USER MOD reduce.3.24.130724 H: found=0, std=0, add=513, rem=0, adj=19 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 951 LYS NZ :NH3+ 154:sc= 0.0315 (180deg=-0.0132) USER MOD Set 1.2: A 954 CYS SG : rot 160:sc= -0.409 USER MOD Set 2.1: A 934 GLN : amide:sc= 0.633 K(o=1,f=-4.8!) USER MOD Set 2.2: A 935 THR OG1 : rot 36:sc= 0.377 USER MOD Set 3.1: A 910 GLN : amide:sc= -0.0398 K(o=1.6,f=-1.7) USER MOD Set 3.2: A 916 GLN : amide:sc= 1.62 K(o=1.6,f=-5.3!) USER MOD Single : A 889 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 890 SER OG : rot 180:sc= 0.00222 USER MOD Single : A 894 LYS NZ :NH3+ -137:sc= -0.0719 (180deg=-0.395) USER MOD Single : A 895 ASN : amide:sc= -0.0027 K(o=-0.0027,f=-1.5!) USER MOD Single : A 900 THR OG1 : rot 180:sc= 0 USER MOD Single : A 901 GLN : amide:sc= -0.236 X(o=-0.24,f=-0.049) USER MOD Single : A 903 THR OG1 : rot -34:sc= 0.452 USER MOD Single : A 904 SER OG : rot -34:sc= 0.42 USER MOD Single : A 912 ASN : amide:sc= -0.12 K(o=-0.12,f=-3.2!) USER MOD Single : A 915 SER OG : rot 180:sc= 0 USER MOD Single : A 920 GLN : amide:sc= -0.381 X(o=-0.38,f=-0.093) USER MOD Single : A 924 SER OG : rot 180:sc= 0 USER MOD Single : A 925 SER OG : rot 180:sc= 0 USER MOD Single : A 927 SER OG : rot 180:sc= 0 USER MOD Single : A 928 TYR OH : rot 180:sc= 0 USER MOD Single : A 929 THR OG1 : rot 180:sc= 0 USER MOD Single : A 930 SER OG : rot -16:sc= 1.17 USER MOD Single : A 932 ASN : amide:sc= 1.19 K(o=1.2,f=-0.2) 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=-0.00428 X(o=-0.0043,f=-0.26) USER MOD Single : A 943 LYS NZ :NH3+ -135:sc= -0.182 (180deg=-0.649) USER MOD Single : A 947 TYR OH : rot 180:sc= 0 USER MOD Single : A 949 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 950 GLN : amide:sc= -0.112 K(o=-0.11,f=-1.5) USER MOD Single : A 953 GLN : amide:sc= -2.33! K(o=-2.3!,f=-0.61) USER MOD ----------------------------------------------------------------- ATOM 83 N LYS A 889 6.392 8.740 8.203 1.00 0.00 N ATOM 84 CA LYS A 889 6.098 8.007 9.431 1.00 0.00 C ATOM 85 C LYS A 889 4.590 7.877 9.615 1.00 0.00 C ATOM 86 O LYS A 889 3.983 8.565 10.439 1.00 0.00 O ATOM 87 CB LYS A 889 6.736 8.666 10.667 1.00 0.00 C ATOM 88 CG LYS A 889 8.200 8.301 10.894 1.00 0.00 C ATOM 89 CD LYS A 889 9.123 8.909 9.849 1.00 0.00 C ATOM 90 CE LYS A 889 9.173 10.426 9.950 1.00 0.00 C ATOM 91 NZ LYS A 889 10.210 11.005 9.054 1.00 0.00 N ATOM 0 HA LYS A 889 6.537 7.014 9.334 1.00 0.00 H new ATOM 0 HB2 LYS A 889 6.656 9.749 10.568 1.00 0.00 H new ATOM 0 HB3 LYS A 889 6.163 8.383 11.550 1.00 0.00 H new ATOM 0 HG2 LYS A 889 8.506 8.639 11.884 1.00 0.00 H new ATOM 0 HG3 LYS A 889 8.307 7.216 10.881 1.00 0.00 H new ATOM 0 HD2 LYS A 889 10.127 8.504 9.972 1.00 0.00 H new ATOM 0 HD3 LYS A 889 8.783 8.622 8.854 1.00 0.00 H new ATOM 0 HE2 LYS A 889 8.198 10.840 9.693 1.00 0.00 H new ATOM 0 HE3 LYS A 889 9.380 10.715 10.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 889 10.214 12.040 9.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 889 11.144 10.629 9.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 889 9.998 10.750 8.068 1.00 0.00 H new ATOM 105 N SER A 890 3.990 7.005 8.821 1.00 0.00 N ATOM 106 CA SER A 890 2.552 6.832 8.834 1.00 0.00 C ATOM 107 C SER A 890 2.130 5.631 9.673 1.00 0.00 C ATOM 108 O SER A 890 2.821 4.611 9.726 1.00 0.00 O ATOM 109 CB SER A 890 2.039 6.677 7.400 1.00 0.00 C ATOM 110 OG SER A 890 2.796 5.713 6.684 1.00 0.00 O ATOM 0 H SER A 890 4.481 6.405 8.158 1.00 0.00 H new ATOM 0 HA SER A 890 2.113 7.719 9.290 1.00 0.00 H new ATOM 0 HB2 SER A 890 0.990 6.380 7.417 1.00 0.00 H new ATOM 0 HB3 SER A 890 2.090 7.637 6.887 1.00 0.00 H new ATOM 0 HG SER A 890 2.446 5.633 5.772 1.00 0.00 H new ATOM 116 N VAL A 891 0.997 5.778 10.341 1.00 0.00 N ATOM 117 CA VAL A 891 0.362 4.687 11.063 1.00 0.00 C ATOM 118 C VAL A 891 -1.082 4.562 10.588 1.00 0.00 C ATOM 119 O VAL A 891 -1.738 5.569 10.347 1.00 0.00 O ATOM 120 CB VAL A 891 0.386 4.927 12.595 1.00 0.00 C ATOM 121 CG1 VAL A 891 -0.245 3.762 13.345 1.00 0.00 C ATOM 122 CG2 VAL A 891 1.807 5.167 13.083 1.00 0.00 C ATOM 0 H VAL A 891 0.490 6.661 10.398 1.00 0.00 H new ATOM 0 HA VAL A 891 0.914 3.769 10.862 1.00 0.00 H new ATOM 0 HB VAL A 891 -0.205 5.820 12.799 1.00 0.00 H new ATOM 0 HG11 VAL A 891 -0.213 3.959 14.417 1.00 0.00 H new ATOM 0 HG12 VAL A 891 -1.281 3.644 13.028 1.00 0.00 H new ATOM 0 HG13 VAL A 891 0.307 2.848 13.128 1.00 0.00 H new ATOM 0 HG21 VAL A 891 1.799 5.333 14.160 1.00 0.00 H new ATOM 0 HG22 VAL A 891 2.422 4.297 12.855 1.00 0.00 H new ATOM 0 HG23 VAL A 891 2.220 6.044 12.584 1.00 0.00 H new ATOM 132 N PHE A 892 -1.574 3.348 10.430 1.00 0.00 N ATOM 133 CA PHE A 892 -2.944 3.152 9.977 1.00 0.00 C ATOM 134 C PHE A 892 -3.827 2.682 11.124 1.00 0.00 C ATOM 135 O PHE A 892 -3.575 1.634 11.716 1.00 0.00 O ATOM 136 CB PHE A 892 -2.988 2.144 8.826 1.00 0.00 C ATOM 137 CG PHE A 892 -2.174 2.566 7.636 1.00 0.00 C ATOM 138 CD1 PHE A 892 -2.604 3.597 6.815 1.00 0.00 C ATOM 139 CD2 PHE A 892 -0.978 1.935 7.337 1.00 0.00 C ATOM 140 CE1 PHE A 892 -1.856 3.991 5.722 1.00 0.00 C ATOM 141 CE2 PHE A 892 -0.226 2.324 6.246 1.00 0.00 C ATOM 142 CZ PHE A 892 -0.666 3.353 5.436 1.00 0.00 C ATOM 0 H PHE A 892 -1.054 2.488 10.606 1.00 0.00 H new ATOM 0 HA PHE A 892 -3.325 4.108 9.618 1.00 0.00 H new ATOM 0 HB2 PHE A 892 -2.625 1.180 9.182 1.00 0.00 H new ATOM 0 HB3 PHE A 892 -4.023 2.001 8.517 1.00 0.00 H new ATOM 0 HD1 PHE A 892 -3.535 4.099 7.032 1.00 0.00 H new ATOM 0 HD2 PHE A 892 -0.629 1.129 7.965 1.00 0.00 H new ATOM 0 HE1 PHE A 892 -2.202 4.797 5.092 1.00 0.00 H new ATOM 0 HE2 PHE A 892 0.706 1.824 6.026 1.00 0.00 H new ATOM 0 HZ PHE A 892 -0.080 3.657 4.581 1.00 0.00 H new ATOM 152 N VAL A 893 -4.858 3.455 11.445 1.00 0.00 N ATOM 153 CA VAL A 893 -5.770 3.067 12.511 1.00 0.00 C ATOM 154 C VAL A 893 -7.121 2.652 11.932 1.00 0.00 C ATOM 155 O VAL A 893 -7.828 3.478 11.325 1.00 0.00 O ATOM 156 CB VAL A 893 -5.985 4.224 13.514 1.00 0.00 C ATOM 157 CG1 VAL A 893 -6.963 3.825 14.603 1.00 0.00 C ATOM 158 CG2 VAL A 893 -4.668 4.675 14.128 1.00 0.00 C ATOM 0 H VAL A 893 -5.080 4.340 10.990 1.00 0.00 H new ATOM 0 HA VAL A 893 -5.320 2.224 13.036 1.00 0.00 H new ATOM 0 HB VAL A 893 -6.407 5.062 12.960 1.00 0.00 H new ATOM 0 HG11 VAL A 893 -7.096 4.657 15.295 1.00 0.00 H new ATOM 0 HG12 VAL A 893 -7.923 3.569 14.154 1.00 0.00 H new ATOM 0 HG13 VAL A 893 -6.574 2.962 15.143 1.00 0.00 H new ATOM 0 HG21 VAL A 893 -4.853 5.489 14.829 1.00 0.00 H new ATOM 0 HG22 VAL A 893 -4.208 3.840 14.656 1.00 0.00 H new ATOM 0 HG23 VAL A 893 -3.998 5.019 13.340 1.00 0.00 H new ATOM 168 N LYS A 894 -7.475 1.376 12.163 1.00 0.00 N ATOM 169 CA LYS A 894 -8.735 0.763 11.697 1.00 0.00 C ATOM 170 C LYS A 894 -8.948 0.914 10.187 1.00 0.00 C ATOM 171 O LYS A 894 -9.985 0.513 9.661 1.00 0.00 O ATOM 172 CB LYS A 894 -9.943 1.346 12.441 1.00 0.00 C ATOM 173 CG LYS A 894 -10.189 0.744 13.820 1.00 0.00 C ATOM 174 CD LYS A 894 -9.146 1.189 14.837 1.00 0.00 C ATOM 175 CE LYS A 894 -9.453 0.668 16.232 1.00 0.00 C ATOM 176 NZ LYS A 894 -10.811 1.064 16.697 1.00 0.00 N ATOM 0 H LYS A 894 -6.885 0.730 12.687 1.00 0.00 H new ATOM 0 HA LYS A 894 -8.648 -0.301 11.917 1.00 0.00 H new ATOM 0 HB2 LYS A 894 -9.803 2.422 12.548 1.00 0.00 H new ATOM 0 HB3 LYS A 894 -10.834 1.200 11.831 1.00 0.00 H new ATOM 0 HG2 LYS A 894 -11.180 1.033 14.169 1.00 0.00 H new ATOM 0 HG3 LYS A 894 -10.181 -0.343 13.746 1.00 0.00 H new ATOM 0 HD2 LYS A 894 -8.163 0.836 14.526 1.00 0.00 H new ATOM 0 HD3 LYS A 894 -9.102 2.278 14.858 1.00 0.00 H new ATOM 0 HE2 LYS A 894 -9.372 -0.419 16.237 1.00 0.00 H new ATOM 0 HE3 LYS A 894 -8.707 1.047 16.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 894 -10.762 1.372 17.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 894 -11.165 1.845 16.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 894 -11.456 0.252 16.618 1.00 0.00 H new ATOM 190 N ASN A 895 -7.961 1.487 9.508 1.00 0.00 N ATOM 191 CA ASN A 895 -8.083 1.895 8.108 1.00 0.00 C ATOM 192 C ASN A 895 -9.206 2.917 7.955 1.00 0.00 C ATOM 193 O ASN A 895 -9.773 3.087 6.876 1.00 0.00 O ATOM 194 CB ASN A 895 -8.331 0.699 7.182 1.00 0.00 C ATOM 195 CG ASN A 895 -7.108 -0.183 7.017 1.00 0.00 C ATOM 196 OD1 ASN A 895 -6.307 -0.341 7.937 1.00 0.00 O ATOM 197 ND2 ASN A 895 -6.938 -0.751 5.833 1.00 0.00 N ATOM 0 H ASN A 895 -7.046 1.684 9.914 1.00 0.00 H new ATOM 0 HA ASN A 895 -7.136 2.348 7.815 1.00 0.00 H new ATOM 0 HB2 ASN A 895 -9.152 0.102 7.579 1.00 0.00 H new ATOM 0 HB3 ASN A 895 -8.645 1.062 6.204 1.00 0.00 H new ATOM 0 HD21 ASN A 895 -6.123 -1.340 5.662 1.00 0.00 H new ATOM 0 HD22 ASN A 895 -7.622 -0.599 5.092 1.00 0.00 H new ATOM 204 N VAL A 896 -9.511 3.608 9.050 1.00 0.00 N ATOM 205 CA VAL A 896 -10.471 4.698 9.032 1.00 0.00 C ATOM 206 C VAL A 896 -9.716 6.010 9.093 1.00 0.00 C ATOM 207 O VAL A 896 -10.148 7.032 8.556 1.00 0.00 O ATOM 208 CB VAL A 896 -11.454 4.615 10.223 1.00 0.00 C ATOM 209 CG1 VAL A 896 -12.494 5.723 10.146 1.00 0.00 C ATOM 210 CG2 VAL A 896 -12.129 3.253 10.270 1.00 0.00 C ATOM 0 H VAL A 896 -9.101 3.427 9.966 1.00 0.00 H new ATOM 0 HA VAL A 896 -11.055 4.629 8.114 1.00 0.00 H new ATOM 0 HB VAL A 896 -10.882 4.747 11.141 1.00 0.00 H new ATOM 0 HG11 VAL A 896 -13.174 5.644 10.994 1.00 0.00 H new ATOM 0 HG12 VAL A 896 -11.996 6.692 10.170 1.00 0.00 H new ATOM 0 HG13 VAL A 896 -13.059 5.628 9.218 1.00 0.00 H new ATOM 0 HG21 VAL A 896 -12.816 3.216 11.115 1.00 0.00 H new ATOM 0 HG22 VAL A 896 -12.682 3.089 9.345 1.00 0.00 H new ATOM 0 HG23 VAL A 896 -11.373 2.476 10.383 1.00 0.00 H new ATOM 220 N GLY A 897 -8.557 5.958 9.741 1.00 0.00 N ATOM 221 CA GLY A 897 -7.716 7.123 9.824 1.00 0.00 C ATOM 222 C GLY A 897 -6.257 6.781 9.641 1.00 0.00 C ATOM 223 O GLY A 897 -5.842 5.642 9.864 1.00 0.00 O ATOM 0 H GLY A 897 -8.191 5.128 10.207 1.00 0.00 H new ATOM 0 HA2 GLY A 897 -8.018 7.843 9.063 1.00 0.00 H new ATOM 0 HA3 GLY A 897 -7.857 7.604 10.792 1.00 0.00 H new ATOM 227 N TRP A 898 -5.481 7.777 9.260 1.00 0.00 N ATOM 228 CA TRP A 898 -4.055 7.607 9.061 1.00 0.00 C ATOM 229 C TRP A 898 -3.314 8.576 9.973 1.00 0.00 C ATOM 230 O TRP A 898 -3.694 9.734 10.085 1.00 0.00 O ATOM 231 CB TRP A 898 -3.691 7.862 7.589 1.00 0.00 C ATOM 232 CG TRP A 898 -4.874 7.823 6.656 1.00 0.00 C ATOM 233 CD1 TRP A 898 -5.500 8.896 6.093 1.00 0.00 C ATOM 234 CD2 TRP A 898 -5.579 6.663 6.187 1.00 0.00 C ATOM 235 NE1 TRP A 898 -6.550 8.481 5.313 1.00 0.00 N ATOM 236 CE2 TRP A 898 -6.618 7.115 5.351 1.00 0.00 C ATOM 237 CE3 TRP A 898 -5.437 5.292 6.393 1.00 0.00 C ATOM 238 CZ2 TRP A 898 -7.504 6.244 4.722 1.00 0.00 C ATOM 239 CZ3 TRP A 898 -6.314 4.428 5.768 1.00 0.00 C ATOM 240 CH2 TRP A 898 -7.337 4.907 4.942 1.00 0.00 C ATOM 0 H TRP A 898 -5.819 8.722 9.080 1.00 0.00 H new ATOM 0 HA TRP A 898 -3.766 6.585 9.307 1.00 0.00 H new ATOM 0 HB2 TRP A 898 -3.207 8.835 7.507 1.00 0.00 H new ATOM 0 HB3 TRP A 898 -2.963 7.116 7.270 1.00 0.00 H new ATOM 0 HD1 TRP A 898 -5.210 9.926 6.240 1.00 0.00 H new ATOM 0 HE1 TRP A 898 -7.178 9.092 4.790 1.00 0.00 H new ATOM 0 HE3 TRP A 898 -4.653 4.911 7.031 1.00 0.00 H new ATOM 0 HZ2 TRP A 898 -8.294 6.612 4.084 1.00 0.00 H new ATOM 0 HZ3 TRP A 898 -6.209 3.364 5.919 1.00 0.00 H new ATOM 0 HH2 TRP A 898 -8.008 4.205 4.469 1.00 0.00 H new ATOM 251 N ALA A 899 -2.265 8.108 10.619 1.00 0.00 N ATOM 252 CA ALA A 899 -1.545 8.928 11.578 1.00 0.00 C ATOM 253 C ALA A 899 -0.173 9.325 11.057 1.00 0.00 C ATOM 254 O ALA A 899 0.573 8.496 10.545 1.00 0.00 O ATOM 255 CB ALA A 899 -1.415 8.197 12.906 1.00 0.00 C ATOM 0 H ALA A 899 -1.891 7.167 10.499 1.00 0.00 H new ATOM 0 HA ALA A 899 -2.119 9.842 11.730 1.00 0.00 H new ATOM 0 HB1 ALA A 899 -0.873 8.823 13.615 1.00 0.00 H new ATOM 0 HB2 ALA A 899 -2.408 7.978 13.300 1.00 0.00 H new ATOM 0 HB3 ALA A 899 -0.871 7.265 12.756 1.00 0.00 H new ATOM 261 N THR A 900 0.138 10.601 11.181 1.00 0.00 N ATOM 262 CA THR A 900 1.452 11.112 10.855 1.00 0.00 C ATOM 263 C THR A 900 2.236 11.330 12.146 1.00 0.00 C ATOM 264 O THR A 900 1.753 12.003 13.065 1.00 0.00 O ATOM 265 CB THR A 900 1.353 12.445 10.089 1.00 0.00 C ATOM 266 OG1 THR A 900 0.363 12.345 9.054 1.00 0.00 O ATOM 267 CG2 THR A 900 2.694 12.818 9.472 1.00 0.00 C ATOM 0 H THR A 900 -0.515 11.312 11.511 1.00 0.00 H new ATOM 0 HA THR A 900 1.960 10.387 10.219 1.00 0.00 H new ATOM 0 HB THR A 900 1.065 13.222 10.797 1.00 0.00 H new ATOM 0 HG1 THR A 900 0.305 13.197 8.573 1.00 0.00 H new ATOM 0 HG21 THR A 900 2.598 13.763 8.937 1.00 0.00 H new ATOM 0 HG22 THR A 900 3.441 12.921 10.259 1.00 0.00 H new ATOM 0 HG23 THR A 900 3.005 12.037 8.778 1.00 0.00 H new ATOM 275 N GLN A 901 3.420 10.741 12.226 1.00 0.00 N ATOM 276 CA GLN A 901 4.251 10.855 13.415 1.00 0.00 C ATOM 277 C GLN A 901 5.261 11.985 13.268 1.00 0.00 C ATOM 278 O GLN A 901 6.124 11.955 12.388 1.00 0.00 O ATOM 279 CB GLN A 901 4.981 9.536 13.683 1.00 0.00 C ATOM 280 CG GLN A 901 4.054 8.374 13.999 1.00 0.00 C ATOM 281 CD GLN A 901 3.289 8.577 15.291 1.00 0.00 C ATOM 282 OE1 GLN A 901 3.744 8.180 16.359 1.00 0.00 O ATOM 283 NE2 GLN A 901 2.127 9.204 15.204 1.00 0.00 N ATOM 0 H GLN A 901 3.828 10.178 11.479 1.00 0.00 H new ATOM 0 HA GLN A 901 3.600 11.081 14.260 1.00 0.00 H new ATOM 0 HB2 GLN A 901 5.583 9.281 12.811 1.00 0.00 H new ATOM 0 HB3 GLN A 901 5.670 9.676 14.516 1.00 0.00 H new ATOM 0 HG2 GLN A 901 3.348 8.243 13.179 1.00 0.00 H new ATOM 0 HG3 GLN A 901 4.638 7.456 14.066 1.00 0.00 H new ATOM 0 HE21 GLN A 901 1.784 9.518 14.296 1.00 0.00 H new ATOM 0 HE22 GLN A 901 1.574 9.373 16.045 1.00 0.00 H new ATOM 292 N LEU A 902 5.137 12.990 14.119 1.00 0.00 N ATOM 293 CA LEU A 902 6.081 14.094 14.137 1.00 0.00 C ATOM 294 C LEU A 902 7.037 13.939 15.312 1.00 0.00 C ATOM 295 O LEU A 902 6.606 13.755 16.453 1.00 0.00 O ATOM 296 CB LEU A 902 5.354 15.445 14.222 1.00 0.00 C ATOM 297 CG LEU A 902 4.567 15.863 12.971 1.00 0.00 C ATOM 298 CD1 LEU A 902 3.271 15.074 12.840 1.00 0.00 C ATOM 299 CD2 LEU A 902 4.275 17.353 13.004 1.00 0.00 C ATOM 0 H LEU A 902 4.389 13.064 14.809 1.00 0.00 H new ATOM 0 HA LEU A 902 6.647 14.074 13.206 1.00 0.00 H new ATOM 0 HB2 LEU A 902 4.666 15.413 15.067 1.00 0.00 H new ATOM 0 HB3 LEU A 902 6.090 16.219 14.440 1.00 0.00 H new ATOM 0 HG LEU A 902 5.183 15.641 12.100 1.00 0.00 H new ATOM 0 HD11 LEU A 902 2.739 15.395 11.944 1.00 0.00 H new ATOM 0 HD12 LEU A 902 3.498 14.011 12.766 1.00 0.00 H new ATOM 0 HD13 LEU A 902 2.647 15.251 13.716 1.00 0.00 H new ATOM 0 HD21 LEU A 902 3.717 17.634 12.111 1.00 0.00 H new ATOM 0 HD22 LEU A 902 3.685 17.589 13.890 1.00 0.00 H new ATOM 0 HD23 LEU A 902 5.213 17.907 13.035 1.00 0.00 H new ATOM 311 N THR A 903 8.333 14.027 15.035 1.00 0.00 N ATOM 312 CA THR A 903 9.356 13.835 16.059 1.00 0.00 C ATOM 313 C THR A 903 9.329 14.965 17.095 1.00 0.00 C ATOM 314 O THR A 903 10.061 14.931 18.082 1.00 0.00 O ATOM 315 CB THR A 903 10.772 13.723 15.439 1.00 0.00 C ATOM 316 OG1 THR A 903 11.735 13.398 16.452 1.00 0.00 O ATOM 317 CG2 THR A 903 11.175 15.019 14.749 1.00 0.00 C ATOM 0 H THR A 903 8.702 14.231 14.106 1.00 0.00 H new ATOM 0 HA THR A 903 9.125 12.896 16.561 1.00 0.00 H new ATOM 0 HB THR A 903 10.747 12.928 14.694 1.00 0.00 H new ATOM 0 HG1 THR A 903 11.478 13.824 17.296 1.00 0.00 H new ATOM 0 HG21 THR A 903 12.173 14.910 14.324 1.00 0.00 H new ATOM 0 HG22 THR A 903 10.464 15.244 13.954 1.00 0.00 H new ATOM 0 HG23 THR A 903 11.177 15.832 15.475 1.00 0.00 H new ATOM 325 N SER A 904 8.479 15.962 16.862 1.00 0.00 N ATOM 326 CA SER A 904 8.301 17.058 17.803 1.00 0.00 C ATOM 327 C SER A 904 7.268 16.679 18.869 1.00 0.00 C ATOM 328 O SER A 904 6.974 17.461 19.773 1.00 0.00 O ATOM 329 CB SER A 904 7.857 18.321 17.049 1.00 0.00 C ATOM 330 OG SER A 904 7.745 19.446 17.909 1.00 0.00 O ATOM 0 H SER A 904 7.901 16.031 16.024 1.00 0.00 H new ATOM 0 HA SER A 904 9.250 17.259 18.301 1.00 0.00 H new ATOM 0 HB2 SER A 904 8.573 18.541 16.257 1.00 0.00 H new ATOM 0 HB3 SER A 904 6.897 18.136 16.568 1.00 0.00 H new ATOM 0 HG SER A 904 7.438 19.153 18.793 1.00 0.00 H new ATOM 336 N GLY A 905 6.728 15.469 18.763 1.00 0.00 N ATOM 337 CA GLY A 905 5.752 15.003 19.729 1.00 0.00 C ATOM 338 C GLY A 905 4.331 15.324 19.312 1.00 0.00 C ATOM 339 O GLY A 905 3.400 15.208 20.108 1.00 0.00 O ATOM 0 H GLY A 905 6.950 14.802 18.024 1.00 0.00 H new ATOM 0 HA2 GLY A 905 5.856 13.926 19.856 1.00 0.00 H new ATOM 0 HA3 GLY A 905 5.956 15.460 20.697 1.00 0.00 H new ATOM 343 N ALA A 906 4.170 15.762 18.073 1.00 0.00 N ATOM 344 CA ALA A 906 2.857 16.059 17.536 1.00 0.00 C ATOM 345 C ALA A 906 2.296 14.839 16.825 1.00 0.00 C ATOM 346 O ALA A 906 3.020 14.140 16.112 1.00 0.00 O ATOM 347 CB ALA A 906 2.925 17.243 16.586 1.00 0.00 C ATOM 0 H ALA A 906 4.938 15.919 17.420 1.00 0.00 H new ATOM 0 HA ALA A 906 2.194 16.320 18.361 1.00 0.00 H new ATOM 0 HB1 ALA A 906 1.930 17.451 16.193 1.00 0.00 H new ATOM 0 HB2 ALA A 906 3.294 18.118 17.121 1.00 0.00 H new ATOM 0 HB3 ALA A 906 3.599 17.010 15.762 1.00 0.00 H new ATOM 353 N VAL A 907 1.017 14.584 17.019 1.00 0.00 N ATOM 354 CA VAL A 907 0.356 13.493 16.326 1.00 0.00 C ATOM 355 C VAL A 907 -0.657 14.059 15.344 1.00 0.00 C ATOM 356 O VAL A 907 -1.548 14.816 15.730 1.00 0.00 O ATOM 357 CB VAL A 907 -0.363 12.539 17.305 1.00 0.00 C ATOM 358 CG1 VAL A 907 -0.963 11.354 16.558 1.00 0.00 C ATOM 359 CG2 VAL A 907 0.590 12.060 18.391 1.00 0.00 C ATOM 0 H VAL A 907 0.415 15.115 17.649 1.00 0.00 H new ATOM 0 HA VAL A 907 1.121 12.921 15.800 1.00 0.00 H new ATOM 0 HB VAL A 907 -1.173 13.090 17.782 1.00 0.00 H new ATOM 0 HG11 VAL A 907 -1.465 10.694 17.266 1.00 0.00 H new ATOM 0 HG12 VAL A 907 -1.684 11.714 15.824 1.00 0.00 H new ATOM 0 HG13 VAL A 907 -0.170 10.805 16.050 1.00 0.00 H new ATOM 0 HG21 VAL A 907 0.062 11.389 19.069 1.00 0.00 H new ATOM 0 HG22 VAL A 907 1.425 11.530 17.934 1.00 0.00 H new ATOM 0 HG23 VAL A 907 0.966 12.917 18.949 1.00 0.00 H new ATOM 369 N TRP A 908 -0.514 13.708 14.078 1.00 0.00 N ATOM 370 CA TRP A 908 -1.415 14.214 13.053 1.00 0.00 C ATOM 371 C TRP A 908 -2.309 13.092 12.536 1.00 0.00 C ATOM 372 O TRP A 908 -1.818 12.106 12.000 1.00 0.00 O ATOM 373 CB TRP A 908 -0.600 14.815 11.906 1.00 0.00 C ATOM 374 CG TRP A 908 -1.345 15.829 11.098 1.00 0.00 C ATOM 375 CD1 TRP A 908 -2.393 15.603 10.257 1.00 0.00 C ATOM 376 CD2 TRP A 908 -1.082 17.236 11.046 1.00 0.00 C ATOM 377 NE1 TRP A 908 -2.801 16.782 9.689 1.00 0.00 N ATOM 378 CE2 TRP A 908 -2.015 17.799 10.159 1.00 0.00 C ATOM 379 CE3 TRP A 908 -0.150 18.076 11.667 1.00 0.00 C ATOM 380 CZ2 TRP A 908 -2.047 19.162 9.875 1.00 0.00 C ATOM 381 CZ3 TRP A 908 -0.183 19.430 11.385 1.00 0.00 C ATOM 382 CH2 TRP A 908 -1.127 19.961 10.498 1.00 0.00 C ATOM 0 H TRP A 908 0.212 13.079 13.735 1.00 0.00 H new ATOM 0 HA TRP A 908 -2.049 14.989 13.484 1.00 0.00 H new ATOM 0 HB2 TRP A 908 0.297 15.279 12.315 1.00 0.00 H new ATOM 0 HB3 TRP A 908 -0.271 14.011 11.248 1.00 0.00 H new ATOM 0 HD1 TRP A 908 -2.837 14.637 10.066 1.00 0.00 H new ATOM 0 HE1 TRP A 908 -3.567 16.885 9.023 1.00 0.00 H new ATOM 0 HE3 TRP A 908 0.581 17.675 12.353 1.00 0.00 H new ATOM 0 HZ2 TRP A 908 -2.772 19.574 9.188 1.00 0.00 H new ATOM 0 HZ3 TRP A 908 0.531 20.088 11.857 1.00 0.00 H new ATOM 0 HH2 TRP A 908 -1.129 21.023 10.301 1.00 0.00 H new ATOM 393 N VAL A 909 -3.614 13.231 12.700 1.00 0.00 N ATOM 394 CA VAL A 909 -4.546 12.204 12.251 1.00 0.00 C ATOM 395 C VAL A 909 -5.306 12.658 11.011 1.00 0.00 C ATOM 396 O VAL A 909 -5.905 13.728 10.993 1.00 0.00 O ATOM 397 CB VAL A 909 -5.560 11.819 13.351 1.00 0.00 C ATOM 398 CG1 VAL A 909 -6.487 10.708 12.866 1.00 0.00 C ATOM 399 CG2 VAL A 909 -4.838 11.401 14.624 1.00 0.00 C ATOM 0 H VAL A 909 -4.053 14.040 13.139 1.00 0.00 H new ATOM 0 HA VAL A 909 -3.945 11.327 12.011 1.00 0.00 H new ATOM 0 HB VAL A 909 -6.168 12.695 13.576 1.00 0.00 H new ATOM 0 HG11 VAL A 909 -7.193 10.452 13.656 1.00 0.00 H new ATOM 0 HG12 VAL A 909 -7.034 11.048 11.987 1.00 0.00 H new ATOM 0 HG13 VAL A 909 -5.897 9.829 12.608 1.00 0.00 H new ATOM 0 HG21 VAL A 909 -5.570 11.134 15.386 1.00 0.00 H new ATOM 0 HG22 VAL A 909 -4.201 10.542 14.415 1.00 0.00 H new ATOM 0 HG23 VAL A 909 -4.225 12.228 14.983 1.00 0.00 H new ATOM 409 N GLN A 910 -5.250 11.843 9.974 1.00 0.00 N ATOM 410 CA GLN A 910 -6.024 12.065 8.762 1.00 0.00 C ATOM 411 C GLN A 910 -7.217 11.114 8.736 1.00 0.00 C ATOM 412 O GLN A 910 -7.109 9.973 9.175 1.00 0.00 O ATOM 413 CB GLN A 910 -5.159 11.809 7.523 1.00 0.00 C ATOM 414 CG GLN A 910 -3.992 12.763 7.355 1.00 0.00 C ATOM 415 CD GLN A 910 -4.427 14.154 6.950 1.00 0.00 C ATOM 416 OE1 GLN A 910 -5.465 14.338 6.316 1.00 0.00 O ATOM 417 NE2 GLN A 910 -3.623 15.140 7.298 1.00 0.00 N ATOM 0 H GLN A 910 -4.667 11.007 9.946 1.00 0.00 H new ATOM 0 HA GLN A 910 -6.369 13.099 8.754 1.00 0.00 H new ATOM 0 HB2 GLN A 910 -4.774 10.790 7.570 1.00 0.00 H new ATOM 0 HB3 GLN A 910 -5.791 11.870 6.637 1.00 0.00 H new ATOM 0 HG2 GLN A 910 -3.436 12.819 8.291 1.00 0.00 H new ATOM 0 HG3 GLN A 910 -3.310 12.367 6.603 1.00 0.00 H new ATOM 0 HE21 GLN A 910 -2.772 14.942 7.824 1.00 0.00 H new ATOM 0 HE22 GLN A 910 -3.853 16.100 7.041 1.00 0.00 H new ATOM 426 N PHE A 911 -8.346 11.579 8.235 1.00 0.00 N ATOM 427 CA PHE A 911 -9.506 10.720 8.042 1.00 0.00 C ATOM 428 C PHE A 911 -9.692 10.401 6.568 1.00 0.00 C ATOM 429 O PHE A 911 -9.083 11.035 5.705 1.00 0.00 O ATOM 430 CB PHE A 911 -10.776 11.373 8.590 1.00 0.00 C ATOM 431 CG PHE A 911 -11.082 11.000 10.011 1.00 0.00 C ATOM 432 CD1 PHE A 911 -11.697 9.794 10.300 1.00 0.00 C ATOM 433 CD2 PHE A 911 -10.757 11.848 11.055 1.00 0.00 C ATOM 434 CE1 PHE A 911 -11.983 9.440 11.604 1.00 0.00 C ATOM 435 CE2 PHE A 911 -11.040 11.498 12.363 1.00 0.00 C ATOM 436 CZ PHE A 911 -11.654 10.293 12.636 1.00 0.00 C ATOM 0 H PHE A 911 -8.488 12.549 7.953 1.00 0.00 H new ATOM 0 HA PHE A 911 -9.327 9.796 8.591 1.00 0.00 H new ATOM 0 HB2 PHE A 911 -10.675 12.456 8.522 1.00 0.00 H new ATOM 0 HB3 PHE A 911 -11.620 11.091 7.960 1.00 0.00 H new ATOM 0 HD1 PHE A 911 -11.956 9.121 9.496 1.00 0.00 H new ATOM 0 HD2 PHE A 911 -10.277 12.793 10.846 1.00 0.00 H new ATOM 0 HE1 PHE A 911 -12.464 8.496 11.815 1.00 0.00 H new ATOM 0 HE2 PHE A 911 -10.781 12.167 13.170 1.00 0.00 H new ATOM 0 HZ PHE A 911 -11.877 10.018 13.657 1.00 0.00 H new ATOM 446 N ASN A 912 -10.543 9.425 6.282 1.00 0.00 N ATOM 447 CA ASN A 912 -10.833 9.038 4.904 1.00 0.00 C ATOM 448 C ASN A 912 -11.496 10.178 4.127 1.00 0.00 C ATOM 449 O ASN A 912 -11.378 10.251 2.905 1.00 0.00 O ATOM 450 CB ASN A 912 -11.734 7.796 4.861 1.00 0.00 C ATOM 451 CG ASN A 912 -13.119 8.039 5.441 1.00 0.00 C ATOM 452 OD1 ASN A 912 -13.286 8.790 6.407 1.00 0.00 O ATOM 453 ND2 ASN A 912 -14.123 7.420 4.838 1.00 0.00 N ATOM 0 H ASN A 912 -11.046 8.885 6.986 1.00 0.00 H new ATOM 0 HA ASN A 912 -9.879 8.805 4.430 1.00 0.00 H new ATOM 0 HB2 ASN A 912 -11.833 7.463 3.828 1.00 0.00 H new ATOM 0 HB3 ASN A 912 -11.253 6.987 5.412 1.00 0.00 H new ATOM 0 HD21 ASN A 912 -15.078 7.556 5.169 1.00 0.00 H new ATOM 0 HD22 ASN A 912 -13.941 6.808 4.043 1.00 0.00 H new ATOM 460 N ASP A 913 -12.187 11.067 4.834 1.00 0.00 N ATOM 461 CA ASP A 913 -12.851 12.200 4.187 1.00 0.00 C ATOM 462 C ASP A 913 -11.895 13.385 4.037 1.00 0.00 C ATOM 463 O ASP A 913 -12.246 14.416 3.473 1.00 0.00 O ATOM 464 CB ASP A 913 -14.080 12.615 5.006 1.00 0.00 C ATOM 465 CG ASP A 913 -14.872 13.744 4.367 1.00 0.00 C ATOM 466 OD1 ASP A 913 -15.604 13.480 3.391 1.00 0.00 O ATOM 467 OD2 ASP A 913 -14.767 14.897 4.835 1.00 0.00 O ATOM 0 H ASP A 913 -12.303 11.028 5.847 1.00 0.00 H new ATOM 0 HA ASP A 913 -13.166 11.892 3.190 1.00 0.00 H new ATOM 0 HB2 ASP A 913 -14.731 11.751 5.135 1.00 0.00 H new ATOM 0 HB3 ASP A 913 -13.758 12.923 6.001 1.00 0.00 H new ATOM 472 N GLY A 914 -10.664 13.216 4.493 1.00 0.00 N ATOM 473 CA GLY A 914 -9.704 14.301 4.436 1.00 0.00 C ATOM 474 C GLY A 914 -9.788 15.208 5.650 1.00 0.00 C ATOM 475 O GLY A 914 -9.202 16.289 5.670 1.00 0.00 O ATOM 0 H GLY A 914 -10.312 12.350 4.901 1.00 0.00 H new ATOM 0 HA2 GLY A 914 -8.698 13.889 4.362 1.00 0.00 H new ATOM 0 HA3 GLY A 914 -9.876 14.888 3.534 1.00 0.00 H new ATOM 479 N SER A 915 -10.538 14.777 6.658 1.00 0.00 N ATOM 480 CA SER A 915 -10.609 15.502 7.917 1.00 0.00 C ATOM 481 C SER A 915 -9.331 15.255 8.708 1.00 0.00 C ATOM 482 O SER A 915 -8.688 14.223 8.535 1.00 0.00 O ATOM 483 CB SER A 915 -11.831 15.049 8.715 1.00 0.00 C ATOM 484 OG SER A 915 -13.013 15.142 7.932 1.00 0.00 O ATOM 0 H SER A 915 -11.104 13.929 6.626 1.00 0.00 H new ATOM 0 HA SER A 915 -10.707 16.570 7.721 1.00 0.00 H new ATOM 0 HB2 SER A 915 -11.691 14.021 9.049 1.00 0.00 H new ATOM 0 HB3 SER A 915 -11.934 15.663 9.610 1.00 0.00 H new ATOM 0 HG SER A 915 -13.781 14.845 8.463 1.00 0.00 H new ATOM 490 N GLN A 916 -8.954 16.187 9.568 1.00 0.00 N ATOM 491 CA GLN A 916 -7.668 16.090 10.246 1.00 0.00 C ATOM 492 C GLN A 916 -7.793 16.325 11.747 1.00 0.00 C ATOM 493 O GLN A 916 -8.712 17.000 12.210 1.00 0.00 O ATOM 494 CB GLN A 916 -6.690 17.106 9.649 1.00 0.00 C ATOM 495 CG GLN A 916 -6.447 16.920 8.159 1.00 0.00 C ATOM 496 CD GLN A 916 -5.528 17.978 7.581 1.00 0.00 C ATOM 497 OE1 GLN A 916 -4.308 17.817 7.569 1.00 0.00 O ATOM 498 NE2 GLN A 916 -6.105 19.060 7.081 1.00 0.00 N ATOM 0 H GLN A 916 -9.509 17.008 9.812 1.00 0.00 H new ATOM 0 HA GLN A 916 -7.294 15.077 10.098 1.00 0.00 H new ATOM 0 HB2 GLN A 916 -7.074 18.111 9.823 1.00 0.00 H new ATOM 0 HB3 GLN A 916 -5.738 17.033 10.175 1.00 0.00 H new ATOM 0 HG2 GLN A 916 -6.015 15.935 7.986 1.00 0.00 H new ATOM 0 HG3 GLN A 916 -7.401 16.946 7.633 1.00 0.00 H new ATOM 0 HE21 GLN A 916 -7.120 19.156 7.110 1.00 0.00 H new ATOM 0 HE22 GLN A 916 -5.534 19.797 6.667 1.00 0.00 H new ATOM 507 N LEU A 917 -6.864 15.749 12.498 1.00 0.00 N ATOM 508 CA LEU A 917 -6.728 16.019 13.923 1.00 0.00 C ATOM 509 C LEU A 917 -5.274 16.334 14.234 1.00 0.00 C ATOM 510 O LEU A 917 -4.370 15.652 13.751 1.00 0.00 O ATOM 511 CB LEU A 917 -7.154 14.814 14.783 1.00 0.00 C ATOM 512 CG LEU A 917 -8.659 14.575 14.956 1.00 0.00 C ATOM 513 CD1 LEU A 917 -9.282 14.043 13.678 1.00 0.00 C ATOM 514 CD2 LEU A 917 -8.901 13.609 16.108 1.00 0.00 C ATOM 0 H LEU A 917 -6.183 15.081 12.136 1.00 0.00 H new ATOM 0 HA LEU A 917 -7.378 16.861 14.161 1.00 0.00 H new ATOM 0 HB2 LEU A 917 -6.717 13.916 14.346 1.00 0.00 H new ATOM 0 HB3 LEU A 917 -6.715 14.933 15.773 1.00 0.00 H new ATOM 0 HG LEU A 917 -9.133 15.529 15.184 1.00 0.00 H new ATOM 0 HD11 LEU A 917 -10.349 13.884 13.832 1.00 0.00 H new ATOM 0 HD12 LEU A 917 -9.135 14.764 12.874 1.00 0.00 H new ATOM 0 HD13 LEU A 917 -8.809 13.098 13.409 1.00 0.00 H new ATOM 0 HD21 LEU A 917 -9.972 13.444 16.225 1.00 0.00 H new ATOM 0 HD22 LEU A 917 -8.408 12.660 15.897 1.00 0.00 H new ATOM 0 HD23 LEU A 917 -8.496 14.031 17.028 1.00 0.00 H new ATOM 526 N VAL A 918 -5.048 17.364 15.025 1.00 0.00 N ATOM 527 CA VAL A 918 -3.715 17.660 15.514 1.00 0.00 C ATOM 528 C VAL A 918 -3.672 17.451 17.021 1.00 0.00 C ATOM 529 O VAL A 918 -4.435 18.076 17.759 1.00 0.00 O ATOM 530 CB VAL A 918 -3.297 19.108 15.175 1.00 0.00 C ATOM 531 CG1 VAL A 918 -1.869 19.380 15.627 1.00 0.00 C ATOM 532 CG2 VAL A 918 -3.449 19.375 13.683 1.00 0.00 C ATOM 0 H VAL A 918 -5.770 18.010 15.343 1.00 0.00 H new ATOM 0 HA VAL A 918 -3.013 16.986 15.023 1.00 0.00 H new ATOM 0 HB VAL A 918 -3.958 19.787 15.714 1.00 0.00 H new ATOM 0 HG11 VAL A 918 -1.598 20.406 15.377 1.00 0.00 H new ATOM 0 HG12 VAL A 918 -1.795 19.237 16.705 1.00 0.00 H new ATOM 0 HG13 VAL A 918 -1.190 18.692 15.123 1.00 0.00 H new ATOM 0 HG21 VAL A 918 -3.150 20.400 13.464 1.00 0.00 H new ATOM 0 HG22 VAL A 918 -2.817 18.685 13.124 1.00 0.00 H new ATOM 0 HG23 VAL A 918 -4.489 19.231 13.392 1.00 0.00 H new ATOM 542 N VAL A 919 -2.793 16.575 17.479 1.00 0.00 N ATOM 543 CA VAL A 919 -2.686 16.286 18.897 1.00 0.00 C ATOM 544 C VAL A 919 -1.310 16.657 19.414 1.00 0.00 C ATOM 545 O VAL A 919 -0.295 16.293 18.818 1.00 0.00 O ATOM 546 CB VAL A 919 -2.950 14.792 19.191 1.00 0.00 C ATOM 547 CG1 VAL A 919 -2.903 14.517 20.688 1.00 0.00 C ATOM 548 CG2 VAL A 919 -4.289 14.362 18.612 1.00 0.00 C ATOM 0 H VAL A 919 -2.145 16.053 16.889 1.00 0.00 H new ATOM 0 HA VAL A 919 -3.443 16.883 19.406 1.00 0.00 H new ATOM 0 HB VAL A 919 -2.163 14.208 18.713 1.00 0.00 H new ATOM 0 HG11 VAL A 919 -3.092 13.459 20.870 1.00 0.00 H new ATOM 0 HG12 VAL A 919 -1.919 14.782 21.076 1.00 0.00 H new ATOM 0 HG13 VAL A 919 -3.664 15.113 21.191 1.00 0.00 H new ATOM 0 HG21 VAL A 919 -4.457 13.307 18.829 1.00 0.00 H new ATOM 0 HG22 VAL A 919 -5.086 14.956 19.059 1.00 0.00 H new ATOM 0 HG23 VAL A 919 -4.284 14.514 17.533 1.00 0.00 H new ATOM 558 N GLN A 920 -1.277 17.389 20.513 1.00 0.00 N ATOM 559 CA GLN A 920 -0.026 17.667 21.188 1.00 0.00 C ATOM 560 C GLN A 920 0.192 16.616 22.269 1.00 0.00 C ATOM 561 O GLN A 920 -0.761 16.215 22.944 1.00 0.00 O ATOM 562 CB GLN A 920 -0.051 19.067 21.807 1.00 0.00 C ATOM 563 CG GLN A 920 1.313 19.573 22.258 1.00 0.00 C ATOM 564 CD GLN A 920 2.259 19.840 21.098 1.00 0.00 C ATOM 565 OE1 GLN A 920 2.261 20.930 20.524 1.00 0.00 O ATOM 566 NE2 GLN A 920 3.086 18.862 20.754 1.00 0.00 N ATOM 0 H GLN A 920 -2.100 17.800 20.954 1.00 0.00 H new ATOM 0 HA GLN A 920 0.792 17.631 20.469 1.00 0.00 H new ATOM 0 HB2 GLN A 920 -0.464 19.766 21.080 1.00 0.00 H new ATOM 0 HB3 GLN A 920 -0.726 19.062 22.663 1.00 0.00 H new ATOM 0 HG2 GLN A 920 1.183 20.490 22.832 1.00 0.00 H new ATOM 0 HG3 GLN A 920 1.764 18.840 22.926 1.00 0.00 H new ATOM 0 HE21 GLN A 920 3.057 17.972 21.251 1.00 0.00 H new ATOM 0 HE22 GLN A 920 3.751 19.000 19.993 1.00 0.00 H new ATOM 575 N ALA A 921 1.430 16.162 22.414 1.00 0.00 N ATOM 576 CA ALA A 921 1.788 15.206 23.458 1.00 0.00 C ATOM 577 C ALA A 921 1.283 15.668 24.824 1.00 0.00 C ATOM 578 O ALA A 921 1.494 16.814 25.226 1.00 0.00 O ATOM 579 CB ALA A 921 3.296 15.002 23.495 1.00 0.00 C ATOM 0 H ALA A 921 2.209 16.442 21.818 1.00 0.00 H new ATOM 0 HA ALA A 921 1.309 14.256 23.223 1.00 0.00 H new ATOM 0 HB1 ALA A 921 3.547 14.287 24.278 1.00 0.00 H new ATOM 0 HB2 ALA A 921 3.635 14.620 22.532 1.00 0.00 H new ATOM 0 HB3 ALA A 921 3.787 15.953 23.701 1.00 0.00 H new ATOM 585 N GLY A 922 0.598 14.770 25.518 1.00 0.00 N ATOM 586 CA GLY A 922 0.042 15.086 26.822 1.00 0.00 C ATOM 587 C GLY A 922 -1.428 15.447 26.753 1.00 0.00 C ATOM 588 O GLY A 922 -2.084 15.600 27.786 1.00 0.00 O ATOM 0 H GLY A 922 0.415 13.819 25.199 1.00 0.00 H new ATOM 0 HA2 GLY A 922 0.172 14.231 27.486 1.00 0.00 H new ATOM 0 HA3 GLY A 922 0.597 15.916 27.259 1.00 0.00 H new ATOM 592 N VAL A 923 -1.947 15.568 25.526 1.00 0.00 N ATOM 593 CA VAL A 923 -3.361 15.879 25.289 1.00 0.00 C ATOM 594 C VAL A 923 -3.737 17.198 25.971 1.00 0.00 C ATOM 595 O VAL A 923 -4.853 17.386 26.455 1.00 0.00 O ATOM 596 CB VAL A 923 -4.279 14.726 25.771 1.00 0.00 C ATOM 597 CG1 VAL A 923 -5.710 14.908 25.284 1.00 0.00 C ATOM 598 CG2 VAL A 923 -3.735 13.390 25.298 1.00 0.00 C ATOM 0 H VAL A 923 -1.401 15.454 24.672 1.00 0.00 H new ATOM 0 HA VAL A 923 -3.509 15.990 24.215 1.00 0.00 H new ATOM 0 HB VAL A 923 -4.291 14.746 26.861 1.00 0.00 H new ATOM 0 HG11 VAL A 923 -6.324 14.081 25.641 1.00 0.00 H new ATOM 0 HG12 VAL A 923 -6.108 15.848 25.667 1.00 0.00 H new ATOM 0 HG13 VAL A 923 -5.724 14.926 24.194 1.00 0.00 H new ATOM 0 HG21 VAL A 923 -4.388 12.588 25.643 1.00 0.00 H new ATOM 0 HG22 VAL A 923 -3.692 13.380 24.209 1.00 0.00 H new ATOM 0 HG23 VAL A 923 -2.734 13.241 25.702 1.00 0.00 H new ATOM 608 N SER A 924 -2.785 18.119 25.995 1.00 0.00 N ATOM 609 CA SER A 924 -3.009 19.437 26.564 1.00 0.00 C ATOM 610 C SER A 924 -3.875 20.277 25.631 1.00 0.00 C ATOM 611 O SER A 924 -4.472 21.272 26.042 1.00 0.00 O ATOM 612 CB SER A 924 -1.664 20.124 26.807 1.00 0.00 C ATOM 613 OG SER A 924 -0.805 19.293 27.576 1.00 0.00 O ATOM 0 H SER A 924 -1.846 17.975 25.625 1.00 0.00 H new ATOM 0 HA SER A 924 -3.533 19.333 27.514 1.00 0.00 H new ATOM 0 HB2 SER A 924 -1.192 20.358 25.853 1.00 0.00 H new ATOM 0 HB3 SER A 924 -1.822 21.070 27.325 1.00 0.00 H new ATOM 0 HG SER A 924 0.050 19.750 27.719 1.00 0.00 H new ATOM 619 N SER A 925 -3.958 19.844 24.377 1.00 0.00 N ATOM 620 CA SER A 925 -4.694 20.572 23.354 1.00 0.00 C ATOM 621 C SER A 925 -4.832 19.723 22.095 1.00 0.00 C ATOM 622 O SER A 925 -3.864 19.088 21.658 1.00 0.00 O ATOM 623 CB SER A 925 -3.972 21.881 23.024 1.00 0.00 C ATOM 624 OG SER A 925 -2.622 21.630 22.668 1.00 0.00 O ATOM 0 H SER A 925 -3.520 18.985 24.045 1.00 0.00 H new ATOM 0 HA SER A 925 -5.690 20.799 23.734 1.00 0.00 H new ATOM 0 HB2 SER A 925 -4.482 22.387 22.204 1.00 0.00 H new ATOM 0 HB3 SER A 925 -4.009 22.550 23.884 1.00 0.00 H new ATOM 0 HG SER A 925 -2.176 22.477 22.459 1.00 0.00 H new ATOM 630 N ILE A 926 -6.030 19.700 21.527 1.00 0.00 N ATOM 631 CA ILE A 926 -6.278 18.986 20.281 1.00 0.00 C ATOM 632 C ILE A 926 -6.897 19.946 19.274 1.00 0.00 C ATOM 633 O ILE A 926 -7.674 20.817 19.648 1.00 0.00 O ATOM 634 CB ILE A 926 -7.238 17.774 20.470 1.00 0.00 C ATOM 635 CG1 ILE A 926 -6.774 16.862 21.610 1.00 0.00 C ATOM 636 CG2 ILE A 926 -7.357 16.968 19.182 1.00 0.00 C ATOM 637 CD1 ILE A 926 -7.245 17.307 22.980 1.00 0.00 C ATOM 0 H ILE A 926 -6.850 20.170 21.911 1.00 0.00 H new ATOM 0 HA ILE A 926 -5.321 18.602 19.927 1.00 0.00 H new ATOM 0 HB ILE A 926 -8.217 18.177 20.729 1.00 0.00 H new ATOM 0 HG12 ILE A 926 -7.134 15.850 21.423 1.00 0.00 H new ATOM 0 HG13 ILE A 926 -5.685 16.818 21.607 1.00 0.00 H new ATOM 0 HG21 ILE A 926 -8.033 16.127 19.340 1.00 0.00 H new ATOM 0 HG22 ILE A 926 -7.749 17.605 18.389 1.00 0.00 H new ATOM 0 HG23 ILE A 926 -6.374 16.594 18.894 1.00 0.00 H new ATOM 0 HD11 ILE A 926 -6.877 16.612 23.735 1.00 0.00 H new ATOM 0 HD12 ILE A 926 -6.863 18.306 23.189 1.00 0.00 H new ATOM 0 HD13 ILE A 926 -8.335 17.323 23.003 1.00 0.00 H new ATOM 649 N SER A 927 -6.554 19.796 18.011 1.00 0.00 N ATOM 650 CA SER A 927 -7.140 20.616 16.969 1.00 0.00 C ATOM 651 C SER A 927 -7.890 19.739 15.976 1.00 0.00 C ATOM 652 O SER A 927 -7.292 18.884 15.323 1.00 0.00 O ATOM 653 CB SER A 927 -6.058 21.436 16.253 1.00 0.00 C ATOM 654 OG SER A 927 -6.631 22.361 15.343 1.00 0.00 O ATOM 0 H SER A 927 -5.872 19.113 17.680 1.00 0.00 H new ATOM 0 HA SER A 927 -7.845 21.310 17.426 1.00 0.00 H new ATOM 0 HB2 SER A 927 -5.457 21.971 16.989 1.00 0.00 H new ATOM 0 HB3 SER A 927 -5.385 20.766 15.718 1.00 0.00 H new ATOM 0 HG SER A 927 -5.919 22.871 14.903 1.00 0.00 H new ATOM 660 N TYR A 928 -9.192 19.934 15.867 1.00 0.00 N ATOM 661 CA TYR A 928 -9.975 19.178 14.911 1.00 0.00 C ATOM 662 C TYR A 928 -10.155 19.997 13.645 1.00 0.00 C ATOM 663 O TYR A 928 -10.594 21.146 13.687 1.00 0.00 O ATOM 664 CB TYR A 928 -11.340 18.803 15.496 1.00 0.00 C ATOM 665 CG TYR A 928 -12.167 17.917 14.591 1.00 0.00 C ATOM 666 CD1 TYR A 928 -11.921 16.553 14.517 1.00 0.00 C ATOM 667 CD2 TYR A 928 -13.194 18.442 13.815 1.00 0.00 C ATOM 668 CE1 TYR A 928 -12.671 15.736 13.696 1.00 0.00 C ATOM 669 CE2 TYR A 928 -13.950 17.629 12.991 1.00 0.00 C ATOM 670 CZ TYR A 928 -13.684 16.277 12.935 1.00 0.00 C ATOM 671 OH TYR A 928 -14.432 15.463 12.114 1.00 0.00 O ATOM 0 H TYR A 928 -9.724 20.603 16.424 1.00 0.00 H new ATOM 0 HA TYR A 928 -9.445 18.255 14.676 1.00 0.00 H new ATOM 0 HB2 TYR A 928 -11.190 18.295 16.449 1.00 0.00 H new ATOM 0 HB3 TYR A 928 -11.898 19.715 15.706 1.00 0.00 H new ATOM 0 HD1 TYR A 928 -11.129 16.124 15.112 1.00 0.00 H new ATOM 0 HD2 TYR A 928 -13.404 19.500 13.856 1.00 0.00 H new ATOM 0 HE1 TYR A 928 -12.465 14.677 13.650 1.00 0.00 H new ATOM 0 HE2 TYR A 928 -14.745 18.051 12.394 1.00 0.00 H new ATOM 0 HH TYR A 928 -15.106 16.000 11.647 1.00 0.00 H new ATOM 681 N THR A 929 -9.817 19.400 12.525 1.00 0.00 N ATOM 682 CA THR A 929 -9.916 20.068 11.247 1.00 0.00 C ATOM 683 C THR A 929 -10.986 19.417 10.385 1.00 0.00 C ATOM 684 O THR A 929 -10.912 18.226 10.085 1.00 0.00 O ATOM 685 CB THR A 929 -8.561 20.019 10.514 1.00 0.00 C ATOM 686 OG1 THR A 929 -7.546 20.599 11.343 1.00 0.00 O ATOM 687 CG2 THR A 929 -8.620 20.753 9.181 1.00 0.00 C ATOM 0 H THR A 929 -9.468 18.443 12.474 1.00 0.00 H new ATOM 0 HA THR A 929 -10.191 21.108 11.426 1.00 0.00 H new ATOM 0 HB THR A 929 -8.323 18.975 10.311 1.00 0.00 H new ATOM 0 HG1 THR A 929 -6.685 20.566 10.877 1.00 0.00 H new ATOM 0 HG21 THR A 929 -7.647 20.698 8.692 1.00 0.00 H new ATOM 0 HG22 THR A 929 -9.373 20.290 8.544 1.00 0.00 H new ATOM 0 HG23 THR A 929 -8.882 21.797 9.352 1.00 0.00 H new ATOM 695 N SER A 930 -11.970 20.198 9.984 1.00 0.00 N ATOM 696 CA SER A 930 -12.976 19.719 9.063 1.00 0.00 C ATOM 697 C SER A 930 -13.095 20.684 7.892 1.00 0.00 C ATOM 698 O SER A 930 -13.670 21.763 8.024 1.00 0.00 O ATOM 699 CB SER A 930 -14.328 19.531 9.769 1.00 0.00 C ATOM 700 OG SER A 930 -14.761 20.724 10.404 1.00 0.00 O ATOM 0 H SER A 930 -12.092 21.166 10.282 1.00 0.00 H new ATOM 0 HA SER A 930 -12.673 18.743 8.684 1.00 0.00 H new ATOM 0 HB2 SER A 930 -15.076 19.214 9.043 1.00 0.00 H new ATOM 0 HB3 SER A 930 -14.244 18.735 10.509 1.00 0.00 H new ATOM 0 HG SER A 930 -14.005 21.342 10.489 1.00 0.00 H new ATOM 706 N PRO A 931 -12.525 20.312 6.732 1.00 0.00 N ATOM 707 CA PRO A 931 -12.548 21.143 5.519 1.00 0.00 C ATOM 708 C PRO A 931 -13.968 21.361 5.010 1.00 0.00 C ATOM 709 O PRO A 931 -14.215 22.205 4.153 1.00 0.00 O ATOM 710 CB PRO A 931 -11.729 20.334 4.500 1.00 0.00 C ATOM 711 CG PRO A 931 -10.955 19.352 5.313 1.00 0.00 C ATOM 712 CD PRO A 931 -11.810 19.047 6.507 1.00 0.00 C ATOM 0 HA PRO A 931 -12.145 22.140 5.700 1.00 0.00 H new ATOM 0 HB2 PRO A 931 -12.378 19.829 3.785 1.00 0.00 H new ATOM 0 HB3 PRO A 931 -11.065 20.980 3.926 1.00 0.00 H new ATOM 0 HG2 PRO A 931 -10.746 18.448 4.740 1.00 0.00 H new ATOM 0 HG3 PRO A 931 -9.994 19.767 5.616 1.00 0.00 H new ATOM 0 HD2 PRO A 931 -12.497 18.224 6.312 1.00 0.00 H new ATOM 0 HD3 PRO A 931 -11.210 18.763 7.371 1.00 0.00 H new ATOM 720 N ASN A 932 -14.894 20.587 5.557 1.00 0.00 N ATOM 721 CA ASN A 932 -16.301 20.697 5.211 1.00 0.00 C ATOM 722 C ASN A 932 -16.944 21.838 5.993 1.00 0.00 C ATOM 723 O ASN A 932 -18.074 22.237 5.712 1.00 0.00 O ATOM 724 CB ASN A 932 -17.026 19.385 5.530 1.00 0.00 C ATOM 725 CG ASN A 932 -16.370 18.178 4.887 1.00 0.00 C ATOM 726 OD1 ASN A 932 -15.863 18.250 3.767 1.00 0.00 O ATOM 727 ND2 ASN A 932 -16.348 17.070 5.608 1.00 0.00 N ATOM 0 H ASN A 932 -14.691 19.868 6.251 1.00 0.00 H new ATOM 0 HA ASN A 932 -16.383 20.902 4.144 1.00 0.00 H new ATOM 0 HB2 ASN A 932 -17.054 19.245 6.611 1.00 0.00 H new ATOM 0 HB3 ASN A 932 -18.059 19.455 5.191 1.00 0.00 H new ATOM 0 HD21 ASN A 932 -15.899 16.231 5.241 1.00 0.00 H new ATOM 0 HD22 ASN A 932 -16.780 17.054 6.532 1.00 0.00 H new ATOM 734 N GLY A 933 -16.214 22.366 6.972 1.00 0.00 N ATOM 735 CA GLY A 933 -16.768 23.394 7.827 1.00 0.00 C ATOM 736 C GLY A 933 -15.729 24.346 8.395 1.00 0.00 C ATOM 737 O GLY A 933 -15.680 25.512 8.007 1.00 0.00 O ATOM 0 H GLY A 933 -15.253 22.100 7.186 1.00 0.00 H new ATOM 0 HA2 GLY A 933 -17.502 23.968 7.261 1.00 0.00 H new ATOM 0 HA3 GLY A 933 -17.301 22.920 8.651 1.00 0.00 H new ATOM 741 N GLN A 934 -14.872 23.851 9.286 1.00 0.00 N ATOM 742 CA GLN A 934 -14.029 24.732 10.093 1.00 0.00 C ATOM 743 C GLN A 934 -12.982 23.934 10.878 1.00 0.00 C ATOM 744 O GLN A 934 -13.073 22.707 10.990 1.00 0.00 O ATOM 745 CB GLN A 934 -14.923 25.528 11.063 1.00 0.00 C ATOM 746 CG GLN A 934 -14.194 26.575 11.894 1.00 0.00 C ATOM 747 CD GLN A 934 -13.464 27.585 11.037 1.00 0.00 C ATOM 748 OE1 GLN A 934 -12.290 27.402 10.713 1.00 0.00 O ATOM 749 NE2 GLN A 934 -14.150 28.653 10.668 1.00 0.00 N ATOM 0 H GLN A 934 -14.743 22.855 9.467 1.00 0.00 H new ATOM 0 HA GLN A 934 -13.497 25.414 9.430 1.00 0.00 H new ATOM 0 HB2 GLN A 934 -15.707 26.022 10.489 1.00 0.00 H new ATOM 0 HB3 GLN A 934 -15.415 24.828 11.738 1.00 0.00 H new ATOM 0 HG2 GLN A 934 -14.911 27.093 12.531 1.00 0.00 H new ATOM 0 HG3 GLN A 934 -13.482 26.080 12.554 1.00 0.00 H new ATOM 0 HE21 GLN A 934 -15.121 28.762 10.961 1.00 0.00 H new ATOM 0 HE22 GLN A 934 -13.708 29.368 10.090 1.00 0.00 H new ATOM 758 N THR A 935 -11.973 24.630 11.388 1.00 0.00 N ATOM 759 CA THR A 935 -11.020 24.038 12.311 1.00 0.00 C ATOM 760 C THR A 935 -11.313 24.510 13.736 1.00 0.00 C ATOM 761 O THR A 935 -11.338 25.713 14.003 1.00 0.00 O ATOM 762 CB THR A 935 -9.580 24.441 11.934 1.00 0.00 C ATOM 763 OG1 THR A 935 -9.487 25.870 11.837 1.00 0.00 O ATOM 764 CG2 THR A 935 -9.167 23.821 10.611 1.00 0.00 C ATOM 0 H THR A 935 -11.795 25.611 11.174 1.00 0.00 H new ATOM 0 HA THR A 935 -11.116 22.954 12.253 1.00 0.00 H new ATOM 0 HB THR A 935 -8.911 24.076 12.713 1.00 0.00 H new ATOM 0 HG1 THR A 935 -10.064 26.282 12.514 1.00 0.00 H new ATOM 0 HG21 THR A 935 -8.147 24.122 10.370 1.00 0.00 H new ATOM 0 HG22 THR A 935 -9.216 22.735 10.687 1.00 0.00 H new ATOM 0 HG23 THR A 935 -9.841 24.160 9.824 1.00 0.00 H new ATOM 772 N THR A 936 -11.523 23.573 14.643 1.00 0.00 N ATOM 773 CA THR A 936 -11.803 23.908 16.027 1.00 0.00 C ATOM 774 C THR A 936 -10.757 23.305 16.961 1.00 0.00 C ATOM 775 O THR A 936 -10.471 22.111 16.893 1.00 0.00 O ATOM 776 CB THR A 936 -13.217 23.445 16.430 1.00 0.00 C ATOM 777 OG1 THR A 936 -14.178 24.041 15.547 1.00 0.00 O ATOM 778 CG2 THR A 936 -13.538 23.833 17.868 1.00 0.00 C ATOM 0 H THR A 936 -11.505 22.573 14.445 1.00 0.00 H new ATOM 0 HA THR A 936 -11.757 24.993 16.121 1.00 0.00 H new ATOM 0 HB THR A 936 -13.258 22.358 16.355 1.00 0.00 H new ATOM 0 HG1 THR A 936 -15.079 23.748 15.798 1.00 0.00 H new ATOM 0 HG21 THR A 936 -14.542 23.492 18.121 1.00 0.00 H new ATOM 0 HG22 THR A 936 -12.817 23.368 18.540 1.00 0.00 H new ATOM 0 HG23 THR A 936 -13.485 24.917 17.973 1.00 0.00 H new ATOM 786 N ARG A 937 -10.193 24.127 17.832 1.00 0.00 N ATOM 787 CA ARG A 937 -9.208 23.646 18.789 1.00 0.00 C ATOM 788 C ARG A 937 -9.869 23.393 20.142 1.00 0.00 C ATOM 789 O ARG A 937 -10.569 24.252 20.679 1.00 0.00 O ATOM 790 CB ARG A 937 -8.036 24.632 18.946 1.00 0.00 C ATOM 791 CG ARG A 937 -8.439 26.015 19.439 1.00 0.00 C ATOM 792 CD ARG A 937 -8.966 26.882 18.310 1.00 0.00 C ATOM 793 NE ARG A 937 -9.696 28.045 18.807 1.00 0.00 N ATOM 794 CZ ARG A 937 -9.128 29.214 19.102 1.00 0.00 C ATOM 795 NH1 ARG A 937 -7.812 29.365 19.012 1.00 0.00 N ATOM 796 NH2 ARG A 937 -9.876 30.228 19.509 1.00 0.00 N ATOM 0 H ARG A 937 -10.398 25.124 17.897 1.00 0.00 H new ATOM 0 HA ARG A 937 -8.803 22.710 18.405 1.00 0.00 H new ATOM 0 HB2 ARG A 937 -7.312 24.209 19.642 1.00 0.00 H new ATOM 0 HB3 ARG A 937 -7.532 24.735 17.985 1.00 0.00 H new ATOM 0 HG2 ARG A 937 -9.203 25.918 20.210 1.00 0.00 H new ATOM 0 HG3 ARG A 937 -7.580 26.501 19.901 1.00 0.00 H new ATOM 0 HD2 ARG A 937 -8.134 27.215 17.690 1.00 0.00 H new ATOM 0 HD3 ARG A 937 -9.621 26.288 17.673 1.00 0.00 H new ATOM 0 HE ARG A 937 -10.704 27.957 18.937 1.00 0.00 H new ATOM 0 HH11 ARG A 937 -7.228 28.583 18.715 1.00 0.00 H new ATOM 0 HH12 ARG A 937 -7.385 30.263 19.240 1.00 0.00 H new ATOM 0 HH21 ARG A 937 -10.886 30.114 19.596 1.00 0.00 H new ATOM 0 HH22 ARG A 937 -9.442 31.123 19.735 1.00 0.00 H new ATOM 810 N TYR A 938 -9.650 22.209 20.678 1.00 0.00 N ATOM 811 CA TYR A 938 -10.219 21.825 21.957 1.00 0.00 C ATOM 812 C TYR A 938 -9.135 21.761 23.021 1.00 0.00 C ATOM 813 O TYR A 938 -8.099 21.115 22.831 1.00 0.00 O ATOM 814 CB TYR A 938 -10.917 20.466 21.848 1.00 0.00 C ATOM 815 CG TYR A 938 -12.138 20.466 20.954 1.00 0.00 C ATOM 816 CD1 TYR A 938 -13.393 20.764 21.465 1.00 0.00 C ATOM 817 CD2 TYR A 938 -12.037 20.156 19.604 1.00 0.00 C ATOM 818 CE1 TYR A 938 -14.513 20.759 20.655 1.00 0.00 C ATOM 819 CE2 TYR A 938 -13.152 20.147 18.788 1.00 0.00 C ATOM 820 CZ TYR A 938 -14.387 20.448 19.317 1.00 0.00 C ATOM 821 OH TYR A 938 -15.501 20.429 18.508 1.00 0.00 O ATOM 0 H TYR A 938 -9.075 21.488 20.242 1.00 0.00 H new ATOM 0 HA TYR A 938 -10.954 22.578 22.243 1.00 0.00 H new ATOM 0 HB2 TYR A 938 -10.204 19.733 21.470 1.00 0.00 H new ATOM 0 HB3 TYR A 938 -11.211 20.140 22.846 1.00 0.00 H new ATOM 0 HD1 TYR A 938 -13.497 21.004 22.513 1.00 0.00 H new ATOM 0 HD2 TYR A 938 -11.071 19.918 19.185 1.00 0.00 H new ATOM 0 HE1 TYR A 938 -15.482 20.997 21.068 1.00 0.00 H new ATOM 0 HE2 TYR A 938 -13.055 19.905 17.740 1.00 0.00 H new ATOM 0 HH TYR A 938 -15.238 20.193 17.594 1.00 0.00 H new ATOM 831 N GLY A 939 -9.370 22.442 24.126 1.00 0.00 N ATOM 832 CA GLY A 939 -8.458 22.373 25.241 1.00 0.00 C ATOM 833 C GLY A 939 -8.883 21.314 26.227 1.00 0.00 C ATOM 834 O GLY A 939 -10.009 20.821 26.163 1.00 0.00 O ATOM 0 H GLY A 939 -10.180 23.044 24.271 1.00 0.00 H new ATOM 0 HA2 GLY A 939 -7.453 22.155 24.880 1.00 0.00 H new ATOM 0 HA3 GLY A 939 -8.414 23.341 25.739 1.00 0.00 H new ATOM 838 N GLU A 940 -7.993 20.962 27.139 1.00 0.00 N ATOM 839 CA GLU A 940 -8.281 19.935 28.132 1.00 0.00 C ATOM 840 C GLU A 940 -9.368 20.394 29.100 1.00 0.00 C ATOM 841 O GLU A 940 -10.010 19.580 29.763 1.00 0.00 O ATOM 842 CB GLU A 940 -7.011 19.567 28.899 1.00 0.00 C ATOM 843 CG GLU A 940 -6.338 20.749 29.571 1.00 0.00 C ATOM 844 CD GLU A 940 -5.101 20.343 30.333 1.00 0.00 C ATOM 845 OE1 GLU A 940 -4.033 20.201 29.708 1.00 0.00 O ATOM 846 OE2 GLU A 940 -5.196 20.141 31.560 1.00 0.00 O ATOM 0 H GLU A 940 -7.062 21.372 27.214 1.00 0.00 H new ATOM 0 HA GLU A 940 -8.646 19.052 27.607 1.00 0.00 H new ATOM 0 HB2 GLU A 940 -7.258 18.823 29.656 1.00 0.00 H new ATOM 0 HB3 GLU A 940 -6.305 19.101 28.212 1.00 0.00 H new ATOM 0 HG2 GLU A 940 -6.071 21.490 28.817 1.00 0.00 H new ATOM 0 HG3 GLU A 940 -7.042 21.227 30.252 1.00 0.00 H new ATOM 853 N ASN A 941 -9.565 21.702 29.183 1.00 0.00 N ATOM 854 CA ASN A 941 -10.575 22.265 30.069 1.00 0.00 C ATOM 855 C ASN A 941 -11.895 22.464 29.329 1.00 0.00 C ATOM 856 O ASN A 941 -12.865 22.976 29.890 1.00 0.00 O ATOM 857 CB ASN A 941 -10.093 23.591 30.659 1.00 0.00 C ATOM 858 CG ASN A 941 -8.847 23.439 31.514 1.00 0.00 C ATOM 859 OD1 ASN A 941 -7.726 23.563 31.025 1.00 0.00 O ATOM 860 ND2 ASN A 941 -9.031 23.172 32.800 1.00 0.00 N ATOM 0 H ASN A 941 -9.039 22.393 28.648 1.00 0.00 H new ATOM 0 HA ASN A 941 -10.741 21.561 30.884 1.00 0.00 H new ATOM 0 HB2 ASN A 941 -9.888 24.290 29.848 1.00 0.00 H new ATOM 0 HB3 ASN A 941 -10.890 24.026 31.262 1.00 0.00 H new ATOM 0 HD21 ASN A 941 -8.227 23.063 33.418 1.00 0.00 H new ATOM 0 HD22 ASN A 941 -9.976 23.076 33.171 1.00 0.00 H new ATOM 867 N GLU A 942 -11.922 22.053 28.071 1.00 0.00 N ATOM 868 CA GLU A 942 -13.135 22.099 27.271 1.00 0.00 C ATOM 869 C GLU A 942 -13.804 20.732 27.304 1.00 0.00 C ATOM 870 O GLU A 942 -13.310 19.813 27.958 1.00 0.00 O ATOM 871 CB GLU A 942 -12.812 22.477 25.822 1.00 0.00 C ATOM 872 CG GLU A 942 -12.135 23.829 25.662 1.00 0.00 C ATOM 873 CD GLU A 942 -13.049 24.993 25.991 1.00 0.00 C ATOM 874 OE1 GLU A 942 -13.823 25.411 25.104 1.00 0.00 O ATOM 875 OE2 GLU A 942 -12.988 25.501 27.128 1.00 0.00 O ATOM 0 H GLU A 942 -11.110 21.681 27.579 1.00 0.00 H new ATOM 0 HA GLU A 942 -13.804 22.854 27.684 1.00 0.00 H new ATOM 0 HB2 GLU A 942 -12.168 21.709 25.394 1.00 0.00 H new ATOM 0 HB3 GLU A 942 -13.736 22.476 25.244 1.00 0.00 H new ATOM 0 HG2 GLU A 942 -11.258 23.869 26.309 1.00 0.00 H new ATOM 0 HG3 GLU A 942 -11.780 23.932 24.637 1.00 0.00 H new ATOM 882 N LYS A 943 -14.916 20.592 26.603 1.00 0.00 N ATOM 883 CA LYS A 943 -15.577 19.308 26.488 1.00 0.00 C ATOM 884 C LYS A 943 -15.227 18.693 25.152 1.00 0.00 C ATOM 885 O LYS A 943 -15.368 19.330 24.106 1.00 0.00 O ATOM 886 CB LYS A 943 -17.096 19.421 26.615 1.00 0.00 C ATOM 887 CG LYS A 943 -17.787 18.073 26.488 1.00 0.00 C ATOM 888 CD LYS A 943 -19.286 18.206 26.334 1.00 0.00 C ATOM 889 CE LYS A 943 -19.921 16.868 25.986 1.00 0.00 C ATOM 890 NZ LYS A 943 -19.360 16.296 24.730 1.00 0.00 N ATOM 0 H LYS A 943 -15.378 21.353 26.106 1.00 0.00 H new ATOM 0 HA LYS A 943 -15.229 18.679 27.308 1.00 0.00 H new ATOM 0 HB2 LYS A 943 -17.346 19.866 27.578 1.00 0.00 H new ATOM 0 HB3 LYS A 943 -17.474 20.094 25.846 1.00 0.00 H new ATOM 0 HG2 LYS A 943 -17.382 17.540 25.628 1.00 0.00 H new ATOM 0 HG3 LYS A 943 -17.567 17.470 27.369 1.00 0.00 H new ATOM 0 HD2 LYS A 943 -19.717 18.587 27.260 1.00 0.00 H new ATOM 0 HD3 LYS A 943 -19.512 18.933 25.554 1.00 0.00 H new ATOM 0 HE2 LYS A 943 -19.763 16.167 26.806 1.00 0.00 H new ATOM 0 HE3 LYS A 943 -20.998 16.995 25.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 943 -20.135 15.940 24.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 943 -18.838 17.034 24.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 943 -18.715 15.514 24.962 1.00 0.00 H new ATOM 904 N LEU A 944 -14.772 17.463 25.184 1.00 0.00 N ATOM 905 CA LEU A 944 -14.358 16.793 23.977 1.00 0.00 C ATOM 906 C LEU A 944 -15.527 16.007 23.391 1.00 0.00 C ATOM 907 O LEU A 944 -16.243 15.314 24.120 1.00 0.00 O ATOM 908 CB LEU A 944 -13.179 15.878 24.308 1.00 0.00 C ATOM 909 CG LEU A 944 -12.164 15.657 23.189 1.00 0.00 C ATOM 910 CD1 LEU A 944 -11.894 16.950 22.434 1.00 0.00 C ATOM 911 CD2 LEU A 944 -10.875 15.137 23.788 1.00 0.00 C ATOM 0 H LEU A 944 -14.680 16.907 26.034 1.00 0.00 H new ATOM 0 HA LEU A 944 -14.042 17.519 23.228 1.00 0.00 H new ATOM 0 HB2 LEU A 944 -12.655 16.292 25.169 1.00 0.00 H new ATOM 0 HB3 LEU A 944 -13.573 14.908 24.611 1.00 0.00 H new ATOM 0 HG LEU A 944 -12.570 14.931 22.484 1.00 0.00 H new ATOM 0 HD11 LEU A 944 -11.168 16.764 21.643 1.00 0.00 H new ATOM 0 HD12 LEU A 944 -12.822 17.316 21.996 1.00 0.00 H new ATOM 0 HD13 LEU A 944 -11.498 17.697 23.122 1.00 0.00 H new ATOM 0 HD21 LEU A 944 -10.144 14.976 22.995 1.00 0.00 H new ATOM 0 HD22 LEU A 944 -10.485 15.865 24.499 1.00 0.00 H new ATOM 0 HD23 LEU A 944 -11.066 14.195 24.301 1.00 0.00 H new ATOM 923 N PRO A 945 -15.767 16.138 22.075 1.00 0.00 N ATOM 924 CA PRO A 945 -16.804 15.370 21.385 1.00 0.00 C ATOM 925 C PRO A 945 -16.529 13.873 21.457 1.00 0.00 C ATOM 926 O PRO A 945 -15.372 13.457 21.545 1.00 0.00 O ATOM 927 CB PRO A 945 -16.725 15.862 19.937 1.00 0.00 C ATOM 928 CG PRO A 945 -16.025 17.175 20.010 1.00 0.00 C ATOM 929 CD PRO A 945 -15.073 17.066 21.165 1.00 0.00 C ATOM 0 HA PRO A 945 -17.788 15.513 21.831 1.00 0.00 H new ATOM 0 HB2 PRO A 945 -16.177 15.158 19.311 1.00 0.00 H new ATOM 0 HB3 PRO A 945 -17.719 15.969 19.502 1.00 0.00 H new ATOM 0 HG2 PRO A 945 -15.492 17.387 19.083 1.00 0.00 H new ATOM 0 HG3 PRO A 945 -16.734 17.988 20.163 1.00 0.00 H new ATOM 0 HD2 PRO A 945 -14.103 16.678 20.854 1.00 0.00 H new ATOM 0 HD3 PRO A 945 -14.894 18.034 21.634 1.00 0.00 H new ATOM 937 N ASP A 946 -17.591 13.079 21.398 1.00 0.00 N ATOM 938 CA ASP A 946 -17.496 11.632 21.591 1.00 0.00 C ATOM 939 C ASP A 946 -16.457 11.004 20.675 1.00 0.00 C ATOM 940 O ASP A 946 -15.440 10.495 21.141 1.00 0.00 O ATOM 941 CB ASP A 946 -18.857 10.971 21.353 1.00 0.00 C ATOM 942 CG ASP A 946 -19.899 11.417 22.354 1.00 0.00 C ATOM 943 OD1 ASP A 946 -19.871 10.931 23.505 1.00 0.00 O ATOM 944 OD2 ASP A 946 -20.745 12.269 21.998 1.00 0.00 O ATOM 0 H ASP A 946 -18.537 13.414 21.217 1.00 0.00 H new ATOM 0 HA ASP A 946 -17.183 11.464 22.622 1.00 0.00 H new ATOM 0 HB2 ASP A 946 -19.201 11.207 20.346 1.00 0.00 H new ATOM 0 HB3 ASP A 946 -18.746 9.888 21.407 1.00 0.00 H new ATOM 949 N TYR A 947 -16.699 11.074 19.374 1.00 0.00 N ATOM 950 CA TYR A 947 -15.849 10.392 18.403 1.00 0.00 C ATOM 951 C TYR A 947 -14.405 10.879 18.479 1.00 0.00 C ATOM 952 O TYR A 947 -13.472 10.108 18.256 1.00 0.00 O ATOM 953 CB TYR A 947 -16.391 10.608 16.990 1.00 0.00 C ATOM 954 CG TYR A 947 -17.827 10.161 16.818 1.00 0.00 C ATOM 955 CD1 TYR A 947 -18.880 11.007 17.145 1.00 0.00 C ATOM 956 CD2 TYR A 947 -18.130 8.893 16.340 1.00 0.00 C ATOM 957 CE1 TYR A 947 -20.191 10.604 16.998 1.00 0.00 C ATOM 958 CE2 TYR A 947 -19.441 8.483 16.188 1.00 0.00 C ATOM 959 CZ TYR A 947 -20.467 9.342 16.522 1.00 0.00 C ATOM 960 OH TYR A 947 -21.777 8.942 16.372 1.00 0.00 O ATOM 0 H TYR A 947 -17.475 11.595 18.965 1.00 0.00 H new ATOM 0 HA TYR A 947 -15.860 9.329 18.643 1.00 0.00 H new ATOM 0 HB2 TYR A 947 -16.316 11.666 16.739 1.00 0.00 H new ATOM 0 HB3 TYR A 947 -15.763 10.067 16.282 1.00 0.00 H new ATOM 0 HD1 TYR A 947 -18.668 11.997 17.521 1.00 0.00 H new ATOM 0 HD2 TYR A 947 -17.328 8.216 16.083 1.00 0.00 H new ATOM 0 HE1 TYR A 947 -20.997 11.275 17.255 1.00 0.00 H new ATOM 0 HE2 TYR A 947 -19.661 7.496 15.810 1.00 0.00 H new ATOM 0 HH TYR A 947 -21.802 8.026 16.025 1.00 0.00 H new ATOM 970 N ILE A 948 -14.226 12.147 18.820 1.00 0.00 N ATOM 971 CA ILE A 948 -12.894 12.709 18.973 1.00 0.00 C ATOM 972 C ILE A 948 -12.220 12.116 20.208 1.00 0.00 C ATOM 973 O ILE A 948 -11.053 11.736 20.168 1.00 0.00 O ATOM 974 CB ILE A 948 -12.920 14.261 19.066 1.00 0.00 C ATOM 975 CG1 ILE A 948 -13.269 14.895 17.710 1.00 0.00 C ATOM 976 CG2 ILE A 948 -11.582 14.794 19.550 1.00 0.00 C ATOM 977 CD1 ILE A 948 -14.703 14.691 17.269 1.00 0.00 C ATOM 0 H ILE A 948 -14.986 12.804 18.996 1.00 0.00 H new ATOM 0 HA ILE A 948 -12.321 12.449 18.083 1.00 0.00 H new ATOM 0 HB ILE A 948 -13.693 14.532 19.785 1.00 0.00 H new ATOM 0 HG12 ILE A 948 -13.067 15.965 17.761 1.00 0.00 H new ATOM 0 HG13 ILE A 948 -12.607 14.482 16.949 1.00 0.00 H new ATOM 0 HG21 ILE A 948 -11.623 15.882 19.608 1.00 0.00 H new ATOM 0 HG22 ILE A 948 -11.363 14.386 20.537 1.00 0.00 H new ATOM 0 HG23 ILE A 948 -10.798 14.497 18.853 1.00 0.00 H new ATOM 0 HD11 ILE A 948 -14.858 15.172 16.303 1.00 0.00 H new ATOM 0 HD12 ILE A 948 -14.908 13.624 17.181 1.00 0.00 H new ATOM 0 HD13 ILE A 948 -15.376 15.130 18.005 1.00 0.00 H new ATOM 989 N LYS A 949 -12.981 12.006 21.291 1.00 0.00 N ATOM 990 CA LYS A 949 -12.473 11.430 22.530 1.00 0.00 C ATOM 991 C LYS A 949 -12.111 9.961 22.312 1.00 0.00 C ATOM 992 O LYS A 949 -11.086 9.488 22.804 1.00 0.00 O ATOM 993 CB LYS A 949 -13.512 11.579 23.649 1.00 0.00 C ATOM 994 CG LYS A 949 -12.904 11.809 25.027 1.00 0.00 C ATOM 995 CD LYS A 949 -12.356 10.533 25.649 1.00 0.00 C ATOM 996 CE LYS A 949 -13.474 9.629 26.148 1.00 0.00 C ATOM 997 NZ LYS A 949 -12.945 8.453 26.889 1.00 0.00 N ATOM 0 H LYS A 949 -13.954 12.309 21.336 1.00 0.00 H new ATOM 0 HA LYS A 949 -11.572 11.965 22.831 1.00 0.00 H new ATOM 0 HB2 LYS A 949 -14.172 12.413 23.410 1.00 0.00 H new ATOM 0 HB3 LYS A 949 -14.130 10.682 23.680 1.00 0.00 H new ATOM 0 HG2 LYS A 949 -12.102 12.543 24.948 1.00 0.00 H new ATOM 0 HG3 LYS A 949 -13.660 12.234 25.687 1.00 0.00 H new ATOM 0 HD2 LYS A 949 -11.755 9.998 24.914 1.00 0.00 H new ATOM 0 HD3 LYS A 949 -11.695 10.786 26.478 1.00 0.00 H new ATOM 0 HE2 LYS A 949 -14.139 10.198 26.797 1.00 0.00 H new ATOM 0 HE3 LYS A 949 -14.070 9.287 25.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 949 -13.737 7.862 27.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 949 -12.330 7.896 26.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 949 -12.397 8.778 27.711 1.00 0.00 H new ATOM 1011 N GLN A 950 -12.957 9.249 21.565 1.00 0.00 N ATOM 1012 CA GLN A 950 -12.671 7.864 21.190 1.00 0.00 C ATOM 1013 C GLN A 950 -11.376 7.788 20.388 1.00 0.00 C ATOM 1014 O GLN A 950 -10.551 6.899 20.602 1.00 0.00 O ATOM 1015 CB GLN A 950 -13.815 7.243 20.376 1.00 0.00 C ATOM 1016 CG GLN A 950 -14.910 6.602 21.218 1.00 0.00 C ATOM 1017 CD GLN A 950 -15.872 7.604 21.824 1.00 0.00 C ATOM 1018 OE1 GLN A 950 -16.882 7.949 21.214 1.00 0.00 O ATOM 1019 NE2 GLN A 950 -15.578 8.065 23.029 1.00 0.00 N ATOM 0 H GLN A 950 -13.843 9.608 21.209 1.00 0.00 H new ATOM 0 HA GLN A 950 -12.565 7.295 22.114 1.00 0.00 H new ATOM 0 HB2 GLN A 950 -14.261 8.016 19.750 1.00 0.00 H new ATOM 0 HB3 GLN A 950 -13.401 6.490 19.706 1.00 0.00 H new ATOM 0 HG2 GLN A 950 -15.470 5.901 20.599 1.00 0.00 H new ATOM 0 HG3 GLN A 950 -14.450 6.023 22.018 1.00 0.00 H new ATOM 0 HE21 GLN A 950 -14.729 7.753 23.501 1.00 0.00 H new ATOM 0 HE22 GLN A 950 -16.200 8.732 23.486 1.00 0.00 H new ATOM 1028 N LYS A 951 -11.199 8.731 19.467 1.00 0.00 N ATOM 1029 CA LYS A 951 -9.989 8.784 18.656 1.00 0.00 C ATOM 1030 C LYS A 951 -8.762 9.073 19.514 1.00 0.00 C ATOM 1031 O LYS A 951 -7.725 8.432 19.349 1.00 0.00 O ATOM 1032 CB LYS A 951 -10.122 9.831 17.545 1.00 0.00 C ATOM 1033 CG LYS A 951 -11.069 9.432 16.413 1.00 0.00 C ATOM 1034 CD LYS A 951 -10.466 8.360 15.508 1.00 0.00 C ATOM 1035 CE LYS A 951 -10.435 6.991 16.172 1.00 0.00 C ATOM 1036 NZ LYS A 951 -9.216 6.222 15.799 1.00 0.00 N ATOM 0 H LYS A 951 -11.876 9.466 19.265 1.00 0.00 H new ATOM 0 HA LYS A 951 -9.858 7.805 18.195 1.00 0.00 H new ATOM 0 HB2 LYS A 951 -10.472 10.766 17.983 1.00 0.00 H new ATOM 0 HB3 LYS A 951 -9.135 10.026 17.125 1.00 0.00 H new ATOM 0 HG2 LYS A 951 -12.004 9.064 16.836 1.00 0.00 H new ATOM 0 HG3 LYS A 951 -11.313 10.312 15.818 1.00 0.00 H new ATOM 0 HD2 LYS A 951 -11.043 8.300 14.585 1.00 0.00 H new ATOM 0 HD3 LYS A 951 -9.452 8.650 15.232 1.00 0.00 H new ATOM 0 HE2 LYS A 951 -10.471 7.111 17.255 1.00 0.00 H new ATOM 0 HE3 LYS A 951 -11.322 6.427 15.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 951 -8.993 5.539 16.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 951 -9.386 5.713 14.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 951 -8.417 6.876 15.677 1.00 0.00 H new ATOM 1050 N LEU A 952 -8.888 10.014 20.438 1.00 0.00 N ATOM 1051 CA LEU A 952 -7.794 10.341 21.350 1.00 0.00 C ATOM 1052 C LEU A 952 -7.453 9.149 22.239 1.00 0.00 C ATOM 1053 O LEU A 952 -6.285 8.897 22.540 1.00 0.00 O ATOM 1054 CB LEU A 952 -8.152 11.554 22.213 1.00 0.00 C ATOM 1055 CG LEU A 952 -7.647 12.904 21.695 1.00 0.00 C ATOM 1056 CD1 LEU A 952 -6.127 12.934 21.679 1.00 0.00 C ATOM 1057 CD2 LEU A 952 -8.199 13.195 20.309 1.00 0.00 C ATOM 0 H LEU A 952 -9.734 10.566 20.579 1.00 0.00 H new ATOM 0 HA LEU A 952 -6.919 10.586 20.748 1.00 0.00 H new ATOM 0 HB2 LEU A 952 -9.237 11.603 22.307 1.00 0.00 H new ATOM 0 HB3 LEU A 952 -7.752 11.396 23.215 1.00 0.00 H new ATOM 0 HG LEU A 952 -8.003 13.681 22.372 1.00 0.00 H new ATOM 0 HD11 LEU A 952 -5.786 13.901 21.308 1.00 0.00 H new ATOM 0 HD12 LEU A 952 -5.749 12.779 22.690 1.00 0.00 H new ATOM 0 HD13 LEU A 952 -5.754 12.144 21.028 1.00 0.00 H new ATOM 0 HD21 LEU A 952 -7.826 14.159 19.964 1.00 0.00 H new ATOM 0 HD22 LEU A 952 -7.880 12.414 19.619 1.00 0.00 H new ATOM 0 HD23 LEU A 952 -9.288 13.221 20.349 1.00 0.00 H new ATOM 1069 N GLN A 953 -8.477 8.406 22.635 1.00 0.00 N ATOM 1070 CA GLN A 953 -8.283 7.209 23.437 1.00 0.00 C ATOM 1071 C GLN A 953 -7.561 6.147 22.615 1.00 0.00 C ATOM 1072 O GLN A 953 -6.736 5.394 23.138 1.00 0.00 O ATOM 1073 CB GLN A 953 -9.640 6.687 23.939 1.00 0.00 C ATOM 1074 CG GLN A 953 -9.543 5.514 24.908 1.00 0.00 C ATOM 1075 CD GLN A 953 -9.459 4.163 24.219 1.00 0.00 C ATOM 1076 OE1 GLN A 953 -8.843 3.228 24.733 1.00 0.00 O ATOM 1077 NE2 GLN A 953 -10.082 4.046 23.056 1.00 0.00 N ATOM 0 H GLN A 953 -9.451 8.612 22.413 1.00 0.00 H new ATOM 0 HA GLN A 953 -7.668 7.450 24.304 1.00 0.00 H new ATOM 0 HB2 GLN A 953 -10.172 7.503 24.428 1.00 0.00 H new ATOM 0 HB3 GLN A 953 -10.240 6.385 23.080 1.00 0.00 H new ATOM 0 HG2 GLN A 953 -8.664 5.646 25.539 1.00 0.00 H new ATOM 0 HG3 GLN A 953 -10.412 5.524 25.566 1.00 0.00 H new ATOM 0 HE21 GLN A 953 -10.582 4.843 22.663 1.00 0.00 H new ATOM 0 HE22 GLN A 953 -10.062 3.158 22.554 1.00 0.00 H new ATOM 1086 N CYS A 954 -7.848 6.113 21.317 1.00 0.00 N ATOM 1087 CA CYS A 954 -7.230 5.140 20.434 1.00 0.00 C ATOM 1088 C CYS A 954 -5.755 5.485 20.231 1.00 0.00 C ATOM 1089 O CYS A 954 -4.918 4.607 20.030 1.00 0.00 O ATOM 1090 CB CYS A 954 -7.977 5.128 19.095 1.00 0.00 C ATOM 1091 SG CYS A 954 -7.445 3.842 17.945 1.00 0.00 S ATOM 0 H CYS A 954 -8.502 6.747 20.859 1.00 0.00 H new ATOM 0 HA CYS A 954 -7.288 4.147 20.879 1.00 0.00 H new ATOM 0 HB2 CYS A 954 -9.042 5.004 19.290 1.00 0.00 H new ATOM 0 HB3 CYS A 954 -7.852 6.099 18.616 1.00 0.00 H new ATOM 0 HG CYS A 954 -8.377 3.637 17.062 1.00 0.00 H new ATOM 1097 N LEU A 955 -5.445 6.773 20.327 1.00 0.00 N ATOM 1098 CA LEU A 955 -4.070 7.250 20.229 1.00 0.00 C ATOM 1099 C LEU A 955 -3.282 6.924 21.491 1.00 0.00 C ATOM 1100 O LEU A 955 -2.074 6.710 21.438 1.00 0.00 O ATOM 1101 CB LEU A 955 -4.042 8.759 19.972 1.00 0.00 C ATOM 1102 CG LEU A 955 -3.979 9.183 18.499 1.00 0.00 C ATOM 1103 CD1 LEU A 955 -5.099 8.549 17.689 1.00 0.00 C ATOM 1104 CD2 LEU A 955 -4.033 10.697 18.384 1.00 0.00 C ATOM 0 H LEU A 955 -6.134 7.511 20.474 1.00 0.00 H new ATOM 0 HA LEU A 955 -3.601 6.737 19.389 1.00 0.00 H new ATOM 0 HB2 LEU A 955 -4.931 9.202 20.420 1.00 0.00 H new ATOM 0 HB3 LEU A 955 -3.180 9.181 20.489 1.00 0.00 H new ATOM 0 HG LEU A 955 -3.033 8.830 18.089 1.00 0.00 H new ATOM 0 HD11 LEU A 955 -5.024 8.871 16.650 1.00 0.00 H new ATOM 0 HD12 LEU A 955 -5.015 7.463 17.739 1.00 0.00 H new ATOM 0 HD13 LEU A 955 -6.062 8.858 18.096 1.00 0.00 H new ATOM 0 HD21 LEU A 955 -3.987 10.984 17.333 1.00 0.00 H new ATOM 0 HD22 LEU A 955 -4.963 11.062 18.820 1.00 0.00 H new ATOM 0 HD23 LEU A 955 -3.187 11.133 18.916 1.00 0.00 H new