USER MOD reduce.3.24.130724 H: found=0, std=0, add=513, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 514 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 929 THR OG1 : rot 180:sc= 1 USER MOD Set 1.2: A 935 THR OG1 : rot 108:sc= 1.22 USER MOD Single : A 889 LYS NZ :NH3+ -161:sc= -0.0904 (180deg=-0.554) USER MOD Single : A 890 SER OG : rot 180:sc= 0.00323 USER MOD Single : A 894 LYS NZ :NH3+ -161:sc= -0.0816 (180deg=-0.505) USER MOD Single : A 895 ASN : amide:sc= -0.0131 K(o=-0.013,f=-1.3) USER MOD Single : A 900 THR OG1 : rot 180:sc= 0 USER MOD Single : A 901 GLN :FLIP amide:sc= -1.02 F(o=-1.6!,f=-1) USER MOD Single : A 903 THR OG1 : rot 180:sc= 0.00569 USER MOD Single : A 904 SER OG : rot 180:sc= 0 USER MOD Single : A 910 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 912 ASN : amide:sc=-0.00627 X(o=-0.0063,f=-0.0036) USER MOD Single : A 915 SER OG : rot 180:sc= 0 USER MOD Single : A 916 GLN : amide:sc= -0.131 K(o=-0.13,f=-3.7!) USER MOD Single : A 920 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 924 SER OG : rot 180:sc= 0 USER MOD Single : A 925 SER OG : rot 127:sc= 0.728 USER MOD Single : A 927 SER OG : rot 180:sc= -2.35! USER MOD Single : A 928 TYR OH : rot 180:sc= 0 USER MOD Single : A 930 SER OG : rot -14:sc= 0.236 USER MOD Single : A 932 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 934 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 936 THR OG1 : rot 180:sc= 0 USER MOD Single : A 938 TYR OH : rot 180:sc= 0 USER MOD Single : A 941 ASN : amide:sc= -0.17 K(o=-0.17,f=-0.9) USER MOD Single : A 943 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 947 TYR OH : rot 180:sc= 0 USER MOD Single : A 949 LYS NZ :NH3+ 151:sc= -0.818 (180deg=-1.92!) USER MOD Single : A 950 GLN : amide:sc= -0.15 K(o=-0.15,f=-0.8) USER MOD Single : A 951 LYS NZ :NH3+ -169:sc= -0.469 (180deg=-0.672) USER MOD Single : A 953 GLN : amide:sc= -0.395 X(o=-0.39,f=-0.1) USER MOD Single : A 954 CYS SG : rot 53:sc= 0.558 USER MOD ----------------------------------------------------------------- ATOM 83 N LYS A 889 7.199 8.476 9.972 1.00 0.00 N ATOM 84 CA LYS A 889 6.771 8.203 11.336 1.00 0.00 C ATOM 85 C LYS A 889 5.277 8.461 11.487 1.00 0.00 C ATOM 86 O LYS A 889 4.818 9.014 12.489 1.00 0.00 O ATOM 87 CB LYS A 889 7.572 9.040 12.333 1.00 0.00 C ATOM 88 CG LYS A 889 9.018 8.591 12.455 1.00 0.00 C ATOM 89 CD LYS A 889 9.720 9.264 13.618 1.00 0.00 C ATOM 90 CE LYS A 889 11.087 8.652 13.863 1.00 0.00 C ATOM 91 NZ LYS A 889 11.002 7.197 14.168 1.00 0.00 N ATOM 0 HA LYS A 889 6.960 7.151 11.552 1.00 0.00 H new ATOM 0 HB2 LYS A 889 7.546 10.085 12.025 1.00 0.00 H new ATOM 0 HB3 LYS A 889 7.096 8.984 13.312 1.00 0.00 H new ATOM 0 HG2 LYS A 889 9.053 7.509 12.586 1.00 0.00 H new ATOM 0 HG3 LYS A 889 9.548 8.817 11.530 1.00 0.00 H new ATOM 0 HD2 LYS A 889 9.827 10.329 13.414 1.00 0.00 H new ATOM 0 HD3 LYS A 889 9.111 9.171 14.517 1.00 0.00 H new ATOM 0 HE2 LYS A 889 11.714 8.802 12.984 1.00 0.00 H new ATOM 0 HE3 LYS A 889 11.572 9.168 14.692 1.00 0.00 H new ATOM 0 HZ1 LYS A 889 11.879 6.888 14.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 889 10.194 7.021 14.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 889 10.874 6.664 13.284 1.00 0.00 H new ATOM 105 N SER A 890 4.528 8.053 10.477 1.00 0.00 N ATOM 106 CA SER A 890 3.087 8.164 10.497 1.00 0.00 C ATOM 107 C SER A 890 2.461 6.786 10.696 1.00 0.00 C ATOM 108 O SER A 890 2.958 5.791 10.165 1.00 0.00 O ATOM 109 CB SER A 890 2.605 8.788 9.188 1.00 0.00 C ATOM 110 OG SER A 890 3.189 8.130 8.075 1.00 0.00 O ATOM 0 H SER A 890 4.904 7.637 9.625 1.00 0.00 H new ATOM 0 HA SER A 890 2.783 8.804 11.326 1.00 0.00 H new ATOM 0 HB2 SER A 890 1.519 8.723 9.127 1.00 0.00 H new ATOM 0 HB3 SER A 890 2.863 9.847 9.167 1.00 0.00 H new ATOM 0 HG SER A 890 2.868 8.542 7.246 1.00 0.00 H new ATOM 116 N VAL A 891 1.376 6.733 11.449 1.00 0.00 N ATOM 117 CA VAL A 891 0.690 5.479 11.726 1.00 0.00 C ATOM 118 C VAL A 891 -0.779 5.603 11.345 1.00 0.00 C ATOM 119 O VAL A 891 -1.384 6.649 11.557 1.00 0.00 O ATOM 120 CB VAL A 891 0.800 5.094 13.222 1.00 0.00 C ATOM 121 CG1 VAL A 891 0.178 3.728 13.481 1.00 0.00 C ATOM 122 CG2 VAL A 891 2.250 5.120 13.685 1.00 0.00 C ATOM 0 H VAL A 891 0.947 7.550 11.883 1.00 0.00 H new ATOM 0 HA VAL A 891 1.166 4.697 11.134 1.00 0.00 H new ATOM 0 HB VAL A 891 0.245 5.834 13.799 1.00 0.00 H new ATOM 0 HG11 VAL A 891 0.269 3.482 14.539 1.00 0.00 H new ATOM 0 HG12 VAL A 891 -0.876 3.749 13.202 1.00 0.00 H new ATOM 0 HG13 VAL A 891 0.695 2.974 12.887 1.00 0.00 H new ATOM 0 HG21 VAL A 891 2.300 4.846 14.739 1.00 0.00 H new ATOM 0 HG22 VAL A 891 2.832 4.410 13.097 1.00 0.00 H new ATOM 0 HG23 VAL A 891 2.657 6.122 13.551 1.00 0.00 H new ATOM 132 N PHE A 892 -1.351 4.558 10.771 1.00 0.00 N ATOM 133 CA PHE A 892 -2.765 4.572 10.434 1.00 0.00 C ATOM 134 C PHE A 892 -3.584 4.038 11.604 1.00 0.00 C ATOM 135 O PHE A 892 -3.414 2.897 12.032 1.00 0.00 O ATOM 136 CB PHE A 892 -3.036 3.773 9.147 1.00 0.00 C ATOM 137 CG PHE A 892 -2.373 2.420 9.090 1.00 0.00 C ATOM 138 CD1 PHE A 892 -1.065 2.291 8.645 1.00 0.00 C ATOM 139 CD2 PHE A 892 -3.059 1.278 9.470 1.00 0.00 C ATOM 140 CE1 PHE A 892 -0.457 1.051 8.584 1.00 0.00 C ATOM 141 CE2 PHE A 892 -2.456 0.035 9.410 1.00 0.00 C ATOM 142 CZ PHE A 892 -1.154 -0.078 8.967 1.00 0.00 C ATOM 0 H PHE A 892 -0.863 3.695 10.530 1.00 0.00 H new ATOM 0 HA PHE A 892 -3.069 5.601 10.243 1.00 0.00 H new ATOM 0 HB2 PHE A 892 -4.112 3.639 9.039 1.00 0.00 H new ATOM 0 HB3 PHE A 892 -2.701 4.362 8.293 1.00 0.00 H new ATOM 0 HD1 PHE A 892 -0.515 3.170 8.343 1.00 0.00 H new ATOM 0 HD2 PHE A 892 -4.078 1.360 9.818 1.00 0.00 H new ATOM 0 HE1 PHE A 892 0.562 0.965 8.237 1.00 0.00 H new ATOM 0 HE2 PHE A 892 -3.003 -0.846 9.710 1.00 0.00 H new ATOM 0 HZ PHE A 892 -0.681 -1.048 8.920 1.00 0.00 H new ATOM 152 N VAL A 893 -4.469 4.878 12.124 1.00 0.00 N ATOM 153 CA VAL A 893 -5.233 4.534 13.311 1.00 0.00 C ATOM 154 C VAL A 893 -6.625 4.033 12.941 1.00 0.00 C ATOM 155 O VAL A 893 -7.383 4.719 12.236 1.00 0.00 O ATOM 156 CB VAL A 893 -5.343 5.733 14.289 1.00 0.00 C ATOM 157 CG1 VAL A 893 -3.970 6.117 14.817 1.00 0.00 C ATOM 158 CG2 VAL A 893 -6.005 6.935 13.629 1.00 0.00 C ATOM 0 H VAL A 893 -4.674 5.801 11.741 1.00 0.00 H new ATOM 0 HA VAL A 893 -4.694 3.732 13.816 1.00 0.00 H new ATOM 0 HB VAL A 893 -5.971 5.420 15.123 1.00 0.00 H new ATOM 0 HG11 VAL A 893 -4.066 6.960 15.502 1.00 0.00 H new ATOM 0 HG12 VAL A 893 -3.533 5.269 15.344 1.00 0.00 H new ATOM 0 HG13 VAL A 893 -3.325 6.398 13.984 1.00 0.00 H new ATOM 0 HG21 VAL A 893 -6.065 7.756 14.344 1.00 0.00 H new ATOM 0 HG22 VAL A 893 -5.416 7.247 12.767 1.00 0.00 H new ATOM 0 HG23 VAL A 893 -7.009 6.664 13.303 1.00 0.00 H new ATOM 168 N LYS A 894 -6.928 2.807 13.388 1.00 0.00 N ATOM 169 CA LYS A 894 -8.242 2.174 13.198 1.00 0.00 C ATOM 170 C LYS A 894 -8.563 1.978 11.709 1.00 0.00 C ATOM 171 O LYS A 894 -9.638 1.494 11.350 1.00 0.00 O ATOM 172 CB LYS A 894 -9.320 3.034 13.872 1.00 0.00 C ATOM 173 CG LYS A 894 -10.640 2.323 14.112 1.00 0.00 C ATOM 174 CD LYS A 894 -10.509 1.223 15.149 1.00 0.00 C ATOM 175 CE LYS A 894 -11.869 0.655 15.523 1.00 0.00 C ATOM 176 NZ LYS A 894 -12.755 1.686 16.130 1.00 0.00 N ATOM 0 H LYS A 894 -6.264 2.222 13.895 1.00 0.00 H new ATOM 0 HA LYS A 894 -8.221 1.186 13.657 1.00 0.00 H new ATOM 0 HB2 LYS A 894 -8.936 3.391 14.828 1.00 0.00 H new ATOM 0 HB3 LYS A 894 -9.503 3.913 13.254 1.00 0.00 H new ATOM 0 HG2 LYS A 894 -11.387 3.045 14.441 1.00 0.00 H new ATOM 0 HG3 LYS A 894 -10.999 1.898 13.175 1.00 0.00 H new ATOM 0 HD2 LYS A 894 -9.874 0.427 14.760 1.00 0.00 H new ATOM 0 HD3 LYS A 894 -10.019 1.616 16.040 1.00 0.00 H new ATOM 0 HE2 LYS A 894 -12.347 0.244 14.634 1.00 0.00 H new ATOM 0 HE3 LYS A 894 -11.738 -0.169 16.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 894 -13.522 1.219 16.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 894 -12.202 2.280 16.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 894 -13.161 2.280 15.379 1.00 0.00 H new ATOM 190 N ASN A 895 -7.606 2.344 10.860 1.00 0.00 N ATOM 191 CA ASN A 895 -7.801 2.444 9.412 1.00 0.00 C ATOM 192 C ASN A 895 -8.888 3.462 9.096 1.00 0.00 C ATOM 193 O ASN A 895 -9.492 3.436 8.021 1.00 0.00 O ATOM 194 CB ASN A 895 -8.174 1.089 8.798 1.00 0.00 C ATOM 195 CG ASN A 895 -6.998 0.138 8.681 1.00 0.00 C ATOM 196 OD1 ASN A 895 -6.080 0.157 9.498 1.00 0.00 O ATOM 197 ND2 ASN A 895 -7.023 -0.704 7.660 1.00 0.00 N ATOM 0 H ASN A 895 -6.661 2.583 11.160 1.00 0.00 H new ATOM 0 HA ASN A 895 -6.856 2.769 8.975 1.00 0.00 H new ATOM 0 HB2 ASN A 895 -8.949 0.624 9.406 1.00 0.00 H new ATOM 0 HB3 ASN A 895 -8.600 1.252 7.808 1.00 0.00 H new ATOM 0 HD21 ASN A 895 -6.261 -1.370 7.529 1.00 0.00 H new ATOM 0 HD22 ASN A 895 -7.804 -0.687 7.004 1.00 0.00 H new ATOM 204 N VAL A 896 -9.123 4.369 10.035 1.00 0.00 N ATOM 205 CA VAL A 896 -10.059 5.456 9.825 1.00 0.00 C ATOM 206 C VAL A 896 -9.306 6.763 9.624 1.00 0.00 C ATOM 207 O VAL A 896 -9.754 7.657 8.906 1.00 0.00 O ATOM 208 CB VAL A 896 -11.032 5.593 11.015 1.00 0.00 C ATOM 209 CG1 VAL A 896 -12.068 6.669 10.747 1.00 0.00 C ATOM 210 CG2 VAL A 896 -11.705 4.263 11.310 1.00 0.00 C ATOM 0 H VAL A 896 -8.675 4.370 10.951 1.00 0.00 H new ATOM 0 HA VAL A 896 -10.641 5.230 8.931 1.00 0.00 H new ATOM 0 HB VAL A 896 -10.456 5.890 11.892 1.00 0.00 H new ATOM 0 HG11 VAL A 896 -12.742 6.746 11.600 1.00 0.00 H new ATOM 0 HG12 VAL A 896 -11.568 7.625 10.592 1.00 0.00 H new ATOM 0 HG13 VAL A 896 -12.640 6.410 9.856 1.00 0.00 H new ATOM 0 HG21 VAL A 896 -12.387 4.379 12.152 1.00 0.00 H new ATOM 0 HG22 VAL A 896 -12.263 3.935 10.433 1.00 0.00 H new ATOM 0 HG23 VAL A 896 -10.948 3.519 11.557 1.00 0.00 H new ATOM 220 N GLY A 897 -8.145 6.856 10.255 1.00 0.00 N ATOM 221 CA GLY A 897 -7.362 8.068 10.170 1.00 0.00 C ATOM 222 C GLY A 897 -5.883 7.797 10.032 1.00 0.00 C ATOM 223 O GLY A 897 -5.429 6.666 10.220 1.00 0.00 O ATOM 0 H GLY A 897 -7.733 6.115 10.823 1.00 0.00 H new ATOM 0 HA2 GLY A 897 -7.701 8.656 9.317 1.00 0.00 H new ATOM 0 HA3 GLY A 897 -7.535 8.671 11.061 1.00 0.00 H new ATOM 227 N TRP A 898 -5.129 8.835 9.710 1.00 0.00 N ATOM 228 CA TRP A 898 -3.684 8.738 9.637 1.00 0.00 C ATOM 229 C TRP A 898 -3.092 9.663 10.684 1.00 0.00 C ATOM 230 O TRP A 898 -3.519 10.807 10.808 1.00 0.00 O ATOM 231 CB TRP A 898 -3.175 9.142 8.246 1.00 0.00 C ATOM 232 CG TRP A 898 -4.251 9.193 7.198 1.00 0.00 C ATOM 233 CD1 TRP A 898 -5.023 10.271 6.872 1.00 0.00 C ATOM 234 CD2 TRP A 898 -4.674 8.124 6.344 1.00 0.00 C ATOM 235 NE1 TRP A 898 -5.905 9.938 5.875 1.00 0.00 N ATOM 236 CE2 TRP A 898 -5.708 8.626 5.530 1.00 0.00 C ATOM 237 CE3 TRP A 898 -4.281 6.792 6.186 1.00 0.00 C ATOM 238 CZ2 TRP A 898 -6.352 7.844 4.576 1.00 0.00 C ATOM 239 CZ3 TRP A 898 -4.921 6.017 5.238 1.00 0.00 C ATOM 240 CH2 TRP A 898 -5.944 6.545 4.442 1.00 0.00 C ATOM 0 H TRP A 898 -5.499 9.761 9.494 1.00 0.00 H new ATOM 0 HA TRP A 898 -3.382 7.706 9.819 1.00 0.00 H new ATOM 0 HB2 TRP A 898 -2.700 10.121 8.313 1.00 0.00 H new ATOM 0 HB3 TRP A 898 -2.407 8.436 7.931 1.00 0.00 H new ATOM 0 HD1 TRP A 898 -4.950 11.245 7.332 1.00 0.00 H new ATOM 0 HE1 TRP A 898 -6.594 10.564 5.459 1.00 0.00 H new ATOM 0 HE3 TRP A 898 -3.491 6.376 6.794 1.00 0.00 H new ATOM 0 HZ2 TRP A 898 -7.145 8.248 3.964 1.00 0.00 H new ATOM 0 HZ3 TRP A 898 -4.627 4.986 5.109 1.00 0.00 H new ATOM 0 HH2 TRP A 898 -6.421 5.914 3.707 1.00 0.00 H new ATOM 251 N ALA A 899 -2.112 9.190 11.425 1.00 0.00 N ATOM 252 CA ALA A 899 -1.537 9.985 12.490 1.00 0.00 C ATOM 253 C ALA A 899 -0.057 10.233 12.257 1.00 0.00 C ATOM 254 O ALA A 899 0.701 9.314 11.964 1.00 0.00 O ATOM 255 CB ALA A 899 -1.761 9.311 13.835 1.00 0.00 C ATOM 0 H ALA A 899 -1.699 8.264 11.311 1.00 0.00 H new ATOM 0 HA ALA A 899 -2.039 10.952 12.495 1.00 0.00 H new ATOM 0 HB1 ALA A 899 -1.323 9.921 14.625 1.00 0.00 H new ATOM 0 HB2 ALA A 899 -2.831 9.200 14.013 1.00 0.00 H new ATOM 0 HB3 ALA A 899 -1.290 8.328 13.832 1.00 0.00 H new ATOM 261 N THR A 900 0.338 11.482 12.380 1.00 0.00 N ATOM 262 CA THR A 900 1.728 11.870 12.264 1.00 0.00 C ATOM 263 C THR A 900 2.212 12.419 13.601 1.00 0.00 C ATOM 264 O THR A 900 1.587 13.314 14.170 1.00 0.00 O ATOM 265 CB THR A 900 1.904 12.933 11.165 1.00 0.00 C ATOM 266 OG1 THR A 900 1.217 12.512 9.976 1.00 0.00 O ATOM 267 CG2 THR A 900 3.378 13.154 10.850 1.00 0.00 C ATOM 0 H THR A 900 -0.297 12.259 12.564 1.00 0.00 H new ATOM 0 HA THR A 900 2.318 10.995 11.992 1.00 0.00 H new ATOM 0 HB THR A 900 1.484 13.873 11.524 1.00 0.00 H new ATOM 0 HG1 THR A 900 1.328 13.190 9.277 1.00 0.00 H new ATOM 0 HG21 THR A 900 3.474 13.910 10.070 1.00 0.00 H new ATOM 0 HG22 THR A 900 3.895 13.491 11.748 1.00 0.00 H new ATOM 0 HG23 THR A 900 3.821 12.219 10.506 1.00 0.00 H new ATOM 275 N GLN A 901 3.306 11.875 14.109 1.00 0.00 N ATOM 276 CA GLN A 901 3.811 12.274 15.411 1.00 0.00 C ATOM 277 C GLN A 901 4.782 13.436 15.266 1.00 0.00 C ATOM 278 O GLN A 901 5.579 13.481 14.328 1.00 0.00 O ATOM 279 CB GLN A 901 4.497 11.101 16.119 1.00 0.00 C ATOM 280 CG GLN A 901 5.837 10.708 15.514 1.00 0.00 C ATOM 281 CD GLN A 901 6.552 9.644 16.320 1.00 0.00 C ATOM 282 OE1 GLN A 901 7.872 9.727 16.365 1.00 0.00 O flip ATOM 283 NE2 GLN A 901 5.925 8.774 16.922 1.00 0.00 N flip ATOM 0 H GLN A 901 3.860 11.158 13.640 1.00 0.00 H new ATOM 0 HA GLN A 901 2.964 12.591 16.019 1.00 0.00 H new ATOM 0 HB2 GLN A 901 4.646 11.360 17.167 1.00 0.00 H new ATOM 0 HB3 GLN A 901 3.832 10.237 16.095 1.00 0.00 H new ATOM 0 HG2 GLN A 901 5.680 10.345 14.498 1.00 0.00 H new ATOM 0 HG3 GLN A 901 6.472 11.591 15.442 1.00 0.00 H new ATOM 0 HE21 GLN A 901 4.907 8.745 16.861 1.00 0.00 H new ATOM 0 HE22 GLN A 901 6.423 8.082 17.482 1.00 0.00 H new ATOM 292 N LEU A 902 4.681 14.392 16.168 1.00 0.00 N ATOM 293 CA LEU A 902 5.597 15.516 16.190 1.00 0.00 C ATOM 294 C LEU A 902 6.470 15.443 17.435 1.00 0.00 C ATOM 295 O LEU A 902 5.995 15.068 18.508 1.00 0.00 O ATOM 296 CB LEU A 902 4.837 16.849 16.163 1.00 0.00 C ATOM 297 CG LEU A 902 4.120 17.194 14.847 1.00 0.00 C ATOM 298 CD1 LEU A 902 2.906 16.304 14.610 1.00 0.00 C ATOM 299 CD2 LEU A 902 3.697 18.650 14.855 1.00 0.00 C ATOM 0 H LEU A 902 3.970 14.413 16.899 1.00 0.00 H new ATOM 0 HA LEU A 902 6.224 15.464 15.300 1.00 0.00 H new ATOM 0 HB2 LEU A 902 4.097 16.838 16.964 1.00 0.00 H new ATOM 0 HB3 LEU A 902 5.541 17.650 16.390 1.00 0.00 H new ATOM 0 HG LEU A 902 4.823 17.019 14.033 1.00 0.00 H new ATOM 0 HD11 LEU A 902 2.429 16.582 13.670 1.00 0.00 H new ATOM 0 HD12 LEU A 902 3.222 15.262 14.563 1.00 0.00 H new ATOM 0 HD13 LEU A 902 2.197 16.431 15.428 1.00 0.00 H new ATOM 0 HD21 LEU A 902 3.190 18.887 13.920 1.00 0.00 H new ATOM 0 HD22 LEU A 902 3.019 18.827 15.690 1.00 0.00 H new ATOM 0 HD23 LEU A 902 4.577 19.284 14.961 1.00 0.00 H new ATOM 311 N THR A 903 7.738 15.812 17.299 1.00 0.00 N ATOM 312 CA THR A 903 8.669 15.779 18.424 1.00 0.00 C ATOM 313 C THR A 903 8.285 16.808 19.485 1.00 0.00 C ATOM 314 O THR A 903 8.740 16.745 20.629 1.00 0.00 O ATOM 315 CB THR A 903 10.115 16.028 17.954 1.00 0.00 C ATOM 316 OG1 THR A 903 10.158 17.167 17.082 1.00 0.00 O ATOM 317 CG2 THR A 903 10.664 14.806 17.235 1.00 0.00 C ATOM 0 H THR A 903 8.146 16.137 16.423 1.00 0.00 H new ATOM 0 HA THR A 903 8.611 14.784 18.865 1.00 0.00 H new ATOM 0 HB THR A 903 10.734 16.222 18.830 1.00 0.00 H new ATOM 0 HG1 THR A 903 11.081 17.320 16.789 1.00 0.00 H new ATOM 0 HG21 THR A 903 11.686 15.003 16.911 1.00 0.00 H new ATOM 0 HG22 THR A 903 10.656 13.952 17.912 1.00 0.00 H new ATOM 0 HG23 THR A 903 10.044 14.586 16.366 1.00 0.00 H new ATOM 325 N SER A 904 7.418 17.735 19.103 1.00 0.00 N ATOM 326 CA SER A 904 6.954 18.773 20.005 1.00 0.00 C ATOM 327 C SER A 904 5.865 18.239 20.941 1.00 0.00 C ATOM 328 O SER A 904 5.341 18.968 21.783 1.00 0.00 O ATOM 329 CB SER A 904 6.418 19.943 19.183 1.00 0.00 C ATOM 330 OG SER A 904 7.287 20.235 18.098 1.00 0.00 O ATOM 0 H SER A 904 7.020 17.787 18.165 1.00 0.00 H new ATOM 0 HA SER A 904 7.788 19.107 20.622 1.00 0.00 H new ATOM 0 HB2 SER A 904 5.424 19.703 18.805 1.00 0.00 H new ATOM 0 HB3 SER A 904 6.313 20.822 19.818 1.00 0.00 H new ATOM 0 HG SER A 904 6.926 20.986 17.582 1.00 0.00 H new ATOM 336 N GLY A 905 5.534 16.960 20.791 1.00 0.00 N ATOM 337 CA GLY A 905 4.555 16.332 21.658 1.00 0.00 C ATOM 338 C GLY A 905 3.153 16.388 21.089 1.00 0.00 C ATOM 339 O GLY A 905 2.195 15.976 21.736 1.00 0.00 O ATOM 0 H GLY A 905 5.929 16.345 20.080 1.00 0.00 H new ATOM 0 HA2 GLY A 905 4.835 15.292 21.823 1.00 0.00 H new ATOM 0 HA3 GLY A 905 4.568 16.823 22.631 1.00 0.00 H new ATOM 343 N ALA A 906 3.030 16.910 19.881 1.00 0.00 N ATOM 344 CA ALA A 906 1.754 16.953 19.200 1.00 0.00 C ATOM 345 C ALA A 906 1.599 15.729 18.317 1.00 0.00 C ATOM 346 O ALA A 906 2.567 15.268 17.714 1.00 0.00 O ATOM 347 CB ALA A 906 1.634 18.226 18.376 1.00 0.00 C ATOM 0 H ALA A 906 3.804 17.311 19.352 1.00 0.00 H new ATOM 0 HA ALA A 906 0.957 16.953 19.943 1.00 0.00 H new ATOM 0 HB1 ALA A 906 0.669 18.242 17.870 1.00 0.00 H new ATOM 0 HB2 ALA A 906 1.715 19.093 19.032 1.00 0.00 H new ATOM 0 HB3 ALA A 906 2.432 18.256 17.635 1.00 0.00 H new ATOM 353 N VAL A 907 0.405 15.186 18.260 1.00 0.00 N ATOM 354 CA VAL A 907 0.113 14.133 17.314 1.00 0.00 C ATOM 355 C VAL A 907 -0.994 14.590 16.373 1.00 0.00 C ATOM 356 O VAL A 907 -2.083 14.982 16.802 1.00 0.00 O ATOM 357 CB VAL A 907 -0.254 12.802 18.020 1.00 0.00 C ATOM 358 CG1 VAL A 907 -1.351 13.007 19.051 1.00 0.00 C ATOM 359 CG2 VAL A 907 -0.665 11.744 17.006 1.00 0.00 C ATOM 0 H VAL A 907 -0.378 15.455 18.856 1.00 0.00 H new ATOM 0 HA VAL A 907 1.013 13.932 16.733 1.00 0.00 H new ATOM 0 HB VAL A 907 0.636 12.451 18.542 1.00 0.00 H new ATOM 0 HG11 VAL A 907 -1.585 12.055 19.528 1.00 0.00 H new ATOM 0 HG12 VAL A 907 -1.013 13.717 19.806 1.00 0.00 H new ATOM 0 HG13 VAL A 907 -2.243 13.396 18.560 1.00 0.00 H new ATOM 0 HG21 VAL A 907 -0.917 10.820 17.526 1.00 0.00 H new ATOM 0 HG22 VAL A 907 -1.532 12.094 16.446 1.00 0.00 H new ATOM 0 HG23 VAL A 907 0.160 11.559 16.318 1.00 0.00 H new ATOM 369 N TRP A 908 -0.696 14.569 15.091 1.00 0.00 N ATOM 370 CA TRP A 908 -1.629 15.029 14.083 1.00 0.00 C ATOM 371 C TRP A 908 -2.360 13.837 13.493 1.00 0.00 C ATOM 372 O TRP A 908 -1.752 13.004 12.831 1.00 0.00 O ATOM 373 CB TRP A 908 -0.863 15.776 12.984 1.00 0.00 C ATOM 374 CG TRP A 908 -1.732 16.516 12.013 1.00 0.00 C ATOM 375 CD1 TRP A 908 -2.518 15.979 11.034 1.00 0.00 C ATOM 376 CD2 TRP A 908 -1.878 17.936 11.912 1.00 0.00 C ATOM 377 NE1 TRP A 908 -3.157 16.978 10.343 1.00 0.00 N ATOM 378 CE2 TRP A 908 -2.777 18.189 10.860 1.00 0.00 C ATOM 379 CE3 TRP A 908 -1.337 19.018 12.612 1.00 0.00 C ATOM 380 CZ2 TRP A 908 -3.148 19.481 10.493 1.00 0.00 C ATOM 381 CZ3 TRP A 908 -1.702 20.300 12.245 1.00 0.00 C ATOM 382 CH2 TRP A 908 -2.600 20.521 11.194 1.00 0.00 C ATOM 0 H TRP A 908 0.193 14.235 14.720 1.00 0.00 H new ATOM 0 HA TRP A 908 -2.356 15.705 14.533 1.00 0.00 H new ATOM 0 HB2 TRP A 908 -0.179 16.484 13.452 1.00 0.00 H new ATOM 0 HB3 TRP A 908 -0.253 15.060 12.433 1.00 0.00 H new ATOM 0 HD1 TRP A 908 -2.622 14.923 10.833 1.00 0.00 H new ATOM 0 HE1 TRP A 908 -3.809 16.841 9.570 1.00 0.00 H new ATOM 0 HE3 TRP A 908 -0.646 18.855 13.426 1.00 0.00 H new ATOM 0 HZ2 TRP A 908 -3.843 19.655 9.685 1.00 0.00 H new ATOM 0 HZ3 TRP A 908 -1.288 21.144 12.777 1.00 0.00 H new ATOM 0 HH2 TRP A 908 -2.866 21.534 10.931 1.00 0.00 H new ATOM 393 N VAL A 909 -3.656 13.753 13.725 1.00 0.00 N ATOM 394 CA VAL A 909 -4.440 12.665 13.175 1.00 0.00 C ATOM 395 C VAL A 909 -5.451 13.197 12.166 1.00 0.00 C ATOM 396 O VAL A 909 -6.343 13.966 12.497 1.00 0.00 O ATOM 397 CB VAL A 909 -5.144 11.843 14.285 1.00 0.00 C ATOM 398 CG1 VAL A 909 -5.930 12.738 15.232 1.00 0.00 C ATOM 399 CG2 VAL A 909 -6.044 10.779 13.679 1.00 0.00 C ATOM 0 H VAL A 909 -4.185 14.420 14.287 1.00 0.00 H new ATOM 0 HA VAL A 909 -3.756 11.990 12.661 1.00 0.00 H new ATOM 0 HB VAL A 909 -4.368 11.347 14.869 1.00 0.00 H new ATOM 0 HG11 VAL A 909 -6.410 12.127 15.996 1.00 0.00 H new ATOM 0 HG12 VAL A 909 -5.253 13.448 15.707 1.00 0.00 H new ATOM 0 HG13 VAL A 909 -6.691 13.281 14.672 1.00 0.00 H new ATOM 0 HG21 VAL A 909 -6.528 10.214 14.476 1.00 0.00 H new ATOM 0 HG22 VAL A 909 -6.804 11.255 13.059 1.00 0.00 H new ATOM 0 HG23 VAL A 909 -5.447 10.103 13.067 1.00 0.00 H new ATOM 409 N GLN A 910 -5.292 12.782 10.930 1.00 0.00 N ATOM 410 CA GLN A 910 -6.162 13.226 9.856 1.00 0.00 C ATOM 411 C GLN A 910 -7.230 12.177 9.585 1.00 0.00 C ATOM 412 O GLN A 910 -6.963 10.979 9.646 1.00 0.00 O ATOM 413 CB GLN A 910 -5.337 13.497 8.594 1.00 0.00 C ATOM 414 CG GLN A 910 -6.131 14.111 7.452 1.00 0.00 C ATOM 415 CD GLN A 910 -5.277 14.386 6.229 1.00 0.00 C ATOM 416 OE1 GLN A 910 -4.080 14.662 6.337 1.00 0.00 O ATOM 417 NE2 GLN A 910 -5.884 14.312 5.058 1.00 0.00 N ATOM 0 H GLN A 910 -4.562 12.132 10.638 1.00 0.00 H new ATOM 0 HA GLN A 910 -6.655 14.152 10.153 1.00 0.00 H new ATOM 0 HB2 GLN A 910 -4.513 14.163 8.848 1.00 0.00 H new ATOM 0 HB3 GLN A 910 -4.896 12.560 8.253 1.00 0.00 H new ATOM 0 HG2 GLN A 910 -6.945 13.440 7.179 1.00 0.00 H new ATOM 0 HG3 GLN A 910 -6.586 15.042 7.790 1.00 0.00 H new ATOM 0 HE21 GLN A 910 -6.876 14.081 5.012 1.00 0.00 H new ATOM 0 HE22 GLN A 910 -5.360 14.486 4.200 1.00 0.00 H new ATOM 426 N PHE A 911 -8.429 12.636 9.282 1.00 0.00 N ATOM 427 CA PHE A 911 -9.562 11.761 9.055 1.00 0.00 C ATOM 428 C PHE A 911 -9.661 11.423 7.569 1.00 0.00 C ATOM 429 O PHE A 911 -9.253 12.217 6.716 1.00 0.00 O ATOM 430 CB PHE A 911 -10.843 12.447 9.541 1.00 0.00 C ATOM 431 CG PHE A 911 -12.029 11.533 9.660 1.00 0.00 C ATOM 432 CD1 PHE A 911 -12.138 10.657 10.725 1.00 0.00 C ATOM 433 CD2 PHE A 911 -13.035 11.555 8.712 1.00 0.00 C ATOM 434 CE1 PHE A 911 -13.229 9.820 10.839 1.00 0.00 C ATOM 435 CE2 PHE A 911 -14.130 10.720 8.821 1.00 0.00 C ATOM 436 CZ PHE A 911 -14.227 9.851 9.885 1.00 0.00 C ATOM 0 H PHE A 911 -8.645 13.628 9.186 1.00 0.00 H new ATOM 0 HA PHE A 911 -9.429 10.834 9.613 1.00 0.00 H new ATOM 0 HB2 PHE A 911 -10.651 12.902 10.513 1.00 0.00 H new ATOM 0 HB3 PHE A 911 -11.091 13.256 8.854 1.00 0.00 H new ATOM 0 HD1 PHE A 911 -11.361 10.628 11.475 1.00 0.00 H new ATOM 0 HD2 PHE A 911 -12.964 12.234 7.875 1.00 0.00 H new ATOM 0 HE1 PHE A 911 -13.303 9.140 11.675 1.00 0.00 H new ATOM 0 HE2 PHE A 911 -14.909 10.749 8.073 1.00 0.00 H new ATOM 0 HZ PHE A 911 -15.081 9.196 9.973 1.00 0.00 H new ATOM 446 N ASN A 912 -10.211 10.255 7.260 1.00 0.00 N ATOM 447 CA ASN A 912 -10.289 9.774 5.882 1.00 0.00 C ATOM 448 C ASN A 912 -11.173 10.671 5.009 1.00 0.00 C ATOM 449 O ASN A 912 -11.012 10.707 3.789 1.00 0.00 O ATOM 450 CB ASN A 912 -10.809 8.330 5.856 1.00 0.00 C ATOM 451 CG ASN A 912 -12.260 8.212 6.295 1.00 0.00 C ATOM 452 OD1 ASN A 912 -12.554 8.125 7.485 1.00 0.00 O ATOM 453 ND2 ASN A 912 -13.171 8.179 5.335 1.00 0.00 N ATOM 0 H ASN A 912 -10.613 9.618 7.948 1.00 0.00 H new ATOM 0 HA ASN A 912 -9.282 9.805 5.466 1.00 0.00 H new ATOM 0 HB2 ASN A 912 -10.707 7.931 4.847 1.00 0.00 H new ATOM 0 HB3 ASN A 912 -10.187 7.714 6.506 1.00 0.00 H new ATOM 0 HD21 ASN A 912 -14.158 8.078 5.572 1.00 0.00 H new ATOM 0 HD22 ASN A 912 -12.886 8.254 4.359 1.00 0.00 H new ATOM 460 N ASP A 913 -12.082 11.414 5.634 1.00 0.00 N ATOM 461 CA ASP A 913 -13.040 12.239 4.895 1.00 0.00 C ATOM 462 C ASP A 913 -12.434 13.595 4.508 1.00 0.00 C ATOM 463 O ASP A 913 -13.090 14.426 3.878 1.00 0.00 O ATOM 464 CB ASP A 913 -14.305 12.441 5.738 1.00 0.00 C ATOM 465 CG ASP A 913 -15.430 13.122 4.981 1.00 0.00 C ATOM 466 OD1 ASP A 913 -16.048 12.475 4.112 1.00 0.00 O ATOM 467 OD2 ASP A 913 -15.718 14.300 5.262 1.00 0.00 O ATOM 0 H ASP A 913 -12.177 11.464 6.648 1.00 0.00 H new ATOM 0 HA ASP A 913 -13.298 11.719 3.972 1.00 0.00 H new ATOM 0 HB2 ASP A 913 -14.652 11.472 6.097 1.00 0.00 H new ATOM 0 HB3 ASP A 913 -14.056 13.036 6.617 1.00 0.00 H new ATOM 472 N GLY A 914 -11.167 13.798 4.844 1.00 0.00 N ATOM 473 CA GLY A 914 -10.491 15.037 4.485 1.00 0.00 C ATOM 474 C GLY A 914 -10.490 16.062 5.601 1.00 0.00 C ATOM 475 O GLY A 914 -10.065 17.198 5.408 1.00 0.00 O ATOM 0 H GLY A 914 -10.593 13.130 5.358 1.00 0.00 H new ATOM 0 HA2 GLY A 914 -9.462 14.814 4.205 1.00 0.00 H new ATOM 0 HA3 GLY A 914 -10.974 15.466 3.607 1.00 0.00 H new ATOM 479 N SER A 915 -10.966 15.663 6.766 1.00 0.00 N ATOM 480 CA SER A 915 -10.893 16.510 7.947 1.00 0.00 C ATOM 481 C SER A 915 -9.652 16.129 8.746 1.00 0.00 C ATOM 482 O SER A 915 -9.136 15.030 8.578 1.00 0.00 O ATOM 483 CB SER A 915 -12.155 16.337 8.795 1.00 0.00 C ATOM 484 OG SER A 915 -13.324 16.568 8.024 1.00 0.00 O ATOM 0 H SER A 915 -11.408 14.757 6.922 1.00 0.00 H new ATOM 0 HA SER A 915 -10.826 17.557 7.652 1.00 0.00 H new ATOM 0 HB2 SER A 915 -12.183 15.330 9.210 1.00 0.00 H new ATOM 0 HB3 SER A 915 -12.129 17.028 9.637 1.00 0.00 H new ATOM 0 HG SER A 915 -14.117 16.450 8.588 1.00 0.00 H new ATOM 490 N GLN A 916 -9.153 17.011 9.596 1.00 0.00 N ATOM 491 CA GLN A 916 -7.966 16.681 10.373 1.00 0.00 C ATOM 492 C GLN A 916 -8.150 17.038 11.838 1.00 0.00 C ATOM 493 O GLN A 916 -8.954 17.895 12.183 1.00 0.00 O ATOM 494 CB GLN A 916 -6.710 17.361 9.810 1.00 0.00 C ATOM 495 CG GLN A 916 -6.775 18.879 9.762 1.00 0.00 C ATOM 496 CD GLN A 916 -7.229 19.419 8.416 1.00 0.00 C ATOM 497 OE1 GLN A 916 -8.005 18.789 7.703 1.00 0.00 O ATOM 498 NE2 GLN A 916 -6.746 20.601 8.068 1.00 0.00 N ATOM 0 H GLN A 916 -9.539 17.940 9.765 1.00 0.00 H new ATOM 0 HA GLN A 916 -7.825 15.603 10.296 1.00 0.00 H new ATOM 0 HB2 GLN A 916 -5.852 17.067 10.415 1.00 0.00 H new ATOM 0 HB3 GLN A 916 -6.532 16.987 8.802 1.00 0.00 H new ATOM 0 HG2 GLN A 916 -7.457 19.231 10.536 1.00 0.00 H new ATOM 0 HG3 GLN A 916 -5.791 19.285 9.996 1.00 0.00 H new ATOM 0 HE21 GLN A 916 -6.103 21.092 8.689 1.00 0.00 H new ATOM 0 HE22 GLN A 916 -7.017 21.021 7.179 1.00 0.00 H new ATOM 507 N LEU A 917 -7.415 16.356 12.694 1.00 0.00 N ATOM 508 CA LEU A 917 -7.459 16.603 14.124 1.00 0.00 C ATOM 509 C LEU A 917 -6.047 16.790 14.658 1.00 0.00 C ATOM 510 O LEU A 917 -5.120 16.094 14.248 1.00 0.00 O ATOM 511 CB LEU A 917 -8.121 15.440 14.880 1.00 0.00 C ATOM 512 CG LEU A 917 -9.618 15.203 14.628 1.00 0.00 C ATOM 513 CD1 LEU A 917 -9.864 14.580 13.263 1.00 0.00 C ATOM 514 CD2 LEU A 917 -10.189 14.316 15.719 1.00 0.00 C ATOM 0 H LEU A 917 -6.770 15.615 12.419 1.00 0.00 H new ATOM 0 HA LEU A 917 -8.051 17.504 14.283 1.00 0.00 H new ATOM 0 HB2 LEU A 917 -7.586 14.524 14.627 1.00 0.00 H new ATOM 0 HB3 LEU A 917 -7.980 15.607 15.948 1.00 0.00 H new ATOM 0 HG LEU A 917 -10.120 16.170 14.645 1.00 0.00 H new ATOM 0 HD11 LEU A 917 -10.934 14.427 13.120 1.00 0.00 H new ATOM 0 HD12 LEU A 917 -9.486 15.244 12.486 1.00 0.00 H new ATOM 0 HD13 LEU A 917 -9.349 13.621 13.203 1.00 0.00 H new ATOM 0 HD21 LEU A 917 -11.251 14.151 15.535 1.00 0.00 H new ATOM 0 HD22 LEU A 917 -9.668 13.359 15.719 1.00 0.00 H new ATOM 0 HD23 LEU A 917 -10.059 14.800 16.687 1.00 0.00 H new ATOM 526 N VAL A 918 -5.883 17.734 15.563 1.00 0.00 N ATOM 527 CA VAL A 918 -4.605 17.937 16.221 1.00 0.00 C ATOM 528 C VAL A 918 -4.735 17.556 17.687 1.00 0.00 C ATOM 529 O VAL A 918 -5.571 18.104 18.399 1.00 0.00 O ATOM 530 CB VAL A 918 -4.144 19.407 16.121 1.00 0.00 C ATOM 531 CG1 VAL A 918 -2.724 19.565 16.644 1.00 0.00 C ATOM 532 CG2 VAL A 918 -4.254 19.912 14.690 1.00 0.00 C ATOM 0 H VAL A 918 -6.619 18.374 15.861 1.00 0.00 H new ATOM 0 HA VAL A 918 -3.863 17.312 15.725 1.00 0.00 H new ATOM 0 HB VAL A 918 -4.803 20.012 16.744 1.00 0.00 H new ATOM 0 HG11 VAL A 918 -2.421 20.609 16.564 1.00 0.00 H new ATOM 0 HG12 VAL A 918 -2.684 19.255 17.688 1.00 0.00 H new ATOM 0 HG13 VAL A 918 -2.048 18.944 16.055 1.00 0.00 H new ATOM 0 HG21 VAL A 918 -3.924 20.950 14.644 1.00 0.00 H new ATOM 0 HG22 VAL A 918 -3.627 19.302 14.040 1.00 0.00 H new ATOM 0 HG23 VAL A 918 -5.291 19.846 14.360 1.00 0.00 H new ATOM 542 N VAL A 919 -3.924 16.621 18.139 1.00 0.00 N ATOM 543 CA VAL A 919 -3.991 16.174 19.517 1.00 0.00 C ATOM 544 C VAL A 919 -2.690 16.481 20.231 1.00 0.00 C ATOM 545 O VAL A 919 -1.609 16.223 19.707 1.00 0.00 O ATOM 546 CB VAL A 919 -4.280 14.658 19.608 1.00 0.00 C ATOM 547 CG1 VAL A 919 -4.381 14.205 21.059 1.00 0.00 C ATOM 548 CG2 VAL A 919 -5.552 14.311 18.854 1.00 0.00 C ATOM 0 H VAL A 919 -3.212 16.157 17.575 1.00 0.00 H new ATOM 0 HA VAL A 919 -4.810 16.710 19.996 1.00 0.00 H new ATOM 0 HB VAL A 919 -3.446 14.129 19.146 1.00 0.00 H new ATOM 0 HG11 VAL A 919 -4.585 13.135 21.093 1.00 0.00 H new ATOM 0 HG12 VAL A 919 -3.441 14.412 21.571 1.00 0.00 H new ATOM 0 HG13 VAL A 919 -5.189 14.744 21.553 1.00 0.00 H new ATOM 0 HG21 VAL A 919 -5.739 13.240 18.929 1.00 0.00 H new ATOM 0 HG22 VAL A 919 -6.391 14.857 19.285 1.00 0.00 H new ATOM 0 HG23 VAL A 919 -5.440 14.587 17.805 1.00 0.00 H new ATOM 558 N GLN A 920 -2.791 17.054 21.413 1.00 0.00 N ATOM 559 CA GLN A 920 -1.620 17.260 22.236 1.00 0.00 C ATOM 560 C GLN A 920 -1.459 16.062 23.161 1.00 0.00 C ATOM 561 O GLN A 920 -2.452 15.541 23.676 1.00 0.00 O ATOM 562 CB GLN A 920 -1.763 18.551 23.044 1.00 0.00 C ATOM 563 CG GLN A 920 -0.450 19.094 23.574 1.00 0.00 C ATOM 564 CD GLN A 920 -0.627 20.404 24.312 1.00 0.00 C ATOM 565 OE1 GLN A 920 -0.795 20.426 25.531 1.00 0.00 O ATOM 566 NE2 GLN A 920 -0.621 21.504 23.574 1.00 0.00 N ATOM 0 H GLN A 920 -3.666 17.383 21.822 1.00 0.00 H new ATOM 0 HA GLN A 920 -0.735 17.355 21.607 1.00 0.00 H new ATOM 0 HB2 GLN A 920 -2.232 19.310 22.418 1.00 0.00 H new ATOM 0 HB3 GLN A 920 -2.435 18.370 23.883 1.00 0.00 H new ATOM 0 HG2 GLN A 920 0.001 18.361 24.243 1.00 0.00 H new ATOM 0 HG3 GLN A 920 0.243 19.237 22.745 1.00 0.00 H new ATOM 0 HE21 GLN A 920 -0.478 21.441 22.566 1.00 0.00 H new ATOM 0 HE22 GLN A 920 -0.759 22.414 24.014 1.00 0.00 H new ATOM 575 N ALA A 921 -0.223 15.617 23.347 1.00 0.00 N ATOM 576 CA ALA A 921 0.061 14.474 24.211 1.00 0.00 C ATOM 577 C ALA A 921 -0.550 14.659 25.595 1.00 0.00 C ATOM 578 O ALA A 921 -0.361 15.692 26.240 1.00 0.00 O ATOM 579 CB ALA A 921 1.561 14.246 24.323 1.00 0.00 C ATOM 0 H ALA A 921 0.602 16.030 22.911 1.00 0.00 H new ATOM 0 HA ALA A 921 -0.395 13.595 23.756 1.00 0.00 H new ATOM 0 HB1 ALA A 921 1.752 13.390 24.971 1.00 0.00 H new ATOM 0 HB2 ALA A 921 1.974 14.051 23.333 1.00 0.00 H new ATOM 0 HB3 ALA A 921 2.033 15.133 24.745 1.00 0.00 H new ATOM 585 N GLY A 922 -1.286 13.651 26.039 1.00 0.00 N ATOM 586 CA GLY A 922 -1.947 13.719 27.326 1.00 0.00 C ATOM 587 C GLY A 922 -3.400 14.131 27.196 1.00 0.00 C ATOM 588 O GLY A 922 -4.146 14.109 28.177 1.00 0.00 O ATOM 0 H GLY A 922 -1.438 12.782 25.527 1.00 0.00 H new ATOM 0 HA2 GLY A 922 -1.888 12.747 27.816 1.00 0.00 H new ATOM 0 HA3 GLY A 922 -1.424 14.430 27.965 1.00 0.00 H new ATOM 592 N VAL A 923 -3.800 14.489 25.974 1.00 0.00 N ATOM 593 CA VAL A 923 -5.172 14.913 25.682 1.00 0.00 C ATOM 594 C VAL A 923 -5.523 16.172 26.486 1.00 0.00 C ATOM 595 O VAL A 923 -6.669 16.399 26.870 1.00 0.00 O ATOM 596 CB VAL A 923 -6.192 13.775 25.963 1.00 0.00 C ATOM 597 CG1 VAL A 923 -7.576 14.117 25.418 1.00 0.00 C ATOM 598 CG2 VAL A 923 -5.706 12.469 25.356 1.00 0.00 C ATOM 0 H VAL A 923 -3.184 14.493 25.161 1.00 0.00 H new ATOM 0 HA VAL A 923 -5.232 15.149 24.620 1.00 0.00 H new ATOM 0 HB VAL A 923 -6.272 13.663 27.044 1.00 0.00 H new ATOM 0 HG11 VAL A 923 -8.264 13.299 25.632 1.00 0.00 H new ATOM 0 HG12 VAL A 923 -7.938 15.029 25.892 1.00 0.00 H new ATOM 0 HG13 VAL A 923 -7.516 14.267 24.340 1.00 0.00 H new ATOM 0 HG21 VAL A 923 -6.430 11.681 25.561 1.00 0.00 H new ATOM 0 HG22 VAL A 923 -5.594 12.588 24.278 1.00 0.00 H new ATOM 0 HG23 VAL A 923 -4.744 12.200 25.793 1.00 0.00 H new ATOM 608 N SER A 924 -4.517 17.003 26.713 1.00 0.00 N ATOM 609 CA SER A 924 -4.708 18.268 27.407 1.00 0.00 C ATOM 610 C SER A 924 -5.431 19.266 26.505 1.00 0.00 C ATOM 611 O SER A 924 -5.943 20.287 26.965 1.00 0.00 O ATOM 612 CB SER A 924 -3.349 18.822 27.832 1.00 0.00 C ATOM 613 OG SER A 924 -2.604 17.842 28.543 1.00 0.00 O ATOM 0 H SER A 924 -3.555 16.823 26.425 1.00 0.00 H new ATOM 0 HA SER A 924 -5.322 18.103 28.292 1.00 0.00 H new ATOM 0 HB2 SER A 924 -2.791 19.142 26.952 1.00 0.00 H new ATOM 0 HB3 SER A 924 -3.490 19.703 28.458 1.00 0.00 H new ATOM 0 HG SER A 924 -1.737 18.216 28.804 1.00 0.00 H new ATOM 619 N SER A 925 -5.474 18.951 25.215 1.00 0.00 N ATOM 620 CA SER A 925 -6.110 19.811 24.232 1.00 0.00 C ATOM 621 C SER A 925 -6.138 19.109 22.880 1.00 0.00 C ATOM 622 O SER A 925 -5.104 18.641 22.394 1.00 0.00 O ATOM 623 CB SER A 925 -5.354 21.146 24.127 1.00 0.00 C ATOM 624 OG SER A 925 -6.033 22.075 23.290 1.00 0.00 O ATOM 0 H SER A 925 -5.071 18.098 24.826 1.00 0.00 H new ATOM 0 HA SER A 925 -7.133 20.018 24.545 1.00 0.00 H new ATOM 0 HB2 SER A 925 -5.233 21.574 25.122 1.00 0.00 H new ATOM 0 HB3 SER A 925 -4.353 20.967 23.734 1.00 0.00 H new ATOM 0 HG SER A 925 -6.160 22.918 23.773 1.00 0.00 H new ATOM 630 N ILE A 926 -7.321 19.002 22.293 1.00 0.00 N ATOM 631 CA ILE A 926 -7.458 18.421 20.967 1.00 0.00 C ATOM 632 C ILE A 926 -8.177 19.399 20.048 1.00 0.00 C ATOM 633 O ILE A 926 -9.066 20.124 20.477 1.00 0.00 O ATOM 634 CB ILE A 926 -8.213 17.059 20.971 1.00 0.00 C ATOM 635 CG1 ILE A 926 -9.642 17.191 21.534 1.00 0.00 C ATOM 636 CG2 ILE A 926 -7.426 16.017 21.752 1.00 0.00 C ATOM 637 CD1 ILE A 926 -9.723 17.319 23.047 1.00 0.00 C ATOM 0 H ILE A 926 -8.198 19.309 22.714 1.00 0.00 H new ATOM 0 HA ILE A 926 -6.449 18.225 20.604 1.00 0.00 H new ATOM 0 HB ILE A 926 -8.302 16.733 19.935 1.00 0.00 H new ATOM 0 HG12 ILE A 926 -10.115 18.064 21.084 1.00 0.00 H new ATOM 0 HG13 ILE A 926 -10.221 16.320 21.226 1.00 0.00 H new ATOM 0 HG21 ILE A 926 -7.968 15.071 21.745 1.00 0.00 H new ATOM 0 HG22 ILE A 926 -6.448 15.879 21.291 1.00 0.00 H new ATOM 0 HG23 ILE A 926 -7.298 16.354 22.781 1.00 0.00 H new ATOM 0 HD11 ILE A 926 -10.767 17.407 23.349 1.00 0.00 H new ATOM 0 HD12 ILE A 926 -9.284 16.436 23.511 1.00 0.00 H new ATOM 0 HD13 ILE A 926 -9.177 18.206 23.367 1.00 0.00 H new ATOM 649 N SER A 927 -7.782 19.424 18.794 1.00 0.00 N ATOM 650 CA SER A 927 -8.358 20.338 17.829 1.00 0.00 C ATOM 651 C SER A 927 -9.024 19.571 16.696 1.00 0.00 C ATOM 652 O SER A 927 -8.377 18.774 16.021 1.00 0.00 O ATOM 653 CB SER A 927 -7.263 21.252 17.280 1.00 0.00 C ATOM 654 OG SER A 927 -6.497 21.802 18.338 1.00 0.00 O ATOM 0 H SER A 927 -7.057 18.815 18.415 1.00 0.00 H new ATOM 0 HA SER A 927 -9.120 20.943 18.322 1.00 0.00 H new ATOM 0 HB2 SER A 927 -6.615 20.689 16.608 1.00 0.00 H new ATOM 0 HB3 SER A 927 -7.711 22.054 16.693 1.00 0.00 H new ATOM 0 HG SER A 927 -5.799 22.383 17.969 1.00 0.00 H new ATOM 660 N TYR A 928 -10.306 19.801 16.486 1.00 0.00 N ATOM 661 CA TYR A 928 -10.985 19.202 15.355 1.00 0.00 C ATOM 662 C TYR A 928 -11.017 20.215 14.222 1.00 0.00 C ATOM 663 O TYR A 928 -11.510 21.330 14.389 1.00 0.00 O ATOM 664 CB TYR A 928 -12.406 18.786 15.749 1.00 0.00 C ATOM 665 CG TYR A 928 -13.174 18.076 14.657 1.00 0.00 C ATOM 666 CD1 TYR A 928 -13.049 16.705 14.471 1.00 0.00 C ATOM 667 CD2 TYR A 928 -14.035 18.775 13.819 1.00 0.00 C ATOM 668 CE1 TYR A 928 -13.755 16.052 13.480 1.00 0.00 C ATOM 669 CE2 TYR A 928 -14.748 18.128 12.828 1.00 0.00 C ATOM 670 CZ TYR A 928 -14.603 16.767 12.662 1.00 0.00 C ATOM 671 OH TYR A 928 -15.315 16.117 11.680 1.00 0.00 O ATOM 0 H TYR A 928 -10.892 20.391 17.076 1.00 0.00 H new ATOM 0 HA TYR A 928 -10.454 18.307 15.031 1.00 0.00 H new ATOM 0 HB2 TYR A 928 -12.352 18.134 16.621 1.00 0.00 H new ATOM 0 HB3 TYR A 928 -12.962 19.674 16.049 1.00 0.00 H new ATOM 0 HD1 TYR A 928 -12.388 16.140 15.112 1.00 0.00 H new ATOM 0 HD2 TYR A 928 -14.149 19.842 13.945 1.00 0.00 H new ATOM 0 HE1 TYR A 928 -13.643 14.986 13.347 1.00 0.00 H new ATOM 0 HE2 TYR A 928 -15.415 18.685 12.187 1.00 0.00 H new ATOM 0 HH TYR A 928 -15.866 16.764 11.193 1.00 0.00 H new ATOM 681 N THR A 929 -10.498 19.828 13.074 1.00 0.00 N ATOM 682 CA THR A 929 -10.403 20.732 11.948 1.00 0.00 C ATOM 683 C THR A 929 -11.263 20.271 10.783 1.00 0.00 C ATOM 684 O THR A 929 -11.109 19.152 10.281 1.00 0.00 O ATOM 685 CB THR A 929 -8.945 20.878 11.478 1.00 0.00 C ATOM 686 OG1 THR A 929 -8.097 21.122 12.611 1.00 0.00 O ATOM 687 CG2 THR A 929 -8.811 22.017 10.475 1.00 0.00 C ATOM 0 H THR A 929 -10.135 18.891 12.897 1.00 0.00 H new ATOM 0 HA THR A 929 -10.770 21.700 12.289 1.00 0.00 H new ATOM 0 HB THR A 929 -8.642 19.953 10.988 1.00 0.00 H new ATOM 0 HG1 THR A 929 -7.169 21.213 12.311 1.00 0.00 H new ATOM 0 HG21 THR A 929 -7.772 22.101 10.157 1.00 0.00 H new ATOM 0 HG22 THR A 929 -9.441 21.815 9.608 1.00 0.00 H new ATOM 0 HG23 THR A 929 -9.125 22.951 10.941 1.00 0.00 H new ATOM 695 N SER A 930 -12.163 21.139 10.366 1.00 0.00 N ATOM 696 CA SER A 930 -12.921 20.942 9.153 1.00 0.00 C ATOM 697 C SER A 930 -12.752 22.174 8.271 1.00 0.00 C ATOM 698 O SER A 930 -13.341 23.219 8.548 1.00 0.00 O ATOM 699 CB SER A 930 -14.399 20.685 9.477 1.00 0.00 C ATOM 700 OG SER A 930 -14.925 21.673 10.356 1.00 0.00 O ATOM 0 H SER A 930 -12.388 22.002 10.862 1.00 0.00 H new ATOM 0 HA SER A 930 -12.552 20.066 8.620 1.00 0.00 H new ATOM 0 HB2 SER A 930 -14.978 20.675 8.553 1.00 0.00 H new ATOM 0 HB3 SER A 930 -14.506 19.700 9.931 1.00 0.00 H new ATOM 0 HG SER A 930 -14.188 22.182 10.754 1.00 0.00 H new ATOM 706 N PRO A 931 -11.899 22.071 7.234 1.00 0.00 N ATOM 707 CA PRO A 931 -11.532 23.201 6.359 1.00 0.00 C ATOM 708 C PRO A 931 -12.737 23.985 5.845 1.00 0.00 C ATOM 709 O PRO A 931 -12.708 25.215 5.780 1.00 0.00 O ATOM 710 CB PRO A 931 -10.803 22.522 5.199 1.00 0.00 C ATOM 711 CG PRO A 931 -10.221 21.287 5.797 1.00 0.00 C ATOM 712 CD PRO A 931 -11.204 20.828 6.839 1.00 0.00 C ATOM 0 HA PRO A 931 -10.936 23.941 6.893 1.00 0.00 H new ATOM 0 HB2 PRO A 931 -11.487 22.284 4.385 1.00 0.00 H new ATOM 0 HB3 PRO A 931 -10.027 23.167 4.786 1.00 0.00 H new ATOM 0 HG2 PRO A 931 -10.070 20.520 5.038 1.00 0.00 H new ATOM 0 HG3 PRO A 931 -9.247 21.491 6.242 1.00 0.00 H new ATOM 0 HD2 PRO A 931 -11.899 20.091 6.437 1.00 0.00 H new ATOM 0 HD3 PRO A 931 -10.701 20.363 7.687 1.00 0.00 H new ATOM 720 N ASN A 932 -13.790 23.266 5.480 1.00 0.00 N ATOM 721 CA ASN A 932 -15.019 23.883 4.990 1.00 0.00 C ATOM 722 C ASN A 932 -15.674 24.757 6.060 1.00 0.00 C ATOM 723 O ASN A 932 -16.332 25.751 5.747 1.00 0.00 O ATOM 724 CB ASN A 932 -16.001 22.800 4.531 1.00 0.00 C ATOM 725 CG ASN A 932 -17.361 23.359 4.160 1.00 0.00 C ATOM 726 OD1 ASN A 932 -18.252 23.471 5.005 1.00 0.00 O ATOM 727 ND2 ASN A 932 -17.533 23.711 2.897 1.00 0.00 N ATOM 0 H ASN A 932 -13.819 22.247 5.514 1.00 0.00 H new ATOM 0 HA ASN A 932 -14.758 24.522 4.147 1.00 0.00 H new ATOM 0 HB2 ASN A 932 -15.582 22.276 3.672 1.00 0.00 H new ATOM 0 HB3 ASN A 932 -16.120 22.064 5.326 1.00 0.00 H new ATOM 0 HD21 ASN A 932 -18.429 24.091 2.591 1.00 0.00 H new ATOM 0 HD22 ASN A 932 -16.770 23.602 2.229 1.00 0.00 H new ATOM 734 N GLY A 933 -15.478 24.396 7.321 1.00 0.00 N ATOM 735 CA GLY A 933 -16.147 25.092 8.400 1.00 0.00 C ATOM 736 C GLY A 933 -15.191 25.801 9.341 1.00 0.00 C ATOM 737 O GLY A 933 -15.047 27.019 9.275 1.00 0.00 O ATOM 0 H GLY A 933 -14.868 23.634 7.615 1.00 0.00 H new ATOM 0 HA2 GLY A 933 -16.839 25.821 7.979 1.00 0.00 H new ATOM 0 HA3 GLY A 933 -16.743 24.379 8.969 1.00 0.00 H new ATOM 741 N GLN A 934 -14.516 25.035 10.196 1.00 0.00 N ATOM 742 CA GLN A 934 -13.728 25.599 11.297 1.00 0.00 C ATOM 743 C GLN A 934 -12.759 24.570 11.861 1.00 0.00 C ATOM 744 O GLN A 934 -12.994 23.365 11.761 1.00 0.00 O ATOM 745 CB GLN A 934 -14.634 26.044 12.457 1.00 0.00 C ATOM 746 CG GLN A 934 -15.416 27.324 12.228 1.00 0.00 C ATOM 747 CD GLN A 934 -16.271 27.679 13.426 1.00 0.00 C ATOM 748 OE1 GLN A 934 -17.431 27.275 13.521 1.00 0.00 O ATOM 749 NE2 GLN A 934 -15.701 28.426 14.358 1.00 0.00 N ATOM 0 H GLN A 934 -14.498 24.016 10.149 1.00 0.00 H new ATOM 0 HA GLN A 934 -13.187 26.450 10.884 1.00 0.00 H new ATOM 0 HB2 GLN A 934 -15.340 25.242 12.670 1.00 0.00 H new ATOM 0 HB3 GLN A 934 -14.018 26.171 13.347 1.00 0.00 H new ATOM 0 HG2 GLN A 934 -14.725 28.141 12.019 1.00 0.00 H new ATOM 0 HG3 GLN A 934 -16.050 27.211 11.349 1.00 0.00 H new ATOM 0 HE21 GLN A 934 -14.738 28.740 14.241 1.00 0.00 H new ATOM 0 HE22 GLN A 934 -16.225 28.687 15.193 1.00 0.00 H new ATOM 758 N THR A 935 -11.665 25.047 12.434 1.00 0.00 N ATOM 759 CA THR A 935 -10.879 24.229 13.338 1.00 0.00 C ATOM 760 C THR A 935 -11.145 24.697 14.771 1.00 0.00 C ATOM 761 O THR A 935 -11.034 25.887 15.084 1.00 0.00 O ATOM 762 CB THR A 935 -9.366 24.275 13.011 1.00 0.00 C ATOM 763 OG1 THR A 935 -8.634 23.454 13.930 1.00 0.00 O ATOM 764 CG2 THR A 935 -8.823 25.694 13.049 1.00 0.00 C ATOM 0 H THR A 935 -11.305 25.990 12.289 1.00 0.00 H new ATOM 0 HA THR A 935 -11.181 23.188 13.220 1.00 0.00 H new ATOM 0 HB THR A 935 -9.240 23.893 11.998 1.00 0.00 H new ATOM 0 HG1 THR A 935 -8.321 22.647 13.470 1.00 0.00 H new ATOM 0 HG21 THR A 935 -7.759 25.683 12.814 1.00 0.00 H new ATOM 0 HG22 THR A 935 -9.350 26.305 12.316 1.00 0.00 H new ATOM 0 HG23 THR A 935 -8.971 26.113 14.044 1.00 0.00 H new ATOM 772 N THR A 936 -11.547 23.771 15.624 1.00 0.00 N ATOM 773 CA THR A 936 -11.901 24.101 16.991 1.00 0.00 C ATOM 774 C THR A 936 -11.021 23.358 17.988 1.00 0.00 C ATOM 775 O THR A 936 -10.776 22.165 17.832 1.00 0.00 O ATOM 776 CB THR A 936 -13.381 23.775 17.250 1.00 0.00 C ATOM 777 OG1 THR A 936 -14.186 24.391 16.236 1.00 0.00 O ATOM 778 CG2 THR A 936 -13.819 24.272 18.617 1.00 0.00 C ATOM 0 H THR A 936 -11.636 22.782 15.392 1.00 0.00 H new ATOM 0 HA THR A 936 -11.739 25.170 17.129 1.00 0.00 H new ATOM 0 HB THR A 936 -13.507 22.693 17.223 1.00 0.00 H new ATOM 0 HG1 THR A 936 -15.130 24.184 16.397 1.00 0.00 H new ATOM 0 HG21 THR A 936 -14.870 24.028 18.773 1.00 0.00 H new ATOM 0 HG22 THR A 936 -13.216 23.793 19.389 1.00 0.00 H new ATOM 0 HG23 THR A 936 -13.686 25.352 18.671 1.00 0.00 H new ATOM 786 N ARG A 937 -10.548 24.061 19.008 1.00 0.00 N ATOM 787 CA ARG A 937 -9.769 23.423 20.058 1.00 0.00 C ATOM 788 C ARG A 937 -10.647 23.110 21.265 1.00 0.00 C ATOM 789 O ARG A 937 -11.343 23.982 21.788 1.00 0.00 O ATOM 790 CB ARG A 937 -8.599 24.310 20.487 1.00 0.00 C ATOM 791 CG ARG A 937 -7.565 24.533 19.397 1.00 0.00 C ATOM 792 CD ARG A 937 -6.325 25.224 19.941 1.00 0.00 C ATOM 793 NE ARG A 937 -5.699 24.454 21.017 1.00 0.00 N ATOM 794 CZ ARG A 937 -4.429 24.596 21.397 1.00 0.00 C ATOM 795 NH1 ARG A 937 -3.632 25.441 20.755 1.00 0.00 N ATOM 796 NH2 ARG A 937 -3.955 23.866 22.403 1.00 0.00 N ATOM 0 H ARG A 937 -10.689 25.064 19.130 1.00 0.00 H new ATOM 0 HA ARG A 937 -9.372 22.491 19.657 1.00 0.00 H new ATOM 0 HB2 ARG A 937 -8.987 25.276 20.809 1.00 0.00 H new ATOM 0 HB3 ARG A 937 -8.111 23.858 21.351 1.00 0.00 H new ATOM 0 HG2 ARG A 937 -7.286 23.576 18.957 1.00 0.00 H new ATOM 0 HG3 ARG A 937 -7.999 25.136 18.600 1.00 0.00 H new ATOM 0 HD2 ARG A 937 -5.607 25.370 19.134 1.00 0.00 H new ATOM 0 HD3 ARG A 937 -6.594 26.213 20.311 1.00 0.00 H new ATOM 0 HE ARG A 937 -6.270 23.766 21.507 1.00 0.00 H new ATOM 0 HH11 ARG A 937 -3.991 25.983 19.969 1.00 0.00 H new ATOM 0 HH12 ARG A 937 -2.661 25.548 21.047 1.00 0.00 H new ATOM 0 HH21 ARG A 937 -4.563 23.200 22.881 1.00 0.00 H new ATOM 0 HH22 ARG A 937 -2.984 23.972 22.697 1.00 0.00 H new ATOM 810 N TYR A 938 -10.613 21.857 21.682 1.00 0.00 N ATOM 811 CA TYR A 938 -11.348 21.393 22.845 1.00 0.00 C ATOM 812 C TYR A 938 -10.383 21.041 23.970 1.00 0.00 C ATOM 813 O TYR A 938 -9.307 20.485 23.726 1.00 0.00 O ATOM 814 CB TYR A 938 -12.191 20.164 22.495 1.00 0.00 C ATOM 815 CG TYR A 938 -13.232 20.397 21.419 1.00 0.00 C ATOM 816 CD1 TYR A 938 -14.489 20.895 21.739 1.00 0.00 C ATOM 817 CD2 TYR A 938 -12.964 20.103 20.087 1.00 0.00 C ATOM 818 CE1 TYR A 938 -15.447 21.096 20.765 1.00 0.00 C ATOM 819 CE2 TYR A 938 -13.917 20.304 19.106 1.00 0.00 C ATOM 820 CZ TYR A 938 -15.157 20.799 19.451 1.00 0.00 C ATOM 821 OH TYR A 938 -16.110 20.993 18.476 1.00 0.00 O ATOM 0 H TYR A 938 -10.070 21.127 21.220 1.00 0.00 H new ATOM 0 HA TYR A 938 -12.010 22.195 23.172 1.00 0.00 H new ATOM 0 HB2 TYR A 938 -11.526 19.364 22.171 1.00 0.00 H new ATOM 0 HB3 TYR A 938 -12.693 19.815 23.398 1.00 0.00 H new ATOM 0 HD1 TYR A 938 -14.721 21.129 22.768 1.00 0.00 H new ATOM 0 HD2 TYR A 938 -11.995 19.711 19.814 1.00 0.00 H new ATOM 0 HE1 TYR A 938 -16.419 21.484 21.032 1.00 0.00 H new ATOM 0 HE2 TYR A 938 -13.692 20.075 18.075 1.00 0.00 H new ATOM 0 HH TYR A 938 -15.743 20.735 17.604 1.00 0.00 H new ATOM 831 N GLY A 939 -10.752 21.377 25.190 1.00 0.00 N ATOM 832 CA GLY A 939 -9.957 20.983 26.332 1.00 0.00 C ATOM 833 C GLY A 939 -10.624 19.867 27.112 1.00 0.00 C ATOM 834 O GLY A 939 -11.823 19.639 26.966 1.00 0.00 O ATOM 0 H GLY A 939 -11.588 21.916 25.413 1.00 0.00 H new ATOM 0 HA2 GLY A 939 -8.973 20.657 25.997 1.00 0.00 H new ATOM 0 HA3 GLY A 939 -9.803 21.843 26.984 1.00 0.00 H new ATOM 838 N GLU A 940 -9.860 19.162 27.942 1.00 0.00 N ATOM 839 CA GLU A 940 -10.418 18.092 28.773 1.00 0.00 C ATOM 840 C GLU A 940 -11.345 18.673 29.846 1.00 0.00 C ATOM 841 O GLU A 940 -12.006 17.943 30.587 1.00 0.00 O ATOM 842 CB GLU A 940 -9.295 17.250 29.407 1.00 0.00 C ATOM 843 CG GLU A 940 -8.718 17.799 30.709 1.00 0.00 C ATOM 844 CD GLU A 940 -8.201 19.218 30.602 1.00 0.00 C ATOM 845 OE1 GLU A 940 -7.456 19.523 29.650 1.00 0.00 O ATOM 846 OE2 GLU A 940 -8.548 20.041 31.476 1.00 0.00 O ATOM 0 H GLU A 940 -8.857 19.309 28.059 1.00 0.00 H new ATOM 0 HA GLU A 940 -11.009 17.434 28.136 1.00 0.00 H new ATOM 0 HB2 GLU A 940 -9.678 16.247 29.594 1.00 0.00 H new ATOM 0 HB3 GLU A 940 -8.485 17.152 28.684 1.00 0.00 H new ATOM 0 HG2 GLU A 940 -9.487 17.760 31.480 1.00 0.00 H new ATOM 0 HG3 GLU A 940 -7.905 17.151 31.036 1.00 0.00 H new ATOM 853 N ASN A 941 -11.380 19.998 29.909 1.00 0.00 N ATOM 854 CA ASN A 941 -12.157 20.721 30.906 1.00 0.00 C ATOM 855 C ASN A 941 -13.567 21.017 30.388 1.00 0.00 C ATOM 856 O ASN A 941 -14.379 21.639 31.070 1.00 0.00 O ATOM 857 CB ASN A 941 -11.426 22.022 31.256 1.00 0.00 C ATOM 858 CG ASN A 941 -12.047 22.781 32.414 1.00 0.00 C ATOM 859 OD1 ASN A 941 -12.667 22.196 33.303 1.00 0.00 O ATOM 860 ND2 ASN A 941 -11.855 24.088 32.424 1.00 0.00 N ATOM 0 H ASN A 941 -10.868 20.603 29.267 1.00 0.00 H new ATOM 0 HA ASN A 941 -12.258 20.107 31.801 1.00 0.00 H new ATOM 0 HB2 ASN A 941 -10.389 21.791 31.500 1.00 0.00 H new ATOM 0 HB3 ASN A 941 -11.411 22.667 30.377 1.00 0.00 H new ATOM 0 HD21 ASN A 941 -12.226 24.652 33.188 1.00 0.00 H new ATOM 0 HD22 ASN A 941 -11.335 24.533 31.667 1.00 0.00 H new ATOM 867 N GLU A 942 -13.864 20.551 29.184 1.00 0.00 N ATOM 868 CA GLU A 942 -15.182 20.755 28.598 1.00 0.00 C ATOM 869 C GLU A 942 -15.749 19.430 28.102 1.00 0.00 C ATOM 870 O GLU A 942 -15.049 18.414 28.089 1.00 0.00 O ATOM 871 CB GLU A 942 -15.111 21.781 27.460 1.00 0.00 C ATOM 872 CG GLU A 942 -14.230 21.352 26.297 1.00 0.00 C ATOM 873 CD GLU A 942 -13.971 22.471 25.312 1.00 0.00 C ATOM 874 OE1 GLU A 942 -14.808 22.686 24.414 1.00 0.00 O ATOM 875 OE2 GLU A 942 -12.918 23.138 25.428 1.00 0.00 O ATOM 0 H GLU A 942 -13.214 20.031 28.595 1.00 0.00 H new ATOM 0 HA GLU A 942 -15.850 21.148 29.365 1.00 0.00 H new ATOM 0 HB2 GLU A 942 -16.119 21.968 27.090 1.00 0.00 H new ATOM 0 HB3 GLU A 942 -14.737 22.724 27.858 1.00 0.00 H new ATOM 0 HG2 GLU A 942 -13.278 20.987 26.684 1.00 0.00 H new ATOM 0 HG3 GLU A 942 -14.703 20.519 25.777 1.00 0.00 H new ATOM 882 N LYS A 943 -17.017 19.435 27.715 1.00 0.00 N ATOM 883 CA LYS A 943 -17.667 18.233 27.227 1.00 0.00 C ATOM 884 C LYS A 943 -17.298 17.980 25.770 1.00 0.00 C ATOM 885 O LYS A 943 -17.373 18.881 24.927 1.00 0.00 O ATOM 886 CB LYS A 943 -19.188 18.329 27.384 1.00 0.00 C ATOM 887 CG LYS A 943 -19.820 19.505 26.654 1.00 0.00 C ATOM 888 CD LYS A 943 -21.339 19.428 26.692 1.00 0.00 C ATOM 889 CE LYS A 943 -21.847 18.146 26.041 1.00 0.00 C ATOM 890 NZ LYS A 943 -23.331 18.058 26.052 1.00 0.00 N ATOM 0 H LYS A 943 -17.615 20.261 27.731 1.00 0.00 H new ATOM 0 HA LYS A 943 -17.316 17.393 27.826 1.00 0.00 H new ATOM 0 HB2 LYS A 943 -19.638 17.406 27.019 1.00 0.00 H new ATOM 0 HB3 LYS A 943 -19.428 18.403 28.445 1.00 0.00 H new ATOM 0 HG2 LYS A 943 -19.490 20.439 27.110 1.00 0.00 H new ATOM 0 HG3 LYS A 943 -19.480 19.518 25.618 1.00 0.00 H new ATOM 0 HD2 LYS A 943 -21.681 19.473 27.726 1.00 0.00 H new ATOM 0 HD3 LYS A 943 -21.762 20.291 26.178 1.00 0.00 H new ATOM 0 HE2 LYS A 943 -21.490 18.097 25.012 1.00 0.00 H new ATOM 0 HE3 LYS A 943 -21.430 17.285 26.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 943 -23.630 17.171 25.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 943 -23.673 18.078 27.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 943 -23.730 18.864 25.530 1.00 0.00 H new ATOM 904 N LEU A 944 -16.876 16.760 25.490 1.00 0.00 N ATOM 905 CA LEU A 944 -16.505 16.366 24.143 1.00 0.00 C ATOM 906 C LEU A 944 -17.647 15.634 23.455 1.00 0.00 C ATOM 907 O LEU A 944 -18.266 14.746 24.045 1.00 0.00 O ATOM 908 CB LEU A 944 -15.262 15.481 24.182 1.00 0.00 C ATOM 909 CG LEU A 944 -13.944 16.233 24.338 1.00 0.00 C ATOM 910 CD1 LEU A 944 -12.806 15.275 24.640 1.00 0.00 C ATOM 911 CD2 LEU A 944 -13.650 17.014 23.073 1.00 0.00 C ATOM 0 H LEU A 944 -16.781 16.019 26.185 1.00 0.00 H new ATOM 0 HA LEU A 944 -16.286 17.268 23.571 1.00 0.00 H new ATOM 0 HB2 LEU A 944 -15.361 14.776 25.007 1.00 0.00 H new ATOM 0 HB3 LEU A 944 -15.222 14.894 23.264 1.00 0.00 H new ATOM 0 HG LEU A 944 -14.035 16.924 25.176 1.00 0.00 H new ATOM 0 HD11 LEU A 944 -11.877 15.835 24.747 1.00 0.00 H new ATOM 0 HD12 LEU A 944 -13.016 14.741 25.567 1.00 0.00 H new ATOM 0 HD13 LEU A 944 -12.706 14.560 23.824 1.00 0.00 H new ATOM 0 HD21 LEU A 944 -12.708 17.550 23.187 1.00 0.00 H new ATOM 0 HD22 LEU A 944 -13.577 16.327 22.230 1.00 0.00 H new ATOM 0 HD23 LEU A 944 -14.454 17.727 22.891 1.00 0.00 H new ATOM 923 N PRO A 945 -17.946 16.007 22.204 1.00 0.00 N ATOM 924 CA PRO A 945 -18.957 15.323 21.393 1.00 0.00 C ATOM 925 C PRO A 945 -18.564 13.875 21.107 1.00 0.00 C ATOM 926 O PRO A 945 -17.377 13.528 21.129 1.00 0.00 O ATOM 927 CB PRO A 945 -19.003 16.141 20.096 1.00 0.00 C ATOM 928 CG PRO A 945 -18.369 17.447 20.437 1.00 0.00 C ATOM 929 CD PRO A 945 -17.342 17.137 21.485 1.00 0.00 C ATOM 0 HA PRO A 945 -19.922 15.268 21.897 1.00 0.00 H new ATOM 0 HB2 PRO A 945 -18.463 15.638 19.294 1.00 0.00 H new ATOM 0 HB3 PRO A 945 -20.028 16.278 19.753 1.00 0.00 H new ATOM 0 HG2 PRO A 945 -17.908 17.900 19.559 1.00 0.00 H new ATOM 0 HG3 PRO A 945 -19.108 18.156 20.810 1.00 0.00 H new ATOM 0 HD2 PRO A 945 -16.382 16.870 21.044 1.00 0.00 H new ATOM 0 HD3 PRO A 945 -17.165 17.988 22.143 1.00 0.00 H new ATOM 937 N ASP A 946 -19.566 13.046 20.832 1.00 0.00 N ATOM 938 CA ASP A 946 -19.370 11.607 20.652 1.00 0.00 C ATOM 939 C ASP A 946 -18.311 11.287 19.609 1.00 0.00 C ATOM 940 O ASP A 946 -17.365 10.551 19.890 1.00 0.00 O ATOM 941 CB ASP A 946 -20.682 10.924 20.262 1.00 0.00 C ATOM 942 CG ASP A 946 -21.624 10.757 21.432 1.00 0.00 C ATOM 943 OD1 ASP A 946 -22.409 11.686 21.708 1.00 0.00 O ATOM 944 OD2 ASP A 946 -21.597 9.683 22.072 1.00 0.00 O ATOM 0 H ASP A 946 -20.534 13.349 20.727 1.00 0.00 H new ATOM 0 HA ASP A 946 -19.024 11.224 21.612 1.00 0.00 H new ATOM 0 HB2 ASP A 946 -21.174 11.509 19.485 1.00 0.00 H new ATOM 0 HB3 ASP A 946 -20.464 9.946 19.834 1.00 0.00 H new ATOM 949 N TYR A 947 -18.453 11.849 18.414 1.00 0.00 N ATOM 950 CA TYR A 947 -17.554 11.518 17.313 1.00 0.00 C ATOM 951 C TYR A 947 -16.117 11.927 17.620 1.00 0.00 C ATOM 952 O TYR A 947 -15.178 11.260 17.197 1.00 0.00 O ATOM 953 CB TYR A 947 -18.023 12.173 16.010 1.00 0.00 C ATOM 954 CG TYR A 947 -19.264 11.536 15.415 1.00 0.00 C ATOM 955 CD1 TYR A 947 -19.165 10.464 14.535 1.00 0.00 C ATOM 956 CD2 TYR A 947 -20.533 12.007 15.733 1.00 0.00 C ATOM 957 CE1 TYR A 947 -20.293 9.880 13.991 1.00 0.00 C ATOM 958 CE2 TYR A 947 -21.665 11.428 15.193 1.00 0.00 C ATOM 959 CZ TYR A 947 -21.540 10.364 14.323 1.00 0.00 C ATOM 960 OH TYR A 947 -22.666 9.787 13.784 1.00 0.00 O ATOM 0 H TYR A 947 -19.176 12.531 18.183 1.00 0.00 H new ATOM 0 HA TYR A 947 -17.577 10.435 17.190 1.00 0.00 H new ATOM 0 HB2 TYR A 947 -18.222 13.228 16.196 1.00 0.00 H new ATOM 0 HB3 TYR A 947 -17.216 12.125 15.279 1.00 0.00 H new ATOM 0 HD1 TYR A 947 -18.190 10.081 14.272 1.00 0.00 H new ATOM 0 HD2 TYR A 947 -20.635 12.839 16.414 1.00 0.00 H new ATOM 0 HE1 TYR A 947 -20.198 9.048 13.309 1.00 0.00 H new ATOM 0 HE2 TYR A 947 -22.643 11.806 15.450 1.00 0.00 H new ATOM 0 HH TYR A 947 -23.463 10.247 14.122 1.00 0.00 H new ATOM 970 N ILE A 948 -15.941 12.992 18.390 1.00 0.00 N ATOM 971 CA ILE A 948 -14.597 13.441 18.740 1.00 0.00 C ATOM 972 C ILE A 948 -13.930 12.416 19.655 1.00 0.00 C ATOM 973 O ILE A 948 -12.768 12.056 19.461 1.00 0.00 O ATOM 974 CB ILE A 948 -14.595 14.841 19.412 1.00 0.00 C ATOM 975 CG1 ILE A 948 -14.857 15.950 18.381 1.00 0.00 C ATOM 976 CG2 ILE A 948 -13.269 15.100 20.119 1.00 0.00 C ATOM 977 CD1 ILE A 948 -16.244 15.933 17.772 1.00 0.00 C ATOM 0 H ILE A 948 -16.697 13.555 18.780 1.00 0.00 H new ATOM 0 HA ILE A 948 -14.032 13.531 17.812 1.00 0.00 H new ATOM 0 HB ILE A 948 -15.398 14.853 20.149 1.00 0.00 H new ATOM 0 HG12 ILE A 948 -14.696 16.917 18.859 1.00 0.00 H new ATOM 0 HG13 ILE A 948 -14.122 15.864 17.580 1.00 0.00 H new ATOM 0 HG21 ILE A 948 -13.290 16.086 20.582 1.00 0.00 H new ATOM 0 HG22 ILE A 948 -13.112 14.342 20.886 1.00 0.00 H new ATOM 0 HG23 ILE A 948 -12.456 15.057 19.394 1.00 0.00 H new ATOM 0 HD11 ILE A 948 -16.337 16.750 17.057 1.00 0.00 H new ATOM 0 HD12 ILE A 948 -16.405 14.984 17.261 1.00 0.00 H new ATOM 0 HD13 ILE A 948 -16.988 16.053 18.559 1.00 0.00 H new ATOM 989 N LYS A 949 -14.693 11.914 20.621 1.00 0.00 N ATOM 990 CA LYS A 949 -14.214 10.862 21.512 1.00 0.00 C ATOM 991 C LYS A 949 -13.918 9.596 20.717 1.00 0.00 C ATOM 992 O LYS A 949 -12.932 8.901 20.970 1.00 0.00 O ATOM 993 CB LYS A 949 -15.254 10.564 22.599 1.00 0.00 C ATOM 994 CG LYS A 949 -15.522 11.736 23.528 1.00 0.00 C ATOM 995 CD LYS A 949 -14.335 12.030 24.435 1.00 0.00 C ATOM 996 CE LYS A 949 -14.363 11.195 25.712 1.00 0.00 C ATOM 997 NZ LYS A 949 -14.097 9.747 25.471 1.00 0.00 N ATOM 0 H LYS A 949 -15.648 12.220 20.807 1.00 0.00 H new ATOM 0 HA LYS A 949 -13.297 11.206 21.990 1.00 0.00 H new ATOM 0 HB2 LYS A 949 -16.189 10.268 22.123 1.00 0.00 H new ATOM 0 HB3 LYS A 949 -14.915 9.714 23.190 1.00 0.00 H new ATOM 0 HG2 LYS A 949 -15.754 12.622 22.936 1.00 0.00 H new ATOM 0 HG3 LYS A 949 -16.400 11.521 24.138 1.00 0.00 H new ATOM 0 HD2 LYS A 949 -13.409 11.832 23.894 1.00 0.00 H new ATOM 0 HD3 LYS A 949 -14.332 13.088 24.695 1.00 0.00 H new ATOM 0 HE2 LYS A 949 -13.621 11.583 26.409 1.00 0.00 H new ATOM 0 HE3 LYS A 949 -15.337 11.305 26.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 949 -13.652 9.331 26.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 949 -14.993 9.257 25.275 1.00 0.00 H new ATOM 0 HZ3 LYS A 949 -13.460 9.642 24.656 1.00 0.00 H new ATOM 1011 N GLN A 950 -14.785 9.309 19.754 1.00 0.00 N ATOM 1012 CA GLN A 950 -14.635 8.133 18.900 1.00 0.00 C ATOM 1013 C GLN A 950 -13.334 8.182 18.098 1.00 0.00 C ATOM 1014 O GLN A 950 -12.628 7.177 17.989 1.00 0.00 O ATOM 1015 CB GLN A 950 -15.826 8.001 17.948 1.00 0.00 C ATOM 1016 CG GLN A 950 -17.114 7.568 18.631 1.00 0.00 C ATOM 1017 CD GLN A 950 -16.988 6.212 19.299 1.00 0.00 C ATOM 1018 OE1 GLN A 950 -16.216 5.357 18.857 1.00 0.00 O ATOM 1019 NE2 GLN A 950 -17.747 6.001 20.362 1.00 0.00 N ATOM 0 H GLN A 950 -15.605 9.877 19.543 1.00 0.00 H new ATOM 0 HA GLN A 950 -14.600 7.261 19.553 1.00 0.00 H new ATOM 0 HB2 GLN A 950 -15.992 8.958 17.454 1.00 0.00 H new ATOM 0 HB3 GLN A 950 -15.578 7.279 17.169 1.00 0.00 H new ATOM 0 HG2 GLN A 950 -17.395 8.312 19.376 1.00 0.00 H new ATOM 0 HG3 GLN A 950 -17.918 7.534 17.896 1.00 0.00 H new ATOM 0 HE21 GLN A 950 -18.372 6.734 20.696 1.00 0.00 H new ATOM 0 HE22 GLN A 950 -17.707 5.105 20.848 1.00 0.00 H new ATOM 1028 N LYS A 951 -13.021 9.348 17.537 1.00 0.00 N ATOM 1029 CA LYS A 951 -11.793 9.514 16.766 1.00 0.00 C ATOM 1030 C LYS A 951 -10.591 9.426 17.692 1.00 0.00 C ATOM 1031 O LYS A 951 -9.576 8.812 17.366 1.00 0.00 O ATOM 1032 CB LYS A 951 -11.777 10.852 16.011 1.00 0.00 C ATOM 1033 CG LYS A 951 -12.347 10.801 14.590 1.00 0.00 C ATOM 1034 CD LYS A 951 -13.870 10.884 14.552 1.00 0.00 C ATOM 1035 CE LYS A 951 -14.540 9.536 14.783 1.00 0.00 C ATOM 1036 NZ LYS A 951 -14.369 8.613 13.631 1.00 0.00 N ATOM 0 H LYS A 951 -13.598 10.187 17.602 1.00 0.00 H new ATOM 0 HA LYS A 951 -11.747 8.714 16.027 1.00 0.00 H new ATOM 0 HB2 LYS A 951 -12.343 11.584 16.587 1.00 0.00 H new ATOM 0 HB3 LYS A 951 -10.749 11.212 15.961 1.00 0.00 H new ATOM 0 HG2 LYS A 951 -11.930 11.623 14.008 1.00 0.00 H new ATOM 0 HG3 LYS A 951 -12.028 9.876 14.110 1.00 0.00 H new ATOM 0 HD2 LYS A 951 -14.210 11.589 15.311 1.00 0.00 H new ATOM 0 HD3 LYS A 951 -14.184 11.280 13.586 1.00 0.00 H new ATOM 0 HE2 LYS A 951 -14.124 9.075 15.679 1.00 0.00 H new ATOM 0 HE3 LYS A 951 -15.603 9.689 14.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 951 -14.991 7.788 13.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 951 -14.617 9.107 12.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 951 -13.379 8.297 13.584 1.00 0.00 H new ATOM 1050 N LEU A 952 -10.740 10.034 18.860 1.00 0.00 N ATOM 1051 CA LEU A 952 -9.699 10.065 19.873 1.00 0.00 C ATOM 1052 C LEU A 952 -9.333 8.655 20.332 1.00 0.00 C ATOM 1053 O LEU A 952 -8.169 8.357 20.602 1.00 0.00 O ATOM 1054 CB LEU A 952 -10.192 10.891 21.058 1.00 0.00 C ATOM 1055 CG LEU A 952 -9.148 11.224 22.114 1.00 0.00 C ATOM 1056 CD1 LEU A 952 -8.048 12.084 21.515 1.00 0.00 C ATOM 1057 CD2 LEU A 952 -9.807 11.931 23.284 1.00 0.00 C ATOM 0 H LEU A 952 -11.593 10.523 19.132 1.00 0.00 H new ATOM 0 HA LEU A 952 -8.803 10.517 19.448 1.00 0.00 H new ATOM 0 HB2 LEU A 952 -10.608 11.824 20.678 1.00 0.00 H new ATOM 0 HB3 LEU A 952 -11.008 10.351 21.539 1.00 0.00 H new ATOM 0 HG LEU A 952 -8.697 10.299 22.475 1.00 0.00 H new ATOM 0 HD11 LEU A 952 -7.308 12.315 22.282 1.00 0.00 H new ATOM 0 HD12 LEU A 952 -7.568 11.544 20.698 1.00 0.00 H new ATOM 0 HD13 LEU A 952 -8.477 13.011 21.135 1.00 0.00 H new ATOM 0 HD21 LEU A 952 -9.055 12.167 24.037 1.00 0.00 H new ATOM 0 HD22 LEU A 952 -10.274 12.852 22.936 1.00 0.00 H new ATOM 0 HD23 LEU A 952 -10.566 11.282 23.720 1.00 0.00 H new ATOM 1069 N GLN A 953 -10.339 7.790 20.398 1.00 0.00 N ATOM 1070 CA GLN A 953 -10.158 6.417 20.855 1.00 0.00 C ATOM 1071 C GLN A 953 -9.222 5.643 19.921 1.00 0.00 C ATOM 1072 O GLN A 953 -8.532 4.714 20.345 1.00 0.00 O ATOM 1073 CB GLN A 953 -11.515 5.711 20.927 1.00 0.00 C ATOM 1074 CG GLN A 953 -11.783 5.003 22.248 1.00 0.00 C ATOM 1075 CD GLN A 953 -10.670 4.057 22.648 1.00 0.00 C ATOM 1076 OE1 GLN A 953 -10.651 2.895 22.246 1.00 0.00 O ATOM 1077 NE2 GLN A 953 -9.756 4.539 23.475 1.00 0.00 N ATOM 0 H GLN A 953 -11.298 8.019 20.138 1.00 0.00 H new ATOM 0 HA GLN A 953 -9.706 6.445 21.846 1.00 0.00 H new ATOM 0 HB2 GLN A 953 -12.303 6.444 20.755 1.00 0.00 H new ATOM 0 HB3 GLN A 953 -11.576 4.982 20.119 1.00 0.00 H new ATOM 0 HG2 GLN A 953 -11.919 5.748 23.032 1.00 0.00 H new ATOM 0 HG3 GLN A 953 -12.717 4.446 22.172 1.00 0.00 H new ATOM 0 HE21 GLN A 953 -9.809 5.510 23.784 1.00 0.00 H new ATOM 0 HE22 GLN A 953 -8.999 3.940 23.803 1.00 0.00 H new ATOM 1086 N CYS A 954 -9.185 6.050 18.656 1.00 0.00 N ATOM 1087 CA CYS A 954 -8.405 5.349 17.639 1.00 0.00 C ATOM 1088 C CYS A 954 -6.903 5.514 17.871 1.00 0.00 C ATOM 1089 O CYS A 954 -6.103 4.710 17.395 1.00 0.00 O ATOM 1090 CB CYS A 954 -8.780 5.862 16.249 1.00 0.00 C ATOM 1091 SG CYS A 954 -10.553 5.780 15.892 1.00 0.00 S ATOM 0 H CYS A 954 -9.689 6.866 18.308 1.00 0.00 H new ATOM 0 HA CYS A 954 -8.639 4.287 17.710 1.00 0.00 H new ATOM 0 HB2 CYS A 954 -8.447 6.895 16.151 1.00 0.00 H new ATOM 0 HB3 CYS A 954 -8.241 5.281 15.500 1.00 0.00 H new ATOM 0 HG CYS A 954 -11.215 6.367 16.845 1.00 0.00 H new ATOM 1097 N LEU A 955 -6.531 6.545 18.624 1.00 0.00 N ATOM 1098 CA LEU A 955 -5.123 6.834 18.900 1.00 0.00 C ATOM 1099 C LEU A 955 -4.484 5.764 19.783 1.00 0.00 C ATOM 1100 O LEU A 955 -3.259 5.699 19.897 1.00 0.00 O ATOM 1101 CB LEU A 955 -4.960 8.209 19.557 1.00 0.00 C ATOM 1102 CG LEU A 955 -4.984 9.412 18.601 1.00 0.00 C ATOM 1103 CD1 LEU A 955 -6.351 9.588 17.961 1.00 0.00 C ATOM 1104 CD2 LEU A 955 -4.583 10.682 19.334 1.00 0.00 C ATOM 0 H LEU A 955 -7.185 7.197 19.056 1.00 0.00 H new ATOM 0 HA LEU A 955 -4.609 6.835 17.939 1.00 0.00 H new ATOM 0 HB2 LEU A 955 -5.755 8.337 20.292 1.00 0.00 H new ATOM 0 HB3 LEU A 955 -4.017 8.221 20.103 1.00 0.00 H new ATOM 0 HG LEU A 955 -4.263 9.216 17.807 1.00 0.00 H new ATOM 0 HD11 LEU A 955 -6.331 10.448 17.291 1.00 0.00 H new ATOM 0 HD12 LEU A 955 -6.605 8.692 17.394 1.00 0.00 H new ATOM 0 HD13 LEU A 955 -7.098 9.750 18.738 1.00 0.00 H new ATOM 0 HD21 LEU A 955 -4.605 11.524 18.642 1.00 0.00 H new ATOM 0 HD22 LEU A 955 -5.280 10.866 20.152 1.00 0.00 H new ATOM 0 HD23 LEU A 955 -3.576 10.568 19.735 1.00 0.00 H new