.926 1.00 0.00 H new ATOM 0 HG2 ARG A 194 -7.281 0.681 -7.475 1.00 0.00 H new ATOM 0 HG3 ARG A 194 -5.997 0.089 -6.439 1.00 0.00 H new ATOM 0 HD2 ARG A 194 -5.354 -0.701 -8.598 1.00 0.00 H new ATOM 0 HD3 ARG A 194 -6.099 -2.109 -7.867 1.00 0.00 H new ATOM 0 HE ARG A 194 -8.267 -0.848 -9.147 1.00 0.00 H new ATOM 0 HH11 ARG A 194 -5.010 -1.796 -9.997 1.00 0.00 H new ATOM 0 HH12 ARG A 194 -5.418 -2.176 -11.673 1.00 0.00 H new ATOM 0 HH21 ARG A 194 -8.793 -1.311 -11.300 1.00 0.00 H new ATOM 0 HH22 ARG A 194 -7.548 -1.903 -12.405 1.00 0.00 H new ATOM 369 N PRO A 195 -11.000 -0.544 -5.013 1.00 0.00 N ATOM 370 CA PRO A 195 -12.170 -1.249 -4.412 1.00 0.00 C ATOM 371 C PRO A 195 -11.933 -2.757 -4.239 1.00 0.00 C ATOM 372 O PRO A 195 -12.578 -3.408 -3.447 1.00 0.00 O ATOM 373 CB PRO A 195 -13.283 -0.995 -5.424 1.00 0.00 C ATOM 374 CG PRO A 195 -12.972 0.345 -6.005 1.00 0.00 C ATOM 375 CD PRO A 195 -11.443 0.477 -5.992 1.00 0.00 C ATOM 0 HA PRO A 195 -12.390 -0.888 -3.407 1.00 0.00 H new ATOM 0 HB2 PRO A 195 -13.300 -1.766 -6.195 1.00 0.00 H new ATOM 0 HB3 PRO A 195 -14.262 -1.001 -4.945 1.00 0.00 H new ATOM 0 HG2 PRO A 195 -13.361 0.428 -7.020 1.00 0.00 H new ATOM 0 HG3 PRO A 195 -13.436 1.139 -5.420 1.00 0.00 H new ATOM 0 HD2 PRO A 195 -11.019 0.293 -6.979 1.00 0.00 H new ATOM 0 HD3 PRO A 195 -11.132 1.478 -5.693 1.00 0.00 H new ATOM 383 N GLU A 196 -11.019 -3.321 -4.977 1.00 0.00 N ATOM 384 CA GLU A 196 -10.771 -4.786 -4.835 1.00 0.00 C ATOM 385 C GLU A 196 -10.201 -5.064 -3.449 1.00 0.00 C ATOM 386 O GLU A 196 -10.563 -6.030 -2.817 1.00 0.00 O ATOM 387 CB GLU A 196 -9.775 -5.247 -5.895 1.00 0.00 C ATOM 388 CG GLU A 196 -10.427 -5.187 -7.284 1.00 0.00 C ATOM 389 CD GLU A 196 -11.511 -6.257 -7.396 1.00 0.00 C ATOM 390 OE1 GLU A 196 -11.355 -7.299 -6.781 1.00 0.00 O ATOM 391 OE2 GLU A 196 -12.482 -6.013 -8.096 1.00 0.00 O ATOM 0 H GLU A 196 -10.439 -2.840 -5.664 1.00 0.00 H new ATOM 0 HA GLU A 196 -11.708 -5.327 -4.965 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -8.887 -4.615 -5.872 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -9.447 -6.264 -5.681 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -10.859 -4.200 -7.450 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -9.673 -5.339 -8.056 1.00 0.00 H new ATOM 398 N LYS A 197 -9.324 -4.218 -2.969 1.00 0.00 N ATOM 399 CA LYS A 197 -8.732 -4.416 -1.608 1.00 0.00 C ATOM 400 C LYS A 197 -8.432 -5.901 -1.340 1.00 0.00 C ATOM 401 O LYS A 197 -8.944 -6.468 -0.397 1.00 0.00 O ATOM 402 CB LYS A 197 -9.723 -3.918 -0.545 1.00 0.00 C ATOM 403 CG LYS A 197 -10.036 -2.434 -0.793 1.00 0.00 C ATOM 404 CD LYS A 197 -11.049 -1.924 0.247 1.00 0.00 C ATOM 405 CE LYS A 197 -10.333 -1.567 1.556 1.00 0.00 C ATOM 406 NZ LYS A 197 -11.296 -0.930 2.497 1.00 0.00 N ATOM 0 H LYS A 197 -8.990 -3.392 -3.465 1.00 0.00 H new ATOM 0 HA LYS A 197 -7.799 -3.854 -1.561 1.00 0.00 H new ATOM 0 HB2 LYS A 197 -10.640 -4.506 -0.584 1.00 0.00 H new ATOM 0 HB3 LYS A 197 -9.301 -4.050 0.451 1.00 0.00 H new ATOM 0 HG2 LYS A 197 -9.119 -1.847 -0.737 1.00 0.00 H new ATOM 0 HG3 LYS A 197 -10.438 -2.302 -1.798 1.00 0.00 H new ATOM 0 HD2 LYS A 197 -11.570 -1.049 -0.141 1.00 0.00 H new ATOM 0 HD3 LYS A 197 -11.804 -2.687 0.434 1.00 0.00 H new ATOM 0 HE2 LYS A 197 -9.909 -2.465 2.006 1.00 0.00 H new ATOM 0 HE3 LYS A 197 -9.504 -0.889 1.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 197 -10.852 -0.828 3.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 197 -11.564 0.008 2.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 197 -12.145 -1.525 2.580 1.00 0.00 H new ATOM 420 N PRO A 198 -7.606 -6.536 -2.137 1.00 0.00 N ATOM 421 CA PRO A 198 -7.262 -7.976 -1.931 1.00 0.00 C ATOM 422 C PRO A 198 -6.747 -8.224 -0.513 1.00 0.00 C ATOM 423 O PRO A 198 -6.780 -7.345 0.325 1.00 0.00 O ATOM 424 CB PRO A 198 -6.170 -8.258 -2.969 1.00 0.00 C ATOM 425 CG PRO A 198 -6.354 -7.206 -4.021 1.00 0.00 C ATOM 426 CD PRO A 198 -6.915 -5.971 -3.305 1.00 0.00 C ATOM 0 HA PRO A 198 -8.127 -8.628 -2.050 1.00 0.00 H new ATOM 0 HB2 PRO A 198 -5.177 -8.201 -2.523 1.00 0.00 H new ATOM 0 HB3 PRO A 198 -6.273 -9.259 -3.389 1.00 0.00 H new ATOM 0 HG2 PRO A 198 -5.407 -6.975 -4.509 1.00 0.00 H new ATOM 0 HG3 PRO A 198 -7.038 -7.549 -4.798 1.00 0.00 H new ATOM 0 HD2 PRO A 198 -6.122 -5.284 -3.009 1.00 0.00 H new ATOM 0 HD3 PRO A 198 -7.599 -5.412 -3.944 1.00 0.00 H new ATOM 434 N ALA A 199 -6.275 -9.409 -0.233 1.00 0.00 N ATOM 435 CA ALA A 199 -5.770 -9.684 1.134 1.00 0.00 C ATOM 436 C ALA A 199 -4.483 -8.886 1.334 1.00 0.00 C ATOM 437 O ALA A 199 -3.673 -8.773 0.440 1.00 0.00 O ATOM 438 CB ALA A 199 -5.494 -11.187 1.301 1.00 0.00 C ATOM 0 H ALA A 199 -6.219 -10.189 -0.888 1.00 0.00 H new ATOM 0 HA ALA A 199 -6.512 -9.390 1.877 1.00 0.00 H new ATOM 0 HB1 ALA A 199 -5.124 -11.379 2.308 1.00 0.00 H new ATOM 0 HB2 ALA A 199 -6.416 -11.746 1.141 1.00 0.00 H new ATOM 0 HB3 ALA A 199 -4.747 -11.503 0.573 1.00 0.00 H new ATOM 444 N PHE A 200 -4.291 -8.316 2.489 1.00 0.00 N ATOM 445 CA PHE A 200 -3.055 -7.515 2.714 1.00 0.00 C ATOM 446 C PHE A 200 -1.832 -8.417 2.524 1.00 0.00 C ATOM 447 O PHE A 200 -0.847 -8.019 1.934 1.00 0.00 O ATOM 448 CB PHE A 200 -3.058 -6.953 4.136 1.00 0.00 C ATOM 449 CG PHE A 200 -1.806 -6.137 4.360 1.00 0.00 C ATOM 450 CD1 PHE A 200 -1.599 -4.962 3.623 1.00 0.00 C ATOM 451 CD2 PHE A 200 -0.847 -6.550 5.301 1.00 0.00 C ATOM 452 CE1 PHE A 200 -0.442 -4.202 3.826 1.00 0.00 C ATOM 453 CE2 PHE A 200 0.305 -5.792 5.502 1.00 0.00 C ATOM 454 CZ PHE A 200 0.508 -4.617 4.762 1.00 0.00 C ATOM 0 H PHE A 200 -4.930 -8.368 3.282 1.00 0.00 H new ATOM 0 HA PHE A 200 -3.019 -6.690 2.002 1.00 0.00 H new ATOM 0 HB2 PHE A 200 -3.941 -6.333 4.291 1.00 0.00 H new ATOM 0 HB3 PHE A 200 -3.108 -7.767 4.860 1.00 0.00 H new ATOM 0 HD1 PHE A 200 -2.333 -4.643 2.898 1.00 0.00 H new ATOM 0 HD2 PHE A 200 -1.003 -7.455 5.869 1.00 0.00 H new ATOM 0 HE1 PHE A 200 -0.284 -3.296 3.260 1.00 0.00 H new ATOM 0 HE2 PHE A 200 1.041 -6.108 6.226 1.00 0.00 H new ATOM 0 HZ PHE A 200 1.402 -4.031 4.917 1.00 0.00 H new ATOM 464 N ARG A 201 -1.885 -9.628 3.019 1.00 0.00 N ATOM 465 CA ARG A 201 -0.718 -10.548 2.857 1.00 0.00 C ATOM 466 C ARG A 201 -0.511 -10.808 1.361 1.00 0.00 C ATOM 467 O ARG A 201 0.602 -10.855 0.881 1.00 0.00 O ATOM 468 CB ARG A 201 -1.000 -11.881 3.608 1.00 0.00 C ATOM 469 CG ARG A 201 -0.042 -12.053 4.800 1.00 0.00 C ATOM 470 CD ARG A 201 1.406 -12.138 4.301 1.00 0.00 C ATOM 471 NE ARG A 201 2.121 -13.256 5.007 1.00 0.00 N ATOM 472 CZ ARG A 201 2.088 -13.374 6.303 1.00 0.00 C ATOM 473 NH1 ARG A 201 1.477 -12.494 7.034 1.00 0.00 N ATOM 474 NH2 ARG A 201 2.706 -14.369 6.870 1.00 0.00 N ATOM 0 H ARG A 201 -2.680 -10.018 3.525 1.00 0.00 H new ATOM 0 HA ARG A 201 0.183 -10.100 3.277 1.00 0.00 H new ATOM 0 HB2 ARG A 201 -2.031 -11.893 3.960 1.00 0.00 H new ATOM 0 HB3 ARG A 201 -0.888 -12.720 2.922 1.00 0.00 H new ATOM 0 HG2 ARG A 201 -0.150 -11.214 5.488 1.00 0.00 H new ATOM 0 HG3 ARG A 201 -0.298 -12.955 5.355 1.00 0.00 H new ATOM 0 HD2 ARG A 201 1.420 -12.307 3.224 1.00 0.00 H new ATOM 0 HD3 ARG A 201 1.919 -11.194 4.482 1.00 0.00 H new ATOM 0 HE ARG A 201 2.644 -13.938 4.458 1.00 0.00 H new ATOM 0 HH11 ARG A 201 1.015 -11.698 6.594 1.00 0.00 H new ATOM 0 HH12 ARG A 201 1.458 -12.598 8.049 1.00 0.00 H new ATOM 0 HH21 ARG A 201 3.210 -15.048 6.300 1.00 0.00 H new ATOM 0 HH22 ARG A 201 2.686 -14.470 7.885 1.00 0.00 H new ATOM 488 N LYS A 202 -1.574 -10.973 0.624 1.00 0.00 N ATOM 489 CA LYS A 202 -1.429 -11.234 -0.836 1.00 0.00 C ATOM 490 C LYS A 202 -0.933 -9.976 -1.540 1.00 0.00 C ATOM 491 O LYS A 202 -0.101 -10.048 -2.428 1.00 0.00 O ATOM 492 CB LYS A 202 -2.787 -11.629 -1.428 1.00 0.00 C ATOM 493 CG LYS A 202 -3.239 -12.985 -0.876 1.00 0.00 C ATOM 494 CD LYS A 202 -2.547 -14.124 -1.623 1.00 0.00 C ATOM 495 CE LYS A 202 -3.188 -15.444 -1.210 1.00 0.00 C ATOM 496 NZ LYS A 202 -2.619 -16.553 -2.030 1.00 0.00 N ATOM 0 H LYS A 202 -2.534 -10.939 0.968 1.00 0.00 H new ATOM 0 HA LYS A 202 -0.713 -12.043 -0.980 1.00 0.00 H new ATOM 0 HB2 LYS A 202 -3.529 -10.867 -1.190 1.00 0.00 H new ATOM 0 HB3 LYS A 202 -2.716 -11.677 -2.515 1.00 0.00 H new ATOM 0 HG2 LYS A 202 -3.008 -13.047 0.188 1.00 0.00 H new ATOM 0 HG3 LYS A 202 -4.320 -13.082 -0.974 1.00 0.00 H new ATOM 0 HD2 LYS A 202 -2.639 -13.980 -2.700 1.00 0.00 H new ATOM 0 HD3 LYS A 202 -1.482 -14.134 -1.393 1.00 0.00 H new ATOM 0 HE2 LYS A 202 -3.009 -15.632 -0.151 1.00 0.00 H new ATOM 0 HE3 LYS A 202 -4.268 -15.394 -1.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 202 -3.057 -17.453 -1.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 202 -2.812 -16.375 -3.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 202 -1.591 -16.605 -1.878 1.00 0.00 H new ATOM 510 N CYS A 203 -1.429 -8.822 -1.154 1.00 0.00 N ATOM 511 CA CYS A 203 -0.969 -7.563 -1.809 1.00 0.00 C ATOM 512 C CYS A 203 0.532 -7.418 -1.595 1.00 0.00 C ATOM 513 O CYS A 203 1.278 -7.130 -2.512 1.00 0.00 O ATOM 514 CB CYS A 203 -1.685 -6.353 -1.188 1.00 0.00 C ATOM 515 SG CYS A 203 -3.465 -6.638 -1.199 1.00 0.00 S ATOM 0 H CYS A 203 -2.127 -8.702 -0.419 1.00 0.00 H new ATOM 0 HA CYS A 203 -1.198 -7.605 -2.874 1.00 0.00 H new ATOM 0 HB2 CYS A 203 -1.337 -6.196 -0.167 1.00 0.00 H new ATOM 0 HB3 CYS A 203 -1.447 -5.449 -1.749 1.00 0.00 H new ATOM 0 HG CYS A 203 -3.737 -7.707 -0.512 1.00 0.00 H new ATOM 521 N TYR A 204 0.982 -7.614 -0.385 1.00 0.00 N ATOM 522 CA TYR A 204 2.435 -7.479 -0.113 1.00 0.00 C ATOM 523 C TYR A 204 3.218 -8.480 -0.969 1.00 0.00 C ATOM 524 O TYR A 204 4.246 -8.158 -1.536 1.00 0.00 O ATOM 525 CB TYR A 204 2.708 -7.756 1.367 1.00 0.00 C ATOM 526 CG TYR A 204 4.105 -7.280 1.713 1.00 0.00 C ATOM 527 CD1 TYR A 204 5.223 -8.076 1.418 1.00 0.00 C ATOM 528 CD2 TYR A 204 4.279 -6.034 2.331 1.00 0.00 C ATOM 529 CE1 TYR A 204 6.511 -7.621 1.745 1.00 0.00 C ATOM 530 CE2 TYR A 204 5.563 -5.584 2.657 1.00 0.00 C ATOM 531 CZ TYR A 204 6.678 -6.376 2.365 1.00 0.00 C ATOM 532 OH TYR A 204 7.945 -5.929 2.691 1.00 0.00 O ATOM 0 H TYR A 204 0.407 -7.860 0.421 1.00 0.00 H new ATOM 0 HA TYR A 204 2.752 -6.466 -0.360 1.00 0.00 H new ATOM 0 HB2 TYR A 204 1.972 -7.244 1.987 1.00 0.00 H new ATOM 0 HB3 TYR A 204 2.612 -8.822 1.574 1.00 0.00 H new ATOM 0 HD1 TYR A 204 5.093 -9.036 0.941 1.00 0.00 H new ATOM 0 HD2 TYR A 204 3.420 -5.420 2.556 1.00 0.00 H new ATOM 0 HE1 TYR A 204 7.373 -8.231 1.518 1.00 0.00 H new ATOM 0 HE2 TYR A 204 5.693 -4.624 3.135 1.00 0.00 H new ATOM 0 HH TYR A 204 7.912 -5.443 3.542 1.00 0.00 H new ATOM 542 N GLU A 205 2.747 -9.691 -1.074 1.00 0.00 N ATOM 543 CA GLU A 205 3.482 -10.687 -1.897 1.00 0.00 C ATOM 544 C GLU A 205 3.548 -10.199 -3.340 1.00 0.00 C ATOM 545 O GLU A 205 4.561 -10.319 -3.998 1.00 0.00 O ATOM 546 CB GLU A 205 2.765 -12.031 -1.850 1.00 0.00 C ATOM 547 CG GLU A 205 2.918 -12.649 -0.458 1.00 0.00 C ATOM 548 CD GLU A 205 2.093 -13.932 -0.385 1.00 0.00 C ATOM 549 OE1 GLU A 205 2.384 -14.839 -1.144 1.00 0.00 O ATOM 550 OE2 GLU A 205 1.185 -13.985 0.428 1.00 0.00 O ATOM 0 H GLU A 205 1.894 -10.031 -0.630 1.00 0.00 H new ATOM 0 HA GLU A 205 4.491 -10.805 -1.501 1.00 0.00 H new ATOM 0 HB2 GLU A 205 1.709 -11.899 -2.086 1.00 0.00 H new ATOM 0 HB3 GLU A 205 3.179 -12.701 -2.604 1.00 0.00 H new ATOM 0 HG2 GLU A 205 3.967 -12.865 -0.256 1.00 0.00 H new ATOM 0 HG3 GLU A 205 2.585 -11.945 0.304 1.00 0.00 H new ATOM 557 N ARG A 206 2.476 -9.632 -3.830 1.00 0.00 N ATOM 558 CA ARG A 206 2.474 -9.117 -5.226 1.00 0.00 C ATOM 559 C ARG A 206 3.537 -8.030 -5.324 1.00 0.00 C ATOM 560 O ARG A 206 4.255 -7.929 -6.298 1.00 0.00 O ATOM 561 CB ARG A 206 1.086 -8.557 -5.568 1.00 0.00 C ATOM 562 CG ARG A 206 1.066 -8.075 -7.019 1.00 0.00 C ATOM 563 CD ARG A 206 -0.327 -7.546 -7.367 1.00 0.00 C ATOM 564 NE ARG A 206 -0.350 -7.087 -8.786 1.00 0.00 N ATOM 565 CZ ARG A 206 -1.484 -6.889 -9.399 1.00 0.00 C ATOM 566 NH1 ARG A 206 -2.614 -7.039 -8.762 1.00 0.00 N ATOM 567 NH2 ARG A 206 -1.482 -6.525 -10.650 1.00 0.00 N ATOM 0 H ARG A 206 1.602 -9.505 -3.320 1.00 0.00 H new ATOM 0 HA ARG A 206 2.697 -9.914 -5.935 1.00 0.00 H new ATOM 0 HB2 ARG A 206 0.327 -9.325 -5.420 1.00 0.00 H new ATOM 0 HB3 ARG A 206 0.841 -7.733 -4.898 1.00 0.00 H new ATOM 0 HG2 ARG A 206 1.810 -7.291 -7.162 1.00 0.00 H new ATOM 0 HG3 ARG A 206 1.333 -8.893 -7.688 1.00 0.00 H new ATOM 0 HD2 ARG A 206 -1.072 -8.327 -7.215 1.00 0.00 H new ATOM 0 HD3 ARG A 206 -0.590 -6.722 -6.704 1.00 0.00 H new ATOM 0 HE ARG A 206 0.528 -6.927 -9.281 1.00 0.00 H new ATOM 0 HH11 ARG A 206 -2.613 -7.312 -7.779 1.00 0.00 H new ATOM 0 HH12 ARG A 206 -3.498 -6.883 -9.247 1.00 0.00 H new ATOM 0 HH21 ARG A 206 -0.598 -6.397 -11.142 1.00 0.00 H new ATOM 0 HH22 ARG A 206 -2.364 -6.368 -11.137 1.00 0.00 H new ATOM 581 N LEU A 207 3.645 -7.217 -4.312 1.00 0.00 N ATOM 582 CA LEU A 207 4.671 -6.139 -4.327 1.00 0.00 C ATOM 583 C LEU A 207 6.054 -6.783 -4.439 1.00 0.00 C ATOM 584 O LEU A 207 6.931 -6.276 -5.107 1.00 0.00 O ATOM 585 CB LEU A 207 4.597 -5.314 -3.042 1.00 0.00 C ATOM 586 CG LEU A 207 5.652 -4.192 -3.060 1.00 0.00 C ATOM 587 CD1 LEU A 207 5.291 -3.130 -4.107 1.00 0.00 C ATOM 588 CD2 LEU A 207 5.702 -3.542 -1.678 1.00 0.00 C ATOM 0 H LEU A 207 3.066 -7.253 -3.473 1.00 0.00 H new ATOM 0 HA LEU A 207 4.490 -5.478 -5.175 1.00 0.00 H new ATOM 0 HB2 LEU A 207 3.601 -4.883 -2.936 1.00 0.00 H new ATOM 0 HB3 LEU A 207 4.759 -5.959 -2.179 1.00 0.00 H new ATOM 0 HG LEU A 207 6.622 -4.617 -3.316 1.00 0.00 H new ATOM 0 HD11 LEU A 207 6.048 -2.345 -4.105 1.00 0.00 H new ATOM 0 HD12 LEU A 207 5.249 -3.591 -5.094 1.00 0.00 H new ATOM 0 HD13 LEU A 207 4.320 -2.698 -3.867 1.00 0.00 H new ATOM 0 HD21 LEU A 207 6.446 -2.745 -1.677 1.00 0.00 H new ATOM 0 HD22 LEU A 207 4.724 -3.126 -1.436 1.00 0.00 H new ATOM 0 HD23 LEU A 207 5.972 -4.291 -0.933 1.00 0.00 H new ATOM 600 N GLU A 208 6.265 -7.884 -3.759 1.00 0.00 N ATOM 601 CA GLU A 208 7.606 -8.539 -3.806 1.00 0.00 C ATOM 602 C GLU A 208 7.937 -8.904 -5.252 1.00 0.00 C ATOM 603 O GLU A 208 9.053 -8.731 -5.700 1.00 0.00 O ATOM 604 CB GLU A 208 7.605 -9.804 -2.938 1.00 0.00 C ATOM 605 CG GLU A 208 7.505 -9.420 -1.456 1.00 0.00 C ATOM 606 CD GLU A 208 7.399 -10.689 -0.605 1.00 0.00 C ATOM 607 OE1 GLU A 208 8.338 -11.464 -0.613 1.00 0.00 O ATOM 608 OE2 GLU A 208 6.378 -10.868 0.036 1.00 0.00 O ATOM 0 H GLU A 208 5.571 -8.353 -3.178 1.00 0.00 H new ATOM 0 HA GLU A 208 8.358 -7.850 -3.421 1.00 0.00 H new ATOM 0 HB2 GLU A 208 6.767 -10.444 -3.214 1.00 0.00 H new ATOM 0 HB3 GLU A 208 8.516 -10.377 -3.114 1.00 0.00 H new ATOM 0 HG2 GLU A 208 8.381 -8.843 -1.159 1.00 0.00 H new ATOM 0 HG3 GLU A 208 6.634 -8.786 -1.292 1.00 0.00 H new ATOM 615 N LEU A 209 6.981 -9.378 -6.002 1.00 0.00 N ATOM 616 CA LEU A 209 7.276 -9.695 -7.427 1.00 0.00 C ATOM 617 C LEU A 209 7.693 -8.386 -8.111 1.00 0.00 C ATOM 618 O LEU A 209 8.635 -8.336 -8.879 1.00 0.00 O ATOM 619 CB LEU A 209 6.021 -10.266 -8.117 1.00 0.00 C ATOM 620 CG LEU A 209 5.897 -11.764 -7.832 1.00 0.00 C ATOM 621 CD1 LEU A 209 5.540 -11.983 -6.363 1.00 0.00 C ATOM 622 CD2 LEU A 209 4.786 -12.345 -8.715 1.00 0.00 C ATOM 0 H LEU A 209 6.024 -9.557 -5.697 1.00 0.00 H new ATOM 0 HA LEU A 209 8.069 -10.440 -7.495 1.00 0.00 H new ATOM 0 HB2 LEU A 209 5.132 -9.746 -7.760 1.00 0.00 H new ATOM 0 HB3 LEU A 209 6.079 -10.097 -9.192 1.00 0.00 H new ATOM 0 HG LEU A 209 6.845 -12.258 -8.048 1.00 0.00 H new ATOM 0 HD11 LEU A 209 5.453 -13.051 -6.165 1.00 0.00 H new ATOM 0 HD12 LEU A 209 6.321 -11.560 -5.732 1.00 0.00 H new ATOM 0 HD13 LEU A 209 4.591 -11.495 -6.143 1.00 0.00 H new ATOM 0 HD21 LEU A 209 4.688 -13.413 -8.521 1.00 0.00 H new ATOM 0 HD22 LEU A 209 3.843 -11.847 -8.488 1.00 0.00 H new ATOM 0 HD23 LEU A 209 5.036 -12.188 -9.764 1.00 0.00 H new ATOM 634 N ALA A 210 6.998 -7.318 -7.800 1.00 0.00 N ATOM 635 CA ALA A 210 7.331 -5.992 -8.385 1.00 0.00 C ATOM 636 C ALA A 210 8.714 -5.562 -7.881 1.00 0.00 C ATOM 637 O ALA A 210 9.546 -5.087 -8.628 1.00 0.00 O ATOM 638 CB ALA A 210 6.273 -4.968 -7.953 1.00 0.00 C ATOM 0 H ALA A 210 6.206 -7.314 -7.158 1.00 0.00 H new ATOM 0 HA ALA A 210 7.344 -6.053 -9.473 1.00 0.00 H new ATOM 0 HB1 ALA A 210 6.513 -3.994 -8.380 1.00 0.00 H new ATOM 0 HB2 ALA A 210 5.292 -5.287 -8.306 1.00 0.00 H new ATOM 0 HB3 ALA A 210 6.261 -4.894 -6.866 1.00 0.00 H new ATOM 644 N ALA A 211 8.975 -5.754 -6.615 1.00 0.00 N ATOM 645 CA ALA A 211 10.306 -5.386 -6.057 1.00 0.00 C ATOM 646 C ALA A 211 11.377 -6.161 -6.809 1.00 0.00 C ATOM 647 O ALA A 211 12.433 -5.654 -7.103 1.00 0.00 O ATOM 648 CB ALA A 211 10.376 -5.753 -4.570 1.00 0.00 C ATOM 0 H ALA A 211 8.320 -6.152 -5.942 1.00 0.00 H new ATOM 0 HA ALA A 211 10.461 -4.313 -6.166 1.00 0.00 H new ATOM 0 HB1 ALA A 211 11.354 -5.479 -4.173 1.00 0.00 H new ATOM 0 HB2 ALA A 211 9.600 -5.215 -4.026 1.00 0.00 H new ATOM 0 HB3 ALA A 211 10.224 -6.826 -4.453 1.00 0.00 H new ATOM 654 N ARG A 212 11.118 -7.396 -7.120 1.00 0.00 N ATOM 655 CA ARG A 212 12.137 -8.187 -7.857 1.00 0.00 C ATOM 656 C ARG A 212 12.319 -7.589 -9.262 1.00 0.00 C ATOM 657 O ARG A 212 13.420 -7.493 -9.765 1.00 0.00 O ATOM 658 CB ARG A 212 11.671 -9.645 -7.951 1.00 0.00 C ATOM 659 CG ARG A 212 12.717 -10.485 -8.683 1.00 0.00 C ATOM 660 CD ARG A 212 12.238 -11.933 -8.739 1.00 0.00 C ATOM 661 NE ARG A 212 13.345 -12.815 -9.227 1.00 0.00 N ATOM 662 CZ ARG A 212 13.905 -12.630 -10.389 1.00 0.00 C ATOM 663 NH1 ARG A 212 13.384 -11.794 -11.248 1.00 0.00 N ATOM 664 NH2 ARG A 212 14.958 -13.324 -10.719 1.00 0.00 N ATOM 0 H ARG A 212 10.253 -7.889 -6.899 1.00 0.00 H new ATOM 0 HA ARG A 212 13.092 -8.155 -7.332 1.00 0.00 H new ATOM 0 HB2 ARG A 212 11.505 -10.047 -6.951 1.00 0.00 H new ATOM 0 HB3 ARG A 212 10.718 -9.697 -8.478 1.00 0.00 H new ATOM 0 HG2 ARG A 212 12.871 -10.100 -9.691 1.00 0.00 H new ATOM 0 HG3 ARG A 212 13.676 -10.425 -8.168 1.00 0.00 H new ATOM 0 HD2 ARG A 212 11.912 -12.256 -7.750 1.00 0.00 H new ATOM 0 HD3 ARG A 212 11.376 -12.015 -9.401 1.00 0.00 H new ATOM 0 HE ARG A 212 13.669 -13.580 -8.635 1.00 0.00 H new ATOM 0 HH11 ARG A 212 12.534 -11.282 -11.010 1.00 0.00 H new ATOM 0 HH12 ARG A 212 13.827 -11.654 -12.156 1.00 0.00 H new ATOM 0 HH21 ARG A 212 15.341 -14.010 -10.068 1.00 0.00 H new ATOM 0 HH22 ARG A 212 15.399 -13.181 -11.628 1.00 0.00 H new ATOM 678 N GLU A 213 11.253 -7.175 -9.898 1.00 0.00 N ATOM 679 CA GLU A 213 11.391 -6.582 -11.259 1.00 0.00 C ATOM 680 C GLU A 213 12.100 -5.233 -11.180 1.00 0.00 C ATOM 681 O GLU A 213 12.951 -4.932 -11.992 1.00 0.00 O ATOM 682 CB GLU A 213 10.002 -6.383 -11.867 1.00 0.00 C ATOM 683 CG GLU A 213 9.402 -7.748 -12.226 1.00 0.00 C ATOM 684 CD GLU A 213 8.004 -7.563 -12.819 1.00 0.00 C ATOM 685 OE1 GLU A 213 7.914 -7.240 -13.993 1.00 0.00 O ATOM 686 OE2 GLU A 213 7.046 -7.755 -12.086 1.00 0.00 O ATOM 0 H GLU A 213 10.301 -7.222 -9.536 1.00 0.00 H new ATOM 0 HA GLU A 213 11.979 -7.258 -11.880 1.00 0.00 H new ATOM 0 HB2 GLU A 213 9.355 -5.864 -11.160 1.00 0.00 H new ATOM 0 HB3 GLU A 213 10.069 -5.757 -12.757 1.00 0.00 H new ATOM 0 HG2 GLU A 213 10.045 -8.261 -12.941 1.00 0.00 H new ATOM 0 HG3 GLU A 213 9.349 -8.377 -11.337 1.00 0.00 H new ATOM 693 N HIS A 214 11.767 -4.420 -10.211 1.00 0.00 N ATOM 694 CA HIS A 214 12.432 -3.091 -10.090 1.00 0.00 C ATOM 695 C HIS A 214 13.643 -3.199 -9.167 1.00 0.00 C ATOM 696 O HIS A 214 14.457 -2.302 -9.099 1.00 0.00 O ATOM 697 CB HIS A 214 11.454 -2.087 -9.493 1.00 0.00 C ATOM 698 CG HIS A 214 10.333 -1.840 -10.463 1.00 0.00 C ATOM 699 ND1 HIS A 214 10.395 -0.858 -11.438 1.00 0.00 N ATOM 700 CD2 HIS A 214 9.114 -2.448 -10.616 1.00 0.00 C ATOM 701 CE1 HIS A 214 9.236 -0.899 -12.128 1.00 0.00 C ATOM 702 NE2 HIS A 214 8.419 -1.852 -11.667 1.00 0.00 N ATOM 0 H HIS A 214 11.064 -4.620 -9.500 1.00 0.00 H new ATOM 0 HA HIS A 214 12.751 -2.763 -11.080 1.00 0.00 H new ATOM 0 HB2 HIS A 214 11.057 -2.466 -8.551 1.00 0.00 H new ATOM 0 HB3 HIS A 214 11.968 -1.152 -9.269 1.00 0.00 H new ATOM 0 HD2 HIS A 214 8.747 -3.266 -10.013 1.00 0.00 H new ATOM 0 HE1 HIS A 214 8.997 -0.242 -12.952 1.00 0.00 H new ATOM 0 HE2 HIS A 214 7.489 -2.091 -12.010 1.00 0.00 H new ATOM 710 N GLY A 215 13.759 -4.277 -8.443 1.00 0.00 N ATOM 711 CA GLY A 215 14.912 -4.425 -7.512 1.00 0.00 C ATOM 712 C GLY A 215 14.728 -3.485 -6.314 1.00 0.00 C ATOM 713 O GLY A 215 15.676 -3.114 -5.658 1.00 0.00 O ATOM 0 H GLY A 215 13.106 -5.061 -8.456 1.00 0.00 H new ATOM 0 HA2 GLY A 215 14.986 -5.457 -7.170 1.00 0.00 H new ATOM 0 HA3 GLY A 215 15.843 -4.193 -8.030 1.00 0.00 H new ATOM 717 N TRP A 216 13.515 -3.095 -6.026 1.00 0.00 N ATOM 718 CA TRP A 216 13.274 -2.177 -4.868 1.00 0.00 C ATOM 719 C TRP A 216 13.537 -2.897 -3.540 1.00 0.00 C ATOM 720 O TRP A 216 13.146 -4.038 -3.345 1.00 0.00 O ATOM 721 CB TRP A 216 11.804 -1.731 -4.810 1.00 0.00 C ATOM 722 CG TRP A 216 11.401 -0.894 -5.982 1.00 0.00 C ATOM 723 CD1 TRP A 216 12.116 0.116 -6.526 1.00 0.00 C ATOM 724 CD2 TRP A 216 10.150 -0.958 -6.720 1.00 0.00 C ATOM 725 NE1 TRP A 216 11.385 0.667 -7.568 1.00 0.00 N ATOM 726 CE2 TRP A 216 10.163 0.035 -7.729 1.00 0.00 C ATOM 727 CE3 TRP A 216 9.014 -1.786 -6.612 1.00 0.00 C ATOM 728 CZ2 TRP A 216 9.081 0.203 -8.604 1.00 0.00 C ATOM 729 CZ3 TRP A 216 7.926 -1.615 -7.492 1.00 0.00 C ATOM 730 CH2 TRP A 216 7.959 -0.624 -8.483 1.00 0.00 C ATOM 0 H TRP A 216 12.679 -3.371 -6.541 1.00 0.00 H new ATOM 0 HA TRP A 216 13.943 -1.328 -5.008 1.00 0.00 H new ATOM 0 HB2 TRP A 216 11.164 -2.612 -4.763 1.00 0.00 H new ATOM 0 HB3 TRP A 216 11.637 -1.166 -3.893 1.00 0.00 H new ATOM 0 HD1 TRP A 216 13.094 0.440 -6.203 1.00 0.00 H new ATOM 0 HE1 TRP A 216 11.708 1.443 -8.146 1.00 0.00 H new ATOM 0 HE3 TRP A 216 8.977 -2.553 -5.853 1.00 0.00 H new ATOM 0 HZ2 TRP A 216 9.113 0.966 -9.367 1.00 0.00 H new ATOM 0 HZ3 TRP A 216 7.059 -2.253 -7.402 1.00 0.00 H new ATOM 0 HH2 TRP A 216 7.120 -0.499 -9.152 1.00 0.00 H new ATOM 741 N SER A 217 14.121 -2.208 -2.592 1.00 0.00 N ATOM 742 CA SER A 217 14.319 -2.817 -1.250 1.00 0.00 C ATOM 743 C SER A 217 13.009 -2.561 -0.498 1.00 0.00 C ATOM 744 O SER A 217 12.606 -1.429 -0.326 1.00 0.00 O ATOM 745 CB SER A 217 15.484 -2.127 -0.525 1.00 0.00 C ATOM 746 OG SER A 217 15.669 -2.721 0.756 1.00 0.00 O ATOM 0 H SER A 217 14.467 -1.254 -2.693 1.00 0.00 H new ATOM 0 HA SER A 217 14.557 -3.879 -1.312 1.00 0.00 H new ATOM 0 HB2 SER A 217 16.397 -2.217 -1.114 1.00 0.00 H new ATOM 0 HB3 SER A 217 15.279 -1.062 -0.417 1.00 0.00 H new ATOM 0 HG SER A 217 16.414 -2.281 1.216 1.00 0.00 H new ATOM 752 N ILE A 218 12.302 -3.588 -0.108 1.00 0.00 N ATOM 753 CA ILE A 218 10.980 -3.377 0.577 1.00 0.00 C ATOM 754 C ILE A 218 11.155 -3.365 2.103 1.00 0.00 C ATOM 755 O ILE A 218 12.029 -4.026 2.630 1.00 0.00 O ATOM 756 CB ILE A 218 10.022 -4.505 0.174 1.00 0.00 C ATOM 757 CG1 ILE A 218 10.454 -5.821 0.832 1.00 0.00 C ATOM 758 CG2 ILE A 218 10.036 -4.655 -1.352 1.00 0.00 C ATOM 759 CD1 ILE A 218 9.681 -6.992 0.220 1.00 0.00 C ATOM 0 H ILE A 218 12.576 -4.563 -0.231 1.00 0.00 H new ATOM 0 HA ILE A 218 10.571 -2.414 0.272 1.00 0.00 H new ATOM 0 HB ILE A 218 9.013 -4.262 0.508 1.00 0.00 H new ATOM 0 HG12 ILE A 218 11.525 -5.971 0.695 1.00 0.00 H new ATOM 0 HG13 ILE A 218 10.273 -5.777 1.906 1.00 0.00 H new ATOM 0 HG21 ILE A 218 9.357 -5.456 -1.645 1.00 0.00 H new ATOM 0 HG22 ILE A 218 9.716 -3.720 -1.812 1.00 0.00 H new ATOM 0 HG23 ILE A 218 11.046 -4.896 -1.685 1.00 0.00 H new ATOM 0 HD11 ILE A 218 9.995 -7.922 0.694 1.00 0.00 H new ATOM 0 HD12 ILE A 218 8.613 -6.846 0.380 1.00 0.00 H new ATOM 0 HD13 ILE A 218 9.884 -7.043 -0.850 1.00 0.00 H new ATOM 771 N PRO A 219 10.326 -2.629 2.819 1.00 0.00 N ATOM 772 CA PRO A 219 10.409 -2.561 4.302 1.00 0.00 C ATOM 773 C PRO A 219 9.746 -3.778 4.944 1.00 0.00 C ATOM 774 O PRO A 219 9.116 -4.568 4.269 1.00 0.00 O ATOM 775 CB PRO A 219 9.637 -1.287 4.626 1.00 0.00 C ATOM 776 CG PRO A 219 8.580 -1.228 3.590 1.00 0.00 C ATOM 777 CD PRO A 219 9.217 -1.783 2.315 1.00 0.00 C ATOM 0 HA PRO A 219 11.433 -2.554 4.677 1.00 0.00 H new ATOM 0 HB2 PRO A 219 9.210 -1.324 5.628 1.00 0.00 H new ATOM 0 HB3 PRO A 219 10.282 -0.410 4.587 1.00 0.00 H new ATOM 0 HG2 PRO A 219 7.712 -1.818 3.883 1.00 0.00 H new ATOM 0 HG3 PRO A 219 8.234 -0.205 3.441 1.00 0.00 H new ATOM 0 HD2 PRO A 219 8.504 -2.364 1.730 1.00 0.00 H new ATOM 0 HD3 PRO A 219 9.583 -0.985 1.669 1.00 0.00 H new ATOM 785 N SER A 220 9.871 -3.932 6.232 1.00 0.00 N ATOM 786 CA SER A 220 9.233 -5.092 6.906 1.00 0.00 C ATOM 787 C SER A 220 7.720 -5.039 6.683 1.00 0.00 C ATOM 788 O SER A 220 7.112 -3.991 6.727 1.00 0.00 O ATOM 789 CB SER A 220 9.536 -5.040 8.407 1.00 0.00 C ATOM 790 OG SER A 220 8.997 -6.190 9.034 1.00 0.00 O ATOM 0 H SER A 220 10.388 -3.303 6.846 1.00 0.00 H new ATOM 0 HA SER A 220 9.628 -6.019 6.491 1.00 0.00 H new ATOM 0 HB2 SER A 220 10.613 -4.993 8.571 1.00 0.00 H new ATOM 0 HB3 SER A 220 9.108 -4.139 8.845 1.00 0.00 H new ATOM 0 HG SER A 220 9.191 -6.160 9.994 1.00 0.00 H new ATOM 796 N ARG A 221 7.111 -6.166 6.448 1.00 0.00 N ATOM 797 CA ARG A 221 5.637 -6.196 6.225 1.00 0.00 C ATOM 798 C ARG A 221 4.925 -5.511 7.391 1.00 0.00 C ATOM 799 O ARG A 221 3.970 -4.781 7.202 1.00 0.00 O ATOM 800 CB ARG A 221 5.181 -7.653 6.155 1.00 0.00 C ATOM 801 CG ARG A 221 5.685 -8.291 4.856 1.00 0.00 C ATOM 802 CD ARG A 221 5.297 -9.763 4.845 1.00 0.00 C ATOM 803 NE ARG A 221 6.074 -10.473 5.895 1.00 0.00 N ATOM 804 CZ ARG A 221 5.712 -11.670 6.269 1.00 0.00 C ATOM 805 NH1 ARG A 221 4.679 -12.233 5.713 1.00 0.00 N ATOM 806 NH2 ARG A 221 6.374 -12.300 7.197 1.00 0.00 N ATOM 0 H ARG A 221 7.573 -7.074 6.400 1.00 0.00 H new ATOM 0 HA ARG A 221 5.397 -5.677 5.297 1.00 0.00 H new ATOM 0 HB2 ARG A 221 5.562 -8.205 7.014 1.00 0.00 H new ATOM 0 HB3 ARG A 221 4.093 -7.706 6.199 1.00 0.00 H new ATOM 0 HG2 ARG A 221 5.254 -7.781 3.994 1.00 0.00 H new ATOM 0 HG3 ARG A 221 6.767 -8.186 4.780 1.00 0.00 H new ATOM 0 HD2 ARG A 221 4.228 -9.873 5.028 1.00 0.00 H new ATOM 0 HD3 ARG A 221 5.499 -10.199 3.867 1.00 0.00 H new ATOM 0 HE ARG A 221 6.886 -10.027 6.321 1.00 0.00 H new ATOM 0 HH11 ARG A 221 4.157 -11.739 4.989 1.00 0.00 H new ATOM 0 HH12 ARG A 221 4.391 -13.168 6.001 1.00 0.00 H new ATOM 0 HH21 ARG A 221 7.181 -11.858 7.637 1.00 0.00 H new ATOM 0 HH22 ARG A 221 6.085 -13.235 7.484 1.00 0.00 H new ATOM 820 N ALA A 222 5.377 -5.738 8.594 1.00 0.00 N ATOM 821 CA ALA A 222 4.722 -5.100 9.766 1.00 0.00 C ATOM 822 C ALA A 222 4.796 -3.579 9.628 1.00 0.00 C ATOM 823 O ALA A 222 3.862 -2.872 9.932 1.00 0.00 O ATOM 824 CB ALA A 222 5.423 -5.541 11.047 1.00 0.00 C ATOM 0 H ALA A 222 6.172 -6.338 8.814 1.00 0.00 H new ATOM 0 HA ALA A 222 3.676 -5.405 9.809 1.00 0.00 H new ATOM 0 HB1 ALA A 222 4.941 -5.072 11.905 1.00 0.00 H new ATOM 0 HB2 ALA A 222 5.359 -6.625 11.142 1.00 0.00 H new ATOM 0 HB3 ALA A 222 6.470 -5.241 11.010 1.00 0.00 H new ATOM 830 N THR A 223 5.906 -3.077 9.169 1.00 0.00 N ATOM 831 CA THR A 223 6.058 -1.604 9.001 1.00 0.00 C ATOM 832 C THR A 223 5.025 -1.066 8.009 1.00 0.00 C ATOM 833 O THR A 223 4.487 0.015 8.179 1.00 0.00 O ATOM 834 CB THR A 223 7.463 -1.282 8.491 1.00 0.00 C ATOM 835 OG1 THR A 223 8.416 -1.710 9.446 1.00 0.00 O ATOM 836 CG2 THR A 223 7.598 0.222 8.273 1.00 0.00 C ATOM 0 H THR A 223 6.722 -3.627 8.900 1.00 0.00 H new ATOM 0 HA THR A 223 5.900 -1.129 9.969 1.00 0.00 H new ATOM 0 HB THR A 223 7.635 -1.798 7.546 1.00 0.00 H new ATOM 0 HG1 THR A 223 9.318 -1.507 9.122 1.00 0.00 H new ATOM 0 HG21 THR A 223 8.600 0.448 7.910 1.00 0.00 H new ATOM 0 HG22 THR A 223 6.863 0.551 7.538 1.00 0.00 H new ATOM 0 HG23 THR A 223 7.427 0.743 9.215 1.00 0.00 H new ATOM 844 N ALA A 224 4.775 -1.795 6.959 1.00 0.00 N ATOM 845 CA ALA A 224 3.806 -1.319 5.931 1.00 0.00 C ATOM 846 C ALA A 224 2.412 -1.128 6.536 1.00 0.00 C ATOM 847 O ALA A 224 1.859 -0.049 6.491 1.00 0.00 O ATOM 848 CB ALA A 224 3.739 -2.357 4.807 1.00 0.00 C ATOM 0 H ALA A 224 5.200 -2.702 6.767 1.00 0.00 H new ATOM 0 HA ALA A 224 4.141 -0.357 5.544 1.00 0.00 H new ATOM 0 HB1 ALA A 224 3.034 -2.024 4.046 1.00 0.00 H new ATOM 0 HB2 ALA A 224 4.726 -2.474 4.361 1.00 0.00 H new ATOM 0 HB3 ALA A 224 3.409 -3.313 5.214 1.00 0.00 H new ATOM 854 N PHE A 225 1.840 -2.155 7.104 1.00 0.00 N ATOM 855 CA PHE A 225 0.476 -2.009 7.692 1.00 0.00 C ATOM 856 C PHE A 225 0.471 -0.943 8.791 1.00 0.00 C ATOM 857 O PHE A 225 -0.464 -0.174 8.903 1.00 0.00 O ATOM 858 CB PHE A 225 -0.025 -3.348 8.244 1.00 0.00 C ATOM 859 CG PHE A 225 -1.353 -3.126 8.944 1.00 0.00 C ATOM 860 CD1 PHE A 225 -2.468 -2.678 8.216 1.00 0.00 C ATOM 861 CD2 PHE A 225 -1.472 -3.377 10.315 1.00 0.00 C ATOM 862 CE1 PHE A 225 -3.696 -2.490 8.864 1.00 0.00 C ATOM 863 CE2 PHE A 225 -2.698 -3.184 10.958 1.00 0.00 C ATOM 864 CZ PHE A 225 -3.811 -2.743 10.233 1.00 0.00 C ATOM 0 H PHE A 225 2.254 -3.083 7.187 1.00 0.00 H new ATOM 0 HA PHE A 225 -0.201 -1.690 6.899 1.00 0.00 H new ATOM 0 HB2 PHE A 225 -0.141 -4.069 7.435 1.00 0.00 H new ATOM 0 HB3 PHE A 225 0.703 -3.765 8.940 1.00 0.00 H new ATOM 0 HD1 PHE A 225 -2.379 -2.479 7.158 1.00 0.00 H new ATOM 0 HD2 PHE A 225 -0.616 -3.720 10.877 1.00 0.00 H new ATOM 0 HE1 PHE A 225 -4.555 -2.149 8.304 1.00 0.00 H new ATOM 0 HE2 PHE A 225 -2.787 -3.376 12.017 1.00 0.00 H new ATOM 0 HZ PHE A 225 -4.758 -2.598 10.732 1.00 0.00 H new ATOM 874 N ARG A 226 1.487 -0.881 9.608 1.00 0.00 N ATOM 875 CA ARG A 226 1.497 0.145 10.685 1.00 0.00 C ATOM 876 C ARG A 226 1.388 1.522 10.034 1.00 0.00 C ATOM 877 O ARG A 226 0.709 2.401 10.519 1.00 0.00 O ATOM 878 CB ARG A 226 2.800 0.051 11.480 1.00 0.00 C ATOM 879 CG ARG A 226 2.709 0.943 12.716 1.00 0.00 C ATOM 880 CD ARG A 226 3.991 0.791 13.540 1.00 0.00 C ATOM 881 NE ARG A 226 3.770 1.347 14.918 1.00 0.00 N ATOM 882 CZ ARG A 226 3.354 2.579 15.102 1.00 0.00 C ATOM 883 NH1 ARG A 226 3.330 3.421 14.108 1.00 0.00 N ATOM 884 NH2 ARG A 226 3.022 2.987 16.297 1.00 0.00 N ATOM 0 H ARG A 226 2.303 -1.492 9.576 1.00 0.00 H new ATOM 0 HA ARG A 226 0.661 -0.018 11.366 1.00 0.00 H new ATOM 0 HB2 ARG A 226 2.984 -0.982 11.777 1.00 0.00 H new ATOM 0 HB3 ARG A 226 3.641 0.358 10.858 1.00 0.00 H new ATOM 0 HG2 ARG A 226 2.574 1.983 12.420 1.00 0.00 H new ATOM 0 HG3 ARG A 226 1.842 0.667 13.316 1.00 0.00 H new ATOM 0 HD2 ARG A 226 4.274 -0.260 13.601 1.00 0.00 H new ATOM 0 HD3 ARG A 226 4.813 1.315 13.053 1.00 0.00 H new ATOM 0 HE ARG A 226 3.947 0.754 15.729 1.00 0.00 H new ATOM 0 HH11 ARG A 226 3.635 3.125 13.181 1.00 0.00 H new ATOM 0 HH12 ARG A 226 3.006 4.377 14.257 1.00 0.00 H new ATOM 0 HH21 ARG A 226 3.086 2.348 17.090 1.00 0.00 H new ATOM 0 HH22 ARG A 226 2.699 3.944 16.438 1.00 0.00 H new ATOM 898 N ARG A 227 2.052 1.718 8.939 1.00 0.00 N ATOM 899 CA ARG A 227 1.977 3.035 8.250 1.00 0.00 C ATOM 900 C ARG A 227 0.556 3.257 7.706 1.00 0.00 C ATOM 901 O ARG A 227 0.041 4.361 7.703 1.00 0.00 O ATOM 902 CB ARG A 227 2.991 3.072 7.098 1.00 0.00 C ATOM 903 CG ARG A 227 3.157 4.516 6.577 1.00 0.00 C ATOM 904 CD ARG A 227 4.227 5.253 7.404 1.00 0.00 C ATOM 905 NE ARG A 227 3.898 6.714 7.477 1.00 0.00 N ATOM 906 CZ ARG A 227 3.646 7.401 6.402 1.00 0.00 C ATOM 907 NH1 ARG A 227 3.816 6.868 5.227 1.00 0.00 N ATOM 908 NH2 ARG A 227 3.268 8.644 6.498 1.00 0.00 N ATOM 0 H ARG A 227 2.647 1.024 8.486 1.00 0.00 H new ATOM 0 HA ARG A 227 2.213 3.828 8.960 1.00 0.00 H new ATOM 0 HB2 ARG A 227 3.953 2.688 7.438 1.00 0.00 H new ATOM 0 HB3 ARG A 227 2.657 2.422 6.289 1.00 0.00 H new ATOM 0 HG2 ARG A 227 3.444 4.502 5.526 1.00 0.00 H new ATOM 0 HG3 ARG A 227 2.207 5.046 6.641 1.00 0.00 H new ATOM 0 HD2 ARG A 227 4.277 4.832 8.408 1.00 0.00 H new ATOM 0 HD3 ARG A 227 5.209 5.114 6.951 1.00 0.00 H new ATOM 0 HE ARG A 227 3.871 7.177 8.385 1.00 0.00 H new ATOM 0 HH11 ARG A 227 4.148 5.907 5.146 1.00 0.00 H new ATOM 0 HH12 ARG A 227 3.617 7.411 4.387 1.00 0.00 H new ATOM 0 HH21 ARG A 227 3.170 9.078 7.416 1.00 0.00 H new ATOM 0 HH22 ARG A 227 3.070 9.183 5.655 1.00 0.00 H new ATOM 922 N ILE A 228 -0.068 2.219 7.224 1.00 0.00 N ATOM 923 CA ILE A 228 -1.444 2.371 6.648 1.00 0.00 C ATOM 924 C ILE A 228 -2.410 2.886 7.725 1.00 0.00 C ATOM 925 O ILE A 228 -3.146 3.831 7.511 1.00 0.00 O ATOM 926 CB ILE A 228 -1.961 1.020 6.144 1.00 0.00 C ATOM 927 CG1 ILE A 228 -1.024 0.444 5.060 1.00 0.00 C ATOM 928 CG2 ILE A 228 -3.372 1.208 5.569 1.00 0.00 C ATOM 929 CD1 ILE A 228 -1.344 1.017 3.669 1.00 0.00 C ATOM 0 H ILE A 228 0.310 1.272 7.201 1.00 0.00 H new ATOM 0 HA ILE A 228 -1.391 3.079 5.821 1.00 0.00 H new ATOM 0 HB ILE A 228 -1.989 0.317 6.976 1.00 0.00 H new ATOM 0 HG12 ILE A 228 0.011 0.669 5.317 1.00 0.00 H new ATOM 0 HG13 ILE A 228 -1.118 -0.642 5.037 1.00 0.00 H new ATOM 0 HG21 ILE A 228 -3.748 0.251 5.208 1.00 0.00 H new ATOM 0 HG22 ILE A 228 -4.034 1.588 6.347 1.00 0.00 H new ATOM 0 HG23 ILE A 228 -3.337 1.919 4.744 1.00 0.00 H new ATOM 0 HD11 ILE A 228 -0.664 0.588 2.933 1.00 0.00 H new ATOM 0 HD12 ILE A 228 -2.371 0.770 3.401 1.00 0.00 H new ATOM 0 HD13 ILE A 228 -1.224 2.100 3.685 1.00 0.00 H new ATOM 941 N GLN A 229 -2.415 2.278 8.886 1.00 0.00 N ATOM 942 CA GLN A 229 -3.336 2.743 9.961 1.00 0.00 C ATOM 943 C GLN A 229 -2.913 4.139 10.406 1.00 0.00 C ATOM 944 O GLN A 229 -3.675 4.872 10.997 1.00 0.00 O ATOM 945 CB GLN A 229 -3.275 1.776 11.145 1.00 0.00 C ATOM 946 CG GLN A 229 -1.826 1.610 11.594 1.00 0.00 C ATOM 947 CD GLN A 229 -1.763 0.653 12.787 1.00 0.00 C ATOM 948 OE1 GLN A 229 -2.469 -0.335 12.824 1.00 0.00 O ATOM 949 NE2 GLN A 229 -0.934 0.900 13.768 1.00 0.00 N ATOM 0 H GLN A 229 -1.823 1.484 9.132 1.00 0.00 H new ATOM 0 HA GLN A 229 -4.359 2.774 9.585 1.00 0.00 H new ATOM 0 HB2 GLN A 229 -3.881 2.154 11.968 1.00 0.00 H new ATOM 0 HB3 GLN A 229 -3.692 0.810 10.861 1.00 0.00 H new ATOM 0 HG2 GLN A 229 -1.223 1.223 10.773 1.00 0.00 H new ATOM 0 HG3 GLN A 229 -1.407 2.578 11.869 1.00 0.00 H new ATOM 0 HE21 GLN A 229 -0.341 1.729 13.738 1.00 0.00 H new ATOM 0 HE22 GLN A 229 -0.881 0.263 14.563 1.00 0.00 H new ATOM 958 N GLN A 230 -1.704 4.515 10.123 1.00 0.00 N ATOM 959 CA GLN A 230 -1.238 5.869 10.528 1.00 0.00 C ATOM 960 C GLN A 230 -1.809 6.894 9.535 1.00 0.00 C ATOM 961 O GLN A 230 -1.774 8.090 9.765 1.00 0.00 O ATOM 962 CB GLN A 230 0.293 5.901 10.486 1.00 0.00 C ATOM 963 CG GLN A 230 0.811 7.220 11.090 1.00 0.00 C ATOM 964 CD GLN A 230 2.341 7.242 11.009 1.00 0.00 C ATOM 965 OE1 GLN A 230 2.945 8.291 11.086 1.00 0.00 O ATOM 966 NE2 GLN A 230 3.000 6.121 10.847 1.00 0.00 N ATOM 0 H GLN A 230 -1.016 3.946 9.629 1.00 0.00 H new ATOM 0 HA GLN A 230 -1.574 6.106 11.537 1.00 0.00 H new ATOM 0 HB2 GLN A 230 0.698 5.054 11.040 1.00 0.00 H new ATOM 0 HB3 GLN A 230 0.639 5.803 9.457 1.00 0.00 H new ATOM 0 HG2 GLN A 230 0.394 8.070 10.550 1.00 0.00 H new ATOM 0 HG3 GLN A 230 0.488 7.311 12.127 1.00 0.00 H new ATOM 0 HE21 GLN A 230 2.495 5.237 10.782 1.00 0.00 H new ATOM 0 HE22 GLN A 230 4.018 6.132 10.786 1.00 0.00 H new ATOM 975 N LEU A 231 -2.346 6.436 8.430 1.00 0.00 N ATOM 976 CA LEU A 231 -2.920 7.387 7.440 1.00 0.00 C ATOM 977 C LEU A 231 -4.175 8.031 8.031 1.00 0.00 C ATOM 978 O LEU A 231 -4.112 9.085 8.623 1.00 0.00 O ATOM 979 CB LEU A 231 -3.290 6.638 6.162 1.00 0.00 C ATOM 980 CG LEU A 231 -2.050 5.986 5.543 1.00 0.00 C ATOM 981 CD1 LEU A 231 -2.482 5.136 4.348 1.00 0.00 C ATOM 982 CD2 LEU A 231 -1.072 7.064 5.058 1.00 0.00 C ATOM 0 H LEU A 231 -2.409 5.450 8.176 1.00 0.00 H new ATOM 0 HA LEU A 231 -2.184 8.157 7.207 1.00 0.00 H new ATOM 0 HB2 LEU A 231 -4.036 5.875 6.384 1.00 0.00 H new ATOM 0 HB3 LEU A 231 -3.741 7.327 5.448 1.00 0.00 H new ATOM 0 HG LEU A 231 -1.558 5.367 6.293 1.00 0.00 H new ATOM 0 HD11 LEU A 231 -1.606 4.667 3.900 1.00 0.00 H new ATOM 0 HD12 LEU A 231 -3.176 4.365 4.682 1.00 0.00 H new ATOM 0 HD13 LEU A 231 -2.972 5.770 3.609 1.00 0.00 H new ATOM 0 HD21 LEU A 231 -0.194 6.589 4.620 1.00 0.00 H new ATOM 0 HD22 LEU A 231 -1.560 7.687 4.308 1.00 0.00 H new ATOM 0 HD23 LEU A 231 -0.766 7.684 5.901 1.00 0.00 H new ATOM 994 N ASP A 232 -5.314 7.408 7.898 1.00 0.00 N ATOM 995 CA ASP A 232 -6.545 8.014 8.484 1.00 0.00 C ATOM 996 C ASP A 232 -7.755 7.100 8.259 1.00 0.00 C ATOM 997 O ASP A 232 -7.758 6.261 7.386 1.00 0.00 O ATOM 998 CB ASP A 232 -6.806 9.375 7.830 1.00 0.00 C ATOM 999 CG ASP A 232 -6.448 9.315 6.339 1.00 0.00 C ATOM 1000 OD1 ASP A 232 -5.267 9.389 6.035 1.00 0.00 O ATOM 1001 OD2 ASP A 232 -7.359 9.222 5.528 1.00 0.00 O ATOM 0 H ASP A 232 -5.446 6.519 7.416 1.00 0.00 H new ATOM 0 HA ASP A 232 -6.396 8.141 9.556 1.00 0.00 H new ATOM 0 HB2 ASP A 232 -7.853 9.651 7.951 1.00 0.00 H new ATOM 0 HB3 ASP A 232 -6.214 10.145 8.324 1.00 0.00 H new ATOM 1006 N GLU A 233 -8.789 7.289 9.038 1.00 0.00 N ATOM 1007 CA GLU A 233 -10.032 6.462 8.881 1.00 0.00 C ATOM 1008 C GLU A 233 -10.656 6.789 7.524 1.00 0.00 C ATOM 1009 O GLU A 233 -11.203 5.938 6.853 1.00 0.00 O ATOM 1010 CB GLU A 233 -11.026 6.793 9.999 1.00 0.00 C ATOM 1011 CG GLU A 233 -10.496 6.269 11.341 1.00 0.00 C ATOM 1012 CD GLU A 233 -10.517 4.732 11.348 1.00 0.00 C ATOM 1013 OE1 GLU A 233 -11.543 4.177 11.715 1.00 0.00 O ATOM 1014 OE2 GLU A 233 -9.510 4.136 10.995 1.00 0.00 O ATOM 0 H GLU A 233 -8.829 7.985 9.783 1.00 0.00 H new ATOM 0 HA GLU A 233 -9.785 5.402 8.939 1.00 0.00 H new ATOM 0 HB2 GLU A 233 -11.179 7.871 10.054 1.00 0.00 H new ATOM 0 HB3 GLU A 233 -11.995 6.344 9.781 1.00 0.00 H new ATOM 0 HG2 GLU A 233 -9.480 6.628 11.506 1.00 0.00 H new ATOM 0 HG3 GLU A 233 -11.107 6.653 12.158 1.00 0.00 H new ATOM 1021 N ALA A 234 -10.563 8.020 7.111 1.00 0.00 N ATOM 1022 CA ALA A 234 -11.135 8.408 5.790 1.00 0.00 C ATOM 1023 C ALA A 234 -10.437 7.573 4.726 1.00 0.00 C ATOM 1024 O ALA A 234 -11.018 7.215 3.723 1.00 0.00 O ATOM 1025 CB ALA A 234 -10.873 9.887 5.521 1.00 0.00 C ATOM 0 H ALA A 234 -10.116 8.776 7.630 1.00 0.00 H new ATOM 0 HA ALA A 234 -12.212 8.238 5.779 1.00 0.00 H new ATOM 0 HB1 ALA A 234 -11.294 10.161 4.554 1.00 0.00 H new ATOM 0 HB2 ALA A 234 -11.338 10.487 6.303 1.00 0.00 H new ATOM 0 HB3 ALA A 234 -9.799 10.071 5.514 1.00 0.00 H new ATOM 1031 N MET A 235 -9.191 7.245 4.948 1.00 0.00 N ATOM 1032 CA MET A 235 -8.459 6.414 3.964 1.00 0.00 C ATOM 1033 C MET A 235 -9.202 5.082 3.829 1.00 0.00 C ATOM 1034 O MET A 235 -9.363 4.555 2.747 1.00 0.00 O ATOM 1035 CB MET A 235 -7.032 6.185 4.467 1.00 0.00 C ATOM 1036 CG MET A 235 -6.158 5.618 3.339 1.00 0.00 C ATOM 1037 SD MET A 235 -6.659 3.916 2.960 1.00 0.00 S ATOM 1038 CE MET A 235 -6.237 3.173 4.555 1.00 0.00 C ATOM 0 H MET A 235 -8.654 7.520 5.770 1.00 0.00 H new ATOM 0 HA MET A 235 -8.409 6.906 2.993 1.00 0.00 H new ATOM 0 HB2 MET A 235 -6.610 7.123 4.827 1.00 0.00 H new ATOM 0 HB3 MET A 235 -7.042 5.495 5.311 1.00 0.00 H new ATOM 0 HG2 MET A 235 -6.251 6.240 2.449 1.00 0.00 H new ATOM 0 HG3 MET A 235 -5.109 5.640 3.635 1.00 0.00 H new ATOM 0 HE1 MET A 235 -5.821 2.178 4.394 1.00 0.00 H new ATOM 0 HE2 MET A 235 -5.501 3.796 5.063 1.00 0.00 H new ATOM 0 HE3 MET A 235 -7.134 3.096 5.169 1.00 0.00 H new ATOM 1048 N VAL A 236 -9.687 4.544 4.914 1.00 0.00 N ATOM 1049 CA VAL A 236 -10.435 3.266 4.818 1.00 0.00 C ATOM 1050 C VAL A 236 -11.696 3.521 3.995 1.00 0.00 C ATOM 1051 O VAL A 236 -12.075 2.733 3.153 1.00 0.00 O ATOM 1052 CB VAL A 236 -10.809 2.760 6.215 1.00 0.00 C ATOM 1053 CG1 VAL A 236 -11.788 1.582 6.100 1.00 0.00 C ATOM 1054 CG2 VAL A 236 -9.532 2.304 6.925 1.00 0.00 C ATOM 0 H VAL A 236 -9.597 4.932 5.853 1.00 0.00 H new ATOM 0 HA VAL A 236 -9.818 2.505 4.341 1.00 0.00 H new ATOM 0 HB VAL A 236 -11.288 3.558 6.783 1.00 0.00 H new ATOM 0 HG11 VAL A 236 -12.049 1.227 7.097 1.00 0.00 H new ATOM 0 HG12 VAL A 236 -12.690 1.908 5.583 1.00 0.00 H new ATOM 0 HG13 VAL A 236 -11.320 0.773 5.539 1.00 0.00 H new ATOM 0 HG21 VAL A 236 -9.780 1.940 7.922 1.00 0.00 H new ATOM 0 HG22 VAL A 236 -9.064 1.503 6.353 1.00 0.00 H new ATOM 0 HG23 VAL A 236 -8.841 3.143 7.006 1.00 0.00 H new ATOM 1064 N VAL A 237 -12.329 4.640 4.234 1.00 0.00 N ATOM 1065 CA VAL A 237 -13.554 5.014 3.477 1.00 0.00 C ATOM 1066 C VAL A 237 -13.157 5.328 2.037 1.00 0.00 C ATOM 1067 O VAL A 237 -13.903 5.091 1.108 1.00 0.00 O ATOM 1068 CB VAL A 237 -14.186 6.243 4.129 1.00 0.00 C ATOM 1069 CG1 VAL A 237 -15.340 6.740 3.264 1.00 0.00 C ATOM 1070 CG2 VAL A 237 -14.699 5.870 5.532 1.00 0.00 C ATOM 0 H VAL A 237 -12.040 5.321 4.936 1.00 0.00 H new ATOM 0 HA VAL A 237 -14.275 4.197 3.486 1.00 0.00 H new ATOM 0 HB VAL A 237 -13.443 7.035 4.220 1.00 0.00 H new ATOM 0 HG11 VAL A 237 -15.791 7.617 3.728 1.00 0.00 H new ATOM 0 HG12 VAL A 237 -14.966 7.005 2.275 1.00 0.00 H new ATOM 0 HG13 VAL A 237 -16.089 5.954 3.169 1.00 0.00 H new ATOM 0 HG21 VAL A 237 -15.150 6.745 5.999 1.00 0.00 H new ATOM 0 HG22 VAL A 237 -15.444 5.079 5.449 1.00 0.00 H new ATOM 0 HG23 VAL A 237 -13.866 5.521 6.143 1.00 0.00 H new ATOM 1080 N ALA A 238 -11.977 5.864 1.864 1.00 0.00 N ATOM 1081 CA ALA A 238 -11.485 6.222 0.510 1.00 0.00 C ATOM 1082 C ALA A 238 -11.480 4.985 -0.382 1.00 0.00 C ATOM 1083 O ALA A 238 -11.817 5.053 -1.551 1.00 0.00 O ATOM 1084 CB ALA A 238 -10.053 6.752 0.636 1.00 0.00 C ATOM 0 H ALA A 238 -11.325 6.071 2.621 1.00 0.00 H new ATOM 0 HA ALA A 238 -12.135 6.979 0.071 1.00 0.00 H new ATOM 0 HB1 ALA A 238 -9.676 7.020 -0.351 1.00 0.00 H new ATOM 0 HB2 ALA A 238 -10.046 7.633 1.278 1.00 0.00 H new ATOM 0 HB3 ALA A 238 -9.417 5.981 1.070 1.00 0.00 H new ATOM 1090 N CYS A 239 -11.097 3.860 0.151 1.00 0.00 N ATOM 1091 CA CYS A 239 -11.073 2.623 -0.683 1.00 0.00 C ATOM 1092 C CYS A 239 -12.508 2.129 -0.909 1.00 0.00 C ATOM 1093 O CYS A 239 -12.894 1.796 -2.012 1.00 0.00 O ATOM 1094 CB CYS A 239 -10.252 1.528 0.022 1.00 0.00 C ATOM 1095 SG CYS A 239 -8.855 2.280 0.894 1.00 0.00 S ATOM 0 H CYS A 239 -10.801 3.741 1.120 1.00 0.00 H new ATOM 0 HA CYS A 239 -10.611 2.849 -1.644 1.00 0.00 H new ATOM 0 HB2 CYS A 239 -10.882 0.984 0.726 1.00 0.00 H new ATOM 0 HB3 CYS A 239 -9.890 0.804 -0.708 1.00 0.00 H new ATOM 0 HG CYS A 239 -9.296 2.986 1.893 1.00 0.00 H new ATOM 1101 N ARG A 240 -13.301 2.081 0.127 1.00 0.00 N ATOM 1102 CA ARG A 240 -14.710 1.608 -0.023 1.00 0.00 C ATOM 1103 C ARG A 240 -15.624 2.801 -0.314 1.00 0.00 C ATOM 1104 O ARG A 240 -16.824 2.694 -0.194 1.00 0.00 O ATOM 1105 CB ARG A 240 -15.175 0.928 1.274 1.00 0.00 C ATOM 1106 CG ARG A 240 -14.448 -0.401 1.457 1.00 0.00 C ATOM 1107 CD ARG A 240 -14.995 -1.120 2.699 1.00 0.00 C ATOM 1108 NE ARG A 240 -16.388 -1.601 2.433 1.00 0.00 N ATOM 1109 CZ ARG A 240 -16.942 -2.487 3.231 1.00 0.00 C ATOM 1110 NH1 ARG A 240 -16.287 -2.932 4.269 1.00 0.00 N ATOM 1111 NH2 ARG A 240 -18.151 -2.921 2.991 1.00 0.00 N ATOM 0 H ARG A 240 -13.034 2.349 1.074 1.00 0.00 H new ATOM 0 HA ARG A 240 -14.757 0.895 -0.846 1.00 0.00 H new ATOM 0 HB2 ARG A 240 -14.979 1.579 2.126 1.00 0.00 H new ATOM 0 HB3 ARG A 240 -16.252 0.761 1.241 1.00 0.00 H new ATOM 0 HG2 ARG A 240 -14.583 -1.026 0.574 1.00 0.00 H new ATOM 0 HG3 ARG A 240 -13.377 -0.229 1.566 1.00 0.00 H new ATOM 0 HD2 ARG A 240 -14.352 -1.962 2.956 1.00 0.00 H new ATOM 0 HD3 ARG A 240 -14.991 -0.444 3.554 1.00 0.00 H new ATOM 0 HE ARG A 240 -16.907 -1.241 1.632 1.00 0.00 H new ATOM 0 HH11 ARG A 240 -15.345 -2.592 4.461 1.00 0.00 H new ATOM 0 HH12 ARG A 240 -16.718 -3.619 4.888 1.00 0.00 H new ATOM 0 HH21 ARG A 240 -18.667 -2.572 2.183 1.00 0.00 H new ATOM 0 HH22 ARG A 240 -18.579 -3.608 3.612 1.00 0.00 H new ATOM 1125 N GLU A 241 -15.074 3.940 -0.674 1.00 0.00 N ATOM 1126 CA GLU A 241 -15.933 5.127 -0.935 1.00 0.00 C ATOM 1127 C GLU A 241 -17.068 4.735 -1.884 1.00 0.00 C ATOM 1128 O GLU A 241 -16.839 4.260 -2.973 1.00 0.00 O ATOM 1129 CB GLU A 241 -15.093 6.234 -1.573 1.00 0.00 C ATOM 1130 CG GLU A 241 -15.906 7.530 -1.583 1.00 0.00 C ATOM 1131 CD GLU A 241 -15.075 8.678 -2.170 1.00 0.00 C ATOM 1132 OE1 GLU A 241 -13.857 8.564 -2.198 1.00 0.00 O ATOM 1133 OE2 GLU A 241 -15.675 9.656 -2.582 1.00 0.00 O ATOM 0 H GLU A 241 -14.073 4.092 -0.796 1.00 0.00 H new ATOM 0 HA GLU A 241 -16.353 5.486 0.005 1.00 0.00 H new ATOM 0 HB2 GLU A 241 -14.167 6.374 -1.015 1.00 0.00 H new ATOM 0 HB3 GLU A 241 -14.813 5.957 -2.589 1.00 0.00 H new ATOM 0 HG2 GLU A 241 -16.814 7.393 -2.170 1.00 0.00 H new ATOM 0 HG3 GLU A 241 -16.217 7.779 -0.569 1.00 0.00 H new ATOM 1140 N GLY A 242 -18.293 4.922 -1.473 1.00 0.00 N ATOM 1141 CA GLY A 242 -19.445 4.552 -2.346 1.00 0.00 C ATOM 1142 C GLY A 242 -20.754 4.962 -1.660 1.00 0.00 C ATOM 1143 O GLY A 242 -20.757 5.730 -0.717 1.00 0.00 O ATOM 0 H GLY A 242 -18.547 5.316 -0.567 1.00 0.00 H new ATOM 0 HA2 GLY A 242 -19.357 5.048 -3.313 1.00 0.00 H new ATOM 0 HA3 GLY A 242 -19.442 3.479 -2.536 1.00 0.00 H new ATOM 1147 N GLU A 243 -21.868 4.459 -2.117 1.00 0.00 N ATOM 1148 CA GLU A 243 -23.173 4.828 -1.481 1.00 0.00 C ATOM 1149 C GLU A 243 -24.189 3.725 -1.763 1.00 0.00 C ATOM 1150 O GLU A 243 -24.614 3.516 -2.887 1.00 0.00 O ATOM 1151 CB GLU A 243 -23.687 6.157 -2.054 1.00 0.00 C ATOM 1152 CG GLU A 243 -24.910 6.628 -1.253 1.00 0.00 C ATOM 1153 CD GLU A 243 -24.482 6.992 0.174 1.00 0.00 C ATOM 1154 OE1 GLU A 243 -23.305 7.245 0.383 1.00 0.00 O ATOM 1155 OE2 GLU A 243 -25.340 7.005 1.035 1.00 0.00 O ATOM 0 H GLU A 243 -21.935 3.810 -2.901 1.00 0.00 H new ATOM 0 HA GLU A 243 -23.032 4.942 -0.406 1.00 0.00 H new ATOM 0 HB2 GLU A 243 -22.901 6.911 -2.012 1.00 0.00 H new ATOM 0 HB3 GLU A 243 -23.954 6.033 -3.104 1.00 0.00 H new ATOM 0 HG2 GLU A 243 -25.365 7.492 -1.738 1.00 0.00 H new ATOM 0 HG3 GLU A 243 -25.665 5.842 -1.228 1.00 0.00 H new ATOM 1162 N HIS A 244 -24.567 2.999 -0.753 1.00 0.00 N ATOM 1163 CA HIS A 244 -25.538 1.895 -0.963 1.00 0.00 C ATOM 1164 C HIS A 244 -26.174 1.512 0.367 1.00 0.00 C ATOM 1165 O HIS A 244 -25.768 1.972 1.410 1.00 0.00 O ATOM 1166 CB HIS A 244 -24.802 0.692 -1.551 1.00 0.00 C ATOM 1167 CG HIS A 244 -25.799 -0.303 -2.065 1.00 0.00 C ATOM 1168 ND1 HIS A 244 -26.291 -1.321 -1.268 1.00 0.00 N ATOM 1169 CD2 HIS A 244 -26.414 -0.447 -3.282 1.00 0.00 C ATOM 1170 CE1 HIS A 244 -27.161 -2.028 -2.004 1.00 0.00 C ATOM 1171 NE2 HIS A 244 -27.275 -1.541 -3.243 1.00 0.00 N ATOM 0 H HIS A 244 -24.246 3.122 0.208 1.00 0.00 H new ATOM 0 HA HIS A 244 -26.321 2.217 -1.650 1.00 0.00 H new ATOM 0 HB2 HIS A 244 -24.144 1.014 -2.358 1.00 0.00 H new ATOM 0 HB3 HIS A 244 -24.171 0.231 -0.791 1.00 0.00 H new ATOM 0 HD1 HIS A 244 -26.038 -1.501 -0.296 1.00 0.00 H new ATOM 0 HD2 HIS A 244 -26.255 0.190 -4.139 1.00 0.00 H new ATOM 0 HE1 HIS A 244 -27.704 -2.887 -1.639 1.00 0.00 H new ATOM 1179 N ALA A 245 -27.170 0.673 0.336 1.00 0.00 N ATOM 1180 CA ALA A 245 -27.834 0.263 1.605 1.00 0.00 C ATOM 1181 C ALA A 245 -26.845 -0.533 2.459 1.00 0.00 C ATOM 1182 O ALA A 245 -26.043 -1.292 1.951 1.00 0.00 O ATOM 1183 CB ALA A 245 -29.043 -0.607 1.279 1.00 0.00 C ATOM 0 H ALA A 245 -27.553 0.254 -0.511 1.00 0.00 H new ATOM 0 HA ALA A 245 -28.158 1.147 2.155 1.00 0.00 H new ATOM 0 HB1 ALA A 245 -29.533 -0.910 2.204 1.00 0.00 H new ATOM 0 HB2 ALA A 245 -29.744 -0.041 0.666 1.00 0.00 H new ATOM 0 HB3 ALA A 245 -28.717 -1.493 0.734 1.00 0.00 H new ATOM 1189 N LEU A 246 -26.894 -0.358 3.759 1.00 0.00 N ATOM 1190 CA LEU A 246 -25.949 -1.094 4.661 1.00 0.00 C ATOM 1191 C LEU A 246 -26.556 -2.444 5.052 1.00 0.00 C ATOM 1192 O LEU A 246 -26.898 -2.671 6.197 1.00 0.00 O ATOM 1193 CB LEU A 246 -25.707 -0.278 5.933 1.00 0.00 C ATOM 1194 CG LEU A 246 -24.695 0.842 5.653 1.00 0.00 C ATOM 1195 CD1 LEU A 246 -25.332 1.892 4.735 1.00 0.00 C ATOM 1196 CD2 LEU A 246 -24.309 1.493 6.980 1.00 0.00 C ATOM 0 H LEU A 246 -27.548 0.263 4.235 1.00 0.00 H new ATOM 0 HA LEU A 246 -25.007 -1.248 4.135 1.00 0.00 H new ATOM 0 HB2 LEU A 246 -26.646 0.149 6.285 1.00 0.00 H new ATOM 0 HB3 LEU A 246 -25.334 -0.927 6.726 1.00 0.00 H new ATOM 0 HG LEU A 246 -23.810 0.431 5.166 1.00 0.00 H new ATOM 0 HD11 LEU A 246 -24.613 2.687 4.537 1.00 0.00 H new ATOM 0 HD12 LEU A 246 -25.624 1.424 3.795 1.00 0.00 H new ATOM 0 HD13 LEU A 246 -26.213 2.313 5.220 1.00 0.00 H new ATOM 0 HD21 LEU A 246 -23.590 2.292 6.798 1.00 0.00 H new ATOM 0 HD22 LEU A 246 -25.199 1.907 7.454 1.00 0.00 H new ATOM 0 HD23 LEU A 246 -23.863 0.745 7.636 1.00 0.00 H new ATOM 1208 N MET A 247 -26.698 -3.332 4.113 1.00 0.00 N ATOM 1209 CA MET A 247 -27.289 -4.667 4.428 1.00 0.00 C ATOM 1210 C MET A 247 -28.639 -4.485 5.135 1.00 0.00 C ATOM 1211 O MET A 247 -28.843 -5.125 6.153 1.00 0.00 O ATOM 1212 CB MET A 247 -26.328 -5.463 5.328 1.00 0.00 C ATOM 1213 CG MET A 247 -25.092 -5.878 4.526 1.00 0.00 C ATOM 1214 SD MET A 247 -23.969 -6.814 5.587 1.00 0.00 S ATOM 1215 CE MET A 247 -22.776 -7.254 4.299 1.00 0.00 C ATOM 1216 OXT MET A 247 -29.450 -3.715 4.644 1.00 0.00 O ATOM 0 H MET A 247 -26.431 -3.195 3.138 1.00 0.00 H new ATOM 0 HA MET A 247 -27.445 -5.217 3.500 1.00 0.00 H new ATOM 0 HB2 MET A 247 -26.031 -4.857 6.184 1.00 0.00 H new ATOM 0 HB3 MET A 247 -26.831 -6.346 5.722 1.00 0.00 H new ATOM 0 HG2 MET A 247 -25.388 -6.483 3.669 1.00 0.00 H new ATOM 0 HG3 MET A 247 -24.587 -4.995 4.134 1.00 0.00 H new ATOM 0 HE1 MET A 247 -21.973 -7.849 4.735 1.00 0.00 H new ATOM 0 HE2 MET A 247 -23.276 -7.832 3.522 1.00 0.00 H new ATOM 0 HE3 MET A 247 -22.359 -6.346 3.863 1.00 0.00 H new TER 1226 MET A 247