USER MOD reduce.3.24.130724 H: found=0, std=0, add=513, rem=0, adj=20 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 915 SER OG : rot -150:sc= 0.635 USER MOD Set 1.2: A 928 TYR OH : rot -137:sc= 1.01 USER MOD Set 1.3: A 951 LYS NZ :NH3+ -149:sc= -0.116 (180deg=-1.01) USER MOD Set 2.1: A 936 THR OG1 : rot 135:sc= 0.331 USER MOD Set 2.2: A 938 TYR OH : rot 180:sc= 0.146 USER MOD Set 3.1: A 890 SER OG : rot -3:sc= 2.2 USER MOD Set 3.2: A 900 THR OG1 : rot -25:sc= 1.12 USER MOD Single : A 889 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0639) USER MOD Single : A 894 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 895 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 901 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 903 THR OG1 : rot 180:sc= 0.00265 USER MOD Single : A 904 SER OG : rot 180:sc= 0 USER MOD Single : A 910 GLN : amide:sc= -0.083 X(o=-0.083,f=0) USER MOD Single : A 912 ASN : amide:sc= -0.0118 K(o=-0.012,f=-0.68) USER MOD Single : A 916 GLN : amide:sc= 0.602 K(o=0.6,f=-4.8!) USER MOD Single : A 920 GLN : amide:sc= -0.0132 K(o=-0.013,f=-0.97) USER MOD Single : A 924 SER OG : rot 180:sc= 0 USER MOD Single : A 925 SER OG : rot 126:sc= 0.97 USER MOD Single : A 927 SER OG : rot 180:sc= -0.952 USER MOD Single : A 929 THR OG1 : rot 180:sc= -0.275 USER MOD Single : A 930 SER OG : rot 180:sc= 0.00876 USER MOD Single : A 932 ASN : amide:sc= -0.241 K(o=-0.24,f=-3.9!) USER MOD Single : A 934 GLN : amide:sc=-0.00117 K(o=-0.0012,f=-0.92) USER MOD Single : A 935 THR OG1 : rot 180:sc= 0.0267 USER MOD Single : A 941 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 943 LYS NZ :NH3+ -147:sc= 1.07 (180deg=0.295) USER MOD Single : A 947 TYR OH : rot 180:sc= 0 USER MOD Single : A 949 LYS NZ :NH3+ -161:sc= -0.0376 (180deg=-0.307) USER MOD Single : A 950 GLN : amide:sc= 0.334 K(o=0.33,f=-0.91) USER MOD Single : A 953 GLN : amide:sc=-0.00699 K(o=-0.007,f=-1.2) USER MOD Single : A 954 CYS SG : rot 63:sc= 0.913 USER MOD ----------------------------------------------------------------- ATOM 83 N LYS A 889 7.906 7.083 10.312 1.00 0.00 N ATOM 84 CA LYS A 889 7.767 7.581 11.672 1.00 0.00 C ATOM 85 C LYS A 889 6.325 8.018 11.895 1.00 0.00 C ATOM 86 O LYS A 889 5.957 8.496 12.965 1.00 0.00 O ATOM 87 CB LYS A 889 8.748 8.727 11.956 1.00 0.00 C ATOM 88 CG LYS A 889 8.683 9.877 10.964 1.00 0.00 C ATOM 89 CD LYS A 889 9.679 10.968 11.325 1.00 0.00 C ATOM 90 CE LYS A 889 9.715 12.070 10.279 1.00 0.00 C ATOM 91 NZ LYS A 889 8.406 12.764 10.146 1.00 0.00 N ATOM 0 HA LYS A 889 8.013 6.781 12.370 1.00 0.00 H new ATOM 0 HB2 LYS A 889 8.553 9.115 12.956 1.00 0.00 H new ATOM 0 HB3 LYS A 889 9.762 8.327 11.962 1.00 0.00 H new ATOM 0 HG2 LYS A 889 8.892 9.508 9.960 1.00 0.00 H new ATOM 0 HG3 LYS A 889 7.675 10.291 10.948 1.00 0.00 H new ATOM 0 HD2 LYS A 889 9.416 11.394 12.293 1.00 0.00 H new ATOM 0 HD3 LYS A 889 10.673 10.533 11.428 1.00 0.00 H new ATOM 0 HE2 LYS A 889 10.483 12.796 10.545 1.00 0.00 H new ATOM 0 HE3 LYS A 889 9.998 11.645 9.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 889 8.505 13.571 9.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 889 7.699 12.102 9.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 889 8.098 13.105 11.079 1.00 0.00 H new ATOM 105 N SER A 890 5.518 7.847 10.854 1.00 0.00 N ATOM 106 CA SER A 890 4.089 8.079 10.935 1.00 0.00 C ATOM 107 C SER A 890 3.370 6.730 10.913 1.00 0.00 C ATOM 108 O SER A 890 3.812 5.803 10.232 1.00 0.00 O ATOM 109 CB SER A 890 3.633 8.959 9.762 1.00 0.00 C ATOM 110 OG SER A 890 2.299 9.407 9.936 1.00 0.00 O ATOM 0 H SER A 890 5.839 7.544 9.934 1.00 0.00 H new ATOM 0 HA SER A 890 3.847 8.600 11.861 1.00 0.00 H new ATOM 0 HB2 SER A 890 4.297 9.818 9.671 1.00 0.00 H new ATOM 0 HB3 SER A 890 3.710 8.396 8.832 1.00 0.00 H new ATOM 0 HG SER A 890 1.928 9.020 10.757 1.00 0.00 H new ATOM 116 N VAL A 891 2.286 6.615 11.668 1.00 0.00 N ATOM 117 CA VAL A 891 1.540 5.365 11.744 1.00 0.00 C ATOM 118 C VAL A 891 0.067 5.600 11.426 1.00 0.00 C ATOM 119 O VAL A 891 -0.508 6.608 11.829 1.00 0.00 O ATOM 120 CB VAL A 891 1.654 4.719 13.146 1.00 0.00 C ATOM 121 CG1 VAL A 891 0.991 3.349 13.171 1.00 0.00 C ATOM 122 CG2 VAL A 891 3.107 4.613 13.582 1.00 0.00 C ATOM 0 H VAL A 891 1.903 7.371 12.236 1.00 0.00 H new ATOM 0 HA VAL A 891 1.974 4.687 11.008 1.00 0.00 H new ATOM 0 HB VAL A 891 1.132 5.365 13.851 1.00 0.00 H new ATOM 0 HG11 VAL A 891 1.085 2.917 14.167 1.00 0.00 H new ATOM 0 HG12 VAL A 891 -0.064 3.451 12.918 1.00 0.00 H new ATOM 0 HG13 VAL A 891 1.477 2.697 12.445 1.00 0.00 H new ATOM 0 HG21 VAL A 891 3.158 4.156 14.570 1.00 0.00 H new ATOM 0 HG22 VAL A 891 3.657 3.999 12.869 1.00 0.00 H new ATOM 0 HG23 VAL A 891 3.549 5.609 13.620 1.00 0.00 H new ATOM 132 N PHE A 892 -0.536 4.673 10.698 1.00 0.00 N ATOM 133 CA PHE A 892 -1.959 4.740 10.403 1.00 0.00 C ATOM 134 C PHE A 892 -2.747 3.969 11.460 1.00 0.00 C ATOM 135 O PHE A 892 -2.411 2.831 11.789 1.00 0.00 O ATOM 136 CB PHE A 892 -2.250 4.195 8.994 1.00 0.00 C ATOM 137 CG PHE A 892 -1.757 2.792 8.751 1.00 0.00 C ATOM 138 CD1 PHE A 892 -0.434 2.555 8.411 1.00 0.00 C ATOM 139 CD2 PHE A 892 -2.621 1.713 8.856 1.00 0.00 C ATOM 140 CE1 PHE A 892 0.018 1.271 8.185 1.00 0.00 C ATOM 141 CE2 PHE A 892 -2.172 0.426 8.630 1.00 0.00 C ATOM 142 CZ PHE A 892 -0.852 0.206 8.294 1.00 0.00 C ATOM 0 H PHE A 892 -0.061 3.863 10.300 1.00 0.00 H new ATOM 0 HA PHE A 892 -2.274 5.783 10.427 1.00 0.00 H new ATOM 0 HB2 PHE A 892 -3.326 4.223 8.823 1.00 0.00 H new ATOM 0 HB3 PHE A 892 -1.793 4.859 8.260 1.00 0.00 H new ATOM 0 HD1 PHE A 892 0.251 3.385 8.322 1.00 0.00 H new ATOM 0 HD2 PHE A 892 -3.656 1.880 9.117 1.00 0.00 H new ATOM 0 HE1 PHE A 892 1.052 1.100 7.923 1.00 0.00 H new ATOM 0 HE2 PHE A 892 -2.854 -0.407 8.716 1.00 0.00 H new ATOM 0 HZ PHE A 892 -0.500 -0.799 8.116 1.00 0.00 H new ATOM 152 N VAL A 893 -3.778 4.593 12.005 1.00 0.00 N ATOM 153 CA VAL A 893 -4.556 3.970 13.066 1.00 0.00 C ATOM 154 C VAL A 893 -5.965 3.606 12.592 1.00 0.00 C ATOM 155 O VAL A 893 -6.718 4.466 12.106 1.00 0.00 O ATOM 156 CB VAL A 893 -4.634 4.869 14.322 1.00 0.00 C ATOM 157 CG1 VAL A 893 -3.281 4.925 15.020 1.00 0.00 C ATOM 158 CG2 VAL A 893 -5.107 6.274 13.963 1.00 0.00 C ATOM 0 H VAL A 893 -4.095 5.524 11.734 1.00 0.00 H new ATOM 0 HA VAL A 893 -4.036 3.051 13.336 1.00 0.00 H new ATOM 0 HB VAL A 893 -5.363 4.432 15.005 1.00 0.00 H new ATOM 0 HG11 VAL A 893 -3.353 5.562 15.902 1.00 0.00 H new ATOM 0 HG12 VAL A 893 -2.985 3.920 15.321 1.00 0.00 H new ATOM 0 HG13 VAL A 893 -2.536 5.333 14.337 1.00 0.00 H new ATOM 0 HG21 VAL A 893 -5.152 6.884 14.865 1.00 0.00 H new ATOM 0 HG22 VAL A 893 -4.410 6.723 13.256 1.00 0.00 H new ATOM 0 HG23 VAL A 893 -6.097 6.220 13.511 1.00 0.00 H new ATOM 168 N LYS A 894 -6.286 2.305 12.710 1.00 0.00 N ATOM 169 CA LYS A 894 -7.610 1.750 12.378 1.00 0.00 C ATOM 170 C LYS A 894 -7.969 1.967 10.900 1.00 0.00 C ATOM 171 O LYS A 894 -9.043 1.581 10.441 1.00 0.00 O ATOM 172 CB LYS A 894 -8.679 2.361 13.304 1.00 0.00 C ATOM 173 CG LYS A 894 -10.071 1.775 13.122 1.00 0.00 C ATOM 174 CD LYS A 894 -11.058 2.311 14.148 1.00 0.00 C ATOM 175 CE LYS A 894 -10.721 1.840 15.554 1.00 0.00 C ATOM 176 NZ LYS A 894 -11.803 2.156 16.526 1.00 0.00 N ATOM 0 H LYS A 894 -5.626 1.602 13.042 1.00 0.00 H new ATOM 0 HA LYS A 894 -7.576 0.672 12.538 1.00 0.00 H new ATOM 0 HB2 LYS A 894 -8.370 2.219 14.340 1.00 0.00 H new ATOM 0 HB3 LYS A 894 -8.724 3.436 13.129 1.00 0.00 H new ATOM 0 HG2 LYS A 894 -10.432 2.004 12.119 1.00 0.00 H new ATOM 0 HG3 LYS A 894 -10.020 0.689 13.202 1.00 0.00 H new ATOM 0 HD2 LYS A 894 -11.057 3.401 14.119 1.00 0.00 H new ATOM 0 HD3 LYS A 894 -12.065 1.987 13.887 1.00 0.00 H new ATOM 0 HE2 LYS A 894 -10.547 0.764 15.543 1.00 0.00 H new ATOM 0 HE3 LYS A 894 -9.793 2.310 15.880 1.00 0.00 H new ATOM 0 HZ1 LYS A 894 -11.531 1.817 17.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 894 -11.952 3.185 16.557 1.00 0.00 H new ATOM 0 HZ3 LYS A 894 -12.683 1.687 16.230 1.00 0.00 H new ATOM 190 N ASN A 895 -7.040 2.566 10.163 1.00 0.00 N ATOM 191 CA ASN A 895 -7.279 3.024 8.796 1.00 0.00 C ATOM 192 C ASN A 895 -8.402 4.051 8.778 1.00 0.00 C ATOM 193 O ASN A 895 -9.031 4.284 7.749 1.00 0.00 O ATOM 194 CB ASN A 895 -7.617 1.856 7.861 1.00 0.00 C ATOM 195 CG ASN A 895 -6.390 1.082 7.430 1.00 0.00 C ATOM 196 OD1 ASN A 895 -5.944 0.163 8.118 1.00 0.00 O ATOM 197 ND2 ASN A 895 -5.852 1.432 6.272 1.00 0.00 N ATOM 0 H ASN A 895 -6.094 2.749 10.498 1.00 0.00 H new ATOM 0 HA ASN A 895 -6.361 3.486 8.433 1.00 0.00 H new ATOM 0 HB2 ASN A 895 -8.310 1.181 8.364 1.00 0.00 H new ATOM 0 HB3 ASN A 895 -8.129 2.239 6.978 1.00 0.00 H new ATOM 0 HD21 ASN A 895 -5.036 0.934 5.918 1.00 0.00 H new ATOM 0 HD22 ASN A 895 -6.254 2.200 5.734 1.00 0.00 H new ATOM 204 N VAL A 896 -8.628 4.680 9.924 1.00 0.00 N ATOM 205 CA VAL A 896 -9.567 5.778 10.020 1.00 0.00 C ATOM 206 C VAL A 896 -8.793 7.086 10.105 1.00 0.00 C ATOM 207 O VAL A 896 -9.256 8.142 9.660 1.00 0.00 O ATOM 208 CB VAL A 896 -10.507 5.623 11.245 1.00 0.00 C ATOM 209 CG1 VAL A 896 -9.743 5.710 12.558 1.00 0.00 C ATOM 210 CG2 VAL A 896 -11.619 6.656 11.207 1.00 0.00 C ATOM 0 H VAL A 896 -8.168 4.443 10.803 1.00 0.00 H new ATOM 0 HA VAL A 896 -10.197 5.777 9.130 1.00 0.00 H new ATOM 0 HB VAL A 896 -10.952 4.630 11.187 1.00 0.00 H new ATOM 0 HG11 VAL A 896 -10.437 5.597 13.391 1.00 0.00 H new ATOM 0 HG12 VAL A 896 -8.996 4.917 12.598 1.00 0.00 H new ATOM 0 HG13 VAL A 896 -9.248 6.679 12.627 1.00 0.00 H new ATOM 0 HG21 VAL A 896 -12.265 6.527 12.076 1.00 0.00 H new ATOM 0 HG22 VAL A 896 -11.187 7.657 11.221 1.00 0.00 H new ATOM 0 HG23 VAL A 896 -12.205 6.527 10.297 1.00 0.00 H new ATOM 220 N GLY A 897 -7.593 6.996 10.668 1.00 0.00 N ATOM 221 CA GLY A 897 -6.738 8.152 10.756 1.00 0.00 C ATOM 222 C GLY A 897 -5.291 7.818 10.479 1.00 0.00 C ATOM 223 O GLY A 897 -4.886 6.658 10.567 1.00 0.00 O ATOM 0 H GLY A 897 -7.202 6.141 11.063 1.00 0.00 H new ATOM 0 HA2 GLY A 897 -7.077 8.906 10.046 1.00 0.00 H new ATOM 0 HA3 GLY A 897 -6.824 8.589 11.751 1.00 0.00 H new ATOM 227 N TRP A 898 -4.515 8.830 10.142 1.00 0.00 N ATOM 228 CA TRP A 898 -3.079 8.676 9.990 1.00 0.00 C ATOM 229 C TRP A 898 -2.412 9.623 10.971 1.00 0.00 C ATOM 230 O TRP A 898 -2.790 10.786 11.052 1.00 0.00 O ATOM 231 CB TRP A 898 -2.654 9.018 8.554 1.00 0.00 C ATOM 232 CG TRP A 898 -3.793 9.003 7.571 1.00 0.00 C ATOM 233 CD1 TRP A 898 -4.491 10.084 7.110 1.00 0.00 C ATOM 234 CD2 TRP A 898 -4.369 7.857 6.938 1.00 0.00 C ATOM 235 NE1 TRP A 898 -5.470 9.678 6.236 1.00 0.00 N ATOM 236 CE2 TRP A 898 -5.414 8.316 6.113 1.00 0.00 C ATOM 237 CE3 TRP A 898 -4.106 6.488 6.992 1.00 0.00 C ATOM 238 CZ2 TRP A 898 -6.191 7.453 5.346 1.00 0.00 C ATOM 239 CZ3 TRP A 898 -4.877 5.631 6.229 1.00 0.00 C ATOM 240 CH2 TRP A 898 -5.910 6.117 5.416 1.00 0.00 C ATOM 0 H TRP A 898 -4.857 9.775 9.967 1.00 0.00 H new ATOM 0 HA TRP A 898 -2.784 7.646 10.189 1.00 0.00 H new ATOM 0 HB2 TRP A 898 -2.191 10.005 8.546 1.00 0.00 H new ATOM 0 HB3 TRP A 898 -1.895 8.307 8.229 1.00 0.00 H new ATOM 0 HD1 TRP A 898 -4.300 11.109 7.392 1.00 0.00 H new ATOM 0 HE1 TRP A 898 -6.130 10.291 5.757 1.00 0.00 H new ATOM 0 HE3 TRP A 898 -3.314 6.105 7.619 1.00 0.00 H new ATOM 0 HZ2 TRP A 898 -6.987 7.825 4.718 1.00 0.00 H new ATOM 0 HZ3 TRP A 898 -4.680 4.570 6.260 1.00 0.00 H new ATOM 0 HH2 TRP A 898 -6.496 5.422 4.833 1.00 0.00 H new ATOM 251 N ALA A 899 -1.419 9.154 11.702 1.00 0.00 N ATOM 252 CA ALA A 899 -0.843 9.966 12.763 1.00 0.00 C ATOM 253 C ALA A 899 0.657 10.128 12.610 1.00 0.00 C ATOM 254 O ALA A 899 1.390 9.155 12.424 1.00 0.00 O ATOM 255 CB ALA A 899 -1.170 9.366 14.124 1.00 0.00 C ATOM 0 H ALA A 899 -0.998 8.232 11.586 1.00 0.00 H new ATOM 0 HA ALA A 899 -1.287 10.958 12.688 1.00 0.00 H new ATOM 0 HB1 ALA A 899 -0.733 9.984 14.908 1.00 0.00 H new ATOM 0 HB2 ALA A 899 -2.252 9.326 14.254 1.00 0.00 H new ATOM 0 HB3 ALA A 899 -0.760 8.358 14.185 1.00 0.00 H new ATOM 261 N THR A 900 1.102 11.366 12.699 1.00 0.00 N ATOM 262 CA THR A 900 2.513 11.684 12.714 1.00 0.00 C ATOM 263 C THR A 900 2.876 12.302 14.060 1.00 0.00 C ATOM 264 O THR A 900 2.243 13.268 14.498 1.00 0.00 O ATOM 265 CB THR A 900 2.877 12.669 11.583 1.00 0.00 C ATOM 266 OG1 THR A 900 2.461 12.147 10.312 1.00 0.00 O ATOM 267 CG2 THR A 900 4.375 12.940 11.551 1.00 0.00 C ATOM 0 H THR A 900 0.492 12.181 12.763 1.00 0.00 H new ATOM 0 HA THR A 900 3.074 10.763 12.558 1.00 0.00 H new ATOM 0 HB THR A 900 2.356 13.606 11.780 1.00 0.00 H new ATOM 0 HG1 THR A 900 2.412 11.169 10.360 1.00 0.00 H new ATOM 0 HG21 THR A 900 4.601 13.637 10.744 1.00 0.00 H new ATOM 0 HG22 THR A 900 4.687 13.372 12.502 1.00 0.00 H new ATOM 0 HG23 THR A 900 4.910 12.005 11.384 1.00 0.00 H new ATOM 275 N GLN A 901 3.865 11.735 14.732 1.00 0.00 N ATOM 276 CA GLN A 901 4.302 12.275 16.006 1.00 0.00 C ATOM 277 C GLN A 901 5.337 13.364 15.779 1.00 0.00 C ATOM 278 O GLN A 901 6.352 13.144 15.114 1.00 0.00 O ATOM 279 CB GLN A 901 4.889 11.178 16.897 1.00 0.00 C ATOM 280 CG GLN A 901 5.310 11.680 18.274 1.00 0.00 C ATOM 281 CD GLN A 901 5.975 10.612 19.121 1.00 0.00 C ATOM 282 OE1 GLN A 901 6.621 9.702 18.604 1.00 0.00 O ATOM 283 NE2 GLN A 901 5.832 10.727 20.434 1.00 0.00 N ATOM 0 H GLN A 901 4.375 10.909 14.419 1.00 0.00 H new ATOM 0 HA GLN A 901 3.434 12.698 16.512 1.00 0.00 H new ATOM 0 HB2 GLN A 901 4.152 10.384 17.017 1.00 0.00 H new ATOM 0 HB3 GLN A 901 5.753 10.738 16.399 1.00 0.00 H new ATOM 0 HG2 GLN A 901 5.996 12.519 18.154 1.00 0.00 H new ATOM 0 HG3 GLN A 901 4.433 12.058 18.800 1.00 0.00 H new ATOM 0 HE21 GLN A 901 5.288 11.497 20.822 1.00 0.00 H new ATOM 0 HE22 GLN A 901 6.266 10.045 21.056 1.00 0.00 H new ATOM 292 N LEU A 902 5.067 14.542 16.310 1.00 0.00 N ATOM 293 CA LEU A 902 6.016 15.635 16.246 1.00 0.00 C ATOM 294 C LEU A 902 6.963 15.538 17.432 1.00 0.00 C ATOM 295 O LEU A 902 6.542 15.205 18.540 1.00 0.00 O ATOM 296 CB LEU A 902 5.305 16.998 16.255 1.00 0.00 C ATOM 297 CG LEU A 902 4.475 17.343 15.008 1.00 0.00 C ATOM 298 CD1 LEU A 902 5.282 17.115 13.740 1.00 0.00 C ATOM 299 CD2 LEU A 902 3.174 16.552 14.969 1.00 0.00 C ATOM 0 H LEU A 902 4.196 14.766 16.791 1.00 0.00 H new ATOM 0 HA LEU A 902 6.573 15.558 15.312 1.00 0.00 H new ATOM 0 HB2 LEU A 902 4.648 17.035 17.124 1.00 0.00 H new ATOM 0 HB3 LEU A 902 6.057 17.775 16.391 1.00 0.00 H new ATOM 0 HG LEU A 902 4.219 18.401 15.065 1.00 0.00 H new ATOM 0 HD11 LEU A 902 4.673 17.366 12.871 1.00 0.00 H new ATOM 0 HD12 LEU A 902 6.170 17.747 13.755 1.00 0.00 H new ATOM 0 HD13 LEU A 902 5.582 16.069 13.683 1.00 0.00 H new ATOM 0 HD21 LEU A 902 2.612 16.820 14.075 1.00 0.00 H new ATOM 0 HD22 LEU A 902 3.397 15.485 14.951 1.00 0.00 H new ATOM 0 HD23 LEU A 902 2.581 16.784 15.854 1.00 0.00 H new ATOM 311 N THR A 903 8.233 15.844 17.207 1.00 0.00 N ATOM 312 CA THR A 903 9.238 15.782 18.262 1.00 0.00 C ATOM 313 C THR A 903 8.966 16.846 19.334 1.00 0.00 C ATOM 314 O THR A 903 9.587 16.862 20.398 1.00 0.00 O ATOM 315 CB THR A 903 10.645 15.975 17.670 1.00 0.00 C ATOM 316 OG1 THR A 903 10.745 15.246 16.438 1.00 0.00 O ATOM 317 CG2 THR A 903 11.719 15.485 18.629 1.00 0.00 C ATOM 0 H THR A 903 8.594 16.139 16.300 1.00 0.00 H new ATOM 0 HA THR A 903 9.183 14.799 18.730 1.00 0.00 H new ATOM 0 HB THR A 903 10.799 17.040 17.495 1.00 0.00 H new ATOM 0 HG1 THR A 903 11.640 15.368 16.057 1.00 0.00 H new ATOM 0 HG21 THR A 903 12.702 15.635 18.182 1.00 0.00 H new ATOM 0 HG22 THR A 903 11.656 16.044 19.563 1.00 0.00 H new ATOM 0 HG23 THR A 903 11.570 14.424 18.831 1.00 0.00 H new ATOM 325 N SER A 904 8.012 17.720 19.041 1.00 0.00 N ATOM 326 CA SER A 904 7.610 18.771 19.961 1.00 0.00 C ATOM 327 C SER A 904 6.561 18.261 20.953 1.00 0.00 C ATOM 328 O SER A 904 6.080 19.012 21.800 1.00 0.00 O ATOM 329 CB SER A 904 7.036 19.938 19.162 1.00 0.00 C ATOM 330 OG SER A 904 7.819 20.190 18.006 1.00 0.00 O ATOM 0 H SER A 904 7.497 17.719 18.160 1.00 0.00 H new ATOM 0 HA SER A 904 8.483 19.096 20.527 1.00 0.00 H new ATOM 0 HB2 SER A 904 6.010 19.715 18.870 1.00 0.00 H new ATOM 0 HB3 SER A 904 7.003 20.831 19.786 1.00 0.00 H new ATOM 0 HG SER A 904 7.434 20.940 17.507 1.00 0.00 H new ATOM 336 N GLY A 905 6.202 16.985 20.832 1.00 0.00 N ATOM 337 CA GLY A 905 5.243 16.385 21.748 1.00 0.00 C ATOM 338 C GLY A 905 3.814 16.512 21.263 1.00 0.00 C ATOM 339 O GLY A 905 2.872 16.143 21.965 1.00 0.00 O ATOM 0 H GLY A 905 6.559 16.354 20.115 1.00 0.00 H new ATOM 0 HA2 GLY A 905 5.485 15.331 21.881 1.00 0.00 H new ATOM 0 HA3 GLY A 905 5.334 16.859 22.725 1.00 0.00 H new ATOM 343 N ALA A 906 3.649 17.055 20.069 1.00 0.00 N ATOM 344 CA ALA A 906 2.338 17.163 19.459 1.00 0.00 C ATOM 345 C ALA A 906 2.062 15.946 18.593 1.00 0.00 C ATOM 346 O ALA A 906 2.966 15.422 17.945 1.00 0.00 O ATOM 347 CB ALA A 906 2.237 18.438 18.639 1.00 0.00 C ATOM 0 H ALA A 906 4.410 17.429 19.502 1.00 0.00 H new ATOM 0 HA ALA A 906 1.587 17.205 20.248 1.00 0.00 H new ATOM 0 HB1 ALA A 906 1.247 18.503 18.188 1.00 0.00 H new ATOM 0 HB2 ALA A 906 2.399 19.300 19.286 1.00 0.00 H new ATOM 0 HB3 ALA A 906 2.993 18.426 17.854 1.00 0.00 H new ATOM 353 N VAL A 907 0.827 15.485 18.591 1.00 0.00 N ATOM 354 CA VAL A 907 0.444 14.392 17.721 1.00 0.00 C ATOM 355 C VAL A 907 -0.537 14.891 16.674 1.00 0.00 C ATOM 356 O VAL A 907 -1.586 15.448 17.007 1.00 0.00 O ATOM 357 CB VAL A 907 -0.191 13.224 18.506 1.00 0.00 C ATOM 358 CG1 VAL A 907 -0.487 12.057 17.576 1.00 0.00 C ATOM 359 CG2 VAL A 907 0.717 12.784 19.646 1.00 0.00 C ATOM 0 H VAL A 907 0.076 15.848 19.178 1.00 0.00 H new ATOM 0 HA VAL A 907 1.349 14.019 17.242 1.00 0.00 H new ATOM 0 HB VAL A 907 -1.131 13.570 18.935 1.00 0.00 H new ATOM 0 HG11 VAL A 907 -0.934 11.242 18.145 1.00 0.00 H new ATOM 0 HG12 VAL A 907 -1.179 12.378 16.798 1.00 0.00 H new ATOM 0 HG13 VAL A 907 0.440 11.713 17.117 1.00 0.00 H new ATOM 0 HG21 VAL A 907 0.250 11.960 20.186 1.00 0.00 H new ATOM 0 HG22 VAL A 907 1.675 12.457 19.242 1.00 0.00 H new ATOM 0 HG23 VAL A 907 0.877 13.620 20.327 1.00 0.00 H new ATOM 369 N TRP A 908 -0.188 14.702 15.415 1.00 0.00 N ATOM 370 CA TRP A 908 -1.044 15.119 14.326 1.00 0.00 C ATOM 371 C TRP A 908 -1.665 13.898 13.669 1.00 0.00 C ATOM 372 O TRP A 908 -0.967 13.084 13.064 1.00 0.00 O ATOM 373 CB TRP A 908 -0.227 15.931 13.316 1.00 0.00 C ATOM 374 CG TRP A 908 -0.977 16.314 12.074 1.00 0.00 C ATOM 375 CD1 TRP A 908 -1.909 17.304 11.947 1.00 0.00 C ATOM 376 CD2 TRP A 908 -0.838 15.723 10.777 1.00 0.00 C ATOM 377 NE1 TRP A 908 -2.358 17.360 10.650 1.00 0.00 N ATOM 378 CE2 TRP A 908 -1.718 16.399 9.914 1.00 0.00 C ATOM 379 CE3 TRP A 908 -0.053 14.686 10.261 1.00 0.00 C ATOM 380 CZ2 TRP A 908 -1.835 16.074 8.566 1.00 0.00 C ATOM 381 CZ3 TRP A 908 -0.172 14.362 8.923 1.00 0.00 C ATOM 382 CH2 TRP A 908 -1.056 15.055 8.088 1.00 0.00 C ATOM 0 H TRP A 908 0.684 14.261 15.123 1.00 0.00 H new ATOM 0 HA TRP A 908 -1.848 15.749 14.706 1.00 0.00 H new ATOM 0 HB2 TRP A 908 0.132 16.838 13.803 1.00 0.00 H new ATOM 0 HB3 TRP A 908 0.652 15.353 13.031 1.00 0.00 H new ATOM 0 HD1 TRP A 908 -2.243 17.947 12.747 1.00 0.00 H new ATOM 0 HE1 TRP A 908 -3.056 18.012 10.293 1.00 0.00 H new ATOM 0 HE3 TRP A 908 0.634 14.148 10.897 1.00 0.00 H new ATOM 0 HZ2 TRP A 908 -2.517 16.607 7.920 1.00 0.00 H new ATOM 0 HZ3 TRP A 908 0.427 13.561 8.515 1.00 0.00 H new ATOM 0 HH2 TRP A 908 -1.125 14.780 7.046 1.00 0.00 H new ATOM 393 N VAL A 909 -2.969 13.759 13.813 1.00 0.00 N ATOM 394 CA VAL A 909 -3.684 12.668 13.186 1.00 0.00 C ATOM 395 C VAL A 909 -4.695 13.196 12.170 1.00 0.00 C ATOM 396 O VAL A 909 -5.620 13.940 12.502 1.00 0.00 O ATOM 397 CB VAL A 909 -4.364 11.738 14.225 1.00 0.00 C ATOM 398 CG1 VAL A 909 -5.278 12.513 15.157 1.00 0.00 C ATOM 399 CG2 VAL A 909 -5.118 10.615 13.530 1.00 0.00 C ATOM 0 H VAL A 909 -3.554 14.390 14.360 1.00 0.00 H new ATOM 0 HA VAL A 909 -2.949 12.062 12.656 1.00 0.00 H new ATOM 0 HB VAL A 909 -3.578 11.295 14.836 1.00 0.00 H new ATOM 0 HG11 VAL A 909 -5.736 11.828 15.870 1.00 0.00 H new ATOM 0 HG12 VAL A 909 -4.698 13.263 15.695 1.00 0.00 H new ATOM 0 HG13 VAL A 909 -6.057 13.006 14.576 1.00 0.00 H new ATOM 0 HG21 VAL A 909 -5.587 9.975 14.277 1.00 0.00 H new ATOM 0 HG22 VAL A 909 -5.885 11.039 12.882 1.00 0.00 H new ATOM 0 HG23 VAL A 909 -4.423 10.026 12.932 1.00 0.00 H new ATOM 409 N GLN A 910 -4.492 12.823 10.925 1.00 0.00 N ATOM 410 CA GLN A 910 -5.384 13.217 9.850 1.00 0.00 C ATOM 411 C GLN A 910 -6.463 12.159 9.659 1.00 0.00 C ATOM 412 O GLN A 910 -6.207 10.970 9.812 1.00 0.00 O ATOM 413 CB GLN A 910 -4.603 13.408 8.545 1.00 0.00 C ATOM 414 CG GLN A 910 -5.468 13.875 7.383 1.00 0.00 C ATOM 415 CD GLN A 910 -4.749 13.838 6.048 1.00 0.00 C ATOM 416 OE1 GLN A 910 -5.370 13.637 5.005 1.00 0.00 O ATOM 417 NE2 GLN A 910 -3.441 14.033 6.065 1.00 0.00 N ATOM 0 H GLN A 910 -3.709 12.241 10.628 1.00 0.00 H new ATOM 0 HA GLN A 910 -5.852 14.165 10.116 1.00 0.00 H new ATOM 0 HB2 GLN A 910 -3.807 14.134 8.710 1.00 0.00 H new ATOM 0 HB3 GLN A 910 -4.124 12.466 8.276 1.00 0.00 H new ATOM 0 HG2 GLN A 910 -6.358 13.248 7.326 1.00 0.00 H new ATOM 0 HG3 GLN A 910 -5.807 14.893 7.577 1.00 0.00 H new ATOM 0 HE21 GLN A 910 -2.961 14.197 6.950 1.00 0.00 H new ATOM 0 HE22 GLN A 910 -2.912 14.020 5.193 1.00 0.00 H new ATOM 426 N PHE A 911 -7.668 12.604 9.350 1.00 0.00 N ATOM 427 CA PHE A 911 -8.776 11.710 9.063 1.00 0.00 C ATOM 428 C PHE A 911 -8.833 11.462 7.558 1.00 0.00 C ATOM 429 O PHE A 911 -8.446 12.328 6.773 1.00 0.00 O ATOM 430 CB PHE A 911 -10.081 12.349 9.556 1.00 0.00 C ATOM 431 CG PHE A 911 -11.231 11.394 9.732 1.00 0.00 C ATOM 432 CD1 PHE A 911 -12.034 11.039 8.663 1.00 0.00 C ATOM 433 CD2 PHE A 911 -11.516 10.863 10.980 1.00 0.00 C ATOM 434 CE1 PHE A 911 -13.095 10.172 8.832 1.00 0.00 C ATOM 435 CE2 PHE A 911 -12.575 9.995 11.156 1.00 0.00 C ATOM 436 CZ PHE A 911 -13.366 9.648 10.080 1.00 0.00 C ATOM 0 H PHE A 911 -7.906 13.594 9.291 1.00 0.00 H new ATOM 0 HA PHE A 911 -8.639 10.757 9.575 1.00 0.00 H new ATOM 0 HB2 PHE A 911 -9.889 12.842 10.509 1.00 0.00 H new ATOM 0 HB3 PHE A 911 -10.377 13.125 8.850 1.00 0.00 H new ATOM 0 HD1 PHE A 911 -11.828 11.445 7.684 1.00 0.00 H new ATOM 0 HD2 PHE A 911 -10.901 11.132 11.826 1.00 0.00 H new ATOM 0 HE1 PHE A 911 -13.713 9.904 7.988 1.00 0.00 H new ATOM 0 HE2 PHE A 911 -12.784 9.588 12.134 1.00 0.00 H new ATOM 0 HZ PHE A 911 -14.195 8.968 10.214 1.00 0.00 H new ATOM 446 N ASN A 912 -9.309 10.289 7.157 1.00 0.00 N ATOM 447 CA ASN A 912 -9.379 9.934 5.736 1.00 0.00 C ATOM 448 C ASN A 912 -10.277 10.902 4.960 1.00 0.00 C ATOM 449 O ASN A 912 -10.167 11.025 3.743 1.00 0.00 O ATOM 450 CB ASN A 912 -9.900 8.504 5.564 1.00 0.00 C ATOM 451 CG ASN A 912 -9.840 8.030 4.119 1.00 0.00 C ATOM 452 OD1 ASN A 912 -8.910 8.360 3.379 1.00 0.00 O ATOM 453 ND2 ASN A 912 -10.840 7.267 3.700 1.00 0.00 N ATOM 0 H ASN A 912 -9.652 9.567 7.790 1.00 0.00 H new ATOM 0 HA ASN A 912 -8.368 10.002 5.333 1.00 0.00 H new ATOM 0 HB2 ASN A 912 -9.314 7.830 6.188 1.00 0.00 H new ATOM 0 HB3 ASN A 912 -10.930 8.451 5.918 1.00 0.00 H new ATOM 0 HD21 ASN A 912 -10.857 6.933 2.737 1.00 0.00 H new ATOM 0 HD22 ASN A 912 -11.592 7.014 4.341 1.00 0.00 H new ATOM 460 N ASP A 913 -11.141 11.610 5.679 1.00 0.00 N ATOM 461 CA ASP A 913 -12.094 12.531 5.063 1.00 0.00 C ATOM 462 C ASP A 913 -11.427 13.866 4.707 1.00 0.00 C ATOM 463 O ASP A 913 -12.060 14.769 4.163 1.00 0.00 O ATOM 464 CB ASP A 913 -13.262 12.758 6.027 1.00 0.00 C ATOM 465 CG ASP A 913 -14.343 13.657 5.467 1.00 0.00 C ATOM 466 OD1 ASP A 913 -15.018 13.252 4.501 1.00 0.00 O ATOM 467 OD2 ASP A 913 -14.537 14.764 6.011 1.00 0.00 O ATOM 0 H ASP A 913 -11.202 11.564 6.696 1.00 0.00 H new ATOM 0 HA ASP A 913 -12.461 12.091 4.136 1.00 0.00 H new ATOM 0 HB2 ASP A 913 -13.701 11.794 6.287 1.00 0.00 H new ATOM 0 HB3 ASP A 913 -12.881 13.194 6.950 1.00 0.00 H new ATOM 472 N GLY A 914 -10.134 13.968 4.980 1.00 0.00 N ATOM 473 CA GLY A 914 -9.396 15.173 4.638 1.00 0.00 C ATOM 474 C GLY A 914 -9.363 16.187 5.767 1.00 0.00 C ATOM 475 O GLY A 914 -8.865 17.300 5.599 1.00 0.00 O ATOM 0 H GLY A 914 -9.581 13.240 5.432 1.00 0.00 H new ATOM 0 HA2 GLY A 914 -8.375 14.903 4.369 1.00 0.00 H new ATOM 0 HA3 GLY A 914 -9.847 15.631 3.758 1.00 0.00 H new ATOM 479 N SER A 915 -9.889 15.807 6.919 1.00 0.00 N ATOM 480 CA SER A 915 -9.848 16.663 8.092 1.00 0.00 C ATOM 481 C SER A 915 -8.659 16.282 8.966 1.00 0.00 C ATOM 482 O SER A 915 -8.212 15.140 8.943 1.00 0.00 O ATOM 483 CB SER A 915 -11.165 16.555 8.862 1.00 0.00 C ATOM 484 OG SER A 915 -11.581 15.202 8.984 1.00 0.00 O ATOM 0 H SER A 915 -10.350 14.909 7.067 1.00 0.00 H new ATOM 0 HA SER A 915 -9.723 17.701 7.784 1.00 0.00 H new ATOM 0 HB2 SER A 915 -11.046 16.992 9.853 1.00 0.00 H new ATOM 0 HB3 SER A 915 -11.936 17.130 8.350 1.00 0.00 H new ATOM 0 HG SER A 915 -12.559 15.163 9.023 1.00 0.00 H new ATOM 490 N GLN A 916 -8.147 17.228 9.736 1.00 0.00 N ATOM 491 CA GLN A 916 -6.918 17.007 10.488 1.00 0.00 C ATOM 492 C GLN A 916 -7.158 17.211 11.974 1.00 0.00 C ATOM 493 O GLN A 916 -8.092 17.906 12.366 1.00 0.00 O ATOM 494 CB GLN A 916 -5.822 17.959 10.004 1.00 0.00 C ATOM 495 CG GLN A 916 -5.470 17.793 8.534 1.00 0.00 C ATOM 496 CD GLN A 916 -4.423 18.789 8.074 1.00 0.00 C ATOM 497 OE1 GLN A 916 -3.573 19.222 8.854 1.00 0.00 O ATOM 498 NE2 GLN A 916 -4.475 19.156 6.806 1.00 0.00 N ATOM 0 H GLN A 916 -8.559 18.153 9.858 1.00 0.00 H new ATOM 0 HA GLN A 916 -6.595 15.979 10.323 1.00 0.00 H new ATOM 0 HB2 GLN A 916 -6.143 18.986 10.177 1.00 0.00 H new ATOM 0 HB3 GLN A 916 -4.925 17.800 10.603 1.00 0.00 H new ATOM 0 HG2 GLN A 916 -5.104 16.781 8.363 1.00 0.00 H new ATOM 0 HG3 GLN A 916 -6.371 17.913 7.932 1.00 0.00 H new ATOM 0 HE21 GLN A 916 -5.195 18.773 6.193 1.00 0.00 H new ATOM 0 HE22 GLN A 916 -3.795 19.822 6.440 1.00 0.00 H new ATOM 507 N LEU A 917 -6.333 16.587 12.797 1.00 0.00 N ATOM 508 CA LEU A 917 -6.438 16.758 14.234 1.00 0.00 C ATOM 509 C LEU A 917 -5.051 16.906 14.849 1.00 0.00 C ATOM 510 O LEU A 917 -4.158 16.111 14.565 1.00 0.00 O ATOM 511 CB LEU A 917 -7.160 15.524 14.795 1.00 0.00 C ATOM 512 CG LEU A 917 -7.522 15.526 16.280 1.00 0.00 C ATOM 513 CD1 LEU A 917 -8.604 14.490 16.529 1.00 0.00 C ATOM 514 CD2 LEU A 917 -6.310 15.221 17.151 1.00 0.00 C ATOM 0 H LEU A 917 -5.587 15.960 12.496 1.00 0.00 H new ATOM 0 HA LEU A 917 -6.999 17.661 14.477 1.00 0.00 H new ATOM 0 HB2 LEU A 917 -8.079 15.386 14.226 1.00 0.00 H new ATOM 0 HB3 LEU A 917 -6.533 14.653 14.604 1.00 0.00 H new ATOM 0 HG LEU A 917 -7.882 16.520 16.545 1.00 0.00 H new ATOM 0 HD11 LEU A 917 -8.867 14.486 17.587 1.00 0.00 H new ATOM 0 HD12 LEU A 917 -9.486 14.735 15.937 1.00 0.00 H new ATOM 0 HD13 LEU A 917 -8.237 13.504 16.243 1.00 0.00 H new ATOM 0 HD21 LEU A 917 -6.604 15.231 18.200 1.00 0.00 H new ATOM 0 HD22 LEU A 917 -5.915 14.238 16.894 1.00 0.00 H new ATOM 0 HD23 LEU A 917 -5.542 15.976 16.983 1.00 0.00 H new ATOM 526 N VAL A 918 -4.878 17.922 15.686 1.00 0.00 N ATOM 527 CA VAL A 918 -3.666 18.061 16.483 1.00 0.00 C ATOM 528 C VAL A 918 -3.999 17.992 17.971 1.00 0.00 C ATOM 529 O VAL A 918 -4.783 18.801 18.471 1.00 0.00 O ATOM 530 CB VAL A 918 -2.938 19.391 16.192 1.00 0.00 C ATOM 531 CG1 VAL A 918 -1.625 19.467 16.956 1.00 0.00 C ATOM 532 CG2 VAL A 918 -2.697 19.564 14.701 1.00 0.00 C ATOM 0 H VAL A 918 -5.564 18.663 15.830 1.00 0.00 H new ATOM 0 HA VAL A 918 -3.006 17.238 16.210 1.00 0.00 H new ATOM 0 HB VAL A 918 -3.580 20.205 16.530 1.00 0.00 H new ATOM 0 HG11 VAL A 918 -1.130 20.413 16.735 1.00 0.00 H new ATOM 0 HG12 VAL A 918 -1.822 19.402 18.026 1.00 0.00 H new ATOM 0 HG13 VAL A 918 -0.981 18.641 16.655 1.00 0.00 H new ATOM 0 HG21 VAL A 918 -2.183 20.508 14.523 1.00 0.00 H new ATOM 0 HG22 VAL A 918 -2.083 18.742 14.334 1.00 0.00 H new ATOM 0 HG23 VAL A 918 -3.652 19.566 14.176 1.00 0.00 H new ATOM 542 N VAL A 919 -3.424 17.037 18.677 1.00 0.00 N ATOM 543 CA VAL A 919 -3.540 17.004 20.127 1.00 0.00 C ATOM 544 C VAL A 919 -2.153 17.057 20.761 1.00 0.00 C ATOM 545 O VAL A 919 -1.188 16.534 20.198 1.00 0.00 O ATOM 546 CB VAL A 919 -4.326 15.765 20.621 1.00 0.00 C ATOM 547 CG1 VAL A 919 -3.545 14.486 20.391 1.00 0.00 C ATOM 548 CG2 VAL A 919 -4.704 15.911 22.087 1.00 0.00 C ATOM 0 H VAL A 919 -2.875 16.277 18.276 1.00 0.00 H new ATOM 0 HA VAL A 919 -4.108 17.881 20.436 1.00 0.00 H new ATOM 0 HB VAL A 919 -5.244 15.703 20.036 1.00 0.00 H new ATOM 0 HG11 VAL A 919 -4.126 13.636 20.749 1.00 0.00 H new ATOM 0 HG12 VAL A 919 -3.347 14.367 19.326 1.00 0.00 H new ATOM 0 HG13 VAL A 919 -2.600 14.534 20.933 1.00 0.00 H new ATOM 0 HG21 VAL A 919 -5.255 15.028 22.410 1.00 0.00 H new ATOM 0 HG22 VAL A 919 -3.800 16.014 22.687 1.00 0.00 H new ATOM 0 HG23 VAL A 919 -5.328 16.795 22.216 1.00 0.00 H new ATOM 558 N GLN A 920 -2.040 17.712 21.904 1.00 0.00 N ATOM 559 CA GLN A 920 -0.774 17.769 22.614 1.00 0.00 C ATOM 560 C GLN A 920 -0.700 16.638 23.632 1.00 0.00 C ATOM 561 O GLN A 920 -1.694 16.317 24.286 1.00 0.00 O ATOM 562 CB GLN A 920 -0.621 19.129 23.294 1.00 0.00 C ATOM 563 CG GLN A 920 0.698 19.314 24.025 1.00 0.00 C ATOM 564 CD GLN A 920 0.880 20.731 24.531 1.00 0.00 C ATOM 565 OE1 GLN A 920 0.396 21.687 23.924 1.00 0.00 O ATOM 566 NE2 GLN A 920 1.575 20.880 25.644 1.00 0.00 N ATOM 0 H GLN A 920 -2.806 18.210 22.358 1.00 0.00 H new ATOM 0 HA GLN A 920 0.046 17.646 21.906 1.00 0.00 H new ATOM 0 HB2 GLN A 920 -0.720 19.912 22.542 1.00 0.00 H new ATOM 0 HB3 GLN A 920 -1.438 19.263 24.003 1.00 0.00 H new ATOM 0 HG2 GLN A 920 0.746 18.621 24.865 1.00 0.00 H new ATOM 0 HG3 GLN A 920 1.520 19.061 23.356 1.00 0.00 H new ATOM 0 HE21 GLN A 920 1.960 20.063 26.118 1.00 0.00 H new ATOM 0 HE22 GLN A 920 1.727 21.812 26.030 1.00 0.00 H new ATOM 575 N ALA A 921 0.466 16.018 23.745 1.00 0.00 N ATOM 576 CA ALA A 921 0.663 14.924 24.686 1.00 0.00 C ATOM 577 C ALA A 921 0.443 15.374 26.129 1.00 0.00 C ATOM 578 O ALA A 921 1.017 16.368 26.574 1.00 0.00 O ATOM 579 CB ALA A 921 2.053 14.335 24.524 1.00 0.00 C ATOM 0 H ALA A 921 1.292 16.255 23.195 1.00 0.00 H new ATOM 0 HA ALA A 921 -0.079 14.157 24.462 1.00 0.00 H new ATOM 0 HB1 ALA A 921 2.187 13.518 25.233 1.00 0.00 H new ATOM 0 HB2 ALA A 921 2.172 13.957 23.509 1.00 0.00 H new ATOM 0 HB3 ALA A 921 2.799 15.106 24.714 1.00 0.00 H new ATOM 585 N GLY A 922 -0.390 14.637 26.850 1.00 0.00 N ATOM 586 CA GLY A 922 -0.591 14.895 28.265 1.00 0.00 C ATOM 587 C GLY A 922 -1.818 15.741 28.547 1.00 0.00 C ATOM 588 O GLY A 922 -2.192 15.935 29.705 1.00 0.00 O ATOM 0 H GLY A 922 -0.935 13.859 26.478 1.00 0.00 H new ATOM 0 HA2 GLY A 922 -0.683 13.945 28.792 1.00 0.00 H new ATOM 0 HA3 GLY A 922 0.289 15.398 28.665 1.00 0.00 H new ATOM 592 N VAL A 923 -2.457 16.242 27.498 1.00 0.00 N ATOM 593 CA VAL A 923 -3.655 17.057 27.665 1.00 0.00 C ATOM 594 C VAL A 923 -4.783 16.564 26.768 1.00 0.00 C ATOM 595 O VAL A 923 -4.545 15.904 25.757 1.00 0.00 O ATOM 596 CB VAL A 923 -3.395 18.554 27.371 1.00 0.00 C ATOM 597 CG1 VAL A 923 -2.359 19.125 28.328 1.00 0.00 C ATOM 598 CG2 VAL A 923 -2.958 18.762 25.928 1.00 0.00 C ATOM 0 H VAL A 923 -2.170 16.101 26.530 1.00 0.00 H new ATOM 0 HA VAL A 923 -3.946 16.958 28.711 1.00 0.00 H new ATOM 0 HB VAL A 923 -4.333 19.088 27.522 1.00 0.00 H new ATOM 0 HG11 VAL A 923 -2.195 20.178 28.100 1.00 0.00 H new ATOM 0 HG12 VAL A 923 -2.717 19.027 29.353 1.00 0.00 H new ATOM 0 HG13 VAL A 923 -1.422 18.579 28.218 1.00 0.00 H new ATOM 0 HG21 VAL A 923 -2.783 19.823 25.750 1.00 0.00 H new ATOM 0 HG22 VAL A 923 -2.039 18.206 25.742 1.00 0.00 H new ATOM 0 HG23 VAL A 923 -3.739 18.406 25.256 1.00 0.00 H new ATOM 608 N SER A 924 -6.011 16.873 27.153 1.00 0.00 N ATOM 609 CA SER A 924 -7.174 16.514 26.358 1.00 0.00 C ATOM 610 C SER A 924 -7.520 17.624 25.369 1.00 0.00 C ATOM 611 O SER A 924 -8.419 17.472 24.544 1.00 0.00 O ATOM 612 CB SER A 924 -8.371 16.227 27.264 1.00 0.00 C ATOM 613 OG SER A 924 -8.074 15.198 28.197 1.00 0.00 O ATOM 0 H SER A 924 -6.228 17.374 28.015 1.00 0.00 H new ATOM 0 HA SER A 924 -6.933 15.613 25.794 1.00 0.00 H new ATOM 0 HB2 SER A 924 -8.653 17.135 27.797 1.00 0.00 H new ATOM 0 HB3 SER A 924 -9.228 15.935 26.657 1.00 0.00 H new ATOM 0 HG SER A 924 -8.856 15.036 28.765 1.00 0.00 H new ATOM 619 N SER A 925 -6.812 18.746 25.467 1.00 0.00 N ATOM 620 CA SER A 925 -7.067 19.881 24.590 1.00 0.00 C ATOM 621 C SER A 925 -6.642 19.540 23.165 1.00 0.00 C ATOM 622 O SER A 925 -5.455 19.360 22.877 1.00 0.00 O ATOM 623 CB SER A 925 -6.336 21.131 25.092 1.00 0.00 C ATOM 624 OG SER A 925 -6.752 22.293 24.386 1.00 0.00 O ATOM 0 H SER A 925 -6.061 18.892 26.142 1.00 0.00 H new ATOM 0 HA SER A 925 -8.136 20.096 24.595 1.00 0.00 H new ATOM 0 HB2 SER A 925 -6.526 21.263 26.157 1.00 0.00 H new ATOM 0 HB3 SER A 925 -5.261 20.997 24.975 1.00 0.00 H new ATOM 0 HG SER A 925 -7.049 22.975 25.024 1.00 0.00 H new ATOM 630 N ILE A 926 -7.622 19.436 22.286 1.00 0.00 N ATOM 631 CA ILE A 926 -7.392 19.004 20.920 1.00 0.00 C ATOM 632 C ILE A 926 -7.836 20.077 19.927 1.00 0.00 C ATOM 633 O ILE A 926 -8.786 20.814 20.180 1.00 0.00 O ATOM 634 CB ILE A 926 -8.133 17.662 20.670 1.00 0.00 C ATOM 635 CG1 ILE A 926 -8.161 17.270 19.185 1.00 0.00 C ATOM 636 CG2 ILE A 926 -9.542 17.732 21.234 1.00 0.00 C ATOM 637 CD1 ILE A 926 -9.368 17.786 18.417 1.00 0.00 C ATOM 0 H ILE A 926 -8.597 19.648 22.498 1.00 0.00 H new ATOM 0 HA ILE A 926 -6.324 18.847 20.769 1.00 0.00 H new ATOM 0 HB ILE A 926 -7.575 16.882 21.188 1.00 0.00 H new ATOM 0 HG12 ILE A 926 -7.256 17.644 18.707 1.00 0.00 H new ATOM 0 HG13 ILE A 926 -8.136 16.183 19.109 1.00 0.00 H new ATOM 0 HG21 ILE A 926 -10.053 16.786 21.054 1.00 0.00 H new ATOM 0 HG22 ILE A 926 -9.496 17.921 22.307 1.00 0.00 H new ATOM 0 HG23 ILE A 926 -10.089 18.539 20.747 1.00 0.00 H new ATOM 0 HD11 ILE A 926 -9.304 17.462 17.378 1.00 0.00 H new ATOM 0 HD12 ILE A 926 -10.280 17.392 18.865 1.00 0.00 H new ATOM 0 HD13 ILE A 926 -9.386 18.875 18.456 1.00 0.00 H new ATOM 649 N SER A 927 -7.131 20.171 18.810 1.00 0.00 N ATOM 650 CA SER A 927 -7.480 21.104 17.753 1.00 0.00 C ATOM 651 C SER A 927 -7.856 20.334 16.492 1.00 0.00 C ATOM 652 O SER A 927 -7.038 19.590 15.948 1.00 0.00 O ATOM 653 CB SER A 927 -6.299 22.031 17.470 1.00 0.00 C ATOM 654 OG SER A 927 -5.748 22.526 18.681 1.00 0.00 O ATOM 0 H SER A 927 -6.305 19.605 18.612 1.00 0.00 H new ATOM 0 HA SER A 927 -8.332 21.705 18.069 1.00 0.00 H new ATOM 0 HB2 SER A 927 -5.534 21.493 16.910 1.00 0.00 H new ATOM 0 HB3 SER A 927 -6.625 22.863 16.846 1.00 0.00 H new ATOM 0 HG SER A 927 -4.992 23.116 18.479 1.00 0.00 H new ATOM 660 N TYR A 928 -9.092 20.481 16.045 1.00 0.00 N ATOM 661 CA TYR A 928 -9.540 19.769 14.863 1.00 0.00 C ATOM 662 C TYR A 928 -9.698 20.729 13.694 1.00 0.00 C ATOM 663 O TYR A 928 -10.344 21.770 13.808 1.00 0.00 O ATOM 664 CB TYR A 928 -10.861 19.046 15.132 1.00 0.00 C ATOM 665 CG TYR A 928 -11.088 17.860 14.218 1.00 0.00 C ATOM 666 CD1 TYR A 928 -10.451 16.653 14.467 1.00 0.00 C ATOM 667 CD2 TYR A 928 -11.924 17.942 13.109 1.00 0.00 C ATOM 668 CE1 TYR A 928 -10.635 15.560 13.645 1.00 0.00 C ATOM 669 CE2 TYR A 928 -12.113 16.849 12.278 1.00 0.00 C ATOM 670 CZ TYR A 928 -11.465 15.659 12.554 1.00 0.00 C ATOM 671 OH TYR A 928 -11.640 14.563 11.732 1.00 0.00 O ATOM 0 H TYR A 928 -9.795 21.080 16.478 1.00 0.00 H new ATOM 0 HA TYR A 928 -8.785 19.025 14.609 1.00 0.00 H new ATOM 0 HB2 TYR A 928 -10.878 18.707 16.168 1.00 0.00 H new ATOM 0 HB3 TYR A 928 -11.684 19.751 15.014 1.00 0.00 H new ATOM 0 HD1 TYR A 928 -9.797 16.567 15.322 1.00 0.00 H new ATOM 0 HD2 TYR A 928 -12.433 18.870 12.893 1.00 0.00 H new ATOM 0 HE1 TYR A 928 -10.129 14.630 13.858 1.00 0.00 H new ATOM 0 HE2 TYR A 928 -12.763 16.926 11.419 1.00 0.00 H new ATOM 0 HH TYR A 928 -11.611 14.849 10.795 1.00 0.00 H new ATOM 681 N THR A 929 -9.104 20.371 12.573 1.00 0.00 N ATOM 682 CA THR A 929 -9.199 21.169 11.369 1.00 0.00 C ATOM 683 C THR A 929 -10.236 20.569 10.431 1.00 0.00 C ATOM 684 O THR A 929 -10.123 19.407 10.032 1.00 0.00 O ATOM 685 CB THR A 929 -7.839 21.234 10.652 1.00 0.00 C ATOM 686 OG1 THR A 929 -6.819 21.617 11.583 1.00 0.00 O ATOM 687 CG2 THR A 929 -7.874 22.223 9.497 1.00 0.00 C ATOM 0 H THR A 929 -8.545 19.524 12.472 1.00 0.00 H new ATOM 0 HA THR A 929 -9.498 22.179 11.649 1.00 0.00 H new ATOM 0 HB THR A 929 -7.619 20.245 10.250 1.00 0.00 H new ATOM 0 HG1 THR A 929 -5.954 21.656 11.123 1.00 0.00 H new ATOM 0 HG21 THR A 929 -6.899 22.248 9.009 1.00 0.00 H new ATOM 0 HG22 THR A 929 -8.632 21.915 8.777 1.00 0.00 H new ATOM 0 HG23 THR A 929 -8.115 23.216 9.876 1.00 0.00 H new ATOM 695 N SER A 930 -11.237 21.356 10.085 1.00 0.00 N ATOM 696 CA SER A 930 -12.295 20.898 9.212 1.00 0.00 C ATOM 697 C SER A 930 -12.393 21.807 7.996 1.00 0.00 C ATOM 698 O SER A 930 -12.542 23.020 8.132 1.00 0.00 O ATOM 699 CB SER A 930 -13.629 20.876 9.969 1.00 0.00 C ATOM 700 OG SER A 930 -14.696 20.462 9.129 1.00 0.00 O ATOM 0 H SER A 930 -11.338 22.321 10.399 1.00 0.00 H new ATOM 0 HA SER A 930 -12.067 19.886 8.877 1.00 0.00 H new ATOM 0 HB2 SER A 930 -13.553 20.202 10.822 1.00 0.00 H new ATOM 0 HB3 SER A 930 -13.840 21.869 10.365 1.00 0.00 H new ATOM 0 HG SER A 930 -15.532 20.457 9.641 1.00 0.00 H new ATOM 706 N PRO A 931 -12.313 21.239 6.787 1.00 0.00 N ATOM 707 CA PRO A 931 -12.460 22.008 5.548 1.00 0.00 C ATOM 708 C PRO A 931 -13.869 22.581 5.411 1.00 0.00 C ATOM 709 O PRO A 931 -14.131 23.438 4.565 1.00 0.00 O ATOM 710 CB PRO A 931 -12.186 20.977 4.446 1.00 0.00 C ATOM 711 CG PRO A 931 -12.442 19.652 5.081 1.00 0.00 C ATOM 712 CD PRO A 931 -12.069 19.809 6.528 1.00 0.00 C ATOM 0 HA PRO A 931 -11.788 22.866 5.509 1.00 0.00 H new ATOM 0 HB2 PRO A 931 -12.838 21.135 3.587 1.00 0.00 H new ATOM 0 HB3 PRO A 931 -11.160 21.049 4.085 1.00 0.00 H new ATOM 0 HG2 PRO A 931 -13.488 19.365 4.976 1.00 0.00 H new ATOM 0 HG3 PRO A 931 -11.848 18.871 4.607 1.00 0.00 H new ATOM 0 HD2 PRO A 931 -12.678 19.174 7.172 1.00 0.00 H new ATOM 0 HD3 PRO A 931 -11.028 19.540 6.707 1.00 0.00 H new ATOM 720 N ASN A 932 -14.768 22.105 6.262 1.00 0.00 N ATOM 721 CA ASN A 932 -16.159 22.520 6.222 1.00 0.00 C ATOM 722 C ASN A 932 -16.474 23.480 7.365 1.00 0.00 C ATOM 723 O ASN A 932 -17.508 24.149 7.349 1.00 0.00 O ATOM 724 CB ASN A 932 -17.090 21.299 6.309 1.00 0.00 C ATOM 725 CG ASN A 932 -16.938 20.335 5.139 1.00 0.00 C ATOM 726 OD1 ASN A 932 -15.862 20.203 4.557 1.00 0.00 O ATOM 727 ND2 ASN A 932 -18.015 19.642 4.794 1.00 0.00 N ATOM 0 H ASN A 932 -14.554 21.426 6.993 1.00 0.00 H new ATOM 0 HA ASN A 932 -16.325 23.032 5.274 1.00 0.00 H new ATOM 0 HB2 ASN A 932 -16.890 20.765 7.238 1.00 0.00 H new ATOM 0 HB3 ASN A 932 -18.123 21.642 6.355 1.00 0.00 H new ATOM 0 HD21 ASN A 932 -17.967 18.974 4.024 1.00 0.00 H new ATOM 0 HD22 ASN A 932 -18.891 19.777 5.298 1.00 0.00 H new ATOM 734 N GLY A 933 -15.587 23.558 8.356 1.00 0.00 N ATOM 735 CA GLY A 933 -15.886 24.360 9.530 1.00 0.00 C ATOM 736 C GLY A 933 -14.669 24.973 10.199 1.00 0.00 C ATOM 737 O GLY A 933 -14.721 25.292 11.388 1.00 0.00 O ATOM 0 H GLY A 933 -14.682 23.088 8.368 1.00 0.00 H new ATOM 0 HA2 GLY A 933 -16.569 25.160 9.244 1.00 0.00 H new ATOM 0 HA3 GLY A 933 -16.409 23.738 10.256 1.00 0.00 H new ATOM 741 N GLN A 934 -13.575 25.119 9.451 1.00 0.00 N ATOM 742 CA GLN A 934 -12.382 25.815 9.939 1.00 0.00 C ATOM 743 C GLN A 934 -11.720 24.997 11.055 1.00 0.00 C ATOM 744 O GLN A 934 -11.954 23.793 11.174 1.00 0.00 O ATOM 745 CB GLN A 934 -12.762 27.225 10.429 1.00 0.00 C ATOM 746 CG GLN A 934 -11.603 28.214 10.498 1.00 0.00 C ATOM 747 CD GLN A 934 -12.020 29.538 11.109 1.00 0.00 C ATOM 748 OE1 GLN A 934 -12.913 29.585 11.956 1.00 0.00 O ATOM 749 NE2 GLN A 934 -11.386 30.621 10.686 1.00 0.00 N ATOM 0 H GLN A 934 -13.490 24.763 8.499 1.00 0.00 H new ATOM 0 HA GLN A 934 -11.664 25.921 9.126 1.00 0.00 H new ATOM 0 HB2 GLN A 934 -13.527 27.630 9.767 1.00 0.00 H new ATOM 0 HB3 GLN A 934 -13.209 27.142 11.420 1.00 0.00 H new ATOM 0 HG2 GLN A 934 -10.793 27.783 11.086 1.00 0.00 H new ATOM 0 HG3 GLN A 934 -11.212 28.385 9.495 1.00 0.00 H new ATOM 0 HE21 GLN A 934 -10.652 30.540 9.983 1.00 0.00 H new ATOM 0 HE22 GLN A 934 -11.632 31.536 11.063 1.00 0.00 H new ATOM 758 N THR A 935 -10.879 25.635 11.852 1.00 0.00 N ATOM 759 CA THR A 935 -10.217 24.956 12.949 1.00 0.00 C ATOM 760 C THR A 935 -10.955 25.195 14.265 1.00 0.00 C ATOM 761 O THR A 935 -11.222 26.336 14.645 1.00 0.00 O ATOM 762 CB THR A 935 -8.757 25.436 13.074 1.00 0.00 C ATOM 763 OG1 THR A 935 -8.691 26.856 12.860 1.00 0.00 O ATOM 764 CG2 THR A 935 -7.860 24.732 12.070 1.00 0.00 C ATOM 0 H THR A 935 -10.640 26.622 11.758 1.00 0.00 H new ATOM 0 HA THR A 935 -10.225 23.887 12.737 1.00 0.00 H new ATOM 0 HB THR A 935 -8.407 25.196 14.078 1.00 0.00 H new ATOM 0 HG1 THR A 935 -7.762 27.156 12.942 1.00 0.00 H new ATOM 0 HG21 THR A 935 -6.837 25.091 12.182 1.00 0.00 H new ATOM 0 HG22 THR A 935 -7.889 23.657 12.247 1.00 0.00 H new ATOM 0 HG23 THR A 935 -8.210 24.942 11.059 1.00 0.00 H new ATOM 772 N THR A 936 -11.303 24.112 14.943 1.00 0.00 N ATOM 773 CA THR A 936 -11.965 24.194 16.235 1.00 0.00 C ATOM 774 C THR A 936 -11.132 23.510 17.317 1.00 0.00 C ATOM 775 O THR A 936 -10.685 22.377 17.138 1.00 0.00 O ATOM 776 CB THR A 936 -13.376 23.571 16.186 1.00 0.00 C ATOM 777 OG1 THR A 936 -13.332 22.282 15.558 1.00 0.00 O ATOM 778 CG2 THR A 936 -14.341 24.473 15.431 1.00 0.00 C ATOM 0 H THR A 936 -11.136 23.160 14.617 1.00 0.00 H new ATOM 0 HA THR A 936 -12.066 25.251 16.482 1.00 0.00 H new ATOM 0 HB THR A 936 -13.729 23.460 17.211 1.00 0.00 H new ATOM 0 HG1 THR A 936 -13.861 21.645 16.082 1.00 0.00 H new ATOM 0 HG21 THR A 936 -15.329 24.012 15.410 1.00 0.00 H new ATOM 0 HG22 THR A 936 -14.402 25.440 15.931 1.00 0.00 H new ATOM 0 HG23 THR A 936 -13.985 24.614 14.411 1.00 0.00 H new ATOM 786 N ARG A 937 -10.905 24.193 18.428 1.00 0.00 N ATOM 787 CA ARG A 937 -10.230 23.576 19.560 1.00 0.00 C ATOM 788 C ARG A 937 -11.243 23.122 20.596 1.00 0.00 C ATOM 789 O ARG A 937 -12.117 23.890 21.005 1.00 0.00 O ATOM 790 CB ARG A 937 -9.221 24.525 20.213 1.00 0.00 C ATOM 791 CG ARG A 937 -7.951 24.732 19.406 1.00 0.00 C ATOM 792 CD ARG A 937 -6.893 25.483 20.207 1.00 0.00 C ATOM 793 NE ARG A 937 -6.580 24.817 21.477 1.00 0.00 N ATOM 794 CZ ARG A 937 -5.419 24.943 22.126 1.00 0.00 C ATOM 795 NH1 ARG A 937 -4.421 25.638 21.596 1.00 0.00 N ATOM 796 NH2 ARG A 937 -5.245 24.343 23.295 1.00 0.00 N ATOM 0 H ARG A 937 -11.175 25.166 18.570 1.00 0.00 H new ATOM 0 HA ARG A 937 -9.684 22.714 19.177 1.00 0.00 H new ATOM 0 HB2 ARG A 937 -9.699 25.492 20.373 1.00 0.00 H new ATOM 0 HB3 ARG A 937 -8.955 24.135 21.195 1.00 0.00 H new ATOM 0 HG2 ARG A 937 -7.555 23.765 19.096 1.00 0.00 H new ATOM 0 HG3 ARG A 937 -8.183 25.288 18.498 1.00 0.00 H new ATOM 0 HD2 ARG A 937 -5.984 25.571 19.612 1.00 0.00 H new ATOM 0 HD3 ARG A 937 -7.243 26.496 20.407 1.00 0.00 H new ATOM 0 HE ARG A 937 -7.295 24.219 21.891 1.00 0.00 H new ATOM 0 HH11 ARG A 937 -4.536 26.082 20.685 1.00 0.00 H new ATOM 0 HH12 ARG A 937 -3.539 25.728 22.100 1.00 0.00 H new ATOM 0 HH21 ARG A 937 -5.997 23.785 23.699 1.00 0.00 H new ATOM 0 HH22 ARG A 937 -4.359 24.439 23.791 1.00 0.00 H new ATOM 810 N TYR A 938 -11.128 21.873 21.004 1.00 0.00 N ATOM 811 CA TYR A 938 -11.974 21.332 22.046 1.00 0.00 C ATOM 812 C TYR A 938 -11.181 21.295 23.339 1.00 0.00 C ATOM 813 O TYR A 938 -10.062 20.765 23.384 1.00 0.00 O ATOM 814 CB TYR A 938 -12.478 19.942 21.660 1.00 0.00 C ATOM 815 CG TYR A 938 -13.174 19.921 20.316 1.00 0.00 C ATOM 816 CD1 TYR A 938 -14.405 20.538 20.142 1.00 0.00 C ATOM 817 CD2 TYR A 938 -12.588 19.304 19.219 1.00 0.00 C ATOM 818 CE1 TYR A 938 -15.037 20.537 18.913 1.00 0.00 C ATOM 819 CE2 TYR A 938 -13.210 19.302 17.987 1.00 0.00 C ATOM 820 CZ TYR A 938 -14.434 19.918 17.840 1.00 0.00 C ATOM 821 OH TYR A 938 -15.052 19.922 16.609 1.00 0.00 O ATOM 0 H TYR A 938 -10.451 21.211 20.625 1.00 0.00 H new ATOM 0 HA TYR A 938 -12.851 21.964 22.182 1.00 0.00 H new ATOM 0 HB2 TYR A 938 -11.637 19.249 21.639 1.00 0.00 H new ATOM 0 HB3 TYR A 938 -13.166 19.585 22.426 1.00 0.00 H new ATOM 0 HD1 TYR A 938 -14.877 21.027 20.981 1.00 0.00 H new ATOM 0 HD2 TYR A 938 -11.630 18.818 19.332 1.00 0.00 H new ATOM 0 HE1 TYR A 938 -15.997 21.018 18.795 1.00 0.00 H new ATOM 0 HE2 TYR A 938 -12.740 18.820 17.142 1.00 0.00 H new ATOM 0 HH TYR A 938 -14.494 19.444 15.961 1.00 0.00 H new ATOM 831 N GLY A 939 -11.759 21.866 24.380 1.00 0.00 N ATOM 832 CA GLY A 939 -11.012 22.129 25.586 1.00 0.00 C ATOM 833 C GLY A 939 -11.115 21.029 26.615 1.00 0.00 C ATOM 834 O GLY A 939 -12.177 20.440 26.813 1.00 0.00 O ATOM 0 H GLY A 939 -12.737 22.153 24.411 1.00 0.00 H new ATOM 0 HA2 GLY A 939 -9.963 22.277 25.328 1.00 0.00 H new ATOM 0 HA3 GLY A 939 -11.366 23.061 26.026 1.00 0.00 H new ATOM 838 N GLU A 940 -10.000 20.771 27.284 1.00 0.00 N ATOM 839 CA GLU A 940 -9.949 19.807 28.374 1.00 0.00 C ATOM 840 C GLU A 940 -10.786 20.309 29.548 1.00 0.00 C ATOM 841 O GLU A 940 -11.244 19.536 30.389 1.00 0.00 O ATOM 842 CB GLU A 940 -8.490 19.598 28.793 1.00 0.00 C ATOM 843 CG GLU A 940 -8.292 18.618 29.935 1.00 0.00 C ATOM 844 CD GLU A 940 -6.833 18.465 30.305 1.00 0.00 C ATOM 845 OE1 GLU A 940 -6.329 19.277 31.108 1.00 0.00 O ATOM 846 OE2 GLU A 940 -6.182 17.536 29.784 1.00 0.00 O ATOM 0 H GLU A 940 -9.107 21.223 27.087 1.00 0.00 H new ATOM 0 HA GLU A 940 -10.361 18.853 28.046 1.00 0.00 H new ATOM 0 HB2 GLU A 940 -7.925 19.247 27.929 1.00 0.00 H new ATOM 0 HB3 GLU A 940 -8.067 20.561 29.081 1.00 0.00 H new ATOM 0 HG2 GLU A 940 -8.853 18.958 30.806 1.00 0.00 H new ATOM 0 HG3 GLU A 940 -8.698 17.647 29.653 1.00 0.00 H new ATOM 853 N ASN A 941 -11.001 21.619 29.576 1.00 0.00 N ATOM 854 CA ASN A 941 -11.791 22.245 30.625 1.00 0.00 C ATOM 855 C ASN A 941 -13.280 22.152 30.312 1.00 0.00 C ATOM 856 O ASN A 941 -14.110 22.654 31.071 1.00 0.00 O ATOM 857 CB ASN A 941 -11.401 23.720 30.783 1.00 0.00 C ATOM 858 CG ASN A 941 -9.938 23.914 31.134 1.00 0.00 C ATOM 859 OD1 ASN A 941 -9.088 24.022 30.252 1.00 0.00 O ATOM 860 ND2 ASN A 941 -9.639 23.982 32.420 1.00 0.00 N ATOM 0 H ASN A 941 -10.637 22.269 28.880 1.00 0.00 H new ATOM 0 HA ASN A 941 -11.588 21.714 31.555 1.00 0.00 H new ATOM 0 HB2 ASN A 941 -11.619 24.249 29.855 1.00 0.00 H new ATOM 0 HB3 ASN A 941 -12.018 24.172 31.560 1.00 0.00 H new ATOM 0 HD21 ASN A 941 -8.673 24.129 32.712 1.00 0.00 H new ATOM 0 HD22 ASN A 941 -10.375 23.887 33.120 1.00 0.00 H new ATOM 867 N GLU A 942 -13.624 21.506 29.203 1.00 0.00 N ATOM 868 CA GLU A 942 -15.018 21.387 28.808 1.00 0.00 C ATOM 869 C GLU A 942 -15.297 20.008 28.203 1.00 0.00 C ATOM 870 O GLU A 942 -14.770 18.999 28.673 1.00 0.00 O ATOM 871 CB GLU A 942 -15.387 22.498 27.820 1.00 0.00 C ATOM 872 CG GLU A 942 -16.879 22.809 27.800 1.00 0.00 C ATOM 873 CD GLU A 942 -17.303 23.595 26.584 1.00 0.00 C ATOM 874 OE1 GLU A 942 -17.538 22.970 25.528 1.00 0.00 O ATOM 875 OE2 GLU A 942 -17.438 24.826 26.682 1.00 0.00 O ATOM 0 H GLU A 942 -12.961 21.061 28.568 1.00 0.00 H new ATOM 0 HA GLU A 942 -15.638 21.495 29.698 1.00 0.00 H new ATOM 0 HB2 GLU A 942 -14.837 23.403 28.078 1.00 0.00 H new ATOM 0 HB3 GLU A 942 -15.069 22.206 26.819 1.00 0.00 H new ATOM 0 HG2 GLU A 942 -17.439 21.875 27.835 1.00 0.00 H new ATOM 0 HG3 GLU A 942 -17.139 23.371 28.697 1.00 0.00 H new ATOM 882 N LYS A 943 -16.116 19.980 27.157 1.00 0.00 N ATOM 883 CA LYS A 943 -16.643 18.740 26.612 1.00 0.00 C ATOM 884 C LYS A 943 -15.874 18.297 25.374 1.00 0.00 C ATOM 885 O LYS A 943 -15.534 19.113 24.513 1.00 0.00 O ATOM 886 CB LYS A 943 -18.123 18.918 26.256 1.00 0.00 C ATOM 887 CG LYS A 943 -18.366 19.882 25.102 1.00 0.00 C ATOM 888 CD LYS A 943 -19.848 20.050 24.810 1.00 0.00 C ATOM 889 CE LYS A 943 -20.537 20.909 25.855 1.00 0.00 C ATOM 890 NZ LYS A 943 -20.160 22.340 25.730 1.00 0.00 N ATOM 0 H LYS A 943 -16.431 20.816 26.666 1.00 0.00 H new ATOM 0 HA LYS A 943 -16.531 17.969 27.374 1.00 0.00 H new ATOM 0 HB2 LYS A 943 -18.545 17.946 26.000 1.00 0.00 H new ATOM 0 HB3 LYS A 943 -18.658 19.276 27.135 1.00 0.00 H new ATOM 0 HG2 LYS A 943 -17.930 20.852 25.341 1.00 0.00 H new ATOM 0 HG3 LYS A 943 -17.859 19.516 24.209 1.00 0.00 H new ATOM 0 HD2 LYS A 943 -19.975 20.503 23.827 1.00 0.00 H new ATOM 0 HD3 LYS A 943 -20.324 19.070 24.774 1.00 0.00 H new ATOM 0 HE2 LYS A 943 -21.618 20.808 25.753 1.00 0.00 H new ATOM 0 HE3 LYS A 943 -20.275 20.550 26.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 943 -20.149 22.780 26.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 943 -19.215 22.414 25.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 943 -20.852 22.830 25.128 1.00 0.00 H new ATOM 904 N LEU A 944 -15.573 17.013 25.309 1.00 0.00 N ATOM 905 CA LEU A 944 -15.040 16.420 24.096 1.00 0.00 C ATOM 906 C LEU A 944 -16.135 15.695 23.320 1.00 0.00 C ATOM 907 O LEU A 944 -16.914 14.933 23.898 1.00 0.00 O ATOM 908 CB LEU A 944 -13.900 15.460 24.428 1.00 0.00 C ATOM 909 CG LEU A 944 -12.551 16.132 24.651 1.00 0.00 C ATOM 910 CD1 LEU A 944 -11.530 15.137 25.160 1.00 0.00 C ATOM 911 CD2 LEU A 944 -12.069 16.760 23.361 1.00 0.00 C ATOM 0 H LEU A 944 -15.689 16.360 26.084 1.00 0.00 H new ATOM 0 HA LEU A 944 -14.650 17.222 23.469 1.00 0.00 H new ATOM 0 HB2 LEU A 944 -14.164 14.899 25.324 1.00 0.00 H new ATOM 0 HB3 LEU A 944 -13.802 14.738 23.617 1.00 0.00 H new ATOM 0 HG LEU A 944 -12.673 16.910 25.405 1.00 0.00 H new ATOM 0 HD11 LEU A 944 -10.575 15.641 25.311 1.00 0.00 H new ATOM 0 HD12 LEU A 944 -11.872 14.716 26.105 1.00 0.00 H new ATOM 0 HD13 LEU A 944 -11.406 14.337 24.430 1.00 0.00 H new ATOM 0 HD21 LEU A 944 -11.104 17.239 23.528 1.00 0.00 H new ATOM 0 HD22 LEU A 944 -11.965 15.989 22.598 1.00 0.00 H new ATOM 0 HD23 LEU A 944 -12.791 17.505 23.027 1.00 0.00 H new ATOM 923 N PRO A 945 -16.217 15.930 22.005 1.00 0.00 N ATOM 924 CA PRO A 945 -17.146 15.212 21.130 1.00 0.00 C ATOM 925 C PRO A 945 -16.766 13.740 21.002 1.00 0.00 C ATOM 926 O PRO A 945 -15.597 13.376 21.169 1.00 0.00 O ATOM 927 CB PRO A 945 -17.002 15.919 19.776 1.00 0.00 C ATOM 928 CG PRO A 945 -16.307 17.204 20.074 1.00 0.00 C ATOM 929 CD PRO A 945 -15.444 16.937 21.271 1.00 0.00 C ATOM 0 HA PRO A 945 -18.166 15.226 21.515 1.00 0.00 H new ATOM 0 HB2 PRO A 945 -16.426 15.314 19.076 1.00 0.00 H new ATOM 0 HB3 PRO A 945 -17.976 16.095 19.319 1.00 0.00 H new ATOM 0 HG2 PRO A 945 -15.707 17.529 19.224 1.00 0.00 H new ATOM 0 HG3 PRO A 945 -17.025 17.998 20.280 1.00 0.00 H new ATOM 0 HD2 PRO A 945 -14.460 16.564 20.986 1.00 0.00 H new ATOM 0 HD3 PRO A 945 -15.284 17.837 21.864 1.00 0.00 H new ATOM 937 N ASP A 946 -17.746 12.903 20.687 1.00 0.00 N ATOM 938 CA ASP A 946 -17.530 11.462 20.601 1.00 0.00 C ATOM 939 C ASP A 946 -16.487 11.120 19.550 1.00 0.00 C ATOM 940 O ASP A 946 -15.574 10.346 19.813 1.00 0.00 O ATOM 941 CB ASP A 946 -18.834 10.725 20.289 1.00 0.00 C ATOM 942 CG ASP A 946 -18.613 9.242 20.049 1.00 0.00 C ATOM 943 OD1 ASP A 946 -18.274 8.521 21.009 1.00 0.00 O ATOM 944 OD2 ASP A 946 -18.782 8.789 18.896 1.00 0.00 O ATOM 0 H ASP A 946 -18.702 13.197 20.486 1.00 0.00 H new ATOM 0 HA ASP A 946 -17.165 11.136 21.575 1.00 0.00 H new ATOM 0 HB2 ASP A 946 -19.531 10.857 21.117 1.00 0.00 H new ATOM 0 HB3 ASP A 946 -19.298 11.168 19.408 1.00 0.00 H new ATOM 949 N TYR A 947 -16.608 11.718 18.370 1.00 0.00 N ATOM 950 CA TYR A 947 -15.686 11.433 17.274 1.00 0.00 C ATOM 951 C TYR A 947 -14.255 11.811 17.640 1.00 0.00 C ATOM 952 O TYR A 947 -13.299 11.168 17.199 1.00 0.00 O ATOM 953 CB TYR A 947 -16.111 12.181 16.011 1.00 0.00 C ATOM 954 CG TYR A 947 -17.363 11.628 15.363 1.00 0.00 C ATOM 955 CD1 TYR A 947 -17.279 10.616 14.417 1.00 0.00 C ATOM 956 CD2 TYR A 947 -18.625 12.115 15.692 1.00 0.00 C ATOM 957 CE1 TYR A 947 -18.411 10.105 13.815 1.00 0.00 C ATOM 958 CE2 TYR A 947 -19.763 11.605 15.095 1.00 0.00 C ATOM 959 CZ TYR A 947 -19.649 10.602 14.157 1.00 0.00 C ATOM 960 OH TYR A 947 -20.778 10.094 13.557 1.00 0.00 O ATOM 0 H TYR A 947 -17.332 12.401 18.147 1.00 0.00 H new ATOM 0 HA TYR A 947 -15.719 10.360 17.085 1.00 0.00 H new ATOM 0 HB2 TYR A 947 -16.275 13.230 16.259 1.00 0.00 H new ATOM 0 HB3 TYR A 947 -15.295 12.148 15.289 1.00 0.00 H new ATOM 0 HD1 TYR A 947 -16.311 10.221 14.147 1.00 0.00 H new ATOM 0 HD2 TYR A 947 -18.716 12.903 16.425 1.00 0.00 H new ATOM 0 HE1 TYR A 947 -18.326 9.319 13.079 1.00 0.00 H new ATOM 0 HE2 TYR A 947 -20.736 11.991 15.362 1.00 0.00 H new ATOM 0 HH TYR A 947 -21.570 10.551 13.910 1.00 0.00 H new ATOM 970 N ILE A 948 -14.107 12.840 18.460 1.00 0.00 N ATOM 971 CA ILE A 948 -12.792 13.245 18.926 1.00 0.00 C ATOM 972 C ILE A 948 -12.232 12.197 19.876 1.00 0.00 C ATOM 973 O ILE A 948 -11.063 11.822 19.789 1.00 0.00 O ATOM 974 CB ILE A 948 -12.829 14.621 19.618 1.00 0.00 C ATOM 975 CG1 ILE A 948 -13.332 15.686 18.636 1.00 0.00 C ATOM 976 CG2 ILE A 948 -11.453 14.988 20.157 1.00 0.00 C ATOM 977 CD1 ILE A 948 -12.518 15.774 17.360 1.00 0.00 C ATOM 0 H ILE A 948 -14.877 13.407 18.814 1.00 0.00 H new ATOM 0 HA ILE A 948 -12.143 13.331 18.055 1.00 0.00 H new ATOM 0 HB ILE A 948 -13.517 14.572 20.462 1.00 0.00 H new ATOM 0 HG12 ILE A 948 -14.369 15.470 18.380 1.00 0.00 H new ATOM 0 HG13 ILE A 948 -13.321 16.657 19.131 1.00 0.00 H new ATOM 0 HG21 ILE A 948 -11.500 15.963 20.642 1.00 0.00 H new ATOM 0 HG22 ILE A 948 -11.134 14.238 20.881 1.00 0.00 H new ATOM 0 HG23 ILE A 948 -10.738 15.026 19.335 1.00 0.00 H new ATOM 0 HD11 ILE A 948 -12.934 16.549 16.716 1.00 0.00 H new ATOM 0 HD12 ILE A 948 -11.485 16.021 17.604 1.00 0.00 H new ATOM 0 HD13 ILE A 948 -12.549 14.816 16.842 1.00 0.00 H new ATOM 989 N LYS A 949 -13.090 11.704 20.759 1.00 0.00 N ATOM 990 CA LYS A 949 -12.731 10.624 21.665 1.00 0.00 C ATOM 991 C LYS A 949 -12.401 9.365 20.874 1.00 0.00 C ATOM 992 O LYS A 949 -11.502 8.609 21.237 1.00 0.00 O ATOM 993 CB LYS A 949 -13.881 10.350 22.640 1.00 0.00 C ATOM 994 CG LYS A 949 -14.192 11.519 23.560 1.00 0.00 C ATOM 995 CD LYS A 949 -13.117 11.698 24.620 1.00 0.00 C ATOM 996 CE LYS A 949 -13.181 10.601 25.673 1.00 0.00 C ATOM 997 NZ LYS A 949 -14.436 10.675 26.470 1.00 0.00 N ATOM 0 H LYS A 949 -14.047 12.039 20.866 1.00 0.00 H new ATOM 0 HA LYS A 949 -11.851 10.921 22.235 1.00 0.00 H new ATOM 0 HB2 LYS A 949 -14.776 10.098 22.071 1.00 0.00 H new ATOM 0 HB3 LYS A 949 -13.633 9.478 23.245 1.00 0.00 H new ATOM 0 HG2 LYS A 949 -14.279 12.432 22.972 1.00 0.00 H new ATOM 0 HG3 LYS A 949 -15.156 11.357 24.042 1.00 0.00 H new ATOM 0 HD2 LYS A 949 -12.135 11.693 24.147 1.00 0.00 H new ATOM 0 HD3 LYS A 949 -13.235 12.670 25.099 1.00 0.00 H new ATOM 0 HE2 LYS A 949 -13.115 9.627 25.188 1.00 0.00 H new ATOM 0 HE3 LYS A 949 -12.322 10.685 26.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 949 -14.315 10.147 27.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 949 -14.653 11.669 26.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 949 -15.218 10.260 25.925 1.00 0.00 H new ATOM 1011 N GLN A 950 -13.144 9.148 19.794 1.00 0.00 N ATOM 1012 CA GLN A 950 -12.901 8.016 18.899 1.00 0.00 C ATOM 1013 C GLN A 950 -11.505 8.103 18.290 1.00 0.00 C ATOM 1014 O GLN A 950 -10.781 7.107 18.224 1.00 0.00 O ATOM 1015 CB GLN A 950 -13.941 7.962 17.773 1.00 0.00 C ATOM 1016 CG GLN A 950 -15.372 7.744 18.243 1.00 0.00 C ATOM 1017 CD GLN A 950 -15.543 6.463 19.034 1.00 0.00 C ATOM 1018 OE1 GLN A 950 -14.815 5.492 18.832 1.00 0.00 O ATOM 1019 NE2 GLN A 950 -16.515 6.449 19.933 1.00 0.00 N ATOM 0 H GLN A 950 -13.924 9.743 19.514 1.00 0.00 H new ATOM 0 HA GLN A 950 -12.982 7.107 19.495 1.00 0.00 H new ATOM 0 HB2 GLN A 950 -13.896 8.894 17.209 1.00 0.00 H new ATOM 0 HB3 GLN A 950 -13.672 7.160 17.086 1.00 0.00 H new ATOM 0 HG2 GLN A 950 -15.680 8.589 18.859 1.00 0.00 H new ATOM 0 HG3 GLN A 950 -16.034 7.722 17.378 1.00 0.00 H new ATOM 0 HE21 GLN A 950 -17.096 7.276 20.069 1.00 0.00 H new ATOM 0 HE22 GLN A 950 -16.683 5.611 20.490 1.00 0.00 H new ATOM 1028 N LYS A 951 -11.136 9.306 17.851 1.00 0.00 N ATOM 1029 CA LYS A 951 -9.821 9.542 17.267 1.00 0.00 C ATOM 1030 C LYS A 951 -8.740 9.394 18.326 1.00 0.00 C ATOM 1031 O LYS A 951 -7.714 8.758 18.099 1.00 0.00 O ATOM 1032 CB LYS A 951 -9.757 10.945 16.647 1.00 0.00 C ATOM 1033 CG LYS A 951 -10.678 11.144 15.451 1.00 0.00 C ATOM 1034 CD LYS A 951 -10.178 10.400 14.221 1.00 0.00 C ATOM 1035 CE LYS A 951 -8.906 11.026 13.664 1.00 0.00 C ATOM 1036 NZ LYS A 951 -9.115 12.445 13.253 1.00 0.00 N ATOM 0 H LYS A 951 -11.733 10.132 17.890 1.00 0.00 H new ATOM 0 HA LYS A 951 -9.652 8.803 16.484 1.00 0.00 H new ATOM 0 HB2 LYS A 951 -10.010 11.679 17.412 1.00 0.00 H new ATOM 0 HB3 LYS A 951 -8.731 11.147 16.338 1.00 0.00 H new ATOM 0 HG2 LYS A 951 -11.680 10.797 15.703 1.00 0.00 H new ATOM 0 HG3 LYS A 951 -10.756 12.208 15.225 1.00 0.00 H new ATOM 0 HD2 LYS A 951 -9.989 9.358 14.478 1.00 0.00 H new ATOM 0 HD3 LYS A 951 -10.952 10.404 13.454 1.00 0.00 H new ATOM 0 HE2 LYS A 951 -8.119 10.979 14.417 1.00 0.00 H new ATOM 0 HE3 LYS A 951 -8.562 10.447 12.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 951 -8.487 12.672 12.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 951 -10.105 12.580 12.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 951 -8.899 13.074 14.053 1.00 0.00 H new ATOM 1050 N LEU A 952 -9.011 9.964 19.492 1.00 0.00 N ATOM 1051 CA LEU A 952 -8.065 9.986 20.600 1.00 0.00 C ATOM 1052 C LEU A 952 -7.784 8.572 21.103 1.00 0.00 C ATOM 1053 O LEU A 952 -6.658 8.245 21.479 1.00 0.00 O ATOM 1054 CB LEU A 952 -8.642 10.845 21.728 1.00 0.00 C ATOM 1055 CG LEU A 952 -7.629 11.399 22.723 1.00 0.00 C ATOM 1056 CD1 LEU A 952 -6.612 12.272 22.006 1.00 0.00 C ATOM 1057 CD2 LEU A 952 -8.347 12.190 23.806 1.00 0.00 C ATOM 0 H LEU A 952 -9.897 10.426 19.697 1.00 0.00 H new ATOM 0 HA LEU A 952 -7.122 10.412 20.257 1.00 0.00 H new ATOM 0 HB2 LEU A 952 -9.181 11.681 21.283 1.00 0.00 H new ATOM 0 HB3 LEU A 952 -9.373 10.250 22.275 1.00 0.00 H new ATOM 0 HG LEU A 952 -7.099 10.570 23.191 1.00 0.00 H new ATOM 0 HD11 LEU A 952 -5.894 12.662 22.728 1.00 0.00 H new ATOM 0 HD12 LEU A 952 -6.088 11.679 21.256 1.00 0.00 H new ATOM 0 HD13 LEU A 952 -7.124 13.102 21.519 1.00 0.00 H new ATOM 0 HD21 LEU A 952 -7.617 12.583 24.514 1.00 0.00 H new ATOM 0 HD22 LEU A 952 -8.893 13.016 23.351 1.00 0.00 H new ATOM 0 HD23 LEU A 952 -9.046 11.538 24.330 1.00 0.00 H new ATOM 1069 N GLN A 953 -8.819 7.740 21.085 1.00 0.00 N ATOM 1070 CA GLN A 953 -8.725 6.352 21.527 1.00 0.00 C ATOM 1071 C GLN A 953 -7.691 5.578 20.708 1.00 0.00 C ATOM 1072 O GLN A 953 -6.990 4.712 21.234 1.00 0.00 O ATOM 1073 CB GLN A 953 -10.099 5.690 21.390 1.00 0.00 C ATOM 1074 CG GLN A 953 -10.128 4.210 21.739 1.00 0.00 C ATOM 1075 CD GLN A 953 -11.460 3.573 21.396 1.00 0.00 C ATOM 1076 OE1 GLN A 953 -12.143 4.008 20.470 1.00 0.00 O ATOM 1077 NE2 GLN A 953 -11.844 2.545 22.137 1.00 0.00 N ATOM 0 H GLN A 953 -9.749 8.009 20.763 1.00 0.00 H new ATOM 0 HA GLN A 953 -8.404 6.338 22.569 1.00 0.00 H new ATOM 0 HB2 GLN A 953 -10.806 6.215 22.032 1.00 0.00 H new ATOM 0 HB3 GLN A 953 -10.447 5.815 20.365 1.00 0.00 H new ATOM 0 HG2 GLN A 953 -9.331 3.695 21.203 1.00 0.00 H new ATOM 0 HG3 GLN A 953 -9.929 4.084 22.803 1.00 0.00 H new ATOM 0 HE21 GLN A 953 -11.249 2.213 22.896 1.00 0.00 H new ATOM 0 HE22 GLN A 953 -12.734 2.085 21.948 1.00 0.00 H new ATOM 1086 N CYS A 954 -7.579 5.921 19.430 1.00 0.00 N ATOM 1087 CA CYS A 954 -6.695 5.204 18.516 1.00 0.00 C ATOM 1088 C CYS A 954 -5.222 5.462 18.837 1.00 0.00 C ATOM 1089 O CYS A 954 -4.361 4.630 18.544 1.00 0.00 O ATOM 1090 CB CYS A 954 -6.998 5.606 17.073 1.00 0.00 C ATOM 1091 SG CYS A 954 -8.722 5.351 16.586 1.00 0.00 S ATOM 0 H CYS A 954 -8.090 6.693 19.002 1.00 0.00 H new ATOM 0 HA CYS A 954 -6.879 4.137 18.641 1.00 0.00 H new ATOM 0 HB2 CYS A 954 -6.745 6.658 16.939 1.00 0.00 H new ATOM 0 HB3 CYS A 954 -6.354 5.035 16.404 1.00 0.00 H new ATOM 0 HG CYS A 954 -9.494 6.107 17.309 1.00 0.00 H new ATOM 1097 N LEU A 955 -4.938 6.602 19.459 1.00 0.00 N ATOM 1098 CA LEU A 955 -3.564 6.973 19.786 1.00 0.00 C ATOM 1099 C LEU A 955 -3.016 6.102 20.912 1.00 0.00 C ATOM 1100 O LEU A 955 -1.821 5.802 20.954 1.00 0.00 O ATOM 1101 CB LEU A 955 -3.483 8.454 20.182 1.00 0.00 C ATOM 1102 CG LEU A 955 -3.398 9.459 19.025 1.00 0.00 C ATOM 1103 CD1 LEU A 955 -4.607 9.354 18.107 1.00 0.00 C ATOM 1104 CD2 LEU A 955 -3.275 10.869 19.576 1.00 0.00 C ATOM 0 H LEU A 955 -5.639 7.285 19.747 1.00 0.00 H new ATOM 0 HA LEU A 955 -2.955 6.812 18.897 1.00 0.00 H new ATOM 0 HB2 LEU A 955 -4.359 8.697 20.783 1.00 0.00 H new ATOM 0 HB3 LEU A 955 -2.610 8.591 20.820 1.00 0.00 H new ATOM 0 HG LEU A 955 -2.513 9.223 18.434 1.00 0.00 H new ATOM 0 HD11 LEU A 955 -4.514 10.080 17.299 1.00 0.00 H new ATOM 0 HD12 LEU A 955 -4.660 8.349 17.688 1.00 0.00 H new ATOM 0 HD13 LEU A 955 -5.514 9.558 18.676 1.00 0.00 H new ATOM 0 HD21 LEU A 955 -3.215 11.578 18.751 1.00 0.00 H new ATOM 0 HD22 LEU A 955 -4.147 11.098 20.188 1.00 0.00 H new ATOM 0 HD23 LEU A 955 -2.374 10.944 20.185 1.00 0.00 H new