USER MOD reduce.3.24.130724 H: found=0, std=0, add=458, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 459 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 146 TYR OH : rot -92:sc= 0.00354 USER MOD Single : A 151 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 156 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 166 LYS NZ :NH3+ 150:sc= -0.17 (180deg=-0.998) USER MOD Single : A 167 ASN : amide:sc= -0.15 X(o=-0.15,f=-0.12) USER MOD Single : A 175 THR OG1 : rot 180:sc= 0 USER MOD Single : A 178 THR OG1 : rot -19:sc= -0.869! USER MOD Single : A 186 TYR OH : rot 180:sc= 0 USER MOD Single : A 193 MET CE :methyl -165:sc= -1.64 (180deg=-2.82!) USER MOD Single : A 196 SER OG : rot 180:sc= -0.0131 USER MOD Single : A 201 ASN :FLIP amide:sc= -2.85! C(o=-7.2!,f=-2.8!) USER MOD ----------------------------------------------------------------- ATOM 40 N TYR A 146 5.725 -3.201 -6.499 1.00 0.00 N ATOM 41 CA TYR A 146 4.331 -3.444 -6.039 1.00 0.00 C ATOM 42 C TYR A 146 3.462 -2.236 -6.398 1.00 0.00 C ATOM 43 O TYR A 146 3.927 -1.115 -6.438 1.00 0.00 O ATOM 44 CB TYR A 146 4.321 -3.645 -4.523 1.00 0.00 C ATOM 45 CG TYR A 146 5.073 -4.904 -4.173 1.00 0.00 C ATOM 46 CD1 TYR A 146 4.795 -6.096 -4.852 1.00 0.00 C ATOM 47 CD2 TYR A 146 6.042 -4.882 -3.162 1.00 0.00 C ATOM 48 CE1 TYR A 146 5.485 -7.267 -4.520 1.00 0.00 C ATOM 49 CE2 TYR A 146 6.732 -6.053 -2.829 1.00 0.00 C ATOM 50 CZ TYR A 146 6.453 -7.247 -3.508 1.00 0.00 C ATOM 51 OH TYR A 146 7.133 -8.402 -3.180 1.00 0.00 O ATOM 0 HA TYR A 146 3.937 -4.336 -6.525 1.00 0.00 H new ATOM 0 HB2 TYR A 146 4.779 -2.787 -4.030 1.00 0.00 H new ATOM 0 HB3 TYR A 146 3.295 -3.710 -4.162 1.00 0.00 H new ATOM 0 HD1 TYR A 146 4.048 -6.112 -5.632 1.00 0.00 H new ATOM 0 HD2 TYR A 146 6.257 -3.961 -2.640 1.00 0.00 H new ATOM 0 HE1 TYR A 146 5.271 -8.187 -5.044 1.00 0.00 H new ATOM 0 HE2 TYR A 146 7.479 -6.037 -2.049 1.00 0.00 H new ATOM 0 HH TYR A 146 6.661 -8.865 -2.457 1.00 0.00 H new ATOM 61 N ARG A 147 2.203 -2.456 -6.663 1.00 0.00 N ATOM 62 CA ARG A 147 1.308 -1.320 -7.023 1.00 0.00 C ATOM 63 C ARG A 147 0.923 -0.554 -5.756 1.00 0.00 C ATOM 64 O ARG A 147 0.005 -0.923 -5.050 1.00 0.00 O ATOM 65 CB ARG A 147 0.047 -1.859 -7.700 1.00 0.00 C ATOM 66 CG ARG A 147 0.423 -3.023 -8.619 1.00 0.00 C ATOM 67 CD ARG A 147 -0.079 -4.333 -8.014 1.00 0.00 C ATOM 68 NE ARG A 147 -0.228 -5.354 -9.090 1.00 0.00 N ATOM 69 CZ ARG A 147 -0.962 -5.097 -10.138 1.00 0.00 C ATOM 70 NH1 ARG A 147 -2.237 -4.857 -10.000 1.00 0.00 N ATOM 71 NH2 ARG A 147 -0.421 -5.082 -11.326 1.00 0.00 N ATOM 0 H ARG A 147 1.756 -3.373 -6.646 1.00 0.00 H new ATOM 0 HA ARG A 147 1.827 -0.650 -7.708 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -0.669 -2.191 -6.948 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -0.437 -1.069 -8.274 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -0.013 -2.876 -9.607 1.00 0.00 H new ATOM 0 HG3 ARG A 147 1.504 -3.062 -8.751 1.00 0.00 H new ATOM 0 HD2 ARG A 147 0.620 -4.687 -7.256 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -1.035 -4.173 -7.515 1.00 0.00 H new ATOM 0 HE ARG A 147 0.244 -6.254 -9.007 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -2.661 -4.870 -9.072 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -2.810 -4.656 -10.820 1.00 0.00 H new ATOM 0 HH21 ARG A 147 0.575 -5.271 -11.435 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -0.995 -4.881 -12.145 1.00 0.00 H new ATOM 85 N GLY A 148 1.620 0.507 -5.461 1.00 0.00 N ATOM 86 CA GLY A 148 1.300 1.298 -4.239 1.00 0.00 C ATOM 87 C GLY A 148 2.561 1.450 -3.389 1.00 0.00 C ATOM 88 O GLY A 148 2.646 2.310 -2.535 1.00 0.00 O ATOM 0 H GLY A 148 2.400 0.862 -6.015 1.00 0.00 H new ATOM 0 HA2 GLY A 148 0.915 2.279 -4.518 1.00 0.00 H new ATOM 0 HA3 GLY A 148 0.518 0.801 -3.665 1.00 0.00 H new ATOM 92 N VAL A 149 3.544 0.622 -3.615 1.00 0.00 N ATOM 93 CA VAL A 149 4.799 0.721 -2.820 1.00 0.00 C ATOM 94 C VAL A 149 5.860 1.468 -3.627 1.00 0.00 C ATOM 95 O VAL A 149 6.155 1.121 -4.753 1.00 0.00 O ATOM 96 CB VAL A 149 5.313 -0.684 -2.500 1.00 0.00 C ATOM 97 CG1 VAL A 149 6.606 -0.585 -1.689 1.00 0.00 C ATOM 98 CG2 VAL A 149 4.265 -1.444 -1.689 1.00 0.00 C ATOM 0 H VAL A 149 3.532 -0.119 -4.316 1.00 0.00 H new ATOM 0 HA VAL A 149 4.596 1.259 -1.894 1.00 0.00 H new ATOM 0 HB VAL A 149 5.506 -1.215 -3.432 1.00 0.00 H new ATOM 0 HG11 VAL A 149 6.971 -1.587 -1.462 1.00 0.00 H new ATOM 0 HG12 VAL A 149 7.358 -0.047 -2.267 1.00 0.00 H new ATOM 0 HG13 VAL A 149 6.412 -0.050 -0.759 1.00 0.00 H new ATOM 0 HG21 VAL A 149 4.635 -2.444 -1.463 1.00 0.00 H new ATOM 0 HG22 VAL A 149 4.068 -0.911 -0.759 1.00 0.00 H new ATOM 0 HG23 VAL A 149 3.343 -1.520 -2.266 1.00 0.00 H new ATOM 108 N ARG A 150 6.447 2.482 -3.057 1.00 0.00 N ATOM 109 CA ARG A 150 7.502 3.238 -3.786 1.00 0.00 C ATOM 110 C ARG A 150 8.866 2.770 -3.283 1.00 0.00 C ATOM 111 O ARG A 150 9.041 2.509 -2.113 1.00 0.00 O ATOM 112 CB ARG A 150 7.340 4.736 -3.518 1.00 0.00 C ATOM 113 CG ARG A 150 6.121 5.259 -4.278 1.00 0.00 C ATOM 114 CD ARG A 150 5.113 5.845 -3.288 1.00 0.00 C ATOM 115 NE ARG A 150 4.330 6.921 -3.958 1.00 0.00 N ATOM 116 CZ ARG A 150 3.543 6.629 -4.956 1.00 0.00 C ATOM 117 NH1 ARG A 150 2.432 5.979 -4.743 1.00 0.00 N ATOM 118 NH2 ARG A 150 3.869 6.985 -6.169 1.00 0.00 N ATOM 0 H ARG A 150 6.242 2.820 -2.117 1.00 0.00 H new ATOM 0 HA ARG A 150 7.417 3.061 -4.858 1.00 0.00 H new ATOM 0 HB2 ARG A 150 7.220 4.915 -2.449 1.00 0.00 H new ATOM 0 HB3 ARG A 150 8.236 5.272 -3.832 1.00 0.00 H new ATOM 0 HG2 ARG A 150 6.426 6.021 -4.996 1.00 0.00 H new ATOM 0 HG3 ARG A 150 5.660 4.451 -4.847 1.00 0.00 H new ATOM 0 HD2 ARG A 150 4.444 5.064 -2.928 1.00 0.00 H new ATOM 0 HD3 ARG A 150 5.632 6.246 -2.418 1.00 0.00 H new ATOM 0 HE ARG A 150 4.409 7.886 -3.636 1.00 0.00 H new ATOM 0 HH11 ARG A 150 2.179 5.699 -3.795 1.00 0.00 H new ATOM 0 HH12 ARG A 150 1.817 5.751 -5.524 1.00 0.00 H new ATOM 0 HH21 ARG A 150 4.739 7.491 -6.336 1.00 0.00 H new ATOM 0 HH22 ARG A 150 3.254 6.757 -6.950 1.00 0.00 H new ATOM 132 N GLN A 151 9.829 2.644 -4.152 1.00 0.00 N ATOM 133 CA GLN A 151 11.170 2.175 -3.702 1.00 0.00 C ATOM 134 C GLN A 151 12.184 3.317 -3.801 1.00 0.00 C ATOM 135 O GLN A 151 12.098 4.166 -4.666 1.00 0.00 O ATOM 136 CB GLN A 151 11.618 1.012 -4.586 1.00 0.00 C ATOM 137 CG GLN A 151 11.712 1.484 -6.037 1.00 0.00 C ATOM 138 CD GLN A 151 13.144 1.295 -6.543 1.00 0.00 C ATOM 139 OE1 GLN A 151 14.070 1.867 -6.004 1.00 0.00 O ATOM 140 NE2 GLN A 151 13.364 0.513 -7.563 1.00 0.00 N ATOM 0 H GLN A 151 9.747 2.844 -5.149 1.00 0.00 H new ATOM 0 HA GLN A 151 11.109 1.846 -2.665 1.00 0.00 H new ATOM 0 HB2 GLN A 151 12.585 0.637 -4.251 1.00 0.00 H new ATOM 0 HB3 GLN A 151 10.911 0.186 -4.506 1.00 0.00 H new ATOM 0 HG2 GLN A 151 11.017 0.920 -6.660 1.00 0.00 H new ATOM 0 HG3 GLN A 151 11.425 2.533 -6.109 1.00 0.00 H new ATOM 0 HE21 GLN A 151 12.586 0.033 -8.015 1.00 0.00 H new ATOM 0 HE22 GLN A 151 14.314 0.381 -7.909 1.00 0.00 H new ATOM 149 N ARG A 152 13.143 3.341 -2.916 1.00 0.00 N ATOM 150 CA ARG A 152 14.168 4.422 -2.948 1.00 0.00 C ATOM 151 C ARG A 152 15.526 3.826 -3.334 1.00 0.00 C ATOM 152 O ARG A 152 15.699 2.623 -3.311 1.00 0.00 O ATOM 153 CB ARG A 152 14.265 5.062 -1.561 1.00 0.00 C ATOM 154 CG ARG A 152 13.233 6.185 -1.447 1.00 0.00 C ATOM 155 CD ARG A 152 13.692 7.201 -0.401 1.00 0.00 C ATOM 156 NE ARG A 152 12.559 7.510 0.516 1.00 0.00 N ATOM 157 CZ ARG A 152 12.696 8.418 1.443 1.00 0.00 C ATOM 158 NH1 ARG A 152 13.884 8.851 1.764 1.00 0.00 N ATOM 159 NH2 ARG A 152 11.642 8.893 2.049 1.00 0.00 N ATOM 0 H ARG A 152 13.261 2.656 -2.170 1.00 0.00 H new ATOM 0 HA ARG A 152 13.884 5.177 -3.681 1.00 0.00 H new ATOM 0 HB2 ARG A 152 14.090 4.312 -0.789 1.00 0.00 H new ATOM 0 HB3 ARG A 152 15.268 5.457 -1.400 1.00 0.00 H new ATOM 0 HG2 ARG A 152 13.106 6.675 -2.412 1.00 0.00 H new ATOM 0 HG3 ARG A 152 12.263 5.774 -1.168 1.00 0.00 H new ATOM 0 HD2 ARG A 152 14.534 6.803 0.165 1.00 0.00 H new ATOM 0 HD3 ARG A 152 14.038 8.112 -0.889 1.00 0.00 H new ATOM 0 HE ARG A 152 11.675 7.011 0.419 1.00 0.00 H new ATOM 0 HH11 ARG A 152 14.707 8.480 1.290 1.00 0.00 H new ATOM 0 HH12 ARG A 152 13.989 9.561 2.489 1.00 0.00 H new ATOM 0 HH21 ARG A 152 10.713 8.554 1.798 1.00 0.00 H new ATOM 0 HH22 ARG A 152 11.747 9.603 2.774 1.00 0.00 H new ATOM 173 N PRO A 153 16.448 4.689 -3.682 1.00 0.00 N ATOM 174 CA PRO A 153 17.806 4.280 -4.083 1.00 0.00 C ATOM 175 C PRO A 153 18.647 3.921 -2.854 1.00 0.00 C ATOM 176 O PRO A 153 19.538 3.098 -2.920 1.00 0.00 O ATOM 177 CB PRO A 153 18.362 5.523 -4.784 1.00 0.00 C ATOM 178 CG PRO A 153 17.540 6.725 -4.260 1.00 0.00 C ATOM 179 CD PRO A 153 16.224 6.150 -3.705 1.00 0.00 C ATOM 0 HA PRO A 153 17.816 3.396 -4.721 1.00 0.00 H new ATOM 0 HB2 PRO A 153 19.422 5.652 -4.564 1.00 0.00 H new ATOM 0 HB3 PRO A 153 18.270 5.432 -5.866 1.00 0.00 H new ATOM 0 HG2 PRO A 153 18.087 7.259 -3.483 1.00 0.00 H new ATOM 0 HG3 PRO A 153 17.344 7.439 -5.060 1.00 0.00 H new ATOM 0 HD2 PRO A 153 16.010 6.536 -2.708 1.00 0.00 H new ATOM 0 HD3 PRO A 153 15.376 6.413 -4.338 1.00 0.00 H new ATOM 187 N TRP A 154 18.371 4.531 -1.733 1.00 0.00 N ATOM 188 CA TRP A 154 19.159 4.220 -0.507 1.00 0.00 C ATOM 189 C TRP A 154 18.762 2.838 0.021 1.00 0.00 C ATOM 190 O TRP A 154 19.589 1.960 0.169 1.00 0.00 O ATOM 191 CB TRP A 154 18.877 5.276 0.562 1.00 0.00 C ATOM 192 CG TRP A 154 19.336 6.612 0.072 1.00 0.00 C ATOM 193 CD1 TRP A 154 18.658 7.396 -0.797 1.00 0.00 C ATOM 194 CD2 TRP A 154 20.558 7.333 0.405 1.00 0.00 C ATOM 195 NE1 TRP A 154 19.386 8.551 -1.021 1.00 0.00 N ATOM 196 CE2 TRP A 154 20.565 8.559 -0.301 1.00 0.00 C ATOM 197 CE3 TRP A 154 21.652 7.044 1.244 1.00 0.00 C ATOM 198 CZ2 TRP A 154 21.620 9.466 -0.181 1.00 0.00 C ATOM 199 CZ3 TRP A 154 22.715 7.955 1.369 1.00 0.00 C ATOM 200 CH2 TRP A 154 22.698 9.163 0.657 1.00 0.00 C ATOM 0 H TRP A 154 17.637 5.229 -1.614 1.00 0.00 H new ATOM 0 HA TRP A 154 20.222 4.223 -0.749 1.00 0.00 H new ATOM 0 HB2 TRP A 154 17.811 5.306 0.788 1.00 0.00 H new ATOM 0 HB3 TRP A 154 19.392 5.019 1.488 1.00 0.00 H new ATOM 0 HD1 TRP A 154 17.704 7.159 -1.243 1.00 0.00 H new ATOM 0 HE1 TRP A 154 19.089 9.304 -1.641 1.00 0.00 H new ATOM 0 HE3 TRP A 154 21.674 6.116 1.795 1.00 0.00 H new ATOM 0 HZ2 TRP A 154 21.604 10.395 -0.731 1.00 0.00 H new ATOM 0 HZ3 TRP A 154 23.548 7.724 2.016 1.00 0.00 H new ATOM 0 HH2 TRP A 154 23.517 9.859 0.756 1.00 0.00 H new ATOM 211 N GLY A 155 17.503 2.636 0.306 1.00 0.00 N ATOM 212 CA GLY A 155 17.062 1.309 0.823 1.00 0.00 C ATOM 213 C GLY A 155 15.794 1.478 1.664 1.00 0.00 C ATOM 214 O GLY A 155 15.727 1.049 2.799 1.00 0.00 O ATOM 0 H GLY A 155 16.763 3.331 0.203 1.00 0.00 H new ATOM 0 HA2 GLY A 155 16.871 0.630 -0.008 1.00 0.00 H new ATOM 0 HA3 GLY A 155 17.853 0.862 1.425 1.00 0.00 H new ATOM 218 N LYS A 156 14.787 2.098 1.116 1.00 0.00 N ATOM 219 CA LYS A 156 13.523 2.294 1.881 1.00 0.00 C ATOM 220 C LYS A 156 12.334 2.196 0.924 1.00 0.00 C ATOM 221 O LYS A 156 12.499 2.143 -0.279 1.00 0.00 O ATOM 222 CB LYS A 156 13.538 3.673 2.543 1.00 0.00 C ATOM 223 CG LYS A 156 14.318 3.601 3.857 1.00 0.00 C ATOM 224 CD LYS A 156 14.728 5.011 4.287 1.00 0.00 C ATOM 225 CE LYS A 156 16.156 4.984 4.835 1.00 0.00 C ATOM 226 NZ LYS A 156 16.149 4.406 6.209 1.00 0.00 N ATOM 0 H LYS A 156 14.784 2.478 0.170 1.00 0.00 H new ATOM 0 HA LYS A 156 13.435 1.526 2.649 1.00 0.00 H new ATOM 0 HB2 LYS A 156 13.996 4.403 1.876 1.00 0.00 H new ATOM 0 HB3 LYS A 156 12.518 4.009 2.731 1.00 0.00 H new ATOM 0 HG2 LYS A 156 13.706 3.137 4.630 1.00 0.00 H new ATOM 0 HG3 LYS A 156 15.202 2.976 3.733 1.00 0.00 H new ATOM 0 HD2 LYS A 156 14.666 5.693 3.439 1.00 0.00 H new ATOM 0 HD3 LYS A 156 14.042 5.384 5.048 1.00 0.00 H new ATOM 0 HE2 LYS A 156 16.796 4.391 4.182 1.00 0.00 H new ATOM 0 HE3 LYS A 156 16.569 5.993 4.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 17.119 4.387 6.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 15.551 4.990 6.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 15.772 3.437 6.176 1.00 0.00 H new ATOM 240 N PHE A 157 11.135 2.174 1.442 1.00 0.00 N ATOM 241 CA PHE A 157 9.946 2.082 0.548 1.00 0.00 C ATOM 242 C PHE A 157 8.792 2.895 1.139 1.00 0.00 C ATOM 243 O PHE A 157 8.948 3.582 2.129 1.00 0.00 O ATOM 244 CB PHE A 157 9.513 0.619 0.410 1.00 0.00 C ATOM 245 CG PHE A 157 10.507 -0.133 -0.442 1.00 0.00 C ATOM 246 CD1 PHE A 157 11.742 -0.512 0.100 1.00 0.00 C ATOM 247 CD2 PHE A 157 10.196 -0.457 -1.770 1.00 0.00 C ATOM 248 CE1 PHE A 157 12.665 -1.215 -0.685 1.00 0.00 C ATOM 249 CE2 PHE A 157 11.120 -1.160 -2.554 1.00 0.00 C ATOM 250 CZ PHE A 157 12.355 -1.539 -2.011 1.00 0.00 C ATOM 0 H PHE A 157 10.929 2.216 2.440 1.00 0.00 H new ATOM 0 HA PHE A 157 10.208 2.478 -0.433 1.00 0.00 H new ATOM 0 HB2 PHE A 157 9.442 0.157 1.395 1.00 0.00 H new ATOM 0 HB3 PHE A 157 8.521 0.565 -0.039 1.00 0.00 H new ATOM 0 HD1 PHE A 157 11.982 -0.262 1.123 1.00 0.00 H new ATOM 0 HD2 PHE A 157 9.244 -0.165 -2.189 1.00 0.00 H new ATOM 0 HE1 PHE A 157 13.617 -1.507 -0.267 1.00 0.00 H new ATOM 0 HE2 PHE A 157 10.880 -1.410 -3.577 1.00 0.00 H new ATOM 0 HZ PHE A 157 13.067 -2.081 -2.615 1.00 0.00 H new ATOM 260 N ALA A 158 7.633 2.819 0.542 1.00 0.00 N ATOM 261 CA ALA A 158 6.469 3.586 1.072 1.00 0.00 C ATOM 262 C ALA A 158 5.167 2.934 0.606 1.00 0.00 C ATOM 263 O ALA A 158 4.842 2.938 -0.565 1.00 0.00 O ATOM 264 CB ALA A 158 6.527 5.026 0.559 1.00 0.00 C ATOM 0 H ALA A 158 7.442 2.259 -0.289 1.00 0.00 H new ATOM 0 HA ALA A 158 6.505 3.585 2.161 1.00 0.00 H new ATOM 0 HB1 ALA A 158 5.676 5.585 0.947 1.00 0.00 H new ATOM 0 HB2 ALA A 158 7.452 5.495 0.894 1.00 0.00 H new ATOM 0 HB3 ALA A 158 6.494 5.026 -0.531 1.00 0.00 H new ATOM 270 N ALA A 159 4.415 2.380 1.516 1.00 0.00 N ATOM 271 CA ALA A 159 3.131 1.735 1.127 1.00 0.00 C ATOM 272 C ALA A 159 2.030 2.796 1.077 1.00 0.00 C ATOM 273 O ALA A 159 1.820 3.531 2.024 1.00 0.00 O ATOM 274 CB ALA A 159 2.765 0.659 2.150 1.00 0.00 C ATOM 0 H ALA A 159 4.634 2.346 2.512 1.00 0.00 H new ATOM 0 HA ALA A 159 3.236 1.272 0.146 1.00 0.00 H new ATOM 0 HB1 ALA A 159 1.825 0.189 1.863 1.00 0.00 H new ATOM 0 HB2 ALA A 159 3.552 -0.094 2.183 1.00 0.00 H new ATOM 0 HB3 ALA A 159 2.657 1.115 3.134 1.00 0.00 H new ATOM 280 N GLU A 160 1.331 2.884 -0.020 1.00 0.00 N ATOM 281 CA GLU A 160 0.250 3.900 -0.139 1.00 0.00 C ATOM 282 C GLU A 160 -0.897 3.326 -0.974 1.00 0.00 C ATOM 283 O GLU A 160 -0.692 2.500 -1.841 1.00 0.00 O ATOM 284 CB GLU A 160 0.806 5.150 -0.822 1.00 0.00 C ATOM 285 CG GLU A 160 -0.204 6.291 -0.704 1.00 0.00 C ATOM 286 CD GLU A 160 -0.379 6.954 -2.071 1.00 0.00 C ATOM 287 OE1 GLU A 160 0.580 7.536 -2.551 1.00 0.00 O ATOM 288 OE2 GLU A 160 -1.466 6.866 -2.617 1.00 0.00 O ATOM 0 H GLU A 160 1.463 2.294 -0.841 1.00 0.00 H new ATOM 0 HA GLU A 160 -0.120 4.161 0.852 1.00 0.00 H new ATOM 0 HB2 GLU A 160 1.751 5.438 -0.362 1.00 0.00 H new ATOM 0 HB3 GLU A 160 1.013 4.941 -1.872 1.00 0.00 H new ATOM 0 HG2 GLU A 160 -1.161 5.910 -0.347 1.00 0.00 H new ATOM 0 HG3 GLU A 160 0.140 7.023 0.027 1.00 0.00 H new ATOM 295 N ILE A 161 -2.102 3.756 -0.719 1.00 0.00 N ATOM 296 CA ILE A 161 -3.259 3.231 -1.498 1.00 0.00 C ATOM 297 C ILE A 161 -4.261 4.360 -1.754 1.00 0.00 C ATOM 298 O ILE A 161 -4.534 5.169 -0.889 1.00 0.00 O ATOM 299 CB ILE A 161 -3.940 2.115 -0.702 1.00 0.00 C ATOM 300 CG1 ILE A 161 -5.293 1.784 -1.338 1.00 0.00 C ATOM 301 CG2 ILE A 161 -4.157 2.575 0.740 1.00 0.00 C ATOM 302 CD1 ILE A 161 -6.044 0.784 -0.456 1.00 0.00 C ATOM 0 H ILE A 161 -2.335 4.447 -0.006 1.00 0.00 H new ATOM 0 HA ILE A 161 -2.907 2.838 -2.452 1.00 0.00 H new ATOM 0 HB ILE A 161 -3.307 1.228 -0.710 1.00 0.00 H new ATOM 0 HG12 ILE A 161 -5.882 2.693 -1.457 1.00 0.00 H new ATOM 0 HG13 ILE A 161 -5.146 1.367 -2.334 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -4.642 1.780 1.306 1.00 0.00 H new ATOM 0 HG22 ILE A 161 -3.195 2.810 1.196 1.00 0.00 H new ATOM 0 HG23 ILE A 161 -4.789 3.463 0.747 1.00 0.00 H new ATOM 0 HD11 ILE A 161 -7.007 0.550 -0.910 1.00 0.00 H new ATOM 0 HD12 ILE A 161 -5.456 -0.129 -0.359 1.00 0.00 H new ATOM 0 HD13 ILE A 161 -6.205 1.218 0.531 1.00 0.00 H new ATOM 314 N ARG A 162 -4.816 4.416 -2.934 1.00 0.00 N ATOM 315 CA ARG A 162 -5.804 5.487 -3.242 1.00 0.00 C ATOM 316 C ARG A 162 -7.109 5.192 -2.500 1.00 0.00 C ATOM 317 O ARG A 162 -7.577 4.071 -2.469 1.00 0.00 O ATOM 318 CB ARG A 162 -6.068 5.524 -4.748 1.00 0.00 C ATOM 319 CG ARG A 162 -7.083 6.625 -5.062 1.00 0.00 C ATOM 320 CD ARG A 162 -6.735 7.272 -6.403 1.00 0.00 C ATOM 321 NE ARG A 162 -7.990 7.673 -7.097 1.00 0.00 N ATOM 322 CZ ARG A 162 -8.478 6.921 -8.045 1.00 0.00 C ATOM 323 NH1 ARG A 162 -7.762 6.659 -9.104 1.00 0.00 N ATOM 324 NH2 ARG A 162 -9.682 6.431 -7.935 1.00 0.00 N ATOM 0 H ARG A 162 -4.628 3.766 -3.697 1.00 0.00 H new ATOM 0 HA ARG A 162 -5.410 6.452 -2.924 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -5.138 5.708 -5.286 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -6.446 4.559 -5.085 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -8.089 6.207 -5.098 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -7.077 7.376 -4.272 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -6.099 8.143 -6.245 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -6.171 6.573 -7.021 1.00 0.00 H new ATOM 0 HE ARG A 162 -8.467 8.534 -6.832 1.00 0.00 H new ATOM 0 HH11 ARG A 162 -6.821 7.042 -9.191 1.00 0.00 H new ATOM 0 HH12 ARG A 162 -8.144 6.071 -9.845 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -10.242 6.636 -7.108 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -10.063 5.843 -8.676 1.00 0.00 H new ATOM 338 N ASP A 163 -7.698 6.187 -1.894 1.00 0.00 N ATOM 339 CA ASP A 163 -8.967 5.956 -1.148 1.00 0.00 C ATOM 340 C ASP A 163 -10.013 6.991 -1.575 1.00 0.00 C ATOM 341 O ASP A 163 -10.031 8.095 -1.067 1.00 0.00 O ATOM 342 CB ASP A 163 -8.701 6.090 0.351 1.00 0.00 C ATOM 343 CG ASP A 163 -9.983 5.788 1.130 1.00 0.00 C ATOM 344 OD1 ASP A 163 -11.049 6.086 0.617 1.00 0.00 O ATOM 345 OD2 ASP A 163 -9.876 5.264 2.228 1.00 0.00 O ATOM 0 H ASP A 163 -7.356 7.148 -1.883 1.00 0.00 H new ATOM 0 HA ASP A 163 -9.341 4.956 -1.367 1.00 0.00 H new ATOM 0 HB2 ASP A 163 -7.910 5.403 0.653 1.00 0.00 H new ATOM 0 HB3 ASP A 163 -8.353 7.097 0.580 1.00 0.00 H new ATOM 350 N PRO A 164 -10.859 6.602 -2.497 1.00 0.00 N ATOM 351 CA PRO A 164 -11.926 7.477 -3.012 1.00 0.00 C ATOM 352 C PRO A 164 -13.087 7.540 -2.017 1.00 0.00 C ATOM 353 O PRO A 164 -13.826 8.503 -1.967 1.00 0.00 O ATOM 354 CB PRO A 164 -12.357 6.792 -4.312 1.00 0.00 C ATOM 355 CG PRO A 164 -11.934 5.308 -4.184 1.00 0.00 C ATOM 356 CD PRO A 164 -10.831 5.257 -3.109 1.00 0.00 C ATOM 0 HA PRO A 164 -11.601 8.506 -3.167 1.00 0.00 H new ATOM 0 HB2 PRO A 164 -13.434 6.878 -4.458 1.00 0.00 H new ATOM 0 HB3 PRO A 164 -11.880 7.259 -5.174 1.00 0.00 H new ATOM 0 HG2 PRO A 164 -12.783 4.686 -3.899 1.00 0.00 H new ATOM 0 HG3 PRO A 164 -11.565 4.926 -5.136 1.00 0.00 H new ATOM 0 HD2 PRO A 164 -11.030 4.480 -2.371 1.00 0.00 H new ATOM 0 HD3 PRO A 164 -9.857 5.039 -3.548 1.00 0.00 H new ATOM 364 N ALA A 165 -13.251 6.517 -1.224 1.00 0.00 N ATOM 365 CA ALA A 165 -14.360 6.510 -0.232 1.00 0.00 C ATOM 366 C ALA A 165 -14.189 7.681 0.738 1.00 0.00 C ATOM 367 O ALA A 165 -15.126 8.110 1.381 1.00 0.00 O ATOM 368 CB ALA A 165 -14.334 5.194 0.550 1.00 0.00 C ATOM 0 H ALA A 165 -12.662 5.684 -1.221 1.00 0.00 H new ATOM 0 HA ALA A 165 -15.312 6.608 -0.753 1.00 0.00 H new ATOM 0 HB1 ALA A 165 -15.146 5.187 1.277 1.00 0.00 H new ATOM 0 HB2 ALA A 165 -14.457 4.359 -0.139 1.00 0.00 H new ATOM 0 HB3 ALA A 165 -13.381 5.098 1.069 1.00 0.00 H new ATOM 374 N LYS A 166 -12.997 8.203 0.850 1.00 0.00 N ATOM 375 CA LYS A 166 -12.767 9.343 1.780 1.00 0.00 C ATOM 376 C LYS A 166 -12.866 10.661 1.007 1.00 0.00 C ATOM 377 O LYS A 166 -12.181 11.617 1.306 1.00 0.00 O ATOM 378 CB LYS A 166 -11.375 9.221 2.400 1.00 0.00 C ATOM 379 CG LYS A 166 -11.284 7.921 3.200 1.00 0.00 C ATOM 380 CD LYS A 166 -11.619 8.198 4.667 1.00 0.00 C ATOM 381 CE LYS A 166 -11.044 7.082 5.541 1.00 0.00 C ATOM 382 NZ LYS A 166 -9.555 7.121 5.479 1.00 0.00 N ATOM 0 H LYS A 166 -12.173 7.888 0.337 1.00 0.00 H new ATOM 0 HA LYS A 166 -13.520 9.326 2.568 1.00 0.00 H new ATOM 0 HB2 LYS A 166 -10.615 9.233 1.619 1.00 0.00 H new ATOM 0 HB3 LYS A 166 -11.179 10.074 3.049 1.00 0.00 H new ATOM 0 HG2 LYS A 166 -11.974 7.182 2.792 1.00 0.00 H new ATOM 0 HG3 LYS A 166 -10.282 7.501 3.118 1.00 0.00 H new ATOM 0 HD2 LYS A 166 -11.207 9.161 4.970 1.00 0.00 H new ATOM 0 HD3 LYS A 166 -12.699 8.258 4.799 1.00 0.00 H new ATOM 0 HE2 LYS A 166 -11.379 7.203 6.571 1.00 0.00 H new ATOM 0 HE3 LYS A 166 -11.408 6.113 5.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 166 -9.161 6.770 6.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 166 -9.224 6.521 4.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 166 -9.240 8.099 5.322 1.00 0.00 H new ATOM 396 N ASN A 167 -13.711 10.716 0.015 1.00 0.00 N ATOM 397 CA ASN A 167 -13.848 11.972 -0.776 1.00 0.00 C ATOM 398 C ASN A 167 -12.550 12.231 -1.543 1.00 0.00 C ATOM 399 O ASN A 167 -12.003 13.316 -1.511 1.00 0.00 O ATOM 400 CB ASN A 167 -14.126 13.144 0.170 1.00 0.00 C ATOM 401 CG ASN A 167 -15.268 12.777 1.120 1.00 0.00 C ATOM 402 OD1 ASN A 167 -15.163 12.964 2.316 1.00 0.00 O ATOM 403 ND2 ASN A 167 -16.364 12.260 0.636 1.00 0.00 N ATOM 0 H ASN A 167 -14.312 9.947 -0.282 1.00 0.00 H new ATOM 0 HA ASN A 167 -14.674 11.872 -1.480 1.00 0.00 H new ATOM 0 HB2 ASN A 167 -13.229 13.385 0.740 1.00 0.00 H new ATOM 0 HB3 ASN A 167 -14.388 14.033 -0.403 1.00 0.00 H new ATOM 0 HD21 ASN A 167 -17.131 12.013 1.261 1.00 0.00 H new ATOM 0 HD22 ASN A 167 -16.454 12.102 -0.368 1.00 0.00 H new ATOM 410 N GLY A 168 -12.051 11.242 -2.232 1.00 0.00 N ATOM 411 CA GLY A 168 -10.787 11.431 -3.001 1.00 0.00 C ATOM 412 C GLY A 168 -9.669 11.870 -2.053 1.00 0.00 C ATOM 413 O GLY A 168 -9.630 12.998 -1.604 1.00 0.00 O ATOM 0 H GLY A 168 -12.463 10.311 -2.296 1.00 0.00 H new ATOM 0 HA2 GLY A 168 -10.511 10.502 -3.500 1.00 0.00 H new ATOM 0 HA3 GLY A 168 -10.932 12.180 -3.780 1.00 0.00 H new ATOM 417 N ALA A 169 -8.757 10.988 -1.745 1.00 0.00 N ATOM 418 CA ALA A 169 -7.642 11.357 -0.828 1.00 0.00 C ATOM 419 C ALA A 169 -6.661 10.188 -0.722 1.00 0.00 C ATOM 420 O ALA A 169 -6.980 9.142 -0.191 1.00 0.00 O ATOM 421 CB ALA A 169 -8.205 11.680 0.559 1.00 0.00 C ATOM 0 H ALA A 169 -8.736 10.028 -2.089 1.00 0.00 H new ATOM 0 HA ALA A 169 -7.124 12.232 -1.221 1.00 0.00 H new ATOM 0 HB1 ALA A 169 -7.389 11.950 1.229 1.00 0.00 H new ATOM 0 HB2 ALA A 169 -8.903 12.514 0.483 1.00 0.00 H new ATOM 0 HB3 ALA A 169 -8.725 10.807 0.953 1.00 0.00 H new ATOM 427 N ARG A 170 -5.468 10.355 -1.224 1.00 0.00 N ATOM 428 CA ARG A 170 -4.467 9.252 -1.151 1.00 0.00 C ATOM 429 C ARG A 170 -4.324 8.787 0.300 1.00 0.00 C ATOM 430 O ARG A 170 -4.777 9.440 1.220 1.00 0.00 O ATOM 431 CB ARG A 170 -3.115 9.758 -1.662 1.00 0.00 C ATOM 432 CG ARG A 170 -2.492 10.697 -0.627 1.00 0.00 C ATOM 433 CD ARG A 170 -1.809 11.864 -1.340 1.00 0.00 C ATOM 434 NE ARG A 170 -1.272 12.816 -0.328 1.00 0.00 N ATOM 435 CZ ARG A 170 -2.044 13.260 0.625 1.00 0.00 C ATOM 436 NH1 ARG A 170 -3.165 13.859 0.330 1.00 0.00 N ATOM 437 NH2 ARG A 170 -1.697 13.103 1.872 1.00 0.00 N ATOM 0 H ARG A 170 -5.143 11.207 -1.681 1.00 0.00 H new ATOM 0 HA ARG A 170 -4.800 8.417 -1.767 1.00 0.00 H new ATOM 0 HB2 ARG A 170 -2.449 8.916 -1.852 1.00 0.00 H new ATOM 0 HB3 ARG A 170 -3.246 10.281 -2.610 1.00 0.00 H new ATOM 0 HG2 ARG A 170 -3.261 11.071 0.050 1.00 0.00 H new ATOM 0 HG3 ARG A 170 -1.768 10.155 -0.019 1.00 0.00 H new ATOM 0 HD2 ARG A 170 -1.002 11.496 -1.973 1.00 0.00 H new ATOM 0 HD3 ARG A 170 -2.519 12.372 -1.992 1.00 0.00 H new ATOM 0 HE ARG A 170 -0.300 13.121 -0.380 1.00 0.00 H new ATOM 0 HH11 ARG A 170 -3.437 13.980 -0.646 1.00 0.00 H new ATOM 0 HH12 ARG A 170 -3.769 14.206 1.075 1.00 0.00 H new ATOM 0 HH21 ARG A 170 -0.822 12.633 2.102 1.00 0.00 H new ATOM 0 HH22 ARG A 170 -2.301 13.450 2.617 1.00 0.00 H new ATOM 451 N VAL A 171 -3.696 7.663 0.512 1.00 0.00 N ATOM 452 CA VAL A 171 -3.522 7.158 1.903 1.00 0.00 C ATOM 453 C VAL A 171 -2.100 6.623 2.080 1.00 0.00 C ATOM 454 O VAL A 171 -1.813 5.481 1.777 1.00 0.00 O ATOM 455 CB VAL A 171 -4.529 6.036 2.167 1.00 0.00 C ATOM 456 CG1 VAL A 171 -4.160 5.308 3.460 1.00 0.00 C ATOM 457 CG2 VAL A 171 -5.927 6.636 2.306 1.00 0.00 C ATOM 0 H VAL A 171 -3.296 7.073 -0.218 1.00 0.00 H new ATOM 0 HA VAL A 171 -3.691 7.971 2.609 1.00 0.00 H new ATOM 0 HB VAL A 171 -4.512 5.330 1.337 1.00 0.00 H new ATOM 0 HG11 VAL A 171 -4.878 4.510 3.646 1.00 0.00 H new ATOM 0 HG12 VAL A 171 -3.161 4.882 3.366 1.00 0.00 H new ATOM 0 HG13 VAL A 171 -4.177 6.012 4.292 1.00 0.00 H new ATOM 0 HG21 VAL A 171 -6.648 5.840 2.494 1.00 0.00 H new ATOM 0 HG22 VAL A 171 -5.939 7.341 3.137 1.00 0.00 H new ATOM 0 HG23 VAL A 171 -6.193 7.156 1.386 1.00 0.00 H new ATOM 467 N TRP A 172 -1.208 7.437 2.573 1.00 0.00 N ATOM 468 CA TRP A 172 0.194 6.973 2.775 1.00 0.00 C ATOM 469 C TRP A 172 0.266 6.126 4.048 1.00 0.00 C ATOM 470 O TRP A 172 0.350 6.642 5.144 1.00 0.00 O ATOM 471 CB TRP A 172 1.122 8.184 2.909 1.00 0.00 C ATOM 472 CG TRP A 172 2.537 7.722 3.067 1.00 0.00 C ATOM 473 CD1 TRP A 172 3.011 7.013 4.117 1.00 0.00 C ATOM 474 CD2 TRP A 172 3.668 7.926 2.170 1.00 0.00 C ATOM 475 NE1 TRP A 172 4.358 6.770 3.922 1.00 0.00 N ATOM 476 CE2 TRP A 172 4.808 7.310 2.738 1.00 0.00 C ATOM 477 CE3 TRP A 172 3.815 8.578 0.930 1.00 0.00 C ATOM 478 CZ2 TRP A 172 6.048 7.338 2.103 1.00 0.00 C ATOM 479 CZ3 TRP A 172 5.064 8.610 0.286 1.00 0.00 C ATOM 480 CH2 TRP A 172 6.178 7.989 0.872 1.00 0.00 C ATOM 0 H TRP A 172 -1.389 8.403 2.845 1.00 0.00 H new ATOM 0 HA TRP A 172 0.508 6.374 1.920 1.00 0.00 H new ATOM 0 HB2 TRP A 172 1.034 8.821 2.029 1.00 0.00 H new ATOM 0 HB3 TRP A 172 0.828 8.786 3.769 1.00 0.00 H new ATOM 0 HD1 TRP A 172 2.432 6.689 4.969 1.00 0.00 H new ATOM 0 HE1 TRP A 172 4.947 6.254 4.576 1.00 0.00 H new ATOM 0 HE3 TRP A 172 2.962 9.056 0.471 1.00 0.00 H new ATOM 0 HZ2 TRP A 172 6.903 6.860 2.558 1.00 0.00 H new ATOM 0 HZ3 TRP A 172 5.167 9.114 -0.663 1.00 0.00 H new ATOM 0 HH2 TRP A 172 7.135 8.014 0.372 1.00 0.00 H new ATOM 491 N LEU A 173 0.225 4.829 3.911 1.00 0.00 N ATOM 492 CA LEU A 173 0.287 3.950 5.112 1.00 0.00 C ATOM 493 C LEU A 173 1.550 4.268 5.914 1.00 0.00 C ATOM 494 O LEU A 173 1.509 4.419 7.118 1.00 0.00 O ATOM 495 CB LEU A 173 0.314 2.485 4.672 1.00 0.00 C ATOM 496 CG LEU A 173 -1.001 2.138 3.973 1.00 0.00 C ATOM 497 CD1 LEU A 173 -0.717 1.266 2.749 1.00 0.00 C ATOM 498 CD2 LEU A 173 -1.906 1.374 4.941 1.00 0.00 C ATOM 0 H LEU A 173 0.151 4.340 3.019 1.00 0.00 H new ATOM 0 HA LEU A 173 -0.590 4.125 5.735 1.00 0.00 H new ATOM 0 HB2 LEU A 173 1.153 2.312 3.998 1.00 0.00 H new ATOM 0 HB3 LEU A 173 0.461 1.837 5.536 1.00 0.00 H new ATOM 0 HG LEU A 173 -1.496 3.056 3.657 1.00 0.00 H new ATOM 0 HD11 LEU A 173 -1.655 1.020 2.252 1.00 0.00 H new ATOM 0 HD12 LEU A 173 -0.072 1.808 2.058 1.00 0.00 H new ATOM 0 HD13 LEU A 173 -0.221 0.348 3.064 1.00 0.00 H new ATOM 0 HD21 LEU A 173 -2.844 1.126 4.444 1.00 0.00 H new ATOM 0 HD22 LEU A 173 -1.409 0.457 5.256 1.00 0.00 H new ATOM 0 HD23 LEU A 173 -2.111 1.994 5.814 1.00 0.00 H new ATOM 510 N GLY A 174 2.672 4.371 5.256 1.00 0.00 N ATOM 511 CA GLY A 174 3.934 4.681 5.986 1.00 0.00 C ATOM 512 C GLY A 174 5.124 4.084 5.234 1.00 0.00 C ATOM 513 O GLY A 174 4.970 3.222 4.392 1.00 0.00 O ATOM 0 H GLY A 174 2.770 4.254 4.247 1.00 0.00 H new ATOM 0 HA2 GLY A 174 4.055 5.760 6.080 1.00 0.00 H new ATOM 0 HA3 GLY A 174 3.890 4.276 6.997 1.00 0.00 H new ATOM 517 N THR A 175 6.312 4.538 5.531 1.00 0.00 N ATOM 518 CA THR A 175 7.511 3.998 4.830 1.00 0.00 C ATOM 519 C THR A 175 7.898 2.657 5.452 1.00 0.00 C ATOM 520 O THR A 175 7.653 2.406 6.615 1.00 0.00 O ATOM 521 CB THR A 175 8.673 4.980 4.968 1.00 0.00 C ATOM 522 OG1 THR A 175 9.368 4.720 6.180 1.00 0.00 O ATOM 523 CG2 THR A 175 8.137 6.411 4.982 1.00 0.00 C ATOM 0 H THR A 175 6.503 5.258 6.228 1.00 0.00 H new ATOM 0 HA THR A 175 7.282 3.859 3.773 1.00 0.00 H new ATOM 0 HB THR A 175 9.353 4.859 4.125 1.00 0.00 H new ATOM 0 HG1 THR A 175 10.115 5.348 6.270 1.00 0.00 H new ATOM 0 HG21 THR A 175 8.968 7.110 5.081 1.00 0.00 H new ATOM 0 HG22 THR A 175 7.605 6.609 4.052 1.00 0.00 H new ATOM 0 HG23 THR A 175 7.456 6.536 5.824 1.00 0.00 H new ATOM 531 N PHE A 176 8.499 1.791 4.687 1.00 0.00 N ATOM 532 CA PHE A 176 8.896 0.468 5.237 1.00 0.00 C ATOM 533 C PHE A 176 10.381 0.221 4.959 1.00 0.00 C ATOM 534 O PHE A 176 11.075 1.076 4.444 1.00 0.00 O ATOM 535 CB PHE A 176 8.050 -0.622 4.581 1.00 0.00 C ATOM 536 CG PHE A 176 6.627 -0.487 5.064 1.00 0.00 C ATOM 537 CD1 PHE A 176 5.748 0.397 4.422 1.00 0.00 C ATOM 538 CD2 PHE A 176 6.187 -1.235 6.164 1.00 0.00 C ATOM 539 CE1 PHE A 176 4.431 0.529 4.878 1.00 0.00 C ATOM 540 CE2 PHE A 176 4.871 -1.103 6.619 1.00 0.00 C ATOM 541 CZ PHE A 176 3.991 -0.221 5.977 1.00 0.00 C ATOM 0 H PHE A 176 8.732 1.942 3.706 1.00 0.00 H new ATOM 0 HA PHE A 176 8.732 0.451 6.314 1.00 0.00 H new ATOM 0 HB2 PHE A 176 8.091 -0.530 3.496 1.00 0.00 H new ATOM 0 HB3 PHE A 176 8.442 -1.607 4.832 1.00 0.00 H new ATOM 0 HD1 PHE A 176 6.087 0.976 3.576 1.00 0.00 H new ATOM 0 HD2 PHE A 176 6.864 -1.914 6.661 1.00 0.00 H new ATOM 0 HE1 PHE A 176 3.754 1.209 4.383 1.00 0.00 H new ATOM 0 HE2 PHE A 176 4.533 -1.681 7.466 1.00 0.00 H new ATOM 0 HZ PHE A 176 2.975 -0.119 6.329 1.00 0.00 H new ATOM 551 N GLU A 177 10.876 -0.936 5.304 1.00 0.00 N ATOM 552 CA GLU A 177 12.319 -1.229 5.070 1.00 0.00 C ATOM 553 C GLU A 177 12.525 -1.790 3.662 1.00 0.00 C ATOM 554 O GLU A 177 13.544 -1.563 3.039 1.00 0.00 O ATOM 555 CB GLU A 177 12.799 -2.255 6.099 1.00 0.00 C ATOM 556 CG GLU A 177 12.867 -1.600 7.480 1.00 0.00 C ATOM 557 CD GLU A 177 14.328 -1.344 7.854 1.00 0.00 C ATOM 558 OE1 GLU A 177 14.953 -2.250 8.379 1.00 0.00 O ATOM 559 OE2 GLU A 177 14.796 -0.244 7.610 1.00 0.00 O ATOM 0 H GLU A 177 10.344 -1.691 5.738 1.00 0.00 H new ATOM 0 HA GLU A 177 12.890 -0.306 5.170 1.00 0.00 H new ATOM 0 HB2 GLU A 177 12.120 -3.107 6.122 1.00 0.00 H new ATOM 0 HB3 GLU A 177 13.780 -2.637 5.817 1.00 0.00 H new ATOM 0 HG2 GLU A 177 12.312 -0.662 7.477 1.00 0.00 H new ATOM 0 HG3 GLU A 177 12.398 -2.245 8.223 1.00 0.00 H new ATOM 566 N THR A 178 11.575 -2.526 3.153 1.00 0.00 N ATOM 567 CA THR A 178 11.741 -3.101 1.784 1.00 0.00 C ATOM 568 C THR A 178 10.437 -2.961 0.995 1.00 0.00 C ATOM 569 O THR A 178 9.450 -2.454 1.490 1.00 0.00 O ATOM 570 CB THR A 178 12.115 -4.584 1.891 1.00 0.00 C ATOM 571 OG1 THR A 178 10.933 -5.370 1.977 1.00 0.00 O ATOM 572 CG2 THR A 178 12.973 -4.808 3.138 1.00 0.00 C ATOM 0 H THR A 178 10.697 -2.754 3.620 1.00 0.00 H new ATOM 0 HA THR A 178 12.533 -2.560 1.266 1.00 0.00 H new ATOM 0 HB THR A 178 12.680 -4.878 1.006 1.00 0.00 H new ATOM 0 HG1 THR A 178 10.182 -4.802 2.248 1.00 0.00 H new ATOM 0 HG21 THR A 178 13.238 -5.863 3.213 1.00 0.00 H new ATOM 0 HG22 THR A 178 13.881 -4.210 3.067 1.00 0.00 H new ATOM 0 HG23 THR A 178 12.412 -4.511 4.024 1.00 0.00 H new ATOM 580 N ALA A 179 10.425 -3.411 -0.232 1.00 0.00 N ATOM 581 CA ALA A 179 9.185 -3.309 -1.049 1.00 0.00 C ATOM 582 C ALA A 179 8.182 -4.358 -0.571 1.00 0.00 C ATOM 583 O ALA A 179 6.987 -4.186 -0.690 1.00 0.00 O ATOM 584 CB ALA A 179 9.512 -3.554 -2.522 1.00 0.00 C ATOM 0 H ALA A 179 11.220 -3.844 -0.701 1.00 0.00 H new ATOM 0 HA ALA A 179 8.759 -2.312 -0.938 1.00 0.00 H new ATOM 0 HB1 ALA A 179 8.600 -3.478 -3.115 1.00 0.00 H new ATOM 0 HB2 ALA A 179 10.230 -2.809 -2.864 1.00 0.00 H new ATOM 0 HB3 ALA A 179 9.939 -4.550 -2.639 1.00 0.00 H new ATOM 590 N GLU A 180 8.661 -5.440 -0.022 1.00 0.00 N ATOM 591 CA GLU A 180 7.733 -6.495 0.475 1.00 0.00 C ATOM 592 C GLU A 180 6.982 -5.955 1.687 1.00 0.00 C ATOM 593 O GLU A 180 5.805 -5.687 1.624 1.00 0.00 O ATOM 594 CB GLU A 180 8.533 -7.735 0.882 1.00 0.00 C ATOM 595 CG GLU A 180 7.588 -8.773 1.489 1.00 0.00 C ATOM 596 CD GLU A 180 8.047 -10.178 1.094 1.00 0.00 C ATOM 597 OE1 GLU A 180 9.203 -10.322 0.730 1.00 0.00 O ATOM 598 OE2 GLU A 180 7.234 -11.086 1.162 1.00 0.00 O ATOM 0 H GLU A 180 9.653 -5.639 0.104 1.00 0.00 H new ATOM 0 HA GLU A 180 7.028 -6.767 -0.311 1.00 0.00 H new ATOM 0 HB2 GLU A 180 9.042 -8.154 0.014 1.00 0.00 H new ATOM 0 HB3 GLU A 180 9.304 -7.463 1.603 1.00 0.00 H new ATOM 0 HG2 GLU A 180 7.574 -8.676 2.575 1.00 0.00 H new ATOM 0 HG3 GLU A 180 6.570 -8.601 1.140 1.00 0.00 H new ATOM 605 N ASP A 181 7.664 -5.797 2.785 1.00 0.00 N ATOM 606 CA ASP A 181 7.007 -5.267 4.027 1.00 0.00 C ATOM 607 C ASP A 181 5.990 -4.178 3.665 1.00 0.00 C ATOM 608 O ASP A 181 4.837 -4.244 4.041 1.00 0.00 O ATOM 609 CB ASP A 181 8.058 -4.667 4.981 1.00 0.00 C ATOM 610 CG ASP A 181 9.396 -4.492 4.266 1.00 0.00 C ATOM 611 OD1 ASP A 181 9.373 -4.109 3.109 1.00 0.00 O ATOM 612 OD2 ASP A 181 10.416 -4.744 4.885 1.00 0.00 O ATOM 0 H ASP A 181 8.656 -6.012 2.883 1.00 0.00 H new ATOM 0 HA ASP A 181 6.500 -6.096 4.520 1.00 0.00 H new ATOM 0 HB2 ASP A 181 7.710 -3.704 5.354 1.00 0.00 H new ATOM 0 HB3 ASP A 181 8.185 -5.317 5.847 1.00 0.00 H new ATOM 617 N ALA A 182 6.409 -3.171 2.948 1.00 0.00 N ATOM 618 CA ALA A 182 5.467 -2.075 2.575 1.00 0.00 C ATOM 619 C ALA A 182 4.310 -2.637 1.752 1.00 0.00 C ATOM 620 O ALA A 182 3.167 -2.261 1.928 1.00 0.00 O ATOM 621 CB ALA A 182 6.210 -1.026 1.746 1.00 0.00 C ATOM 0 H ALA A 182 7.363 -3.059 2.604 1.00 0.00 H new ATOM 0 HA ALA A 182 5.074 -1.619 3.484 1.00 0.00 H new ATOM 0 HB1 ALA A 182 5.523 -0.225 1.473 1.00 0.00 H new ATOM 0 HB2 ALA A 182 7.032 -0.615 2.332 1.00 0.00 H new ATOM 0 HB3 ALA A 182 6.605 -1.490 0.842 1.00 0.00 H new ATOM 627 N ALA A 183 4.594 -3.528 0.850 1.00 0.00 N ATOM 628 CA ALA A 183 3.513 -4.110 0.009 1.00 0.00 C ATOM 629 C ALA A 183 2.513 -4.851 0.899 1.00 0.00 C ATOM 630 O ALA A 183 1.335 -4.908 0.610 1.00 0.00 O ATOM 631 CB ALA A 183 4.120 -5.082 -1.003 1.00 0.00 C ATOM 0 H ALA A 183 5.531 -3.881 0.657 1.00 0.00 H new ATOM 0 HA ALA A 183 2.998 -3.310 -0.523 1.00 0.00 H new ATOM 0 HB1 ALA A 183 3.328 -5.508 -1.619 1.00 0.00 H new ATOM 0 HB2 ALA A 183 4.828 -4.550 -1.639 1.00 0.00 H new ATOM 0 HB3 ALA A 183 4.638 -5.882 -0.474 1.00 0.00 H new ATOM 637 N LEU A 184 2.970 -5.411 1.987 1.00 0.00 N ATOM 638 CA LEU A 184 2.040 -6.134 2.889 1.00 0.00 C ATOM 639 C LEU A 184 1.149 -5.111 3.584 1.00 0.00 C ATOM 640 O LEU A 184 -0.055 -5.263 3.654 1.00 0.00 O ATOM 641 CB LEU A 184 2.843 -6.920 3.927 1.00 0.00 C ATOM 642 CG LEU A 184 1.991 -8.073 4.458 1.00 0.00 C ATOM 643 CD1 LEU A 184 2.524 -9.398 3.911 1.00 0.00 C ATOM 644 CD2 LEU A 184 2.055 -8.088 5.987 1.00 0.00 C ATOM 0 H LEU A 184 3.945 -5.397 2.286 1.00 0.00 H new ATOM 0 HA LEU A 184 1.426 -6.832 2.319 1.00 0.00 H new ATOM 0 HB2 LEU A 184 3.759 -7.306 3.479 1.00 0.00 H new ATOM 0 HB3 LEU A 184 3.140 -6.265 4.746 1.00 0.00 H new ATOM 0 HG LEU A 184 0.958 -7.940 4.137 1.00 0.00 H new ATOM 0 HD11 LEU A 184 1.916 -10.219 4.290 1.00 0.00 H new ATOM 0 HD12 LEU A 184 2.479 -9.386 2.822 1.00 0.00 H new ATOM 0 HD13 LEU A 184 3.557 -9.534 4.230 1.00 0.00 H new ATOM 0 HD21 LEU A 184 1.448 -8.909 6.369 1.00 0.00 H new ATOM 0 HD22 LEU A 184 3.089 -8.221 6.307 1.00 0.00 H new ATOM 0 HD23 LEU A 184 1.674 -7.144 6.376 1.00 0.00 H new ATOM 656 N ALA A 185 1.730 -4.056 4.079 1.00 0.00 N ATOM 657 CA ALA A 185 0.915 -3.007 4.744 1.00 0.00 C ATOM 658 C ALA A 185 -0.097 -2.484 3.730 1.00 0.00 C ATOM 659 O ALA A 185 -1.155 -1.997 4.079 1.00 0.00 O ATOM 660 CB ALA A 185 1.823 -1.864 5.206 1.00 0.00 C ATOM 0 H ALA A 185 2.734 -3.876 4.051 1.00 0.00 H new ATOM 0 HA ALA A 185 0.402 -3.418 5.614 1.00 0.00 H new ATOM 0 HB1 ALA A 185 1.222 -1.096 5.693 1.00 0.00 H new ATOM 0 HB2 ALA A 185 2.562 -2.248 5.910 1.00 0.00 H new ATOM 0 HB3 ALA A 185 2.333 -1.433 4.344 1.00 0.00 H new ATOM 666 N TYR A 186 0.221 -2.595 2.468 1.00 0.00 N ATOM 667 CA TYR A 186 -0.716 -2.126 1.415 1.00 0.00 C ATOM 668 C TYR A 186 -1.872 -3.118 1.304 1.00 0.00 C ATOM 669 O TYR A 186 -3.005 -2.746 1.079 1.00 0.00 O ATOM 670 CB TYR A 186 0.015 -2.054 0.074 1.00 0.00 C ATOM 671 CG TYR A 186 -0.977 -1.743 -1.018 1.00 0.00 C ATOM 672 CD1 TYR A 186 -1.769 -2.767 -1.558 1.00 0.00 C ATOM 673 CD2 TYR A 186 -1.112 -0.431 -1.490 1.00 0.00 C ATOM 674 CE1 TYR A 186 -2.693 -2.478 -2.570 1.00 0.00 C ATOM 675 CE2 TYR A 186 -2.036 -0.141 -2.502 1.00 0.00 C ATOM 676 CZ TYR A 186 -2.826 -1.165 -3.043 1.00 0.00 C ATOM 677 OH TYR A 186 -3.737 -0.881 -4.040 1.00 0.00 O ATOM 0 H TYR A 186 1.095 -2.993 2.123 1.00 0.00 H new ATOM 0 HA TYR A 186 -1.095 -1.137 1.674 1.00 0.00 H new ATOM 0 HB2 TYR A 186 0.788 -1.286 0.109 1.00 0.00 H new ATOM 0 HB3 TYR A 186 0.515 -3.000 -0.132 1.00 0.00 H new ATOM 0 HD1 TYR A 186 -1.666 -3.778 -1.193 1.00 0.00 H new ATOM 0 HD2 TYR A 186 -0.503 0.358 -1.073 1.00 0.00 H new ATOM 0 HE1 TYR A 186 -3.303 -3.266 -2.986 1.00 0.00 H new ATOM 0 HE2 TYR A 186 -2.140 0.871 -2.865 1.00 0.00 H new ATOM 0 HH TYR A 186 -3.704 0.075 -4.251 1.00 0.00 H new ATOM 687 N ASP A 187 -1.589 -4.383 1.466 1.00 0.00 N ATOM 688 CA ASP A 187 -2.660 -5.409 1.378 1.00 0.00 C ATOM 689 C ASP A 187 -3.655 -5.194 2.518 1.00 0.00 C ATOM 690 O ASP A 187 -4.854 -5.214 2.324 1.00 0.00 O ATOM 691 CB ASP A 187 -2.035 -6.798 1.501 1.00 0.00 C ATOM 692 CG ASP A 187 -1.146 -7.076 0.287 1.00 0.00 C ATOM 693 OD1 ASP A 187 -1.120 -6.249 -0.608 1.00 0.00 O ATOM 694 OD2 ASP A 187 -0.506 -8.115 0.274 1.00 0.00 O ATOM 0 H ASP A 187 -0.656 -4.748 1.656 1.00 0.00 H new ATOM 0 HA ASP A 187 -3.177 -5.325 0.422 1.00 0.00 H new ATOM 0 HB2 ASP A 187 -1.447 -6.862 2.416 1.00 0.00 H new ATOM 0 HB3 ASP A 187 -2.817 -7.554 1.571 1.00 0.00 H new ATOM 699 N ARG A 188 -3.163 -4.984 3.705 1.00 0.00 N ATOM 700 CA ARG A 188 -4.074 -4.760 4.862 1.00 0.00 C ATOM 701 C ARG A 188 -4.964 -3.557 4.563 1.00 0.00 C ATOM 702 O ARG A 188 -6.151 -3.566 4.820 1.00 0.00 O ATOM 703 CB ARG A 188 -3.246 -4.485 6.119 1.00 0.00 C ATOM 704 CG ARG A 188 -4.180 -4.276 7.312 1.00 0.00 C ATOM 705 CD ARG A 188 -3.808 -5.254 8.427 1.00 0.00 C ATOM 706 NE ARG A 188 -4.389 -4.782 9.715 1.00 0.00 N ATOM 707 CZ ARG A 188 -3.626 -4.201 10.599 1.00 0.00 C ATOM 708 NH1 ARG A 188 -2.674 -3.397 10.214 1.00 0.00 N ATOM 709 NH2 ARG A 188 -3.818 -4.423 11.871 1.00 0.00 N ATOM 0 H ARG A 188 -2.167 -4.958 3.926 1.00 0.00 H new ATOM 0 HA ARG A 188 -4.690 -5.644 5.025 1.00 0.00 H new ATOM 0 HB2 ARG A 188 -2.573 -5.320 6.313 1.00 0.00 H new ATOM 0 HB3 ARG A 188 -2.624 -3.602 5.972 1.00 0.00 H new ATOM 0 HG2 ARG A 188 -4.103 -3.250 7.673 1.00 0.00 H new ATOM 0 HG3 ARG A 188 -5.215 -4.430 7.008 1.00 0.00 H new ATOM 0 HD2 ARG A 188 -4.181 -6.251 8.191 1.00 0.00 H new ATOM 0 HD3 ARG A 188 -2.724 -5.331 8.511 1.00 0.00 H new ATOM 0 HE ARG A 188 -5.382 -4.913 9.905 1.00 0.00 H new ATOM 0 HH11 ARG A 188 -2.525 -3.222 9.220 1.00 0.00 H new ATOM 0 HH12 ARG A 188 -2.078 -2.943 10.907 1.00 0.00 H new ATOM 0 HH21 ARG A 188 -4.564 -5.050 12.172 1.00 0.00 H new ATOM 0 HH22 ARG A 188 -3.222 -3.969 12.564 1.00 0.00 H new ATOM 723 N ALA A 189 -4.398 -2.522 4.008 1.00 0.00 N ATOM 724 CA ALA A 189 -5.207 -1.318 3.678 1.00 0.00 C ATOM 725 C ALA A 189 -6.008 -1.596 2.406 1.00 0.00 C ATOM 726 O ALA A 189 -6.966 -0.913 2.099 1.00 0.00 O ATOM 727 CB ALA A 189 -4.280 -0.123 3.455 1.00 0.00 C ATOM 0 H ALA A 189 -3.408 -2.459 3.769 1.00 0.00 H new ATOM 0 HA ALA A 189 -5.887 -1.091 4.499 1.00 0.00 H new ATOM 0 HB1 ALA A 189 -4.874 0.758 3.213 1.00 0.00 H new ATOM 0 HB2 ALA A 189 -3.704 0.065 4.361 1.00 0.00 H new ATOM 0 HB3 ALA A 189 -3.600 -0.339 2.631 1.00 0.00 H new ATOM 733 N ALA A 190 -5.629 -2.605 1.670 1.00 0.00 N ATOM 734 CA ALA A 190 -6.370 -2.945 0.424 1.00 0.00 C ATOM 735 C ALA A 190 -7.459 -3.967 0.754 1.00 0.00 C ATOM 736 O ALA A 190 -8.189 -4.413 -0.109 1.00 0.00 O ATOM 737 CB ALA A 190 -5.403 -3.540 -0.604 1.00 0.00 C ATOM 0 H ALA A 190 -4.835 -3.210 1.880 1.00 0.00 H new ATOM 0 HA ALA A 190 -6.823 -2.045 0.009 1.00 0.00 H new ATOM 0 HB1 ALA A 190 -5.948 -3.788 -1.515 1.00 0.00 H new ATOM 0 HB2 ALA A 190 -4.624 -2.813 -0.834 1.00 0.00 H new ATOM 0 HB3 ALA A 190 -4.948 -4.443 -0.196 1.00 0.00 H new ATOM 743 N PHE A 191 -7.575 -4.337 2.001 1.00 0.00 N ATOM 744 CA PHE A 191 -8.616 -5.323 2.399 1.00 0.00 C ATOM 745 C PHE A 191 -9.618 -4.633 3.320 1.00 0.00 C ATOM 746 O PHE A 191 -10.807 -4.873 3.256 1.00 0.00 O ATOM 747 CB PHE A 191 -7.956 -6.492 3.133 1.00 0.00 C ATOM 748 CG PHE A 191 -8.637 -7.781 2.746 1.00 0.00 C ATOM 749 CD1 PHE A 191 -8.332 -8.392 1.524 1.00 0.00 C ATOM 750 CD2 PHE A 191 -9.574 -8.366 3.610 1.00 0.00 C ATOM 751 CE1 PHE A 191 -8.964 -9.590 1.163 1.00 0.00 C ATOM 752 CE2 PHE A 191 -10.205 -9.563 3.248 1.00 0.00 C ATOM 753 CZ PHE A 191 -9.900 -10.175 2.025 1.00 0.00 C ATOM 0 H PHE A 191 -6.990 -3.996 2.764 1.00 0.00 H new ATOM 0 HA PHE A 191 -9.129 -5.703 1.516 1.00 0.00 H new ATOM 0 HB2 PHE A 191 -6.896 -6.540 2.883 1.00 0.00 H new ATOM 0 HB3 PHE A 191 -8.023 -6.343 4.211 1.00 0.00 H new ATOM 0 HD1 PHE A 191 -7.610 -7.941 0.860 1.00 0.00 H new ATOM 0 HD2 PHE A 191 -9.809 -7.894 4.553 1.00 0.00 H new ATOM 0 HE1 PHE A 191 -8.729 -10.062 0.220 1.00 0.00 H new ATOM 0 HE2 PHE A 191 -10.927 -10.015 3.912 1.00 0.00 H new ATOM 0 HZ PHE A 191 -10.387 -11.098 1.747 1.00 0.00 H new ATOM 763 N ARG A 192 -9.143 -3.766 4.167 1.00 0.00 N ATOM 764 CA ARG A 192 -10.059 -3.036 5.085 1.00 0.00 C ATOM 765 C ARG A 192 -10.680 -1.873 4.319 1.00 0.00 C ATOM 766 O ARG A 192 -11.849 -1.569 4.458 1.00 0.00 O ATOM 767 CB ARG A 192 -9.264 -2.497 6.274 1.00 0.00 C ATOM 768 CG ARG A 192 -8.569 -3.656 6.989 1.00 0.00 C ATOM 769 CD ARG A 192 -9.618 -4.663 7.460 1.00 0.00 C ATOM 770 NE ARG A 192 -9.119 -5.369 8.671 1.00 0.00 N ATOM 771 CZ ARG A 192 -8.345 -6.412 8.547 1.00 0.00 C ATOM 772 NH1 ARG A 192 -7.741 -6.647 7.415 1.00 0.00 N ATOM 773 NH2 ARG A 192 -8.177 -7.222 9.556 1.00 0.00 N ATOM 0 H ARG A 192 -8.155 -3.530 4.264 1.00 0.00 H new ATOM 0 HA ARG A 192 -10.838 -3.705 5.450 1.00 0.00 H new ATOM 0 HB2 ARG A 192 -8.526 -1.771 5.933 1.00 0.00 H new ATOM 0 HB3 ARG A 192 -9.928 -1.976 6.963 1.00 0.00 H new ATOM 0 HG2 ARG A 192 -7.860 -4.140 6.317 1.00 0.00 H new ATOM 0 HG3 ARG A 192 -7.998 -3.283 7.840 1.00 0.00 H new ATOM 0 HD2 ARG A 192 -10.554 -4.151 7.684 1.00 0.00 H new ATOM 0 HD3 ARG A 192 -9.829 -5.382 6.668 1.00 0.00 H new ATOM 0 HE ARG A 192 -9.382 -5.037 9.599 1.00 0.00 H new ATOM 0 HH11 ARG A 192 -7.874 -6.015 6.625 1.00 0.00 H new ATOM 0 HH12 ARG A 192 -7.136 -7.463 7.319 1.00 0.00 H new ATOM 0 HH21 ARG A 192 -8.651 -7.040 10.441 1.00 0.00 H new ATOM 0 HH22 ARG A 192 -7.572 -8.038 9.460 1.00 0.00 H new ATOM 787 N MET A 193 -9.899 -1.228 3.502 1.00 0.00 N ATOM 788 CA MET A 193 -10.422 -0.088 2.705 1.00 0.00 C ATOM 789 C MET A 193 -11.283 -0.629 1.564 1.00 0.00 C ATOM 790 O MET A 193 -12.223 0.004 1.128 1.00 0.00 O ATOM 791 CB MET A 193 -9.252 0.705 2.124 1.00 0.00 C ATOM 792 CG MET A 193 -9.784 1.959 1.429 1.00 0.00 C ATOM 793 SD MET A 193 -8.404 2.885 0.714 1.00 0.00 S ATOM 794 CE MET A 193 -7.417 3.025 2.225 1.00 0.00 C ATOM 0 H MET A 193 -8.913 -1.444 3.351 1.00 0.00 H new ATOM 0 HA MET A 193 -11.021 0.562 3.343 1.00 0.00 H new ATOM 0 HB2 MET A 193 -8.557 0.982 2.917 1.00 0.00 H new ATOM 0 HB3 MET A 193 -8.698 0.090 1.415 1.00 0.00 H new ATOM 0 HG2 MET A 193 -10.493 1.682 0.649 1.00 0.00 H new ATOM 0 HG3 MET A 193 -10.323 2.582 2.143 1.00 0.00 H new ATOM 0 HE1 MET A 193 -6.647 3.784 2.087 1.00 0.00 H new ATOM 0 HE2 MET A 193 -8.062 3.309 3.056 1.00 0.00 H new ATOM 0 HE3 MET A 193 -6.947 2.066 2.442 1.00 0.00 H new ATOM 804 N ARG A 194 -10.968 -1.799 1.078 1.00 0.00 N ATOM 805 CA ARG A 194 -11.769 -2.385 -0.033 1.00 0.00 C ATOM 806 C ARG A 194 -12.756 -3.401 0.543 1.00 0.00 C ATOM 807 O ARG A 194 -13.643 -3.875 -0.139 1.00 0.00 O ATOM 808 CB ARG A 194 -10.835 -3.084 -1.022 1.00 0.00 C ATOM 809 CG ARG A 194 -10.637 -2.199 -2.254 1.00 0.00 C ATOM 810 CD ARG A 194 -9.262 -2.474 -2.865 1.00 0.00 C ATOM 811 NE ARG A 194 -8.821 -1.287 -3.650 1.00 0.00 N ATOM 812 CZ ARG A 194 -8.176 -1.449 -4.773 1.00 0.00 C ATOM 813 NH1 ARG A 194 -8.818 -1.818 -5.848 1.00 0.00 N ATOM 814 NH2 ARG A 194 -6.889 -1.243 -4.822 1.00 0.00 N ATOM 0 H ARG A 194 -10.191 -2.374 1.403 1.00 0.00 H new ATOM 0 HA ARG A 194 -12.315 -1.595 -0.549 1.00 0.00 H new ATOM 0 HB2 ARG A 194 -9.874 -3.287 -0.549 1.00 0.00 H new ATOM 0 HB3 ARG A 194 -11.255 -4.046 -1.316 1.00 0.00 H new ATOM 0 HG2 ARG A 194 -11.419 -2.398 -2.987 1.00 0.00 H new ATOM 0 HG3 ARG A 194 -10.720 -1.148 -1.977 1.00 0.00 H new ATOM 0 HD2 ARG A 194 -8.540 -2.692 -2.078 1.00 0.00 H new ATOM 0 HD3 ARG A 194 -9.307 -3.353 -3.509 1.00 0.00 H new ATOM 0 HE ARG A 194 -9.023 -0.347 -3.310 1.00 0.00 H new ATOM 0 HH11 ARG A 194 -9.824 -1.980 -5.811 1.00 0.00 H new ATOM 0 HH12 ARG A 194 -8.313 -1.944 -6.725 1.00 0.00 H new ATOM 0 HH21 ARG A 194 -6.386 -0.955 -3.982 1.00 0.00 H new ATOM 0 HH22 ARG A 194 -6.385 -1.370 -5.700 1.00 0.00 H new ATOM 828 N GLY A 195 -12.609 -3.737 1.794 1.00 0.00 N ATOM 829 CA GLY A 195 -13.536 -4.723 2.417 1.00 0.00 C ATOM 830 C GLY A 195 -13.155 -6.136 1.975 1.00 0.00 C ATOM 831 O GLY A 195 -12.118 -6.354 1.381 1.00 0.00 O ATOM 0 H GLY A 195 -11.886 -3.371 2.413 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -13.489 -4.646 3.503 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -14.564 -4.505 2.126 1.00 0.00 H new ATOM 835 N SER A 196 -13.988 -7.098 2.262 1.00 0.00 N ATOM 836 CA SER A 196 -13.679 -8.499 1.860 1.00 0.00 C ATOM 837 C SER A 196 -13.407 -8.554 0.356 1.00 0.00 C ATOM 838 O SER A 196 -13.930 -7.767 -0.409 1.00 0.00 O ATOM 839 CB SER A 196 -14.870 -9.397 2.195 1.00 0.00 C ATOM 840 OG SER A 196 -14.907 -10.488 1.283 1.00 0.00 O ATOM 0 H SER A 196 -14.870 -6.974 2.758 1.00 0.00 H new ATOM 0 HA SER A 196 -12.797 -8.845 2.399 1.00 0.00 H new ATOM 0 HB2 SER A 196 -14.786 -9.765 3.217 1.00 0.00 H new ATOM 0 HB3 SER A 196 -15.797 -8.827 2.136 1.00 0.00 H new ATOM 0 HG SER A 196 -15.669 -11.067 1.496 1.00 0.00 H new ATOM 846 N ARG A 197 -12.591 -9.477 -0.074 1.00 0.00 N ATOM 847 CA ARG A 197 -12.283 -9.584 -1.528 1.00 0.00 C ATOM 848 C ARG A 197 -11.588 -8.305 -1.997 1.00 0.00 C ATOM 849 O ARG A 197 -12.092 -7.213 -1.824 1.00 0.00 O ATOM 850 CB ARG A 197 -13.582 -9.777 -2.315 1.00 0.00 C ATOM 851 CG ARG A 197 -13.445 -10.994 -3.231 1.00 0.00 C ATOM 852 CD ARG A 197 -14.085 -10.687 -4.586 1.00 0.00 C ATOM 853 NE ARG A 197 -13.406 -11.486 -5.645 1.00 0.00 N ATOM 854 CZ ARG A 197 -13.759 -11.348 -6.893 1.00 0.00 C ATOM 855 NH1 ARG A 197 -13.300 -10.346 -7.594 1.00 0.00 N ATOM 856 NH2 ARG A 197 -14.569 -12.211 -7.439 1.00 0.00 N ATOM 0 H ARG A 197 -12.124 -10.162 0.520 1.00 0.00 H new ATOM 0 HA ARG A 197 -11.627 -10.438 -1.697 1.00 0.00 H new ATOM 0 HB2 ARG A 197 -14.418 -9.916 -1.630 1.00 0.00 H new ATOM 0 HB3 ARG A 197 -13.798 -8.886 -2.905 1.00 0.00 H new ATOM 0 HG2 ARG A 197 -12.393 -11.247 -3.363 1.00 0.00 H new ATOM 0 HG3 ARG A 197 -13.927 -11.860 -2.777 1.00 0.00 H new ATOM 0 HD2 ARG A 197 -15.148 -10.925 -4.561 1.00 0.00 H new ATOM 0 HD3 ARG A 197 -14.002 -9.623 -4.808 1.00 0.00 H new ATOM 0 HE ARG A 197 -12.665 -12.141 -5.394 1.00 0.00 H new ATOM 0 HH11 ARG A 197 -12.666 -9.672 -7.165 1.00 0.00 H new ATOM 0 HH12 ARG A 197 -13.576 -10.238 -8.570 1.00 0.00 H new ATOM 0 HH21 ARG A 197 -14.926 -12.993 -6.890 1.00 0.00 H new ATOM 0 HH22 ARG A 197 -14.846 -12.104 -8.415 1.00 0.00 H new ATOM 870 N ALA A 198 -10.433 -8.431 -2.590 1.00 0.00 N ATOM 871 CA ALA A 198 -9.708 -7.223 -3.070 1.00 0.00 C ATOM 872 C ALA A 198 -8.390 -7.645 -3.721 1.00 0.00 C ATOM 873 O ALA A 198 -7.761 -8.600 -3.310 1.00 0.00 O ATOM 874 CB ALA A 198 -9.421 -6.298 -1.886 1.00 0.00 C ATOM 0 H ALA A 198 -9.961 -9.318 -2.763 1.00 0.00 H new ATOM 0 HA ALA A 198 -10.321 -6.697 -3.801 1.00 0.00 H new ATOM 0 HB1 ALA A 198 -8.890 -5.413 -2.236 1.00 0.00 H new ATOM 0 HB2 ALA A 198 -10.361 -5.998 -1.423 1.00 0.00 H new ATOM 0 HB3 ALA A 198 -8.807 -6.823 -1.154 1.00 0.00 H new ATOM 880 N LEU A 199 -7.969 -6.944 -4.737 1.00 0.00 N ATOM 881 CA LEU A 199 -6.695 -7.310 -5.415 1.00 0.00 C ATOM 882 C LEU A 199 -5.531 -6.566 -4.758 1.00 0.00 C ATOM 883 O LEU A 199 -5.491 -5.352 -4.732 1.00 0.00 O ATOM 884 CB LEU A 199 -6.776 -6.924 -6.893 1.00 0.00 C ATOM 885 CG LEU A 199 -6.657 -8.182 -7.756 1.00 0.00 C ATOM 886 CD1 LEU A 199 -8.019 -8.509 -8.370 1.00 0.00 C ATOM 887 CD2 LEU A 199 -5.639 -7.937 -8.872 1.00 0.00 C ATOM 0 H LEU A 199 -8.452 -6.134 -5.126 1.00 0.00 H new ATOM 0 HA LEU A 199 -6.534 -8.384 -5.326 1.00 0.00 H new ATOM 0 HB2 LEU A 199 -7.720 -6.418 -7.097 1.00 0.00 H new ATOM 0 HB3 LEU A 199 -5.979 -6.223 -7.141 1.00 0.00 H new ATOM 0 HG LEU A 199 -6.327 -9.018 -7.139 1.00 0.00 H new ATOM 0 HD11 LEU A 199 -7.935 -9.405 -8.985 1.00 0.00 H new ATOM 0 HD12 LEU A 199 -8.745 -8.681 -7.575 1.00 0.00 H new ATOM 0 HD13 LEU A 199 -8.349 -7.674 -8.988 1.00 0.00 H new ATOM 0 HD21 LEU A 199 -5.552 -8.832 -9.488 1.00 0.00 H new ATOM 0 HD22 LEU A 199 -5.970 -7.102 -9.489 1.00 0.00 H new ATOM 0 HD23 LEU A 199 -4.669 -7.703 -8.434 1.00 0.00 H new ATOM 899 N LEU A 200 -4.580 -7.287 -4.230 1.00 0.00 N ATOM 900 CA LEU A 200 -3.414 -6.629 -3.578 1.00 0.00 C ATOM 901 C LEU A 200 -2.126 -7.243 -4.125 1.00 0.00 C ATOM 902 O LEU A 200 -2.151 -8.055 -5.029 1.00 0.00 O ATOM 903 CB LEU A 200 -3.459 -6.841 -2.057 1.00 0.00 C ATOM 904 CG LEU A 200 -4.620 -7.763 -1.665 1.00 0.00 C ATOM 905 CD1 LEU A 200 -4.304 -8.437 -0.328 1.00 0.00 C ATOM 906 CD2 LEU A 200 -5.900 -6.938 -1.526 1.00 0.00 C ATOM 0 H LEU A 200 -4.561 -8.307 -4.222 1.00 0.00 H new ATOM 0 HA LEU A 200 -3.447 -5.560 -3.789 1.00 0.00 H new ATOM 0 HB2 LEU A 200 -2.517 -7.272 -1.718 1.00 0.00 H new ATOM 0 HB3 LEU A 200 -3.568 -5.880 -1.555 1.00 0.00 H new ATOM 0 HG LEU A 200 -4.757 -8.523 -2.434 1.00 0.00 H new ATOM 0 HD11 LEU A 200 -5.128 -9.093 -0.047 1.00 0.00 H new ATOM 0 HD12 LEU A 200 -3.390 -9.023 -0.423 1.00 0.00 H new ATOM 0 HD13 LEU A 200 -4.169 -7.676 0.440 1.00 0.00 H new ATOM 0 HD21 LEU A 200 -6.726 -7.592 -1.247 1.00 0.00 H new ATOM 0 HD22 LEU A 200 -5.762 -6.179 -0.755 1.00 0.00 H new ATOM 0 HD23 LEU A 200 -6.125 -6.453 -2.476 1.00 0.00 H new ATOM 918 N ASN A 201 -1.000 -6.880 -3.574 1.00 0.00 N ATOM 919 CA ASN A 201 0.279 -7.469 -4.062 1.00 0.00 C ATOM 920 C ASN A 201 0.373 -8.899 -3.536 1.00 0.00 C ATOM 921 O ASN A 201 0.856 -9.791 -4.204 1.00 0.00 O ATOM 922 CB ASN A 201 1.482 -6.658 -3.560 1.00 0.00 C ATOM 923 CG ASN A 201 1.045 -5.246 -3.161 1.00 0.00 C ATOM 924 OD1 ASN A 201 1.331 -4.807 -1.966 1.00 0.00 O flip ATOM 925 ND2 ASN A 201 0.440 -4.539 -3.942 1.00 0.00 N flip ATOM 0 H ASN A 201 -0.910 -6.207 -2.813 1.00 0.00 H new ATOM 0 HA ASN A 201 0.293 -7.455 -5.152 1.00 0.00 H new ATOM 0 HB2 ASN A 201 1.936 -7.160 -2.706 1.00 0.00 H new ATOM 0 HB3 ASN A 201 2.243 -6.604 -4.339 1.00 0.00 H new ATOM 0 HD21 ASN A 201 0.218 -4.884 -4.876 1.00 0.00 H new ATOM 0 HD22 ASN A 201 0.154 -3.600 -3.664 1.00 0.00 H new ATOM 932 N PHE A 202 -0.105 -9.124 -2.341 1.00 0.00 N ATOM 933 CA PHE A 202 -0.068 -10.495 -1.762 1.00 0.00 C ATOM 934 C PHE A 202 -1.498 -10.918 -1.410 1.00 0.00 C ATOM 935 O PHE A 202 -1.948 -10.712 -0.301 1.00 0.00 O ATOM 936 CB PHE A 202 0.792 -10.503 -0.497 1.00 0.00 C ATOM 937 CG PHE A 202 2.041 -9.693 -0.725 1.00 0.00 C ATOM 938 CD1 PHE A 202 2.683 -9.731 -1.969 1.00 0.00 C ATOM 939 CD2 PHE A 202 2.565 -8.908 0.310 1.00 0.00 C ATOM 940 CE1 PHE A 202 3.847 -8.984 -2.179 1.00 0.00 C ATOM 941 CE2 PHE A 202 3.731 -8.161 0.100 1.00 0.00 C ATOM 942 CZ PHE A 202 4.372 -8.198 -1.145 1.00 0.00 C ATOM 0 H PHE A 202 -0.521 -8.413 -1.740 1.00 0.00 H new ATOM 0 HA PHE A 202 0.361 -11.188 -2.486 1.00 0.00 H new ATOM 0 HB2 PHE A 202 0.228 -10.091 0.340 1.00 0.00 H new ATOM 0 HB3 PHE A 202 1.055 -11.527 -0.231 1.00 0.00 H new ATOM 0 HD1 PHE A 202 2.279 -10.337 -2.766 1.00 0.00 H new ATOM 0 HD2 PHE A 202 2.070 -8.879 1.270 1.00 0.00 H new ATOM 0 HE1 PHE A 202 4.341 -9.013 -3.139 1.00 0.00 H new ATOM 0 HE2 PHE A 202 4.136 -7.556 0.898 1.00 0.00 H new ATOM 0 HZ PHE A 202 5.270 -7.621 -1.308 1.00 0.00 H new ATOM 952 N PRO A 203 -2.172 -11.486 -2.377 1.00 0.00 N ATOM 953 CA PRO A 203 -3.563 -11.941 -2.214 1.00 0.00 C ATOM 954 C PRO A 203 -3.616 -13.254 -1.426 1.00 0.00 C ATOM 955 O PRO A 203 -2.603 -13.871 -1.161 1.00 0.00 O ATOM 956 CB PRO A 203 -4.045 -12.145 -3.653 1.00 0.00 C ATOM 957 CG PRO A 203 -2.776 -12.341 -4.515 1.00 0.00 C ATOM 958 CD PRO A 203 -1.607 -11.731 -3.720 1.00 0.00 C ATOM 0 HA PRO A 203 -4.180 -11.235 -1.658 1.00 0.00 H new ATOM 0 HB2 PRO A 203 -4.700 -13.013 -3.724 1.00 0.00 H new ATOM 0 HB3 PRO A 203 -4.618 -11.284 -3.996 1.00 0.00 H new ATOM 0 HG2 PRO A 203 -2.601 -13.399 -4.712 1.00 0.00 H new ATOM 0 HG3 PRO A 203 -2.885 -11.850 -5.482 1.00 0.00 H new ATOM 0 HD2 PRO A 203 -0.757 -12.412 -3.676 1.00 0.00 H new ATOM 0 HD3 PRO A 203 -1.253 -10.807 -4.178 1.00 0.00 H new