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 932 ASN : amide:sc= 0.877 K(o=1.9,f=-1.7) USER MOD Set 1.2: A 934 GLN : amide:sc= 1.02 K(o=1.9,f=0) USER MOD Set 2.1: A 929 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 935 THR OG1 : rot 29:sc= 0.408 USER MOD Set 3.1: A 915 SER OG : rot 103:sc= 1.25 USER MOD Set 3.2: A 928 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 890 SER OG : rot 180:sc= 1.06 USER MOD Set 4.2: A 900 THR OG1 : rot -64:sc= 1.18 USER MOD Single : A 889 LYS NZ :NH3+ 137:sc= -1.09 (180deg=-3.32!) USER MOD Single : A 894 LYS NZ :NH3+ -167:sc=-0.00338 (180deg=-0.146) USER MOD Single : A 895 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 901 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 903 THR OG1 : rot -24:sc= 0.15 USER MOD Single : A 904 SER OG : rot 180:sc= 0.0409 USER MOD Single : A 910 GLN : amide:sc= 0.0399 X(o=0.04,f=-0.41) USER MOD Single : A 912 ASN : amide:sc= -0.0198 K(o=-0.02,f=-1.1) USER MOD Single : A 916 GLN : amide:sc= -2.47! C(o=-2.5!,f=-4.7!) USER MOD Single : A 920 GLN : amide:sc= -0.662 X(o=-0.66,f=-0.17) USER MOD Single : A 924 SER OG : rot -24:sc= 0.319 USER MOD Single : A 925 SER OG : rot 180:sc= 0 USER MOD Single : A 927 SER OG : rot 150:sc= -1.7! USER MOD Single : A 930 SER OG : rot 180:sc= 0 USER MOD Single : A 936 THR OG1 : rot 180:sc= 0 USER MOD Single : A 938 TYR OH : rot 180:sc= 0 USER MOD Single : A 941 ASN : amide:sc= -0.303 X(o=-0.3,f=-0.16) USER MOD Single : A 943 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 947 TYR OH : rot 180:sc= 0 USER MOD Single : A 949 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00924) USER MOD Single : A 950 GLN : amide:sc= 0.00868 X(o=0.0087,f=-0.097) USER MOD Single : A 951 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 953 GLN : amide:sc= 0 K(o=0,f=-0.89) USER MOD Single : A 954 CYS SG : rot -9:sc= -0.807! USER MOD ----------------------------------------------------------------- ATOM 83 N LYS A 889 5.568 8.972 6.829 1.00 0.00 N ATOM 84 CA LYS A 889 5.069 7.679 7.273 1.00 0.00 C ATOM 85 C LYS A 889 3.696 7.827 7.914 1.00 0.00 C ATOM 86 O LYS A 889 3.581 8.142 9.103 1.00 0.00 O ATOM 87 CB LYS A 889 6.032 7.011 8.259 1.00 0.00 C ATOM 88 CG LYS A 889 7.422 6.755 7.698 1.00 0.00 C ATOM 89 CD LYS A 889 8.218 5.771 8.554 1.00 0.00 C ATOM 90 CE LYS A 889 8.507 6.294 9.957 1.00 0.00 C ATOM 91 NZ LYS A 889 7.312 6.252 10.848 1.00 0.00 N ATOM 0 HA LYS A 889 4.988 7.042 6.392 1.00 0.00 H new ATOM 0 HB2 LYS A 889 6.120 7.640 9.145 1.00 0.00 H new ATOM 0 HB3 LYS A 889 5.603 6.063 8.582 1.00 0.00 H new ATOM 0 HG2 LYS A 889 7.336 6.365 6.684 1.00 0.00 H new ATOM 0 HG3 LYS A 889 7.965 7.698 7.632 1.00 0.00 H new ATOM 0 HD2 LYS A 889 7.665 4.835 8.629 1.00 0.00 H new ATOM 0 HD3 LYS A 889 9.161 5.546 8.056 1.00 0.00 H new ATOM 0 HE2 LYS A 889 9.307 5.703 10.402 1.00 0.00 H new ATOM 0 HE3 LYS A 889 8.868 7.320 9.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 889 7.591 5.901 11.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 889 6.914 7.208 10.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 889 6.596 5.618 10.439 1.00 0.00 H new ATOM 105 N SER A 890 2.663 7.630 7.114 1.00 0.00 N ATOM 106 CA SER A 890 1.301 7.667 7.609 1.00 0.00 C ATOM 107 C SER A 890 0.768 6.246 7.767 1.00 0.00 C ATOM 108 O SER A 890 1.078 5.366 6.963 1.00 0.00 O ATOM 109 CB SER A 890 0.408 8.453 6.643 1.00 0.00 C ATOM 110 OG SER A 890 0.943 9.741 6.378 1.00 0.00 O ATOM 0 H SER A 890 2.744 7.442 6.115 1.00 0.00 H new ATOM 0 HA SER A 890 1.293 8.163 8.579 1.00 0.00 H new ATOM 0 HB2 SER A 890 0.305 7.901 5.709 1.00 0.00 H new ATOM 0 HB3 SER A 890 -0.591 8.552 7.067 1.00 0.00 H new ATOM 0 HG SER A 890 0.353 10.219 5.758 1.00 0.00 H new ATOM 116 N VAL A 891 -0.024 6.025 8.801 1.00 0.00 N ATOM 117 CA VAL A 891 -0.655 4.733 9.023 1.00 0.00 C ATOM 118 C VAL A 891 -2.167 4.908 9.046 1.00 0.00 C ATOM 119 O VAL A 891 -2.672 5.873 9.610 1.00 0.00 O ATOM 120 CB VAL A 891 -0.195 4.090 10.354 1.00 0.00 C ATOM 121 CG1 VAL A 891 -0.797 2.700 10.525 1.00 0.00 C ATOM 122 CG2 VAL A 891 1.324 4.027 10.425 1.00 0.00 C ATOM 0 H VAL A 891 -0.248 6.728 9.506 1.00 0.00 H new ATOM 0 HA VAL A 891 -0.359 4.071 8.209 1.00 0.00 H new ATOM 0 HB VAL A 891 -0.552 4.717 11.171 1.00 0.00 H new ATOM 0 HG11 VAL A 891 -0.458 2.270 11.468 1.00 0.00 H new ATOM 0 HG12 VAL A 891 -1.885 2.773 10.529 1.00 0.00 H new ATOM 0 HG13 VAL A 891 -0.479 2.062 9.700 1.00 0.00 H new ATOM 0 HG21 VAL A 891 1.626 3.572 11.368 1.00 0.00 H new ATOM 0 HG22 VAL A 891 1.702 3.429 9.596 1.00 0.00 H new ATOM 0 HG23 VAL A 891 1.733 5.035 10.361 1.00 0.00 H new ATOM 132 N PHE A 892 -2.884 3.986 8.434 1.00 0.00 N ATOM 133 CA PHE A 892 -4.332 4.072 8.391 1.00 0.00 C ATOM 134 C PHE A 892 -4.950 3.272 9.529 1.00 0.00 C ATOM 135 O PHE A 892 -4.584 2.119 9.762 1.00 0.00 O ATOM 136 CB PHE A 892 -4.870 3.597 7.031 1.00 0.00 C ATOM 137 CG PHE A 892 -4.383 2.237 6.603 1.00 0.00 C ATOM 138 CD1 PHE A 892 -3.177 2.098 5.935 1.00 0.00 C ATOM 139 CD2 PHE A 892 -5.135 1.101 6.865 1.00 0.00 C ATOM 140 CE1 PHE A 892 -2.728 0.854 5.540 1.00 0.00 C ATOM 141 CE2 PHE A 892 -4.690 -0.146 6.471 1.00 0.00 C ATOM 142 CZ PHE A 892 -3.485 -0.269 5.808 1.00 0.00 C ATOM 0 H PHE A 892 -2.491 3.172 7.962 1.00 0.00 H new ATOM 0 HA PHE A 892 -4.615 5.117 8.516 1.00 0.00 H new ATOM 0 HB2 PHE A 892 -5.959 3.582 7.071 1.00 0.00 H new ATOM 0 HB3 PHE A 892 -4.589 4.325 6.270 1.00 0.00 H new ATOM 0 HD1 PHE A 892 -2.581 2.973 5.721 1.00 0.00 H new ATOM 0 HD2 PHE A 892 -6.078 1.193 7.383 1.00 0.00 H new ATOM 0 HE1 PHE A 892 -1.785 0.759 5.022 1.00 0.00 H new ATOM 0 HE2 PHE A 892 -5.284 -1.023 6.681 1.00 0.00 H new ATOM 0 HZ PHE A 892 -3.135 -1.243 5.499 1.00 0.00 H new ATOM 152 N VAL A 893 -5.864 3.897 10.256 1.00 0.00 N ATOM 153 CA VAL A 893 -6.566 3.213 11.324 1.00 0.00 C ATOM 154 C VAL A 893 -7.993 2.922 10.893 1.00 0.00 C ATOM 155 O VAL A 893 -8.768 3.851 10.600 1.00 0.00 O ATOM 156 CB VAL A 893 -6.588 4.053 12.622 1.00 0.00 C ATOM 157 CG1 VAL A 893 -7.261 3.287 13.749 1.00 0.00 C ATOM 158 CG2 VAL A 893 -5.180 4.467 13.025 1.00 0.00 C ATOM 0 H VAL A 893 -6.134 4.872 10.125 1.00 0.00 H new ATOM 0 HA VAL A 893 -6.036 2.283 11.529 1.00 0.00 H new ATOM 0 HB VAL A 893 -7.166 4.956 12.428 1.00 0.00 H new ATOM 0 HG11 VAL A 893 -7.265 3.897 14.652 1.00 0.00 H new ATOM 0 HG12 VAL A 893 -8.287 3.050 13.466 1.00 0.00 H new ATOM 0 HG13 VAL A 893 -6.715 2.363 13.938 1.00 0.00 H new ATOM 0 HG21 VAL A 893 -5.222 5.057 13.941 1.00 0.00 H new ATOM 0 HG22 VAL A 893 -4.573 3.577 13.194 1.00 0.00 H new ATOM 0 HG23 VAL A 893 -4.734 5.064 12.229 1.00 0.00 H new ATOM 168 N LYS A 894 -8.319 1.622 10.853 1.00 0.00 N ATOM 169 CA LYS A 894 -9.651 1.120 10.483 1.00 0.00 C ATOM 170 C LYS A 894 -10.102 1.640 9.116 1.00 0.00 C ATOM 171 O LYS A 894 -11.256 1.470 8.724 1.00 0.00 O ATOM 172 CB LYS A 894 -10.671 1.494 11.559 1.00 0.00 C ATOM 173 CG LYS A 894 -10.368 0.869 12.914 1.00 0.00 C ATOM 174 CD LYS A 894 -10.418 -0.653 12.849 1.00 0.00 C ATOM 175 CE LYS A 894 -11.829 -1.152 12.591 1.00 0.00 C ATOM 176 NZ LYS A 894 -12.726 -0.900 13.747 1.00 0.00 N ATOM 0 H LYS A 894 -7.657 0.880 11.080 1.00 0.00 H new ATOM 0 HA LYS A 894 -9.585 0.034 10.410 1.00 0.00 H new ATOM 0 HB2 LYS A 894 -10.698 2.579 11.664 1.00 0.00 H new ATOM 0 HB3 LYS A 894 -11.663 1.180 11.235 1.00 0.00 H new ATOM 0 HG2 LYS A 894 -9.382 1.188 13.251 1.00 0.00 H new ATOM 0 HG3 LYS A 894 -11.088 1.227 13.650 1.00 0.00 H new ATOM 0 HD2 LYS A 894 -9.756 -1.007 12.059 1.00 0.00 H new ATOM 0 HD3 LYS A 894 -10.049 -1.071 13.786 1.00 0.00 H new ATOM 0 HE2 LYS A 894 -12.232 -0.660 11.705 1.00 0.00 H new ATOM 0 HE3 LYS A 894 -11.803 -2.221 12.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 894 -13.606 -1.441 13.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 894 -12.253 -1.197 14.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 894 -12.948 0.115 13.800 1.00 0.00 H new ATOM 190 N ASN A 895 -9.169 2.273 8.410 1.00 0.00 N ATOM 191 CA ASN A 895 -9.433 2.952 7.143 1.00 0.00 C ATOM 192 C ASN A 895 -10.472 4.051 7.338 1.00 0.00 C ATOM 193 O ASN A 895 -11.122 4.488 6.389 1.00 0.00 O ATOM 194 CB ASN A 895 -9.892 1.963 6.061 1.00 0.00 C ATOM 195 CG ASN A 895 -8.811 0.964 5.690 1.00 0.00 C ATOM 196 OD1 ASN A 895 -7.971 1.236 4.835 1.00 0.00 O ATOM 197 ND2 ASN A 895 -8.830 -0.202 6.316 1.00 0.00 N ATOM 0 H ASN A 895 -8.194 2.330 8.705 1.00 0.00 H new ATOM 0 HA ASN A 895 -8.501 3.404 6.804 1.00 0.00 H new ATOM 0 HB2 ASN A 895 -10.773 1.426 6.414 1.00 0.00 H new ATOM 0 HB3 ASN A 895 -10.192 2.516 5.171 1.00 0.00 H new ATOM 0 HD21 ASN A 895 -8.131 -0.911 6.094 1.00 0.00 H new ATOM 0 HD22 ASN A 895 -9.543 -0.391 7.020 1.00 0.00 H new ATOM 204 N VAL A 896 -10.592 4.519 8.576 1.00 0.00 N ATOM 205 CA VAL A 896 -11.470 5.630 8.893 1.00 0.00 C ATOM 206 C VAL A 896 -10.632 6.875 9.120 1.00 0.00 C ATOM 207 O VAL A 896 -11.057 7.997 8.841 1.00 0.00 O ATOM 208 CB VAL A 896 -12.326 5.336 10.149 1.00 0.00 C ATOM 209 CG1 VAL A 896 -13.281 6.484 10.443 1.00 0.00 C ATOM 210 CG2 VAL A 896 -13.099 4.037 9.981 1.00 0.00 C ATOM 0 H VAL A 896 -10.087 4.141 9.378 1.00 0.00 H new ATOM 0 HA VAL A 896 -12.151 5.783 8.056 1.00 0.00 H new ATOM 0 HB VAL A 896 -11.648 5.231 10.996 1.00 0.00 H new ATOM 0 HG11 VAL A 896 -13.869 6.250 11.330 1.00 0.00 H new ATOM 0 HG12 VAL A 896 -12.711 7.397 10.616 1.00 0.00 H new ATOM 0 HG13 VAL A 896 -13.948 6.629 9.593 1.00 0.00 H new ATOM 0 HG21 VAL A 896 -13.694 3.849 10.875 1.00 0.00 H new ATOM 0 HG22 VAL A 896 -13.758 4.115 9.116 1.00 0.00 H new ATOM 0 HG23 VAL A 896 -12.400 3.214 9.831 1.00 0.00 H new ATOM 220 N GLY A 897 -9.417 6.660 9.610 1.00 0.00 N ATOM 221 CA GLY A 897 -8.505 7.765 9.792 1.00 0.00 C ATOM 222 C GLY A 897 -7.093 7.406 9.392 1.00 0.00 C ATOM 223 O GLY A 897 -6.743 6.228 9.333 1.00 0.00 O ATOM 0 H GLY A 897 -9.052 5.747 9.882 1.00 0.00 H new ATOM 0 HA2 GLY A 897 -8.844 8.616 9.201 1.00 0.00 H new ATOM 0 HA3 GLY A 897 -8.518 8.077 10.836 1.00 0.00 H new ATOM 227 N TRP A 898 -6.287 8.416 9.116 1.00 0.00 N ATOM 228 CA TRP A 898 -4.883 8.218 8.804 1.00 0.00 C ATOM 229 C TRP A 898 -4.052 9.015 9.797 1.00 0.00 C ATOM 230 O TRP A 898 -4.373 10.166 10.084 1.00 0.00 O ATOM 231 CB TRP A 898 -4.568 8.675 7.371 1.00 0.00 C ATOM 232 CG TRP A 898 -5.784 8.853 6.510 1.00 0.00 C ATOM 233 CD1 TRP A 898 -6.367 10.037 6.159 1.00 0.00 C ATOM 234 CD2 TRP A 898 -6.572 7.821 5.902 1.00 0.00 C ATOM 235 NE1 TRP A 898 -7.466 9.807 5.370 1.00 0.00 N ATOM 236 CE2 TRP A 898 -7.614 8.454 5.199 1.00 0.00 C ATOM 237 CE3 TRP A 898 -6.497 6.426 5.882 1.00 0.00 C ATOM 238 CZ2 TRP A 898 -8.571 7.738 4.487 1.00 0.00 C ATOM 239 CZ3 TRP A 898 -7.450 5.718 5.176 1.00 0.00 C ATOM 240 CH2 TRP A 898 -8.474 6.375 4.487 1.00 0.00 C ATOM 0 H TRP A 898 -6.585 9.391 9.102 1.00 0.00 H new ATOM 0 HA TRP A 898 -4.644 7.157 8.875 1.00 0.00 H new ATOM 0 HB2 TRP A 898 -4.022 9.618 7.412 1.00 0.00 H new ATOM 0 HB3 TRP A 898 -3.907 7.945 6.904 1.00 0.00 H new ATOM 0 HD1 TRP A 898 -6.014 11.013 6.459 1.00 0.00 H new ATOM 0 HE1 TRP A 898 -8.074 10.525 4.975 1.00 0.00 H new ATOM 0 HE3 TRP A 898 -5.708 5.910 6.409 1.00 0.00 H new ATOM 0 HZ2 TRP A 898 -9.363 8.242 3.953 1.00 0.00 H new ATOM 0 HZ3 TRP A 898 -7.403 4.639 5.156 1.00 0.00 H new ATOM 0 HH2 TRP A 898 -9.204 5.793 3.943 1.00 0.00 H new ATOM 251 N ALA A 899 -2.996 8.421 10.317 1.00 0.00 N ATOM 252 CA ALA A 899 -2.145 9.108 11.273 1.00 0.00 C ATOM 253 C ALA A 899 -0.716 9.176 10.768 1.00 0.00 C ATOM 254 O ALA A 899 -0.141 8.167 10.367 1.00 0.00 O ATOM 255 CB ALA A 899 -2.199 8.410 12.625 1.00 0.00 C ATOM 0 H ALA A 899 -2.706 7.468 10.096 1.00 0.00 H new ATOM 0 HA ALA A 899 -2.513 10.127 11.391 1.00 0.00 H new ATOM 0 HB1 ALA A 899 -1.557 8.935 13.332 1.00 0.00 H new ATOM 0 HB2 ALA A 899 -3.224 8.413 12.995 1.00 0.00 H new ATOM 0 HB3 ALA A 899 -1.855 7.381 12.517 1.00 0.00 H new ATOM 261 N THR A 900 -0.150 10.364 10.798 1.00 0.00 N ATOM 262 CA THR A 900 1.223 10.572 10.390 1.00 0.00 C ATOM 263 C THR A 900 2.100 10.827 11.611 1.00 0.00 C ATOM 264 O THR A 900 1.737 11.612 12.494 1.00 0.00 O ATOM 265 CB THR A 900 1.335 11.763 9.416 1.00 0.00 C ATOM 266 OG1 THR A 900 0.449 11.568 8.305 1.00 0.00 O ATOM 267 CG2 THR A 900 2.758 11.925 8.904 1.00 0.00 C ATOM 0 H THR A 900 -0.628 11.211 11.105 1.00 0.00 H new ATOM 0 HA THR A 900 1.564 9.671 9.879 1.00 0.00 H new ATOM 0 HB THR A 900 1.058 12.668 9.958 1.00 0.00 H new ATOM 0 HG1 THR A 900 0.726 10.774 7.801 1.00 0.00 H new ATOM 0 HG21 THR A 900 2.804 12.772 8.220 1.00 0.00 H new ATOM 0 HG22 THR A 900 3.429 12.100 9.745 1.00 0.00 H new ATOM 0 HG23 THR A 900 3.062 11.019 8.380 1.00 0.00 H new ATOM 275 N GLN A 901 3.235 10.145 11.672 1.00 0.00 N ATOM 276 CA GLN A 901 4.180 10.344 12.756 1.00 0.00 C ATOM 277 C GLN A 901 5.224 11.371 12.352 1.00 0.00 C ATOM 278 O GLN A 901 6.011 11.138 11.435 1.00 0.00 O ATOM 279 CB GLN A 901 4.873 9.032 13.125 1.00 0.00 C ATOM 280 CG GLN A 901 3.959 8.010 13.775 1.00 0.00 C ATOM 281 CD GLN A 901 4.685 6.722 14.104 1.00 0.00 C ATOM 282 OE1 GLN A 901 4.714 5.790 13.302 1.00 0.00 O ATOM 283 NE2 GLN A 901 5.289 6.666 15.282 1.00 0.00 N ATOM 0 H GLN A 901 3.522 9.450 10.983 1.00 0.00 H new ATOM 0 HA GLN A 901 3.629 10.703 13.625 1.00 0.00 H new ATOM 0 HB2 GLN A 901 5.305 8.596 12.224 1.00 0.00 H new ATOM 0 HB3 GLN A 901 5.699 9.248 13.803 1.00 0.00 H new ATOM 0 HG2 GLN A 901 3.537 8.431 14.688 1.00 0.00 H new ATOM 0 HG3 GLN A 901 3.124 7.795 13.108 1.00 0.00 H new ATOM 0 HE21 GLN A 901 5.241 7.462 15.918 1.00 0.00 H new ATOM 0 HE22 GLN A 901 5.802 5.827 15.552 1.00 0.00 H new ATOM 292 N LEU A 902 5.232 12.500 13.037 1.00 0.00 N ATOM 293 CA LEU A 902 6.204 13.542 12.760 1.00 0.00 C ATOM 294 C LEU A 902 7.421 13.358 13.651 1.00 0.00 C ATOM 295 O LEU A 902 7.299 12.912 14.793 1.00 0.00 O ATOM 296 CB LEU A 902 5.594 14.935 12.965 1.00 0.00 C ATOM 297 CG LEU A 902 4.599 15.396 11.885 1.00 0.00 C ATOM 298 CD1 LEU A 902 3.315 14.577 11.918 1.00 0.00 C ATOM 299 CD2 LEU A 902 4.284 16.871 12.058 1.00 0.00 C ATOM 0 H LEU A 902 4.577 12.719 13.788 1.00 0.00 H new ATOM 0 HA LEU A 902 6.509 13.463 11.717 1.00 0.00 H new ATOM 0 HB2 LEU A 902 5.087 14.951 13.930 1.00 0.00 H new ATOM 0 HB3 LEU A 902 6.405 15.662 13.019 1.00 0.00 H new ATOM 0 HG LEU A 902 5.068 15.240 10.913 1.00 0.00 H new ATOM 0 HD11 LEU A 902 2.637 14.932 11.141 1.00 0.00 H new ATOM 0 HD12 LEU A 902 3.549 13.527 11.744 1.00 0.00 H new ATOM 0 HD13 LEU A 902 2.839 14.686 12.892 1.00 0.00 H new ATOM 0 HD21 LEU A 902 3.579 17.185 11.288 1.00 0.00 H new ATOM 0 HD22 LEU A 902 3.844 17.036 13.042 1.00 0.00 H new ATOM 0 HD23 LEU A 902 5.202 17.452 11.969 1.00 0.00 H new ATOM 311 N THR A 903 8.588 13.705 13.126 1.00 0.00 N ATOM 312 CA THR A 903 9.848 13.519 13.836 1.00 0.00 C ATOM 313 C THR A 903 9.905 14.370 15.112 1.00 0.00 C ATOM 314 O THR A 903 10.745 14.148 15.985 1.00 0.00 O ATOM 315 CB THR A 903 11.055 13.848 12.923 1.00 0.00 C ATOM 316 OG1 THR A 903 12.283 13.502 13.575 1.00 0.00 O ATOM 317 CG2 THR A 903 11.077 15.325 12.546 1.00 0.00 C ATOM 0 H THR A 903 8.689 14.122 12.200 1.00 0.00 H new ATOM 0 HA THR A 903 9.904 12.469 14.124 1.00 0.00 H new ATOM 0 HB THR A 903 10.950 13.259 12.012 1.00 0.00 H new ATOM 0 HG1 THR A 903 12.151 13.508 14.546 1.00 0.00 H new ATOM 0 HG21 THR A 903 11.936 15.524 11.905 1.00 0.00 H new ATOM 0 HG22 THR A 903 10.160 15.578 12.014 1.00 0.00 H new ATOM 0 HG23 THR A 903 11.151 15.930 13.450 1.00 0.00 H new ATOM 325 N SER A 904 8.992 15.329 15.228 1.00 0.00 N ATOM 326 CA SER A 904 8.925 16.186 16.399 1.00 0.00 C ATOM 327 C SER A 904 8.078 15.549 17.499 1.00 0.00 C ATOM 328 O SER A 904 7.911 16.118 18.578 1.00 0.00 O ATOM 329 CB SER A 904 8.349 17.539 15.995 1.00 0.00 C ATOM 330 OG SER A 904 7.232 17.367 15.139 1.00 0.00 O ATOM 0 H SER A 904 8.286 15.530 14.520 1.00 0.00 H new ATOM 0 HA SER A 904 9.931 16.322 16.797 1.00 0.00 H new ATOM 0 HB2 SER A 904 8.051 18.094 16.884 1.00 0.00 H new ATOM 0 HB3 SER A 904 9.113 18.131 15.491 1.00 0.00 H new ATOM 0 HG SER A 904 6.873 18.244 14.890 1.00 0.00 H new ATOM 336 N GLY A 905 7.563 14.357 17.227 1.00 0.00 N ATOM 337 CA GLY A 905 6.724 13.673 18.189 1.00 0.00 C ATOM 338 C GLY A 905 5.272 14.082 18.061 1.00 0.00 C ATOM 339 O GLY A 905 4.458 13.815 18.944 1.00 0.00 O ATOM 0 H GLY A 905 7.713 13.851 16.354 1.00 0.00 H new ATOM 0 HA2 GLY A 905 6.812 12.596 18.047 1.00 0.00 H new ATOM 0 HA3 GLY A 905 7.075 13.891 19.197 1.00 0.00 H new ATOM 343 N ALA A 906 4.950 14.745 16.961 1.00 0.00 N ATOM 344 CA ALA A 906 3.592 15.187 16.708 1.00 0.00 C ATOM 345 C ALA A 906 2.823 14.119 15.948 1.00 0.00 C ATOM 346 O ALA A 906 3.372 13.467 15.058 1.00 0.00 O ATOM 347 CB ALA A 906 3.596 16.495 15.932 1.00 0.00 C ATOM 0 H ALA A 906 5.616 14.989 16.228 1.00 0.00 H new ATOM 0 HA ALA A 906 3.097 15.356 17.664 1.00 0.00 H new ATOM 0 HB1 ALA A 906 2.569 16.813 15.750 1.00 0.00 H new ATOM 0 HB2 ALA A 906 4.116 17.259 16.510 1.00 0.00 H new ATOM 0 HB3 ALA A 906 4.105 16.351 14.979 1.00 0.00 H new ATOM 353 N VAL A 907 1.565 13.931 16.306 1.00 0.00 N ATOM 354 CA VAL A 907 0.717 12.983 15.611 1.00 0.00 C ATOM 355 C VAL A 907 -0.338 13.730 14.810 1.00 0.00 C ATOM 356 O VAL A 907 -1.095 14.534 15.359 1.00 0.00 O ATOM 357 CB VAL A 907 0.025 12.012 16.590 1.00 0.00 C ATOM 358 CG1 VAL A 907 -0.775 10.964 15.833 1.00 0.00 C ATOM 359 CG2 VAL A 907 1.046 11.354 17.508 1.00 0.00 C ATOM 0 H VAL A 907 1.109 14.423 17.074 1.00 0.00 H new ATOM 0 HA VAL A 907 1.350 12.397 14.944 1.00 0.00 H new ATOM 0 HB VAL A 907 -0.666 12.586 17.207 1.00 0.00 H new ATOM 0 HG11 VAL A 907 -1.255 10.290 16.543 1.00 0.00 H new ATOM 0 HG12 VAL A 907 -1.537 11.455 15.227 1.00 0.00 H new ATOM 0 HG13 VAL A 907 -0.108 10.395 15.186 1.00 0.00 H new ATOM 0 HG21 VAL A 907 0.537 10.673 18.190 1.00 0.00 H new ATOM 0 HG22 VAL A 907 1.767 10.796 16.910 1.00 0.00 H new ATOM 0 HG23 VAL A 907 1.567 12.121 18.082 1.00 0.00 H new ATOM 369 N TRP A 908 -0.373 13.476 13.514 1.00 0.00 N ATOM 370 CA TRP A 908 -1.346 14.111 12.636 1.00 0.00 C ATOM 371 C TRP A 908 -2.370 13.074 12.180 1.00 0.00 C ATOM 372 O TRP A 908 -2.027 12.144 11.460 1.00 0.00 O ATOM 373 CB TRP A 908 -0.618 14.709 11.425 1.00 0.00 C ATOM 374 CG TRP A 908 -1.452 15.627 10.580 1.00 0.00 C ATOM 375 CD1 TRP A 908 -2.513 15.287 9.792 1.00 0.00 C ATOM 376 CD2 TRP A 908 -1.262 17.036 10.415 1.00 0.00 C ATOM 377 NE1 TRP A 908 -3.006 16.403 9.161 1.00 0.00 N ATOM 378 CE2 TRP A 908 -2.256 17.488 9.527 1.00 0.00 C ATOM 379 CE3 TRP A 908 -0.355 17.961 10.940 1.00 0.00 C ATOM 380 CZ2 TRP A 908 -2.363 18.825 9.148 1.00 0.00 C ATOM 381 CZ3 TRP A 908 -0.463 19.287 10.562 1.00 0.00 C ATOM 382 CH2 TRP A 908 -1.460 19.708 9.675 1.00 0.00 C ATOM 0 H TRP A 908 0.263 12.832 13.043 1.00 0.00 H new ATOM 0 HA TRP A 908 -1.865 14.908 13.169 1.00 0.00 H new ATOM 0 HB2 TRP A 908 0.256 15.257 11.778 1.00 0.00 H new ATOM 0 HB3 TRP A 908 -0.252 13.894 10.800 1.00 0.00 H new ATOM 0 HD1 TRP A 908 -2.907 14.288 9.681 1.00 0.00 H new ATOM 0 HE1 TRP A 908 -3.802 16.420 8.523 1.00 0.00 H new ATOM 0 HE3 TRP A 908 0.416 17.646 11.628 1.00 0.00 H new ATOM 0 HZ2 TRP A 908 -3.131 19.152 8.463 1.00 0.00 H new ATOM 0 HZ3 TRP A 908 0.234 20.010 10.958 1.00 0.00 H new ATOM 0 HH2 TRP A 908 -1.518 20.751 9.401 1.00 0.00 H new ATOM 393 N VAL A 909 -3.619 13.226 12.600 1.00 0.00 N ATOM 394 CA VAL A 909 -4.659 12.279 12.218 1.00 0.00 C ATOM 395 C VAL A 909 -5.716 12.953 11.356 1.00 0.00 C ATOM 396 O VAL A 909 -6.381 13.886 11.795 1.00 0.00 O ATOM 397 CB VAL A 909 -5.347 11.641 13.446 1.00 0.00 C ATOM 398 CG1 VAL A 909 -6.368 10.597 13.007 1.00 0.00 C ATOM 399 CG2 VAL A 909 -4.320 11.026 14.385 1.00 0.00 C ATOM 0 H VAL A 909 -3.935 13.988 13.200 1.00 0.00 H new ATOM 0 HA VAL A 909 -4.165 11.491 11.650 1.00 0.00 H new ATOM 0 HB VAL A 909 -5.872 12.428 13.988 1.00 0.00 H new ATOM 0 HG11 VAL A 909 -6.842 10.159 13.886 1.00 0.00 H new ATOM 0 HG12 VAL A 909 -7.127 11.070 12.383 1.00 0.00 H new ATOM 0 HG13 VAL A 909 -5.866 9.815 12.437 1.00 0.00 H new ATOM 0 HG21 VAL A 909 -4.829 10.584 15.241 1.00 0.00 H new ATOM 0 HG22 VAL A 909 -3.760 10.254 13.857 1.00 0.00 H new ATOM 0 HG23 VAL A 909 -3.634 11.799 14.731 1.00 0.00 H new ATOM 409 N GLN A 910 -5.852 12.498 10.125 1.00 0.00 N ATOM 410 CA GLN A 910 -6.922 12.961 9.262 1.00 0.00 C ATOM 411 C GLN A 910 -7.979 11.871 9.120 1.00 0.00 C ATOM 412 O GLN A 910 -7.649 10.692 9.072 1.00 0.00 O ATOM 413 CB GLN A 910 -6.376 13.367 7.889 1.00 0.00 C ATOM 414 CG GLN A 910 -7.406 14.065 7.013 1.00 0.00 C ATOM 415 CD GLN A 910 -6.826 14.583 5.711 1.00 0.00 C ATOM 416 OE1 GLN A 910 -5.882 14.013 5.165 1.00 0.00 O ATOM 417 NE2 GLN A 910 -7.385 15.671 5.204 1.00 0.00 N ATOM 0 H GLN A 910 -5.234 11.807 9.700 1.00 0.00 H new ATOM 0 HA GLN A 910 -7.381 13.841 9.713 1.00 0.00 H new ATOM 0 HB2 GLN A 910 -5.520 14.027 8.027 1.00 0.00 H new ATOM 0 HB3 GLN A 910 -6.013 12.478 7.373 1.00 0.00 H new ATOM 0 HG2 GLN A 910 -8.217 13.371 6.792 1.00 0.00 H new ATOM 0 HG3 GLN A 910 -7.841 14.897 7.567 1.00 0.00 H new ATOM 0 HE21 GLN A 910 -8.166 16.115 5.686 1.00 0.00 H new ATOM 0 HE22 GLN A 910 -7.034 16.065 4.331 1.00 0.00 H new ATOM 426 N PHE A 911 -9.239 12.262 9.065 1.00 0.00 N ATOM 427 CA PHE A 911 -10.320 11.316 8.828 1.00 0.00 C ATOM 428 C PHE A 911 -10.569 11.179 7.335 1.00 0.00 C ATOM 429 O PHE A 911 -10.177 12.048 6.550 1.00 0.00 O ATOM 430 CB PHE A 911 -11.613 11.768 9.516 1.00 0.00 C ATOM 431 CG PHE A 911 -11.556 11.751 11.016 1.00 0.00 C ATOM 432 CD1 PHE A 911 -11.519 10.550 11.705 1.00 0.00 C ATOM 433 CD2 PHE A 911 -11.550 12.935 11.736 1.00 0.00 C ATOM 434 CE1 PHE A 911 -11.474 10.529 13.086 1.00 0.00 C ATOM 435 CE2 PHE A 911 -11.507 12.920 13.116 1.00 0.00 C ATOM 436 CZ PHE A 911 -11.469 11.716 13.792 1.00 0.00 C ATOM 0 H PHE A 911 -9.542 13.229 9.181 1.00 0.00 H new ATOM 0 HA PHE A 911 -10.022 10.354 9.245 1.00 0.00 H new ATOM 0 HB2 PHE A 911 -11.852 12.779 9.185 1.00 0.00 H new ATOM 0 HB3 PHE A 911 -12.429 11.124 9.188 1.00 0.00 H new ATOM 0 HD1 PHE A 911 -11.525 9.620 11.157 1.00 0.00 H new ATOM 0 HD2 PHE A 911 -11.579 13.879 11.212 1.00 0.00 H new ATOM 0 HE1 PHE A 911 -11.443 9.586 13.612 1.00 0.00 H new ATOM 0 HE2 PHE A 911 -11.503 13.849 13.667 1.00 0.00 H new ATOM 0 HZ PHE A 911 -11.435 11.703 14.871 1.00 0.00 H new ATOM 446 N ASN A 912 -11.226 10.096 6.941 1.00 0.00 N ATOM 447 CA ASN A 912 -11.610 9.899 5.546 1.00 0.00 C ATOM 448 C ASN A 912 -12.639 10.953 5.129 1.00 0.00 C ATOM 449 O ASN A 912 -12.884 11.175 3.943 1.00 0.00 O ATOM 450 CB ASN A 912 -12.163 8.486 5.326 1.00 0.00 C ATOM 451 CG ASN A 912 -12.327 8.152 3.853 1.00 0.00 C ATOM 452 OD1 ASN A 912 -11.610 8.679 3.002 1.00 0.00 O ATOM 453 ND2 ASN A 912 -13.253 7.261 3.542 1.00 0.00 N ATOM 0 H ASN A 912 -11.505 9.340 7.566 1.00 0.00 H new ATOM 0 HA ASN A 912 -10.722 10.012 4.924 1.00 0.00 H new ATOM 0 HB2 ASN A 912 -11.493 7.761 5.788 1.00 0.00 H new ATOM 0 HB3 ASN A 912 -13.127 8.394 5.826 1.00 0.00 H new ATOM 0 HD21 ASN A 912 -13.392 6.989 2.569 1.00 0.00 H new ATOM 0 HD22 ASN A 912 -13.828 6.846 4.275 1.00 0.00 H new ATOM 460 N ASP A 913 -13.236 11.599 6.127 1.00 0.00 N ATOM 461 CA ASP A 913 -14.171 12.701 5.903 1.00 0.00 C ATOM 462 C ASP A 913 -13.423 13.973 5.471 1.00 0.00 C ATOM 463 O ASP A 913 -14.025 15.001 5.162 1.00 0.00 O ATOM 464 CB ASP A 913 -14.955 12.942 7.205 1.00 0.00 C ATOM 465 CG ASP A 913 -15.775 14.217 7.205 1.00 0.00 C ATOM 466 OD1 ASP A 913 -16.866 14.230 6.598 1.00 0.00 O ATOM 467 OD2 ASP A 913 -15.332 15.209 7.826 1.00 0.00 O ATOM 0 H ASP A 913 -13.087 11.375 7.111 1.00 0.00 H new ATOM 0 HA ASP A 913 -14.861 12.443 5.099 1.00 0.00 H new ATOM 0 HB2 ASP A 913 -15.619 12.095 7.379 1.00 0.00 H new ATOM 0 HB3 ASP A 913 -14.254 12.974 8.039 1.00 0.00 H new ATOM 472 N GLY A 914 -12.103 13.873 5.406 1.00 0.00 N ATOM 473 CA GLY A 914 -11.280 14.968 4.922 1.00 0.00 C ATOM 474 C GLY A 914 -10.967 15.996 5.993 1.00 0.00 C ATOM 475 O GLY A 914 -10.291 16.987 5.727 1.00 0.00 O ATOM 0 H GLY A 914 -11.580 13.042 5.683 1.00 0.00 H new ATOM 0 HA2 GLY A 914 -10.346 14.566 4.528 1.00 0.00 H new ATOM 0 HA3 GLY A 914 -11.790 15.459 4.093 1.00 0.00 H new ATOM 479 N SER A 915 -11.424 15.745 7.212 1.00 0.00 N ATOM 480 CA SER A 915 -11.125 16.626 8.333 1.00 0.00 C ATOM 481 C SER A 915 -9.947 16.059 9.115 1.00 0.00 C ATOM 482 O SER A 915 -9.755 14.848 9.129 1.00 0.00 O ATOM 483 CB SER A 915 -12.355 16.748 9.236 1.00 0.00 C ATOM 484 OG SER A 915 -13.510 17.103 8.485 1.00 0.00 O ATOM 0 H SER A 915 -12.003 14.939 7.450 1.00 0.00 H new ATOM 0 HA SER A 915 -10.865 17.618 7.964 1.00 0.00 H new ATOM 0 HB2 SER A 915 -12.528 15.802 9.749 1.00 0.00 H new ATOM 0 HB3 SER A 915 -12.172 17.499 10.005 1.00 0.00 H new ATOM 0 HG SER A 915 -14.075 16.312 8.360 1.00 0.00 H new ATOM 490 N GLN A 916 -9.157 16.903 9.763 1.00 0.00 N ATOM 491 CA GLN A 916 -7.979 16.399 10.467 1.00 0.00 C ATOM 492 C GLN A 916 -7.855 16.972 11.873 1.00 0.00 C ATOM 493 O GLN A 916 -8.484 17.971 12.205 1.00 0.00 O ATOM 494 CB GLN A 916 -6.690 16.665 9.672 1.00 0.00 C ATOM 495 CG GLN A 916 -6.400 18.132 9.383 1.00 0.00 C ATOM 496 CD GLN A 916 -7.140 18.666 8.169 1.00 0.00 C ATOM 497 OE1 GLN A 916 -8.253 19.172 8.274 1.00 0.00 O ATOM 498 NE2 GLN A 916 -6.520 18.555 7.007 1.00 0.00 N ATOM 0 H GLN A 916 -9.300 17.911 9.818 1.00 0.00 H new ATOM 0 HA GLN A 916 -8.116 15.322 10.558 1.00 0.00 H new ATOM 0 HB2 GLN A 916 -5.848 16.246 10.224 1.00 0.00 H new ATOM 0 HB3 GLN A 916 -6.749 16.129 8.725 1.00 0.00 H new ATOM 0 HG2 GLN A 916 -6.671 18.727 10.255 1.00 0.00 H new ATOM 0 HG3 GLN A 916 -5.328 18.260 9.231 1.00 0.00 H new ATOM 0 HE21 GLN A 916 -5.595 18.128 6.961 1.00 0.00 H new ATOM 0 HE22 GLN A 916 -6.967 18.896 6.156 1.00 0.00 H new ATOM 507 N LEU A 917 -7.050 16.316 12.695 1.00 0.00 N ATOM 508 CA LEU A 917 -6.723 16.810 14.024 1.00 0.00 C ATOM 509 C LEU A 917 -5.236 16.621 14.294 1.00 0.00 C ATOM 510 O LEU A 917 -4.660 15.585 13.957 1.00 0.00 O ATOM 511 CB LEU A 917 -7.541 16.104 15.120 1.00 0.00 C ATOM 512 CG LEU A 917 -7.397 14.578 15.184 1.00 0.00 C ATOM 513 CD1 LEU A 917 -7.645 14.070 16.596 1.00 0.00 C ATOM 514 CD2 LEU A 917 -8.371 13.917 14.232 1.00 0.00 C ATOM 0 H LEU A 917 -6.606 15.428 12.460 1.00 0.00 H new ATOM 0 HA LEU A 917 -6.976 17.870 14.052 1.00 0.00 H new ATOM 0 HB2 LEU A 917 -7.252 16.518 16.086 1.00 0.00 H new ATOM 0 HB3 LEU A 917 -8.594 16.345 14.973 1.00 0.00 H new ATOM 0 HG LEU A 917 -6.378 14.324 14.892 1.00 0.00 H new ATOM 0 HD11 LEU A 917 -7.537 12.986 16.617 1.00 0.00 H new ATOM 0 HD12 LEU A 917 -6.922 14.519 17.277 1.00 0.00 H new ATOM 0 HD13 LEU A 917 -8.654 14.341 16.908 1.00 0.00 H new ATOM 0 HD21 LEU A 917 -8.257 12.834 14.288 1.00 0.00 H new ATOM 0 HD22 LEU A 917 -9.390 14.189 14.507 1.00 0.00 H new ATOM 0 HD23 LEU A 917 -8.168 14.251 13.214 1.00 0.00 H new ATOM 526 N VAL A 918 -4.617 17.630 14.883 1.00 0.00 N ATOM 527 CA VAL A 918 -3.210 17.556 15.239 1.00 0.00 C ATOM 528 C VAL A 918 -3.069 17.351 16.741 1.00 0.00 C ATOM 529 O VAL A 918 -3.589 18.140 17.538 1.00 0.00 O ATOM 530 CB VAL A 918 -2.448 18.834 14.826 1.00 0.00 C ATOM 531 CG1 VAL A 918 -0.950 18.660 15.016 1.00 0.00 C ATOM 532 CG2 VAL A 918 -2.769 19.210 13.389 1.00 0.00 C ATOM 0 H VAL A 918 -5.068 18.512 15.125 1.00 0.00 H new ATOM 0 HA VAL A 918 -2.777 16.713 14.701 1.00 0.00 H new ATOM 0 HB VAL A 918 -2.777 19.647 15.473 1.00 0.00 H new ATOM 0 HG11 VAL A 918 -0.437 19.574 14.718 1.00 0.00 H new ATOM 0 HG12 VAL A 918 -0.738 18.450 16.064 1.00 0.00 H new ATOM 0 HG13 VAL A 918 -0.599 17.830 14.402 1.00 0.00 H new ATOM 0 HG21 VAL A 918 -2.222 20.113 13.118 1.00 0.00 H new ATOM 0 HG22 VAL A 918 -2.476 18.396 12.726 1.00 0.00 H new ATOM 0 HG23 VAL A 918 -3.839 19.391 13.291 1.00 0.00 H new ATOM 542 N VAL A 919 -2.374 16.289 17.117 1.00 0.00 N ATOM 543 CA VAL A 919 -2.194 15.943 18.514 1.00 0.00 C ATOM 544 C VAL A 919 -0.722 16.000 18.883 1.00 0.00 C ATOM 545 O VAL A 919 0.127 15.491 18.150 1.00 0.00 O ATOM 546 CB VAL A 919 -2.724 14.523 18.813 1.00 0.00 C ATOM 547 CG1 VAL A 919 -2.670 14.225 20.303 1.00 0.00 C ATOM 548 CG2 VAL A 919 -4.136 14.355 18.281 1.00 0.00 C ATOM 0 H VAL A 919 -1.922 15.648 16.465 1.00 0.00 H new ATOM 0 HA VAL A 919 -2.758 16.665 19.105 1.00 0.00 H new ATOM 0 HB VAL A 919 -2.079 13.807 18.303 1.00 0.00 H new ATOM 0 HG11 VAL A 919 -3.049 13.220 20.487 1.00 0.00 H new ATOM 0 HG12 VAL A 919 -1.639 14.294 20.651 1.00 0.00 H new ATOM 0 HG13 VAL A 919 -3.283 14.948 20.841 1.00 0.00 H new ATOM 0 HG21 VAL A 919 -4.491 13.348 18.502 1.00 0.00 H new ATOM 0 HG22 VAL A 919 -4.793 15.084 18.756 1.00 0.00 H new ATOM 0 HG23 VAL A 919 -4.140 14.512 17.202 1.00 0.00 H new ATOM 558 N GLN A 920 -0.413 16.641 19.995 1.00 0.00 N ATOM 559 CA GLN A 920 0.935 16.594 20.525 1.00 0.00 C ATOM 560 C GLN A 920 1.031 15.446 21.517 1.00 0.00 C ATOM 561 O GLN A 920 0.106 15.221 22.302 1.00 0.00 O ATOM 562 CB GLN A 920 1.301 17.918 21.203 1.00 0.00 C ATOM 563 CG GLN A 920 1.291 19.115 20.264 1.00 0.00 C ATOM 564 CD GLN A 920 2.266 18.967 19.110 1.00 0.00 C ATOM 565 OE1 GLN A 920 3.431 19.348 19.210 1.00 0.00 O ATOM 566 NE2 GLN A 920 1.795 18.416 18.003 1.00 0.00 N ATOM 0 H GLN A 920 -1.071 17.195 20.544 1.00 0.00 H new ATOM 0 HA GLN A 920 1.639 16.435 19.708 1.00 0.00 H new ATOM 0 HB2 GLN A 920 0.602 18.103 22.019 1.00 0.00 H new ATOM 0 HB3 GLN A 920 2.292 17.826 21.647 1.00 0.00 H new ATOM 0 HG2 GLN A 920 0.285 19.252 19.868 1.00 0.00 H new ATOM 0 HG3 GLN A 920 1.537 20.015 20.828 1.00 0.00 H new ATOM 0 HE21 GLN A 920 0.822 18.112 17.958 1.00 0.00 H new ATOM 0 HE22 GLN A 920 2.405 18.295 17.194 1.00 0.00 H new ATOM 575 N ALA A 921 2.136 14.718 21.475 1.00 0.00 N ATOM 576 CA ALA A 921 2.325 13.578 22.361 1.00 0.00 C ATOM 577 C ALA A 921 2.261 14.006 23.824 1.00 0.00 C ATOM 578 O ALA A 921 2.962 14.925 24.247 1.00 0.00 O ATOM 579 CB ALA A 921 3.653 12.900 22.062 1.00 0.00 C ATOM 0 H ALA A 921 2.914 14.895 20.839 1.00 0.00 H new ATOM 0 HA ALA A 921 1.518 12.867 22.184 1.00 0.00 H new ATOM 0 HB1 ALA A 921 3.785 12.049 22.730 1.00 0.00 H new ATOM 0 HB2 ALA A 921 3.661 12.555 21.028 1.00 0.00 H new ATOM 0 HB3 ALA A 921 4.466 13.610 22.214 1.00 0.00 H new ATOM 585 N GLY A 922 1.405 13.338 24.586 1.00 0.00 N ATOM 586 CA GLY A 922 1.281 13.629 26.003 1.00 0.00 C ATOM 587 C GLY A 922 0.264 14.721 26.289 1.00 0.00 C ATOM 588 O GLY A 922 -0.053 14.995 27.447 1.00 0.00 O ATOM 0 H GLY A 922 0.792 12.597 24.247 1.00 0.00 H new ATOM 0 HA2 GLY A 922 0.992 12.721 26.533 1.00 0.00 H new ATOM 0 HA3 GLY A 922 2.252 13.931 26.394 1.00 0.00 H new ATOM 592 N VAL A 923 -0.259 15.341 25.239 1.00 0.00 N ATOM 593 CA VAL A 923 -1.203 16.441 25.391 1.00 0.00 C ATOM 594 C VAL A 923 -2.601 16.018 24.950 1.00 0.00 C ATOM 595 O VAL A 923 -2.781 15.491 23.855 1.00 0.00 O ATOM 596 CB VAL A 923 -0.758 17.678 24.578 1.00 0.00 C ATOM 597 CG1 VAL A 923 -1.654 18.871 24.871 1.00 0.00 C ATOM 598 CG2 VAL A 923 0.695 18.019 24.868 1.00 0.00 C ATOM 0 H VAL A 923 -0.045 15.100 24.271 1.00 0.00 H new ATOM 0 HA VAL A 923 -1.225 16.707 26.448 1.00 0.00 H new ATOM 0 HB VAL A 923 -0.849 17.435 23.519 1.00 0.00 H new ATOM 0 HG11 VAL A 923 -1.320 19.729 24.287 1.00 0.00 H new ATOM 0 HG12 VAL A 923 -2.682 18.628 24.604 1.00 0.00 H new ATOM 0 HG13 VAL A 923 -1.602 19.113 25.933 1.00 0.00 H new ATOM 0 HG21 VAL A 923 0.987 18.893 24.285 1.00 0.00 H new ATOM 0 HG22 VAL A 923 0.813 18.235 25.930 1.00 0.00 H new ATOM 0 HG23 VAL A 923 1.328 17.174 24.597 1.00 0.00 H new ATOM 608 N SER A 924 -3.588 16.246 25.811 1.00 0.00 N ATOM 609 CA SER A 924 -4.964 15.886 25.499 1.00 0.00 C ATOM 610 C SER A 924 -5.674 17.040 24.788 1.00 0.00 C ATOM 611 O SER A 924 -6.804 16.895 24.321 1.00 0.00 O ATOM 612 CB SER A 924 -5.718 15.494 26.777 1.00 0.00 C ATOM 613 OG SER A 924 -7.032 15.047 26.486 1.00 0.00 O ATOM 0 H SER A 924 -3.460 16.677 26.727 1.00 0.00 H new ATOM 0 HA SER A 924 -4.952 15.027 24.828 1.00 0.00 H new ATOM 0 HB2 SER A 924 -5.171 14.707 27.297 1.00 0.00 H new ATOM 0 HB3 SER A 924 -5.764 16.349 27.451 1.00 0.00 H new ATOM 0 HG SER A 924 -7.325 15.426 25.631 1.00 0.00 H new ATOM 619 N SER A 925 -5.003 18.181 24.713 1.00 0.00 N ATOM 620 CA SER A 925 -5.543 19.340 24.021 1.00 0.00 C ATOM 621 C SER A 925 -5.100 19.319 22.561 1.00 0.00 C ATOM 622 O SER A 925 -3.919 19.483 22.253 1.00 0.00 O ATOM 623 CB SER A 925 -5.087 20.623 24.717 1.00 0.00 C ATOM 624 OG SER A 925 -5.439 20.601 26.093 1.00 0.00 O ATOM 0 H SER A 925 -4.081 18.328 25.125 1.00 0.00 H new ATOM 0 HA SER A 925 -6.632 19.308 24.050 1.00 0.00 H new ATOM 0 HB2 SER A 925 -4.008 20.734 24.615 1.00 0.00 H new ATOM 0 HB3 SER A 925 -5.544 21.487 24.234 1.00 0.00 H new ATOM 0 HG SER A 925 -5.137 21.429 26.521 1.00 0.00 H new ATOM 630 N ILE A 926 -6.053 19.112 21.670 1.00 0.00 N ATOM 631 CA ILE A 926 -5.752 18.889 20.262 1.00 0.00 C ATOM 632 C ILE A 926 -6.267 20.027 19.397 1.00 0.00 C ATOM 633 O ILE A 926 -7.091 20.834 19.835 1.00 0.00 O ATOM 634 CB ILE A 926 -6.379 17.574 19.757 1.00 0.00 C ATOM 635 CG1 ILE A 926 -7.907 17.663 19.809 1.00 0.00 C ATOM 636 CG2 ILE A 926 -5.880 16.399 20.587 1.00 0.00 C ATOM 637 CD1 ILE A 926 -8.607 16.483 19.179 1.00 0.00 C ATOM 0 H ILE A 926 -7.048 19.093 21.895 1.00 0.00 H new ATOM 0 HA ILE A 926 -4.666 18.833 20.183 1.00 0.00 H new ATOM 0 HB ILE A 926 -6.078 17.415 18.721 1.00 0.00 H new ATOM 0 HG12 ILE A 926 -8.222 17.748 20.849 1.00 0.00 H new ATOM 0 HG13 ILE A 926 -8.226 18.575 19.304 1.00 0.00 H new ATOM 0 HG21 ILE A 926 -6.330 15.477 20.220 1.00 0.00 H new ATOM 0 HG22 ILE A 926 -4.795 16.331 20.505 1.00 0.00 H new ATOM 0 HG23 ILE A 926 -6.157 16.547 21.631 1.00 0.00 H new ATOM 0 HD11 ILE A 926 -9.686 16.617 19.254 1.00 0.00 H new ATOM 0 HD12 ILE A 926 -8.323 16.409 18.129 1.00 0.00 H new ATOM 0 HD13 ILE A 926 -8.318 15.569 19.698 1.00 0.00 H new ATOM 649 N SER A 927 -5.800 20.073 18.160 1.00 0.00 N ATOM 650 CA SER A 927 -6.265 21.070 17.214 1.00 0.00 C ATOM 651 C SER A 927 -6.965 20.397 16.038 1.00 0.00 C ATOM 652 O SER A 927 -6.357 19.643 15.283 1.00 0.00 O ATOM 653 CB SER A 927 -5.095 21.935 16.737 1.00 0.00 C ATOM 654 OG SER A 927 -3.973 21.137 16.400 1.00 0.00 O ATOM 0 H SER A 927 -5.099 19.431 17.789 1.00 0.00 H new ATOM 0 HA SER A 927 -6.986 21.720 17.710 1.00 0.00 H new ATOM 0 HB2 SER A 927 -5.402 22.521 15.870 1.00 0.00 H new ATOM 0 HB3 SER A 927 -4.820 22.643 17.519 1.00 0.00 H new ATOM 0 HG SER A 927 -3.458 21.579 15.693 1.00 0.00 H new ATOM 660 N TYR A 928 -8.249 20.668 15.899 1.00 0.00 N ATOM 661 CA TYR A 928 -9.060 20.067 14.856 1.00 0.00 C ATOM 662 C TYR A 928 -9.169 21.021 13.675 1.00 0.00 C ATOM 663 O TYR A 928 -9.445 22.205 13.844 1.00 0.00 O ATOM 664 CB TYR A 928 -10.446 19.740 15.420 1.00 0.00 C ATOM 665 CG TYR A 928 -11.396 19.071 14.451 1.00 0.00 C ATOM 666 CD1 TYR A 928 -11.346 17.702 14.233 1.00 0.00 C ATOM 667 CD2 TYR A 928 -12.362 19.807 13.774 1.00 0.00 C ATOM 668 CE1 TYR A 928 -12.225 17.085 13.365 1.00 0.00 C ATOM 669 CE2 TYR A 928 -13.243 19.198 12.901 1.00 0.00 C ATOM 670 CZ TYR A 928 -13.172 17.837 12.702 1.00 0.00 C ATOM 671 OH TYR A 928 -14.054 17.224 11.840 1.00 0.00 O ATOM 0 H TYR A 928 -8.759 21.310 16.505 1.00 0.00 H new ATOM 0 HA TYR A 928 -8.594 19.145 14.509 1.00 0.00 H new ATOM 0 HB2 TYR A 928 -10.323 19.093 16.289 1.00 0.00 H new ATOM 0 HB3 TYR A 928 -10.904 20.664 15.773 1.00 0.00 H new ATOM 0 HD1 TYR A 928 -10.607 17.109 14.751 1.00 0.00 H new ATOM 0 HD2 TYR A 928 -12.425 20.873 13.933 1.00 0.00 H new ATOM 0 HE1 TYR A 928 -12.171 16.018 13.206 1.00 0.00 H new ATOM 0 HE2 TYR A 928 -13.983 19.786 12.378 1.00 0.00 H new ATOM 0 HH TYR A 928 -14.656 17.895 11.456 1.00 0.00 H new ATOM 681 N THR A 929 -8.923 20.515 12.488 1.00 0.00 N ATOM 682 CA THR A 929 -9.005 21.318 11.290 1.00 0.00 C ATOM 683 C THR A 929 -10.190 20.868 10.443 1.00 0.00 C ATOM 684 O THR A 929 -10.319 19.680 10.109 1.00 0.00 O ATOM 685 CB THR A 929 -7.703 21.224 10.477 1.00 0.00 C ATOM 686 OG1 THR A 929 -6.573 21.359 11.357 1.00 0.00 O ATOM 687 CG2 THR A 929 -7.650 22.311 9.413 1.00 0.00 C ATOM 0 H THR A 929 -8.662 19.542 12.326 1.00 0.00 H new ATOM 0 HA THR A 929 -9.149 22.359 11.581 1.00 0.00 H new ATOM 0 HB THR A 929 -7.674 20.252 9.984 1.00 0.00 H new ATOM 0 HG1 THR A 929 -5.744 21.297 10.837 1.00 0.00 H new ATOM 0 HG21 THR A 929 -6.720 22.225 8.851 1.00 0.00 H new ATOM 0 HG22 THR A 929 -8.496 22.198 8.735 1.00 0.00 H new ATOM 0 HG23 THR A 929 -7.696 23.290 9.890 1.00 0.00 H new ATOM 695 N SER A 930 -11.069 21.815 10.136 1.00 0.00 N ATOM 696 CA SER A 930 -12.262 21.539 9.363 1.00 0.00 C ATOM 697 C SER A 930 -12.222 22.287 8.031 1.00 0.00 C ATOM 698 O SER A 930 -12.012 23.516 7.993 1.00 0.00 O ATOM 699 CB SER A 930 -13.507 21.941 10.163 1.00 0.00 C ATOM 700 OG SER A 930 -14.696 21.693 9.431 1.00 0.00 O ATOM 0 H SER A 930 -10.970 22.790 10.417 1.00 0.00 H new ATOM 0 HA SER A 930 -12.305 20.470 9.154 1.00 0.00 H new ATOM 0 HB2 SER A 930 -13.533 21.386 11.101 1.00 0.00 H new ATOM 0 HB3 SER A 930 -13.450 22.999 10.420 1.00 0.00 H new ATOM 0 HG SER A 930 -15.472 21.958 9.968 1.00 0.00 H new ATOM 706 N PRO A 931 -12.423 21.539 6.924 1.00 0.00 N ATOM 707 CA PRO A 931 -12.446 22.078 5.553 1.00 0.00 C ATOM 708 C PRO A 931 -13.547 23.113 5.346 1.00 0.00 C ATOM 709 O PRO A 931 -13.616 23.757 4.297 1.00 0.00 O ATOM 710 CB PRO A 931 -12.704 20.847 4.677 1.00 0.00 C ATOM 711 CG PRO A 931 -12.306 19.688 5.519 1.00 0.00 C ATOM 712 CD PRO A 931 -12.628 20.082 6.930 1.00 0.00 C ATOM 0 HA PRO A 931 -11.518 22.598 5.316 1.00 0.00 H new ATOM 0 HB2 PRO A 931 -13.752 20.782 4.386 1.00 0.00 H new ATOM 0 HB3 PRO A 931 -12.120 20.887 3.758 1.00 0.00 H new ATOM 0 HG2 PRO A 931 -12.850 18.789 5.230 1.00 0.00 H new ATOM 0 HG3 PRO A 931 -11.244 19.468 5.406 1.00 0.00 H new ATOM 0 HD2 PRO A 931 -13.651 19.820 7.198 1.00 0.00 H new ATOM 0 HD3 PRO A 931 -11.974 19.586 7.647 1.00 0.00 H new ATOM 720 N ASN A 932 -14.410 23.261 6.352 1.00 0.00 N ATOM 721 CA ASN A 932 -15.376 24.356 6.394 1.00 0.00 C ATOM 722 C ASN A 932 -14.646 25.687 6.250 1.00 0.00 C ATOM 723 O ASN A 932 -15.185 26.664 5.724 1.00 0.00 O ATOM 724 CB ASN A 932 -16.149 24.313 7.721 1.00 0.00 C ATOM 725 CG ASN A 932 -16.907 25.595 8.022 1.00 0.00 C ATOM 726 OD1 ASN A 932 -16.389 26.493 8.687 1.00 0.00 O ATOM 727 ND2 ASN A 932 -18.135 25.689 7.541 1.00 0.00 N ATOM 0 H ASN A 932 -14.458 22.631 7.153 1.00 0.00 H new ATOM 0 HA ASN A 932 -16.083 24.250 5.571 1.00 0.00 H new ATOM 0 HB2 ASN A 932 -16.853 23.481 7.696 1.00 0.00 H new ATOM 0 HB3 ASN A 932 -15.450 24.114 8.533 1.00 0.00 H new ATOM 0 HD21 ASN A 932 -18.689 26.528 7.716 1.00 0.00 H new ATOM 0 HD22 ASN A 932 -18.529 24.923 6.994 1.00 0.00 H new ATOM 734 N GLY A 933 -13.401 25.696 6.700 1.00 0.00 N ATOM 735 CA GLY A 933 -12.588 26.881 6.633 1.00 0.00 C ATOM 736 C GLY A 933 -12.206 27.361 8.007 1.00 0.00 C ATOM 737 O GLY A 933 -12.122 28.566 8.245 1.00 0.00 O ATOM 0 H GLY A 933 -12.938 24.888 7.116 1.00 0.00 H new ATOM 0 HA2 GLY A 933 -11.688 26.675 6.054 1.00 0.00 H new ATOM 0 HA3 GLY A 933 -13.131 27.668 6.109 1.00 0.00 H new ATOM 741 N GLN A 934 -11.976 26.425 8.926 1.00 0.00 N ATOM 742 CA GLN A 934 -11.657 26.807 10.292 1.00 0.00 C ATOM 743 C GLN A 934 -10.963 25.682 11.045 1.00 0.00 C ATOM 744 O GLN A 934 -11.295 24.506 10.884 1.00 0.00 O ATOM 745 CB GLN A 934 -12.925 27.229 11.047 1.00 0.00 C ATOM 746 CG GLN A 934 -13.942 26.111 11.231 1.00 0.00 C ATOM 747 CD GLN A 934 -15.128 26.533 12.077 1.00 0.00 C ATOM 748 OE1 GLN A 934 -15.098 26.422 13.303 1.00 0.00 O ATOM 749 NE2 GLN A 934 -16.183 27.006 11.432 1.00 0.00 N ATOM 0 H GLN A 934 -12.004 25.420 8.752 1.00 0.00 H new ATOM 0 HA GLN A 934 -10.972 27.653 10.237 1.00 0.00 H new ATOM 0 HB2 GLN A 934 -12.641 27.611 12.027 1.00 0.00 H new ATOM 0 HB3 GLN A 934 -13.398 28.051 10.509 1.00 0.00 H new ATOM 0 HG2 GLN A 934 -14.296 25.783 10.254 1.00 0.00 H new ATOM 0 HG3 GLN A 934 -13.454 25.255 11.697 1.00 0.00 H new ATOM 0 HE21 GLN A 934 -16.167 27.082 10.415 1.00 0.00 H new ATOM 0 HE22 GLN A 934 -17.012 27.295 11.952 1.00 0.00 H new ATOM 758 N THR A 935 -9.974 26.052 11.837 1.00 0.00 N ATOM 759 CA THR A 935 -9.373 25.135 12.779 1.00 0.00 C ATOM 760 C THR A 935 -9.866 25.464 14.188 1.00 0.00 C ATOM 761 O THR A 935 -9.811 26.612 14.630 1.00 0.00 O ATOM 762 CB THR A 935 -7.826 25.175 12.717 1.00 0.00 C ATOM 763 OG1 THR A 935 -7.262 24.278 13.685 1.00 0.00 O ATOM 764 CG2 THR A 935 -7.293 26.583 12.947 1.00 0.00 C ATOM 0 H THR A 935 -9.570 26.988 11.844 1.00 0.00 H new ATOM 0 HA THR A 935 -9.675 24.122 12.513 1.00 0.00 H new ATOM 0 HB THR A 935 -7.530 24.859 11.717 1.00 0.00 H new ATOM 0 HG1 THR A 935 -7.881 23.535 13.842 1.00 0.00 H new ATOM 0 HG21 THR A 935 -6.204 26.573 12.896 1.00 0.00 H new ATOM 0 HG22 THR A 935 -7.686 27.250 12.180 1.00 0.00 H new ATOM 0 HG23 THR A 935 -7.607 26.935 13.930 1.00 0.00 H new ATOM 772 N THR A 936 -10.379 24.460 14.871 1.00 0.00 N ATOM 773 CA THR A 936 -10.912 24.636 16.205 1.00 0.00 C ATOM 774 C THR A 936 -10.110 23.792 17.193 1.00 0.00 C ATOM 775 O THR A 936 -9.738 22.658 16.891 1.00 0.00 O ATOM 776 CB THR A 936 -12.414 24.261 16.247 1.00 0.00 C ATOM 777 OG1 THR A 936 -12.985 24.591 17.515 1.00 0.00 O ATOM 778 CG2 THR A 936 -12.633 22.782 15.959 1.00 0.00 C ATOM 0 H THR A 936 -10.438 23.505 14.518 1.00 0.00 H new ATOM 0 HA THR A 936 -10.825 25.685 16.488 1.00 0.00 H new ATOM 0 HB THR A 936 -12.909 24.840 15.468 1.00 0.00 H new ATOM 0 HG1 THR A 936 -13.934 24.348 17.520 1.00 0.00 H new ATOM 0 HG21 THR A 936 -13.699 22.558 15.997 1.00 0.00 H new ATOM 0 HG22 THR A 936 -12.248 22.543 14.968 1.00 0.00 H new ATOM 0 HG23 THR A 936 -12.109 22.185 16.705 1.00 0.00 H new ATOM 786 N ARG A 937 -9.818 24.341 18.358 1.00 0.00 N ATOM 787 CA ARG A 937 -9.035 23.613 19.342 1.00 0.00 C ATOM 788 C ARG A 937 -9.944 22.974 20.380 1.00 0.00 C ATOM 789 O ARG A 937 -10.833 23.622 20.933 1.00 0.00 O ATOM 790 CB ARG A 937 -8.013 24.527 20.027 1.00 0.00 C ATOM 791 CG ARG A 937 -8.637 25.691 20.775 1.00 0.00 C ATOM 792 CD ARG A 937 -7.613 26.430 21.617 1.00 0.00 C ATOM 793 NE ARG A 937 -7.003 25.565 22.629 1.00 0.00 N ATOM 794 CZ ARG A 937 -7.465 25.429 23.874 1.00 0.00 C ATOM 795 NH1 ARG A 937 -8.606 26.006 24.230 1.00 0.00 N ATOM 796 NH2 ARG A 937 -6.800 24.688 24.751 1.00 0.00 N ATOM 0 H ARG A 937 -10.106 25.276 18.645 1.00 0.00 H new ATOM 0 HA ARG A 937 -8.490 22.828 18.818 1.00 0.00 H new ATOM 0 HB2 ARG A 937 -7.420 23.935 20.724 1.00 0.00 H new ATOM 0 HB3 ARG A 937 -7.326 24.916 19.275 1.00 0.00 H new ATOM 0 HG2 ARG A 937 -9.089 26.381 20.063 1.00 0.00 H new ATOM 0 HG3 ARG A 937 -9.439 25.324 21.416 1.00 0.00 H new ATOM 0 HD2 ARG A 937 -6.835 26.833 20.969 1.00 0.00 H new ATOM 0 HD3 ARG A 937 -8.091 27.278 22.107 1.00 0.00 H new ATOM 0 HE ARG A 937 -6.173 25.033 22.366 1.00 0.00 H new ATOM 0 HH11 ARG A 937 -9.133 26.556 23.551 1.00 0.00 H new ATOM 0 HH12 ARG A 937 -8.956 25.900 25.182 1.00 0.00 H new ATOM 0 HH21 ARG A 937 -5.936 24.222 24.474 1.00 0.00 H new ATOM 0 HH22 ARG A 937 -7.153 24.584 25.702 1.00 0.00 H new ATOM 810 N TYR A 938 -9.732 21.696 20.626 1.00 0.00 N ATOM 811 CA TYR A 938 -10.476 20.990 21.650 1.00 0.00 C ATOM 812 C TYR A 938 -9.570 20.723 22.838 1.00 0.00 C ATOM 813 O TYR A 938 -8.481 20.169 22.683 1.00 0.00 O ATOM 814 CB TYR A 938 -11.041 19.672 21.115 1.00 0.00 C ATOM 815 CG TYR A 938 -12.220 19.836 20.179 1.00 0.00 C ATOM 816 CD1 TYR A 938 -13.471 20.188 20.668 1.00 0.00 C ATOM 817 CD2 TYR A 938 -12.087 19.622 18.813 1.00 0.00 C ATOM 818 CE1 TYR A 938 -14.556 20.325 19.823 1.00 0.00 C ATOM 819 CE2 TYR A 938 -13.167 19.759 17.961 1.00 0.00 C ATOM 820 CZ TYR A 938 -14.398 20.110 18.470 1.00 0.00 C ATOM 821 OH TYR A 938 -15.475 20.243 17.625 1.00 0.00 O ATOM 0 H TYR A 938 -9.049 21.124 20.129 1.00 0.00 H new ATOM 0 HA TYR A 938 -11.315 21.613 21.960 1.00 0.00 H new ATOM 0 HB2 TYR A 938 -10.249 19.136 20.593 1.00 0.00 H new ATOM 0 HB3 TYR A 938 -11.344 19.051 21.958 1.00 0.00 H new ATOM 0 HD1 TYR A 938 -13.598 20.358 21.727 1.00 0.00 H new ATOM 0 HD2 TYR A 938 -11.124 19.344 18.410 1.00 0.00 H new ATOM 0 HE1 TYR A 938 -15.522 20.599 20.220 1.00 0.00 H new ATOM 0 HE2 TYR A 938 -13.046 19.592 16.901 1.00 0.00 H new ATOM 0 HH TYR A 938 -15.193 20.058 16.705 1.00 0.00 H new ATOM 831 N GLY A 939 -10.015 21.112 24.016 1.00 0.00 N ATOM 832 CA GLY A 939 -9.191 20.961 25.189 1.00 0.00 C ATOM 833 C GLY A 939 -9.910 20.246 26.307 1.00 0.00 C ATOM 834 O GLY A 939 -11.028 19.764 26.129 1.00 0.00 O ATOM 0 H GLY A 939 -10.931 21.529 24.182 1.00 0.00 H new ATOM 0 HA2 GLY A 939 -8.289 20.407 24.928 1.00 0.00 H new ATOM 0 HA3 GLY A 939 -8.872 21.944 25.535 1.00 0.00 H new ATOM 838 N GLU A 940 -9.269 20.203 27.462 1.00 0.00 N ATOM 839 CA GLU A 940 -9.806 19.525 28.637 1.00 0.00 C ATOM 840 C GLU A 940 -11.123 20.158 29.091 1.00 0.00 C ATOM 841 O GLU A 940 -11.965 19.502 29.706 1.00 0.00 O ATOM 842 CB GLU A 940 -8.773 19.592 29.764 1.00 0.00 C ATOM 843 CG GLU A 940 -9.167 18.833 31.019 1.00 0.00 C ATOM 844 CD GLU A 940 -9.333 17.349 30.771 1.00 0.00 C ATOM 845 OE1 GLU A 940 -8.311 16.661 30.569 1.00 0.00 O ATOM 846 OE2 GLU A 940 -10.483 16.865 30.792 1.00 0.00 O ATOM 0 H GLU A 940 -8.359 20.637 27.615 1.00 0.00 H new ATOM 0 HA GLU A 940 -10.012 18.486 28.380 1.00 0.00 H new ATOM 0 HB2 GLU A 940 -7.826 19.197 29.397 1.00 0.00 H new ATOM 0 HB3 GLU A 940 -8.603 20.637 30.024 1.00 0.00 H new ATOM 0 HG2 GLU A 940 -8.408 18.987 31.786 1.00 0.00 H new ATOM 0 HG3 GLU A 940 -10.101 19.240 31.408 1.00 0.00 H new ATOM 853 N ASN A 941 -11.305 21.430 28.770 1.00 0.00 N ATOM 854 CA ASN A 941 -12.484 22.165 29.209 1.00 0.00 C ATOM 855 C ASN A 941 -13.575 22.127 28.135 1.00 0.00 C ATOM 856 O ASN A 941 -14.661 22.678 28.309 1.00 0.00 O ATOM 857 CB ASN A 941 -12.085 23.614 29.533 1.00 0.00 C ATOM 858 CG ASN A 941 -13.204 24.433 30.149 1.00 0.00 C ATOM 859 OD1 ASN A 941 -13.419 24.396 31.361 1.00 0.00 O ATOM 860 ND2 ASN A 941 -13.910 25.194 29.323 1.00 0.00 N ATOM 0 H ASN A 941 -10.652 21.976 28.207 1.00 0.00 H new ATOM 0 HA ASN A 941 -12.888 21.697 30.107 1.00 0.00 H new ATOM 0 HB2 ASN A 941 -11.236 23.603 30.217 1.00 0.00 H new ATOM 0 HB3 ASN A 941 -11.751 24.103 28.618 1.00 0.00 H new ATOM 0 HD21 ASN A 941 -14.664 25.778 29.686 1.00 0.00 H new ATOM 0 HD22 ASN A 941 -13.699 25.195 28.325 1.00 0.00 H new ATOM 867 N GLU A 942 -13.305 21.436 27.036 1.00 0.00 N ATOM 868 CA GLU A 942 -14.234 21.420 25.918 1.00 0.00 C ATOM 869 C GLU A 942 -14.878 20.044 25.762 1.00 0.00 C ATOM 870 O GLU A 942 -14.375 19.047 26.287 1.00 0.00 O ATOM 871 CB GLU A 942 -13.515 21.834 24.629 1.00 0.00 C ATOM 872 CG GLU A 942 -14.460 22.204 23.498 1.00 0.00 C ATOM 873 CD GLU A 942 -15.504 23.215 23.930 1.00 0.00 C ATOM 874 OE1 GLU A 942 -15.231 24.431 23.854 1.00 0.00 O ATOM 875 OE2 GLU A 942 -16.597 22.794 24.367 1.00 0.00 O ATOM 0 H GLU A 942 -12.458 20.885 26.896 1.00 0.00 H new ATOM 0 HA GLU A 942 -15.029 22.138 26.119 1.00 0.00 H new ATOM 0 HB2 GLU A 942 -12.866 22.683 24.842 1.00 0.00 H new ATOM 0 HB3 GLU A 942 -12.873 21.016 24.302 1.00 0.00 H new ATOM 0 HG2 GLU A 942 -13.886 22.611 22.666 1.00 0.00 H new ATOM 0 HG3 GLU A 942 -14.957 21.305 23.133 1.00 0.00 H new ATOM 882 N LYS A 943 -16.001 20.007 25.055 1.00 0.00 N ATOM 883 CA LYS A 943 -16.732 18.770 24.817 1.00 0.00 C ATOM 884 C LYS A 943 -16.164 18.041 23.603 1.00 0.00 C ATOM 885 O LYS A 943 -16.112 18.592 22.503 1.00 0.00 O ATOM 886 CB LYS A 943 -18.218 19.078 24.596 1.00 0.00 C ATOM 887 CG LYS A 943 -19.088 17.848 24.373 1.00 0.00 C ATOM 888 CD LYS A 943 -19.143 16.958 25.605 1.00 0.00 C ATOM 889 CE LYS A 943 -19.704 17.702 26.806 1.00 0.00 C ATOM 890 NZ LYS A 943 -19.867 16.814 27.984 1.00 0.00 N ATOM 0 H LYS A 943 -16.429 20.831 24.632 1.00 0.00 H new ATOM 0 HA LYS A 943 -16.625 18.126 25.690 1.00 0.00 H new ATOM 0 HB2 LYS A 943 -18.596 19.624 25.460 1.00 0.00 H new ATOM 0 HB3 LYS A 943 -18.316 19.738 23.734 1.00 0.00 H new ATOM 0 HG2 LYS A 943 -20.097 18.161 24.107 1.00 0.00 H new ATOM 0 HG3 LYS A 943 -18.699 17.277 23.530 1.00 0.00 H new ATOM 0 HD2 LYS A 943 -19.760 16.084 25.396 1.00 0.00 H new ATOM 0 HD3 LYS A 943 -18.142 16.593 25.837 1.00 0.00 H new ATOM 0 HE2 LYS A 943 -19.040 18.527 27.063 1.00 0.00 H new ATOM 0 HE3 LYS A 943 -20.668 18.138 26.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 943 -20.252 17.361 28.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 943 -20.520 16.040 27.748 1.00 0.00 H new ATOM 0 HZ3 LYS A 943 -18.943 16.418 28.251 1.00 0.00 H new ATOM 904 N LEU A 944 -15.745 16.804 23.809 1.00 0.00 N ATOM 905 CA LEU A 944 -15.175 15.999 22.739 1.00 0.00 C ATOM 906 C LEU A 944 -16.219 15.066 22.133 1.00 0.00 C ATOM 907 O LEU A 944 -16.981 14.421 22.854 1.00 0.00 O ATOM 908 CB LEU A 944 -13.984 15.194 23.267 1.00 0.00 C ATOM 909 CG LEU A 944 -12.734 16.020 23.575 1.00 0.00 C ATOM 910 CD1 LEU A 944 -11.686 15.169 24.272 1.00 0.00 C ATOM 911 CD2 LEU A 944 -12.173 16.605 22.294 1.00 0.00 C ATOM 0 H LEU A 944 -15.789 16.332 24.712 1.00 0.00 H new ATOM 0 HA LEU A 944 -14.832 16.671 21.953 1.00 0.00 H new ATOM 0 HB2 LEU A 944 -14.290 14.673 24.174 1.00 0.00 H new ATOM 0 HB3 LEU A 944 -13.726 14.431 22.533 1.00 0.00 H new ATOM 0 HG LEU A 944 -13.011 16.834 24.245 1.00 0.00 H new ATOM 0 HD11 LEU A 944 -10.805 15.776 24.482 1.00 0.00 H new ATOM 0 HD12 LEU A 944 -12.093 14.784 25.207 1.00 0.00 H new ATOM 0 HD13 LEU A 944 -11.407 14.335 23.628 1.00 0.00 H new ATOM 0 HD21 LEU A 944 -11.283 17.192 22.521 1.00 0.00 H new ATOM 0 HD22 LEU A 944 -11.911 15.798 21.610 1.00 0.00 H new ATOM 0 HD23 LEU A 944 -12.921 17.246 21.829 1.00 0.00 H new ATOM 923 N PRO A 945 -16.285 15.013 20.794 1.00 0.00 N ATOM 924 CA PRO A 945 -17.165 14.087 20.071 1.00 0.00 C ATOM 925 C PRO A 945 -16.691 12.634 20.168 1.00 0.00 C ATOM 926 O PRO A 945 -15.571 12.362 20.615 1.00 0.00 O ATOM 927 CB PRO A 945 -17.094 14.575 18.615 1.00 0.00 C ATOM 928 CG PRO A 945 -16.444 15.917 18.674 1.00 0.00 C ATOM 929 CD PRO A 945 -15.549 15.886 19.877 1.00 0.00 C ATOM 0 HA PRO A 945 -18.174 14.088 20.484 1.00 0.00 H new ATOM 0 HB2 PRO A 945 -16.517 13.886 17.998 1.00 0.00 H new ATOM 0 HB3 PRO A 945 -18.089 14.640 18.174 1.00 0.00 H new ATOM 0 HG2 PRO A 945 -15.873 16.115 17.767 1.00 0.00 H new ATOM 0 HG3 PRO A 945 -17.188 16.708 18.761 1.00 0.00 H new ATOM 0 HD2 PRO A 945 -14.563 15.487 19.640 1.00 0.00 H new ATOM 0 HD3 PRO A 945 -15.398 16.881 20.297 1.00 0.00 H new ATOM 937 N ASP A 946 -17.544 11.713 19.721 1.00 0.00 N ATOM 938 CA ASP A 946 -17.266 10.275 19.801 1.00 0.00 C ATOM 939 C ASP A 946 -15.972 9.905 19.090 1.00 0.00 C ATOM 940 O ASP A 946 -15.066 9.332 19.697 1.00 0.00 O ATOM 941 CB ASP A 946 -18.416 9.461 19.195 1.00 0.00 C ATOM 942 CG ASP A 946 -19.672 9.488 20.041 1.00 0.00 C ATOM 943 OD1 ASP A 946 -19.780 8.669 20.981 1.00 0.00 O ATOM 944 OD2 ASP A 946 -20.560 10.325 19.768 1.00 0.00 O ATOM 0 H ASP A 946 -18.443 11.938 19.295 1.00 0.00 H new ATOM 0 HA ASP A 946 -17.163 10.037 20.860 1.00 0.00 H new ATOM 0 HB2 ASP A 946 -18.645 9.849 18.203 1.00 0.00 H new ATOM 0 HB3 ASP A 946 -18.094 8.428 19.066 1.00 0.00 H new ATOM 949 N TYR A 947 -15.885 10.241 17.805 1.00 0.00 N ATOM 950 CA TYR A 947 -14.725 9.864 16.999 1.00 0.00 C ATOM 951 C TYR A 947 -13.448 10.492 17.536 1.00 0.00 C ATOM 952 O TYR A 947 -12.376 9.895 17.458 1.00 0.00 O ATOM 953 CB TYR A 947 -14.918 10.291 15.542 1.00 0.00 C ATOM 954 CG TYR A 947 -15.932 9.467 14.778 1.00 0.00 C ATOM 955 CD1 TYR A 947 -17.291 9.741 14.864 1.00 0.00 C ATOM 956 CD2 TYR A 947 -15.524 8.420 13.964 1.00 0.00 C ATOM 957 CE1 TYR A 947 -18.214 8.995 14.157 1.00 0.00 C ATOM 958 CE2 TYR A 947 -16.440 7.669 13.255 1.00 0.00 C ATOM 959 CZ TYR A 947 -17.783 7.959 13.355 1.00 0.00 C ATOM 960 OH TYR A 947 -18.703 7.215 12.647 1.00 0.00 O ATOM 0 H TYR A 947 -16.598 10.770 17.302 1.00 0.00 H new ATOM 0 HA TYR A 947 -14.634 8.779 17.053 1.00 0.00 H new ATOM 0 HB2 TYR A 947 -15.227 11.336 15.520 1.00 0.00 H new ATOM 0 HB3 TYR A 947 -13.958 10.231 15.028 1.00 0.00 H new ATOM 0 HD1 TYR A 947 -17.631 10.550 15.493 1.00 0.00 H new ATOM 0 HD2 TYR A 947 -14.472 8.189 13.884 1.00 0.00 H new ATOM 0 HE1 TYR A 947 -19.267 9.222 14.232 1.00 0.00 H new ATOM 0 HE2 TYR A 947 -16.105 6.858 12.625 1.00 0.00 H new ATOM 0 HH TYR A 947 -18.237 6.525 12.130 1.00 0.00 H new ATOM 970 N ILE A 948 -13.569 11.680 18.104 1.00 0.00 N ATOM 971 CA ILE A 948 -12.409 12.380 18.631 1.00 0.00 C ATOM 972 C ILE A 948 -11.873 11.684 19.878 1.00 0.00 C ATOM 973 O ILE A 948 -10.669 11.485 20.015 1.00 0.00 O ATOM 974 CB ILE A 948 -12.734 13.856 18.939 1.00 0.00 C ATOM 975 CG1 ILE A 948 -13.172 14.578 17.656 1.00 0.00 C ATOM 976 CG2 ILE A 948 -11.533 14.556 19.559 1.00 0.00 C ATOM 977 CD1 ILE A 948 -12.124 14.572 16.559 1.00 0.00 C ATOM 0 H ILE A 948 -14.453 12.178 18.212 1.00 0.00 H new ATOM 0 HA ILE A 948 -11.637 12.358 17.862 1.00 0.00 H new ATOM 0 HB ILE A 948 -13.553 13.887 19.658 1.00 0.00 H new ATOM 0 HG12 ILE A 948 -14.081 14.109 17.279 1.00 0.00 H new ATOM 0 HG13 ILE A 948 -13.423 15.610 17.899 1.00 0.00 H new ATOM 0 HG21 ILE A 948 -11.786 15.596 19.768 1.00 0.00 H new ATOM 0 HG22 ILE A 948 -11.260 14.055 20.488 1.00 0.00 H new ATOM 0 HG23 ILE A 948 -10.692 14.519 18.866 1.00 0.00 H new ATOM 0 HD11 ILE A 948 -12.508 15.101 15.686 1.00 0.00 H new ATOM 0 HD12 ILE A 948 -11.221 15.068 16.916 1.00 0.00 H new ATOM 0 HD13 ILE A 948 -11.889 13.543 16.286 1.00 0.00 H new ATOM 989 N LYS A 949 -12.774 11.279 20.766 1.00 0.00 N ATOM 990 CA LYS A 949 -12.373 10.556 21.966 1.00 0.00 C ATOM 991 C LYS A 949 -11.740 9.226 21.599 1.00 0.00 C ATOM 992 O LYS A 949 -10.697 8.851 22.135 1.00 0.00 O ATOM 993 CB LYS A 949 -13.572 10.312 22.885 1.00 0.00 C ATOM 994 CG LYS A 949 -13.915 11.480 23.793 1.00 0.00 C ATOM 995 CD LYS A 949 -12.769 11.811 24.741 1.00 0.00 C ATOM 996 CE LYS A 949 -12.380 10.621 25.613 1.00 0.00 C ATOM 997 NZ LYS A 949 -13.468 10.221 26.545 1.00 0.00 N ATOM 0 H LYS A 949 -13.778 11.437 20.679 1.00 0.00 H new ATOM 0 HA LYS A 949 -11.643 11.169 22.494 1.00 0.00 H new ATOM 0 HB2 LYS A 949 -14.442 10.077 22.272 1.00 0.00 H new ATOM 0 HB3 LYS A 949 -13.370 9.436 23.501 1.00 0.00 H new ATOM 0 HG2 LYS A 949 -14.151 12.355 23.187 1.00 0.00 H new ATOM 0 HG3 LYS A 949 -14.808 11.242 24.371 1.00 0.00 H new ATOM 0 HD2 LYS A 949 -11.903 12.134 24.163 1.00 0.00 H new ATOM 0 HD3 LYS A 949 -13.057 12.647 25.378 1.00 0.00 H new ATOM 0 HE2 LYS A 949 -12.123 9.775 24.975 1.00 0.00 H new ATOM 0 HE3 LYS A 949 -11.487 10.871 26.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 949 -13.144 9.431 27.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 949 -13.721 11.028 27.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 949 -14.301 9.924 25.999 1.00 0.00 H new ATOM 1011 N GLN A 950 -12.375 8.525 20.671 1.00 0.00 N ATOM 1012 CA GLN A 950 -11.901 7.220 20.241 1.00 0.00 C ATOM 1013 C GLN A 950 -10.505 7.313 19.628 1.00 0.00 C ATOM 1014 O GLN A 950 -9.627 6.501 19.930 1.00 0.00 O ATOM 1015 CB GLN A 950 -12.880 6.614 19.234 1.00 0.00 C ATOM 1016 CG GLN A 950 -12.521 5.199 18.809 1.00 0.00 C ATOM 1017 CD GLN A 950 -12.502 4.228 19.972 1.00 0.00 C ATOM 1018 OE1 GLN A 950 -13.518 3.617 20.300 1.00 0.00 O ATOM 1019 NE2 GLN A 950 -11.347 4.082 20.606 1.00 0.00 N ATOM 0 H GLN A 950 -13.223 8.841 20.200 1.00 0.00 H new ATOM 0 HA GLN A 950 -11.841 6.575 21.117 1.00 0.00 H new ATOM 0 HB2 GLN A 950 -13.879 6.611 19.669 1.00 0.00 H new ATOM 0 HB3 GLN A 950 -12.919 7.251 18.350 1.00 0.00 H new ATOM 0 HG2 GLN A 950 -13.239 4.854 18.064 1.00 0.00 H new ATOM 0 HG3 GLN A 950 -11.542 5.205 18.330 1.00 0.00 H new ATOM 0 HE21 GLN A 950 -10.528 4.608 20.301 1.00 0.00 H new ATOM 0 HE22 GLN A 950 -11.277 3.444 21.398 1.00 0.00 H new ATOM 1028 N LYS A 951 -10.303 8.309 18.775 1.00 0.00 N ATOM 1029 CA LYS A 951 -9.022 8.494 18.103 1.00 0.00 C ATOM 1030 C LYS A 951 -7.929 8.926 19.077 1.00 0.00 C ATOM 1031 O LYS A 951 -6.798 8.452 18.994 1.00 0.00 O ATOM 1032 CB LYS A 951 -9.155 9.474 16.934 1.00 0.00 C ATOM 1033 CG LYS A 951 -9.505 8.788 15.614 1.00 0.00 C ATOM 1034 CD LYS A 951 -10.622 7.768 15.787 1.00 0.00 C ATOM 1035 CE LYS A 951 -10.929 7.030 14.496 1.00 0.00 C ATOM 1036 NZ LYS A 951 -11.887 5.914 14.713 1.00 0.00 N ATOM 0 H LYS A 951 -11.010 9.002 18.531 1.00 0.00 H new ATOM 0 HA LYS A 951 -8.720 7.529 17.696 1.00 0.00 H new ATOM 0 HB2 LYS A 951 -9.924 10.209 17.170 1.00 0.00 H new ATOM 0 HB3 LYS A 951 -8.218 10.019 16.816 1.00 0.00 H new ATOM 0 HG2 LYS A 951 -9.807 9.538 14.883 1.00 0.00 H new ATOM 0 HG3 LYS A 951 -8.619 8.293 15.215 1.00 0.00 H new ATOM 0 HD2 LYS A 951 -10.340 7.049 16.556 1.00 0.00 H new ATOM 0 HD3 LYS A 951 -11.522 8.273 16.138 1.00 0.00 H new ATOM 0 HE2 LYS A 951 -11.343 7.728 13.768 1.00 0.00 H new ATOM 0 HE3 LYS A 951 -10.004 6.638 14.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 951 -12.072 5.434 13.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 951 -11.482 5.235 15.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 951 -12.779 6.291 15.093 1.00 0.00 H new ATOM 1050 N LEU A 952 -8.262 9.805 20.010 1.00 0.00 N ATOM 1051 CA LEU A 952 -7.305 10.204 21.036 1.00 0.00 C ATOM 1052 C LEU A 952 -6.922 9.005 21.896 1.00 0.00 C ATOM 1053 O LEU A 952 -5.767 8.856 22.296 1.00 0.00 O ATOM 1054 CB LEU A 952 -7.878 11.320 21.914 1.00 0.00 C ATOM 1055 CG LEU A 952 -7.494 12.743 21.500 1.00 0.00 C ATOM 1056 CD1 LEU A 952 -7.924 13.031 20.071 1.00 0.00 C ATOM 1057 CD2 LEU A 952 -8.108 13.752 22.459 1.00 0.00 C ATOM 0 H LEU A 952 -9.176 10.252 20.080 1.00 0.00 H new ATOM 0 HA LEU A 952 -6.412 10.583 20.539 1.00 0.00 H new ATOM 0 HB2 LEU A 952 -8.965 11.240 21.911 1.00 0.00 H new ATOM 0 HB3 LEU A 952 -7.549 11.157 22.940 1.00 0.00 H new ATOM 0 HG LEU A 952 -6.409 12.832 21.546 1.00 0.00 H new ATOM 0 HD11 LEU A 952 -7.639 14.048 19.803 1.00 0.00 H new ATOM 0 HD12 LEU A 952 -7.437 12.328 19.396 1.00 0.00 H new ATOM 0 HD13 LEU A 952 -9.005 12.924 19.988 1.00 0.00 H new ATOM 0 HD21 LEU A 952 -7.828 14.760 22.154 1.00 0.00 H new ATOM 0 HD22 LEU A 952 -9.194 13.656 22.442 1.00 0.00 H new ATOM 0 HD23 LEU A 952 -7.743 13.563 23.469 1.00 0.00 H new ATOM 1069 N GLN A 953 -7.894 8.139 22.151 1.00 0.00 N ATOM 1070 CA GLN A 953 -7.676 6.966 22.985 1.00 0.00 C ATOM 1071 C GLN A 953 -6.796 5.933 22.281 1.00 0.00 C ATOM 1072 O GLN A 953 -5.996 5.253 22.928 1.00 0.00 O ATOM 1073 CB GLN A 953 -9.020 6.344 23.371 1.00 0.00 C ATOM 1074 CG GLN A 953 -8.912 5.204 24.370 1.00 0.00 C ATOM 1075 CD GLN A 953 -10.270 4.689 24.799 1.00 0.00 C ATOM 1076 OE1 GLN A 953 -11.247 5.437 24.835 1.00 0.00 O ATOM 1077 NE2 GLN A 953 -10.341 3.412 25.134 1.00 0.00 N ATOM 0 H GLN A 953 -8.844 8.228 21.790 1.00 0.00 H new ATOM 0 HA GLN A 953 -7.154 7.285 23.887 1.00 0.00 H new ATOM 0 HB2 GLN A 953 -9.661 7.120 23.790 1.00 0.00 H new ATOM 0 HB3 GLN A 953 -9.511 5.978 22.469 1.00 0.00 H new ATOM 0 HG2 GLN A 953 -8.339 4.389 23.928 1.00 0.00 H new ATOM 0 HG3 GLN A 953 -8.360 5.543 25.247 1.00 0.00 H new ATOM 0 HE21 GLN A 953 -9.507 2.826 25.090 1.00 0.00 H new ATOM 0 HE22 GLN A 953 -11.230 3.013 25.436 1.00 0.00 H new ATOM 1086 N CYS A 954 -6.929 5.805 20.961 1.00 0.00 N ATOM 1087 CA CYS A 954 -6.111 4.840 20.232 1.00 0.00 C ATOM 1088 C CYS A 954 -4.665 5.316 20.140 1.00 0.00 C ATOM 1089 O CYS A 954 -3.744 4.513 20.015 1.00 0.00 O ATOM 1090 CB CYS A 954 -6.681 4.536 18.840 1.00 0.00 C ATOM 1091 SG CYS A 954 -6.757 5.943 17.707 1.00 0.00 S ATOM 0 H CYS A 954 -7.579 6.343 20.387 1.00 0.00 H new ATOM 0 HA CYS A 954 -6.131 3.907 20.795 1.00 0.00 H new ATOM 0 HB2 CYS A 954 -6.075 3.754 18.381 1.00 0.00 H new ATOM 0 HB3 CYS A 954 -7.686 4.132 18.958 1.00 0.00 H new ATOM 0 HG CYS A 954 -6.477 7.036 18.353 1.00 0.00 H new ATOM 1097 N LEU A 955 -4.475 6.629 20.233 1.00 0.00 N ATOM 1098 CA LEU A 955 -3.143 7.224 20.181 1.00 0.00 C ATOM 1099 C LEU A 955 -2.357 6.930 21.454 1.00 0.00 C ATOM 1100 O LEU A 955 -1.142 7.108 21.497 1.00 0.00 O ATOM 1101 CB LEU A 955 -3.234 8.737 19.963 1.00 0.00 C ATOM 1102 CG LEU A 955 -3.876 9.165 18.644 1.00 0.00 C ATOM 1103 CD1 LEU A 955 -3.928 10.680 18.541 1.00 0.00 C ATOM 1104 CD2 LEU A 955 -3.114 8.581 17.467 1.00 0.00 C ATOM 0 H LEU A 955 -5.231 7.304 20.345 1.00 0.00 H new ATOM 0 HA LEU A 955 -2.615 6.776 19.339 1.00 0.00 H new ATOM 0 HB2 LEU A 955 -3.803 9.173 20.784 1.00 0.00 H new ATOM 0 HB3 LEU A 955 -2.229 9.157 20.013 1.00 0.00 H new ATOM 0 HG LEU A 955 -4.896 8.783 18.620 1.00 0.00 H new ATOM 0 HD11 LEU A 955 -4.388 10.965 17.595 1.00 0.00 H new ATOM 0 HD12 LEU A 955 -4.517 11.081 19.366 1.00 0.00 H new ATOM 0 HD13 LEU A 955 -2.916 11.083 18.588 1.00 0.00 H new ATOM 0 HD21 LEU A 955 -3.585 8.896 16.536 1.00 0.00 H new ATOM 0 HD22 LEU A 955 -2.083 8.934 17.490 1.00 0.00 H new ATOM 0 HD23 LEU A 955 -3.126 7.493 17.530 1.00 0.00 H new