USER MOD reduce.3.24.130724 H: found=0, std=0, add=292, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 293 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 681 TYR OH : rot 180:sc= 0 USER MOD Single : A 691 SER OG : rot 180:sc= 0 USER MOD Single : A 703 SER OG : rot 180:sc= 0 USER MOD Single : A 706 ASN : amide:sc= -0.0445 K(o=-0.045,f=-1.9!) USER MOD ----------------------------------------------------------------- ATOM 41 N LEU A 679 2.191 -6.048 -10.896 1.00 0.00 N ATOM 42 CA LEU A 679 2.084 -6.391 -9.483 1.00 0.00 C ATOM 43 C LEU A 679 2.199 -7.899 -9.286 1.00 0.00 C ATOM 44 O LEU A 679 2.865 -8.362 -8.362 1.00 0.00 O ATOM 45 CB LEU A 679 0.746 -5.902 -8.924 1.00 0.00 C ATOM 46 CG LEU A 679 0.859 -4.429 -8.525 1.00 0.00 C ATOM 47 CD1 LEU A 679 1.019 -3.567 -9.778 1.00 0.00 C ATOM 48 CD2 LEU A 679 -0.407 -4.008 -7.775 1.00 0.00 C ATOM 0 HA LEU A 679 2.900 -5.903 -8.949 1.00 0.00 H new ATOM 0 HB2 LEU A 679 -0.038 -6.027 -9.671 1.00 0.00 H new ATOM 0 HB3 LEU A 679 0.461 -6.502 -8.059 1.00 0.00 H new ATOM 0 HG LEU A 679 1.728 -4.294 -7.881 1.00 0.00 H new ATOM 0 HD11 LEU A 679 1.099 -2.519 -9.491 1.00 0.00 H new ATOM 0 HD12 LEU A 679 1.920 -3.867 -10.313 1.00 0.00 H new ATOM 0 HD13 LEU A 679 0.152 -3.701 -10.425 1.00 0.00 H new ATOM 0 HD21 LEU A 679 -0.329 -2.959 -7.490 1.00 0.00 H new ATOM 0 HD22 LEU A 679 -1.275 -4.145 -8.420 1.00 0.00 H new ATOM 0 HD23 LEU A 679 -0.520 -4.620 -6.880 1.00 0.00 H new ATOM 60 N TRP A 680 1.548 -8.655 -10.159 1.00 0.00 N ATOM 61 CA TRP A 680 1.584 -10.111 -10.072 1.00 0.00 C ATOM 62 C TRP A 680 3.026 -10.611 -10.072 1.00 0.00 C ATOM 63 O TRP A 680 3.415 -11.411 -9.220 1.00 0.00 O ATOM 64 CB TRP A 680 0.827 -10.723 -11.253 1.00 0.00 C ATOM 65 CG TRP A 680 0.926 -12.213 -11.188 1.00 0.00 C ATOM 66 CD1 TRP A 680 1.706 -12.974 -11.989 1.00 0.00 C ATOM 67 CD2 TRP A 680 0.238 -13.133 -10.292 1.00 0.00 C ATOM 68 NE1 TRP A 680 1.541 -14.302 -11.642 1.00 0.00 N ATOM 69 CE2 TRP A 680 0.645 -14.452 -10.601 1.00 0.00 C ATOM 70 CE3 TRP A 680 -0.692 -12.953 -9.252 1.00 0.00 C ATOM 71 CZ2 TRP A 680 0.149 -15.554 -9.904 1.00 0.00 C ATOM 72 CZ3 TRP A 680 -1.194 -14.060 -8.548 1.00 0.00 C ATOM 73 CH2 TRP A 680 -0.774 -15.357 -8.872 1.00 0.00 C ATOM 0 H TRP A 680 0.992 -8.289 -10.931 1.00 0.00 H new ATOM 0 HA TRP A 680 1.107 -10.414 -9.140 1.00 0.00 H new ATOM 0 HB2 TRP A 680 -0.218 -10.416 -11.228 1.00 0.00 H new ATOM 0 HB3 TRP A 680 1.243 -10.361 -12.193 1.00 0.00 H new ATOM 0 HD1 TRP A 680 2.352 -12.605 -12.772 1.00 0.00 H new ATOM 0 HE1 TRP A 680 2.022 -15.077 -12.099 1.00 0.00 H new ATOM 0 HE3 TRP A 680 -1.022 -11.958 -8.993 1.00 0.00 H new ATOM 0 HZ2 TRP A 680 0.475 -16.551 -10.159 1.00 0.00 H new ATOM 0 HZ3 TRP A 680 -1.908 -13.911 -7.752 1.00 0.00 H new ATOM 0 HH2 TRP A 680 -1.163 -16.204 -8.325 1.00 0.00 H new ATOM 84 N TYR A 681 3.814 -10.128 -11.028 1.00 0.00 N ATOM 85 CA TYR A 681 5.213 -10.529 -11.126 1.00 0.00 C ATOM 86 C TYR A 681 6.010 -9.994 -9.942 1.00 0.00 C ATOM 87 O TYR A 681 6.950 -10.636 -9.475 1.00 0.00 O ATOM 88 CB TYR A 681 5.816 -10.001 -12.429 1.00 0.00 C ATOM 89 CG TYR A 681 7.206 -10.563 -12.607 1.00 0.00 C ATOM 90 CD1 TYR A 681 7.377 -11.853 -13.124 1.00 0.00 C ATOM 91 CD2 TYR A 681 8.322 -9.796 -12.255 1.00 0.00 C ATOM 92 CE1 TYR A 681 8.665 -12.375 -13.289 1.00 0.00 C ATOM 93 CE2 TYR A 681 9.611 -10.318 -12.420 1.00 0.00 C ATOM 94 CZ TYR A 681 9.782 -11.608 -12.936 1.00 0.00 C ATOM 95 OH TYR A 681 11.052 -12.122 -13.098 1.00 0.00 O ATOM 0 H TYR A 681 3.511 -9.464 -11.740 1.00 0.00 H new ATOM 0 HA TYR A 681 5.260 -11.618 -11.117 1.00 0.00 H new ATOM 0 HB2 TYR A 681 5.187 -10.284 -13.273 1.00 0.00 H new ATOM 0 HB3 TYR A 681 5.853 -8.912 -12.410 1.00 0.00 H new ATOM 0 HD1 TYR A 681 6.515 -12.445 -13.395 1.00 0.00 H new ATOM 0 HD2 TYR A 681 8.189 -8.801 -11.856 1.00 0.00 H new ATOM 0 HE1 TYR A 681 8.797 -13.370 -13.689 1.00 0.00 H new ATOM 0 HE2 TYR A 681 10.473 -9.726 -12.149 1.00 0.00 H new ATOM 0 HH TYR A 681 11.713 -11.460 -12.806 1.00 0.00 H new ATOM 105 N ILE A 682 5.623 -8.819 -9.455 1.00 0.00 N ATOM 106 CA ILE A 682 6.308 -8.210 -8.321 1.00 0.00 C ATOM 107 C ILE A 682 6.122 -9.064 -7.070 1.00 0.00 C ATOM 108 O ILE A 682 7.062 -9.270 -6.302 1.00 0.00 O ATOM 109 CB ILE A 682 5.843 -6.774 -8.075 1.00 0.00 C ATOM 110 CG1 ILE A 682 6.460 -5.858 -9.137 1.00 0.00 C ATOM 111 CG2 ILE A 682 6.292 -6.321 -6.685 1.00 0.00 C ATOM 112 CD1 ILE A 682 5.680 -4.545 -9.198 1.00 0.00 C ATOM 0 H ILE A 682 4.845 -8.273 -9.825 1.00 0.00 H new ATOM 0 HA ILE A 682 7.370 -8.165 -8.562 1.00 0.00 H new ATOM 0 HB ILE A 682 4.756 -6.725 -8.135 1.00 0.00 H new ATOM 0 HG12 ILE A 682 7.505 -5.661 -8.899 1.00 0.00 H new ATOM 0 HG13 ILE A 682 6.442 -6.349 -10.110 1.00 0.00 H new ATOM 0 HG21 ILE A 682 5.960 -5.297 -6.511 1.00 0.00 H new ATOM 0 HG22 ILE A 682 5.857 -6.977 -5.931 1.00 0.00 H new ATOM 0 HG23 ILE A 682 7.379 -6.365 -6.621 1.00 0.00 H new ATOM 0 HD11 ILE A 682 6.120 -3.895 -9.954 1.00 0.00 H new ATOM 0 HD12 ILE A 682 4.641 -4.751 -9.457 1.00 0.00 H new ATOM 0 HD13 ILE A 682 5.721 -4.052 -8.227 1.00 0.00 H new ATOM 124 N ARG A 683 4.906 -9.564 -6.873 1.00 0.00 N ATOM 125 CA ARG A 683 4.611 -10.396 -5.715 1.00 0.00 C ATOM 126 C ARG A 683 5.431 -11.682 -5.760 1.00 0.00 C ATOM 127 O ARG A 683 6.012 -12.094 -4.755 1.00 0.00 O ATOM 128 CB ARG A 683 3.120 -10.738 -5.689 1.00 0.00 C ATOM 129 CG ARG A 683 2.809 -11.591 -4.457 1.00 0.00 C ATOM 130 CD ARG A 683 1.307 -11.877 -4.403 1.00 0.00 C ATOM 131 NE ARG A 683 0.987 -12.690 -3.234 1.00 0.00 N ATOM 132 CZ ARG A 683 1.132 -14.017 -3.236 1.00 0.00 C ATOM 133 NH1 ARG A 683 1.582 -14.643 -4.294 1.00 0.00 N ATOM 134 NH2 ARG A 683 0.821 -14.700 -2.168 1.00 0.00 N ATOM 0 H ARG A 683 4.114 -9.408 -7.497 1.00 0.00 H new ATOM 0 HA ARG A 683 4.873 -9.843 -4.813 1.00 0.00 H new ATOM 0 HB2 ARG A 683 2.527 -9.823 -5.669 1.00 0.00 H new ATOM 0 HB3 ARG A 683 2.845 -11.277 -6.596 1.00 0.00 H new ATOM 0 HG2 ARG A 683 3.367 -12.526 -4.498 1.00 0.00 H new ATOM 0 HG3 ARG A 683 3.124 -11.071 -3.552 1.00 0.00 H new ATOM 0 HD2 ARG A 683 0.753 -10.939 -4.365 1.00 0.00 H new ATOM 0 HD3 ARG A 683 0.996 -12.395 -5.310 1.00 0.00 H new ATOM 0 HE ARG A 683 0.643 -12.231 -2.391 1.00 0.00 H new ATOM 0 HH11 ARG A 683 1.827 -14.116 -5.132 1.00 0.00 H new ATOM 0 HH12 ARG A 683 1.687 -15.657 -4.280 1.00 0.00 H new ATOM 0 HH21 ARG A 683 0.470 -14.219 -1.340 1.00 0.00 H new ATOM 0 HH22 ARG A 683 0.929 -15.714 -2.162 1.00 0.00 H new ATOM 148 N ILE A 684 5.473 -12.310 -6.930 1.00 0.00 N ATOM 149 CA ILE A 684 6.226 -13.549 -7.094 1.00 0.00 C ATOM 150 C ILE A 684 7.694 -13.330 -6.739 1.00 0.00 C ATOM 151 O ILE A 684 8.288 -14.117 -6.001 1.00 0.00 O ATOM 152 CB ILE A 684 6.114 -14.041 -8.538 1.00 0.00 C ATOM 153 CG1 ILE A 684 4.679 -14.500 -8.810 1.00 0.00 C ATOM 154 CG2 ILE A 684 7.073 -15.212 -8.755 1.00 0.00 C ATOM 155 CD1 ILE A 684 4.493 -14.729 -10.311 1.00 0.00 C ATOM 0 H ILE A 684 4.999 -11.985 -7.773 1.00 0.00 H new ATOM 0 HA ILE A 684 5.809 -14.300 -6.423 1.00 0.00 H new ATOM 0 HB ILE A 684 6.372 -13.230 -9.219 1.00 0.00 H new ATOM 0 HG12 ILE A 684 4.470 -15.419 -8.262 1.00 0.00 H new ATOM 0 HG13 ILE A 684 3.972 -13.750 -8.455 1.00 0.00 H new ATOM 0 HG21 ILE A 684 6.993 -15.562 -9.784 1.00 0.00 H new ATOM 0 HG22 ILE A 684 8.095 -14.886 -8.561 1.00 0.00 H new ATOM 0 HG23 ILE A 684 6.816 -16.024 -8.074 1.00 0.00 H new ATOM 0 HD11 ILE A 684 3.471 -15.056 -10.505 1.00 0.00 H new ATOM 0 HD12 ILE A 684 4.685 -13.800 -10.847 1.00 0.00 H new ATOM 0 HD13 ILE A 684 5.190 -15.495 -10.651 1.00 0.00 H new ATOM 167 N PHE A 685 8.274 -12.258 -7.269 1.00 0.00 N ATOM 168 CA PHE A 685 9.673 -11.949 -6.998 1.00 0.00 C ATOM 169 C PHE A 685 9.904 -11.790 -5.500 1.00 0.00 C ATOM 170 O PHE A 685 10.904 -12.268 -4.962 1.00 0.00 O ATOM 171 CB PHE A 685 10.072 -10.659 -7.717 1.00 0.00 C ATOM 172 CG PHE A 685 11.518 -10.344 -7.418 1.00 0.00 C ATOM 173 CD1 PHE A 685 11.838 -9.373 -6.462 1.00 0.00 C ATOM 174 CD2 PHE A 685 12.537 -11.020 -8.098 1.00 0.00 C ATOM 175 CE1 PHE A 685 13.179 -9.079 -6.185 1.00 0.00 C ATOM 176 CE2 PHE A 685 13.879 -10.727 -7.820 1.00 0.00 C ATOM 177 CZ PHE A 685 14.199 -9.756 -6.863 1.00 0.00 C ATOM 0 H PHE A 685 7.802 -11.594 -7.883 1.00 0.00 H new ATOM 0 HA PHE A 685 10.286 -12.773 -7.364 1.00 0.00 H new ATOM 0 HB2 PHE A 685 9.927 -10.769 -8.792 1.00 0.00 H new ATOM 0 HB3 PHE A 685 9.435 -9.837 -7.392 1.00 0.00 H new ATOM 0 HD1 PHE A 685 11.051 -8.851 -5.938 1.00 0.00 H new ATOM 0 HD2 PHE A 685 12.289 -11.768 -8.837 1.00 0.00 H new ATOM 0 HE1 PHE A 685 13.426 -8.329 -5.448 1.00 0.00 H new ATOM 0 HE2 PHE A 685 14.666 -11.250 -8.343 1.00 0.00 H new ATOM 0 HZ PHE A 685 15.233 -9.530 -6.648 1.00 0.00 H new ATOM 187 N ILE A 686 8.973 -11.117 -4.830 1.00 0.00 N ATOM 188 CA ILE A 686 9.087 -10.905 -3.393 1.00 0.00 C ATOM 189 C ILE A 686 9.099 -12.239 -2.653 1.00 0.00 C ATOM 190 O ILE A 686 9.921 -12.461 -1.765 1.00 0.00 O ATOM 191 CB ILE A 686 7.924 -10.047 -2.891 1.00 0.00 C ATOM 192 CG1 ILE A 686 8.082 -8.618 -3.418 1.00 0.00 C ATOM 193 CG2 ILE A 686 7.924 -10.029 -1.362 1.00 0.00 C ATOM 194 CD1 ILE A 686 6.789 -7.839 -3.178 1.00 0.00 C ATOM 0 H ILE A 686 8.139 -10.713 -5.256 1.00 0.00 H new ATOM 0 HA ILE A 686 10.025 -10.386 -3.197 1.00 0.00 H new ATOM 0 HB ILE A 686 6.983 -10.466 -3.248 1.00 0.00 H new ATOM 0 HG12 ILE A 686 8.915 -8.124 -2.917 1.00 0.00 H new ATOM 0 HG13 ILE A 686 8.316 -8.636 -4.482 1.00 0.00 H new ATOM 0 HG21 ILE A 686 7.095 -9.418 -1.005 1.00 0.00 H new ATOM 0 HG22 ILE A 686 7.813 -11.046 -0.986 1.00 0.00 H new ATOM 0 HG23 ILE A 686 8.864 -9.611 -1.003 1.00 0.00 H new ATOM 0 HD11 ILE A 686 6.902 -6.822 -3.553 1.00 0.00 H new ATOM 0 HD12 ILE A 686 5.967 -8.329 -3.700 1.00 0.00 H new ATOM 0 HD13 ILE A 686 6.575 -7.810 -2.110 1.00 0.00 H new ATOM 206 N ILE A 687 8.180 -13.123 -3.025 1.00 0.00 N ATOM 207 CA ILE A 687 8.093 -14.433 -2.392 1.00 0.00 C ATOM 208 C ILE A 687 9.371 -15.230 -2.636 1.00 0.00 C ATOM 209 O ILE A 687 9.870 -15.911 -1.740 1.00 0.00 O ATOM 210 CB ILE A 687 6.895 -15.206 -2.948 1.00 0.00 C ATOM 211 CG1 ILE A 687 5.599 -14.539 -2.480 1.00 0.00 C ATOM 212 CG2 ILE A 687 6.938 -16.649 -2.439 1.00 0.00 C ATOM 213 CD1 ILE A 687 4.415 -15.126 -3.250 1.00 0.00 C ATOM 0 H ILE A 687 7.489 -12.958 -3.757 1.00 0.00 H new ATOM 0 HA ILE A 687 7.965 -14.289 -1.319 1.00 0.00 H new ATOM 0 HB ILE A 687 6.934 -15.204 -4.037 1.00 0.00 H new ATOM 0 HG12 ILE A 687 5.463 -14.695 -1.410 1.00 0.00 H new ATOM 0 HG13 ILE A 687 5.653 -13.462 -2.641 1.00 0.00 H new ATOM 0 HG21 ILE A 687 6.085 -17.200 -2.835 1.00 0.00 H new ATOM 0 HG22 ILE A 687 7.862 -17.124 -2.769 1.00 0.00 H new ATOM 0 HG23 ILE A 687 6.898 -16.652 -1.350 1.00 0.00 H new ATOM 0 HD11 ILE A 687 3.492 -14.651 -2.916 1.00 0.00 H new ATOM 0 HD12 ILE A 687 4.550 -14.947 -4.317 1.00 0.00 H new ATOM 0 HD13 ILE A 687 4.357 -16.199 -3.066 1.00 0.00 H new ATOM 225 N ILE A 688 9.898 -15.138 -3.853 1.00 0.00 N ATOM 226 CA ILE A 688 11.119 -15.854 -4.204 1.00 0.00 C ATOM 227 C ILE A 688 12.274 -15.412 -3.309 1.00 0.00 C ATOM 228 O ILE A 688 13.027 -16.242 -2.797 1.00 0.00 O ATOM 229 CB ILE A 688 11.477 -15.593 -5.672 1.00 0.00 C ATOM 230 CG1 ILE A 688 10.463 -16.283 -6.599 1.00 0.00 C ATOM 231 CG2 ILE A 688 12.882 -16.132 -5.956 1.00 0.00 C ATOM 232 CD1 ILE A 688 10.695 -17.799 -6.625 1.00 0.00 C ATOM 0 H ILE A 688 9.502 -14.578 -4.608 1.00 0.00 H new ATOM 0 HA ILE A 688 10.948 -16.920 -4.058 1.00 0.00 H new ATOM 0 HB ILE A 688 11.450 -14.519 -5.859 1.00 0.00 H new ATOM 0 HG12 ILE A 688 9.449 -16.071 -6.259 1.00 0.00 H new ATOM 0 HG13 ILE A 688 10.552 -15.879 -7.608 1.00 0.00 H new ATOM 0 HG21 ILE A 688 13.138 -15.947 -6.999 1.00 0.00 H new ATOM 0 HG22 ILE A 688 13.602 -15.629 -5.311 1.00 0.00 H new ATOM 0 HG23 ILE A 688 12.907 -17.204 -5.760 1.00 0.00 H new ATOM 0 HD11 ILE A 688 9.967 -18.267 -7.287 1.00 0.00 H new ATOM 0 HD12 ILE A 688 11.702 -18.007 -6.988 1.00 0.00 H new ATOM 0 HD13 ILE A 688 10.582 -18.202 -5.618 1.00 0.00 H new ATOM 244 N VAL A 689 12.407 -14.103 -3.129 1.00 0.00 N ATOM 245 CA VAL A 689 13.475 -13.562 -2.295 1.00 0.00 C ATOM 246 C VAL A 689 13.298 -13.997 -0.844 1.00 0.00 C ATOM 247 O VAL A 689 14.271 -14.310 -0.156 1.00 0.00 O ATOM 248 CB VAL A 689 13.474 -12.034 -2.374 1.00 0.00 C ATOM 249 CG1 VAL A 689 14.443 -11.468 -1.335 1.00 0.00 C ATOM 250 CG2 VAL A 689 13.914 -11.597 -3.772 1.00 0.00 C ATOM 0 H VAL A 689 11.795 -13.401 -3.545 1.00 0.00 H new ATOM 0 HA VAL A 689 14.426 -13.946 -2.663 1.00 0.00 H new ATOM 0 HB VAL A 689 12.470 -11.661 -2.175 1.00 0.00 H new ATOM 0 HG11 VAL A 689 14.442 -10.379 -1.392 1.00 0.00 H new ATOM 0 HG12 VAL A 689 14.131 -11.780 -0.338 1.00 0.00 H new ATOM 0 HG13 VAL A 689 15.448 -11.841 -1.534 1.00 0.00 H new ATOM 0 HG21 VAL A 689 13.914 -10.509 -3.830 1.00 0.00 H new ATOM 0 HG22 VAL A 689 14.918 -11.971 -3.971 1.00 0.00 H new ATOM 0 HG23 VAL A 689 13.224 -12.000 -4.513 1.00 0.00 H new ATOM 260 N GLY A 690 12.053 -14.011 -0.383 1.00 0.00 N ATOM 261 CA GLY A 690 11.762 -14.409 0.990 1.00 0.00 C ATOM 262 C GLY A 690 12.132 -15.870 1.215 1.00 0.00 C ATOM 263 O GLY A 690 12.681 -16.228 2.257 1.00 0.00 O ATOM 0 H GLY A 690 11.234 -13.754 -0.934 1.00 0.00 H new ATOM 0 HA2 GLY A 690 12.317 -13.777 1.683 1.00 0.00 H new ATOM 0 HA3 GLY A 690 10.703 -14.260 1.201 1.00 0.00 H new ATOM 267 N SER A 691 11.827 -16.711 0.232 1.00 0.00 N ATOM 268 CA SER A 691 12.135 -18.134 0.335 1.00 0.00 C ATOM 269 C SER A 691 13.639 -18.347 0.479 1.00 0.00 C ATOM 270 O SER A 691 14.085 -19.155 1.294 1.00 0.00 O ATOM 271 CB SER A 691 11.631 -18.869 -0.907 1.00 0.00 C ATOM 272 OG SER A 691 11.942 -20.252 -0.795 1.00 0.00 O ATOM 0 H SER A 691 11.371 -16.436 -0.638 1.00 0.00 H new ATOM 0 HA SER A 691 11.636 -18.531 1.219 1.00 0.00 H new ATOM 0 HB2 SER A 691 10.554 -18.734 -1.011 1.00 0.00 H new ATOM 0 HB3 SER A 691 12.093 -18.452 -1.802 1.00 0.00 H new ATOM 0 HG SER A 691 11.618 -20.725 -1.590 1.00 0.00 H new ATOM 278 N LEU A 692 14.413 -17.615 -0.314 1.00 0.00 N ATOM 279 CA LEU A 692 15.866 -17.732 -0.265 1.00 0.00 C ATOM 280 C LEU A 692 16.394 -17.267 1.089 1.00 0.00 C ATOM 281 O LEU A 692 17.282 -17.893 1.668 1.00 0.00 O ATOM 282 CB LEU A 692 16.497 -16.889 -1.377 1.00 0.00 C ATOM 283 CG LEU A 692 16.190 -17.513 -2.741 1.00 0.00 C ATOM 284 CD1 LEU A 692 16.607 -16.543 -3.849 1.00 0.00 C ATOM 285 CD2 LEU A 692 16.971 -18.824 -2.896 1.00 0.00 C ATOM 0 H LEU A 692 14.063 -16.939 -0.993 1.00 0.00 H new ATOM 0 HA LEU A 692 16.133 -18.779 -0.408 1.00 0.00 H new ATOM 0 HB2 LEU A 692 16.110 -15.871 -1.338 1.00 0.00 H new ATOM 0 HB3 LEU A 692 17.575 -16.826 -1.230 1.00 0.00 H new ATOM 0 HG LEU A 692 15.121 -17.716 -2.813 1.00 0.00 H new ATOM 0 HD11 LEU A 692 16.389 -16.986 -4.821 1.00 0.00 H new ATOM 0 HD12 LEU A 692 16.054 -15.610 -3.743 1.00 0.00 H new ATOM 0 HD13 LEU A 692 17.676 -16.342 -3.773 1.00 0.00 H new ATOM 0 HD21 LEU A 692 16.751 -19.266 -3.868 1.00 0.00 H new ATOM 0 HD22 LEU A 692 18.040 -18.622 -2.823 1.00 0.00 H new ATOM 0 HD23 LEU A 692 16.678 -19.517 -2.107 1.00 0.00 H new ATOM 297 N ILE A 693 15.842 -16.164 1.586 1.00 0.00 N ATOM 298 CA ILE A 693 16.265 -15.621 2.872 1.00 0.00 C ATOM 299 C ILE A 693 15.979 -16.616 3.993 1.00 0.00 C ATOM 300 O ILE A 693 16.805 -16.814 4.885 1.00 0.00 O ATOM 301 CB ILE A 693 15.536 -14.307 3.152 1.00 0.00 C ATOM 302 CG1 ILE A 693 16.033 -13.233 2.183 1.00 0.00 C ATOM 303 CG2 ILE A 693 15.815 -13.864 4.590 1.00 0.00 C ATOM 304 CD1 ILE A 693 15.117 -12.009 2.262 1.00 0.00 C ATOM 0 H ILE A 693 15.106 -15.632 1.121 1.00 0.00 H new ATOM 0 HA ILE A 693 17.338 -15.436 2.831 1.00 0.00 H new ATOM 0 HB ILE A 693 14.464 -14.451 3.018 1.00 0.00 H new ATOM 0 HG12 ILE A 693 17.056 -12.951 2.430 1.00 0.00 H new ATOM 0 HG13 ILE A 693 16.047 -13.625 1.166 1.00 0.00 H new ATOM 0 HG21 ILE A 693 15.295 -12.927 4.789 1.00 0.00 H new ATOM 0 HG22 ILE A 693 15.462 -14.629 5.281 1.00 0.00 H new ATOM 0 HG23 ILE A 693 16.887 -13.720 4.725 1.00 0.00 H new ATOM 0 HD11 ILE A 693 15.472 -11.244 1.571 1.00 0.00 H new ATOM 0 HD12 ILE A 693 14.101 -12.297 1.994 1.00 0.00 H new ATOM 0 HD13 ILE A 693 15.126 -11.613 3.278 1.00 0.00 H new ATOM 316 N GLY A 694 14.808 -17.240 3.939 1.00 0.00 N ATOM 317 CA GLY A 694 14.423 -18.214 4.956 1.00 0.00 C ATOM 318 C GLY A 694 15.391 -19.394 4.959 1.00 0.00 C ATOM 319 O GLY A 694 15.885 -19.800 6.011 1.00 0.00 O ATOM 0 H GLY A 694 14.112 -17.091 3.208 1.00 0.00 H new ATOM 0 HA2 GLY A 694 14.415 -17.740 5.938 1.00 0.00 H new ATOM 0 HA3 GLY A 694 13.410 -18.568 4.764 1.00 0.00 H new ATOM 323 N LEU A 695 15.654 -19.942 3.777 1.00 0.00 N ATOM 324 CA LEU A 695 16.564 -21.075 3.659 1.00 0.00 C ATOM 325 C LEU A 695 17.912 -20.744 4.290 1.00 0.00 C ATOM 326 O LEU A 695 18.456 -21.530 5.066 1.00 0.00 O ATOM 327 CB LEU A 695 16.760 -21.438 2.185 1.00 0.00 C ATOM 328 CG LEU A 695 17.798 -22.555 2.065 1.00 0.00 C ATOM 329 CD1 LEU A 695 17.336 -23.570 1.017 1.00 0.00 C ATOM 330 CD2 LEU A 695 19.142 -21.960 1.636 1.00 0.00 C ATOM 0 H LEU A 695 15.254 -19.623 2.895 1.00 0.00 H new ATOM 0 HA LEU A 695 16.128 -21.925 4.185 1.00 0.00 H new ATOM 0 HB2 LEU A 695 15.813 -21.759 1.750 1.00 0.00 H new ATOM 0 HB3 LEU A 695 17.087 -20.562 1.625 1.00 0.00 H new ATOM 0 HG LEU A 695 17.910 -23.051 3.029 1.00 0.00 H new ATOM 0 HD11 LEU A 695 18.075 -24.366 0.931 1.00 0.00 H new ATOM 0 HD12 LEU A 695 16.379 -23.995 1.319 1.00 0.00 H new ATOM 0 HD13 LEU A 695 17.224 -23.073 0.053 1.00 0.00 H new ATOM 0 HD21 LEU A 695 19.882 -22.756 1.551 1.00 0.00 H new ATOM 0 HD22 LEU A 695 19.029 -21.464 0.672 1.00 0.00 H new ATOM 0 HD23 LEU A 695 19.473 -21.235 2.380 1.00 0.00 H new ATOM 342 N ARG A 696 18.447 -19.574 3.951 1.00 0.00 N ATOM 343 CA ARG A 696 19.732 -19.147 4.491 1.00 0.00 C ATOM 344 C ARG A 696 19.693 -19.132 6.016 1.00 0.00 C ATOM 345 O ARG A 696 20.584 -19.666 6.676 1.00 0.00 O ATOM 346 CB ARG A 696 20.077 -17.750 3.973 1.00 0.00 C ATOM 347 CG ARG A 696 21.430 -17.316 4.540 1.00 0.00 C ATOM 348 CD ARG A 696 21.821 -15.961 3.947 1.00 0.00 C ATOM 349 NE ARG A 696 23.084 -15.504 4.519 1.00 0.00 N ATOM 350 CZ ARG A 696 24.261 -15.949 4.074 1.00 0.00 C ATOM 351 NH1 ARG A 696 24.324 -16.825 3.103 1.00 0.00 N ATOM 352 NH2 ARG A 696 25.363 -15.504 4.612 1.00 0.00 N ATOM 0 H ARG A 696 18.014 -18.910 3.310 1.00 0.00 H new ATOM 0 HA ARG A 696 20.496 -19.853 4.165 1.00 0.00 H new ATOM 0 HB2 ARG A 696 20.111 -17.753 2.884 1.00 0.00 H new ATOM 0 HB3 ARG A 696 19.303 -17.040 4.266 1.00 0.00 H new ATOM 0 HG2 ARG A 696 21.376 -17.247 5.626 1.00 0.00 H new ATOM 0 HG3 ARG A 696 22.190 -18.061 4.305 1.00 0.00 H new ATOM 0 HD2 ARG A 696 21.913 -16.043 2.864 1.00 0.00 H new ATOM 0 HD3 ARG A 696 21.038 -15.229 4.146 1.00 0.00 H new ATOM 0 HE ARG A 696 23.066 -14.825 5.280 1.00 0.00 H new ATOM 0 HH11 ARG A 696 23.467 -17.176 2.677 1.00 0.00 H new ATOM 0 HH12 ARG A 696 25.231 -17.156 2.773 1.00 0.00 H new ATOM 0 HH21 ARG A 696 25.322 -14.820 5.368 1.00 0.00 H new ATOM 0 HH22 ARG A 696 26.266 -15.840 4.277 1.00 0.00 H new ATOM 366 N ILE A 697 18.655 -18.512 6.572 1.00 0.00 N ATOM 367 CA ILE A 697 18.513 -18.431 8.020 1.00 0.00 C ATOM 368 C ILE A 697 18.476 -19.827 8.634 1.00 0.00 C ATOM 369 O ILE A 697 19.145 -20.094 9.630 1.00 0.00 O ATOM 370 CB ILE A 697 17.230 -17.679 8.378 1.00 0.00 C ATOM 371 CG1 ILE A 697 17.379 -16.206 7.989 1.00 0.00 C ATOM 372 CG2 ILE A 697 16.977 -17.785 9.883 1.00 0.00 C ATOM 373 CD1 ILE A 697 16.018 -15.514 8.084 1.00 0.00 C ATOM 0 H ILE A 697 17.906 -18.062 6.045 1.00 0.00 H new ATOM 0 HA ILE A 697 19.372 -17.893 8.421 1.00 0.00 H new ATOM 0 HB ILE A 697 16.390 -18.116 7.838 1.00 0.00 H new ATOM 0 HG12 ILE A 697 18.095 -15.715 8.648 1.00 0.00 H new ATOM 0 HG13 ILE A 697 17.771 -16.124 6.975 1.00 0.00 H new ATOM 0 HG21 ILE A 697 16.063 -17.249 10.137 1.00 0.00 H new ATOM 0 HG22 ILE A 697 16.872 -18.834 10.161 1.00 0.00 H new ATOM 0 HG23 ILE A 697 17.816 -17.348 10.425 1.00 0.00 H new ATOM 0 HD11 ILE A 697 16.123 -14.465 7.807 1.00 0.00 H new ATOM 0 HD12 ILE A 697 15.315 -15.999 7.407 1.00 0.00 H new ATOM 0 HD13 ILE A 697 15.645 -15.584 9.106 1.00 0.00 H new ATOM 385 N VAL A 698 17.684 -20.710 8.036 1.00 0.00 N ATOM 386 CA VAL A 698 17.565 -22.076 8.533 1.00 0.00 C ATOM 387 C VAL A 698 18.934 -22.744 8.594 1.00 0.00 C ATOM 388 O VAL A 698 19.287 -23.371 9.596 1.00 0.00 O ATOM 389 CB VAL A 698 16.643 -22.885 7.620 1.00 0.00 C ATOM 390 CG1 VAL A 698 16.709 -24.363 8.006 1.00 0.00 C ATOM 391 CG2 VAL A 698 15.205 -22.382 7.775 1.00 0.00 C ATOM 0 H VAL A 698 17.118 -20.507 7.212 1.00 0.00 H new ATOM 0 HA VAL A 698 17.144 -22.042 9.538 1.00 0.00 H new ATOM 0 HB VAL A 698 16.962 -22.766 6.585 1.00 0.00 H new ATOM 0 HG11 VAL A 698 16.051 -24.939 7.355 1.00 0.00 H new ATOM 0 HG12 VAL A 698 17.732 -24.722 7.898 1.00 0.00 H new ATOM 0 HG13 VAL A 698 16.390 -24.483 9.041 1.00 0.00 H new ATOM 0 HG21 VAL A 698 14.546 -22.958 7.125 1.00 0.00 H new ATOM 0 HG22 VAL A 698 14.887 -22.501 8.811 1.00 0.00 H new ATOM 0 HG23 VAL A 698 15.156 -21.328 7.500 1.00 0.00 H new ATOM 401 N PHE A 699 19.702 -22.606 7.520 1.00 0.00 N ATOM 402 CA PHE A 699 21.032 -23.198 7.462 1.00 0.00 C ATOM 403 C PHE A 699 21.937 -22.584 8.525 1.00 0.00 C ATOM 404 O PHE A 699 22.700 -23.288 9.186 1.00 0.00 O ATOM 405 CB PHE A 699 21.643 -22.979 6.079 1.00 0.00 C ATOM 406 CG PHE A 699 23.013 -23.611 6.027 1.00 0.00 C ATOM 407 CD1 PHE A 699 24.157 -22.817 6.168 1.00 0.00 C ATOM 408 CD2 PHE A 699 23.139 -24.993 5.840 1.00 0.00 C ATOM 409 CE1 PHE A 699 25.426 -23.404 6.121 1.00 0.00 C ATOM 410 CE2 PHE A 699 24.409 -25.580 5.792 1.00 0.00 C ATOM 411 CZ PHE A 699 25.553 -24.785 5.933 1.00 0.00 C ATOM 0 H PHE A 699 19.429 -22.092 6.682 1.00 0.00 H new ATOM 0 HA PHE A 699 20.942 -24.268 7.651 1.00 0.00 H new ATOM 0 HB2 PHE A 699 21.001 -23.414 5.313 1.00 0.00 H new ATOM 0 HB3 PHE A 699 21.715 -21.912 5.866 1.00 0.00 H new ATOM 0 HD1 PHE A 699 24.060 -21.751 6.313 1.00 0.00 H new ATOM 0 HD2 PHE A 699 22.256 -25.606 5.733 1.00 0.00 H new ATOM 0 HE1 PHE A 699 26.308 -22.791 6.230 1.00 0.00 H new ATOM 0 HE2 PHE A 699 24.506 -26.646 5.646 1.00 0.00 H new ATOM 0 HZ PHE A 699 26.533 -25.237 5.897 1.00 0.00 H new ATOM 421 N ALA A 700 21.843 -21.269 8.684 1.00 0.00 N ATOM 422 CA ALA A 700 22.656 -20.569 9.673 1.00 0.00 C ATOM 423 C ALA A 700 22.324 -21.055 11.079 1.00 0.00 C ATOM 424 O ALA A 700 23.213 -21.248 11.907 1.00 0.00 O ATOM 425 CB ALA A 700 22.412 -19.062 9.579 1.00 0.00 C ATOM 0 H ALA A 700 21.217 -20.669 8.146 1.00 0.00 H new ATOM 0 HA ALA A 700 23.706 -20.779 9.467 1.00 0.00 H new ATOM 0 HB1 ALA A 700 23.023 -18.548 10.321 1.00 0.00 H new ATOM 0 HB2 ALA A 700 22.680 -18.712 8.582 1.00 0.00 H new ATOM 0 HB3 ALA A 700 21.359 -18.851 9.767 1.00 0.00 H new ATOM 431 N VAL A 701 21.037 -21.253 11.342 1.00 0.00 N ATOM 432 CA VAL A 701 20.598 -21.718 12.652 1.00 0.00 C ATOM 433 C VAL A 701 21.187 -23.092 12.955 1.00 0.00 C ATOM 434 O VAL A 701 21.651 -23.347 14.065 1.00 0.00 O ATOM 435 CB VAL A 701 19.071 -21.793 12.699 1.00 0.00 C ATOM 436 CG1 VAL A 701 18.634 -22.504 13.982 1.00 0.00 C ATOM 437 CG2 VAL A 701 18.490 -20.376 12.682 1.00 0.00 C ATOM 0 H VAL A 701 20.284 -21.100 10.671 1.00 0.00 H new ATOM 0 HA VAL A 701 20.947 -21.010 13.403 1.00 0.00 H new ATOM 0 HB VAL A 701 18.708 -22.347 11.833 1.00 0.00 H new ATOM 0 HG11 VAL A 701 17.546 -22.558 14.016 1.00 0.00 H new ATOM 0 HG12 VAL A 701 19.048 -23.512 13.998 1.00 0.00 H new ATOM 0 HG13 VAL A 701 18.997 -21.949 14.847 1.00 0.00 H new ATOM 0 HG21 VAL A 701 17.402 -20.429 12.715 1.00 0.00 H new ATOM 0 HG22 VAL A 701 18.853 -19.823 13.548 1.00 0.00 H new ATOM 0 HG23 VAL A 701 18.801 -19.866 11.770 1.00 0.00 H new ATOM 447 N LEU A 702 21.161 -23.971 11.960 1.00 0.00 N ATOM 448 CA LEU A 702 21.695 -25.318 12.131 1.00 0.00 C ATOM 449 C LEU A 702 23.194 -25.271 12.408 1.00 0.00 C ATOM 450 O LEU A 702 23.698 -25.988 13.274 1.00 0.00 O ATOM 451 CB LEU A 702 21.435 -26.146 10.870 1.00 0.00 C ATOM 452 CG LEU A 702 19.936 -26.434 10.736 1.00 0.00 C ATOM 453 CD1 LEU A 702 19.658 -27.041 9.358 1.00 0.00 C ATOM 454 CD2 LEU A 702 19.501 -27.425 11.823 1.00 0.00 C ATOM 0 H LEU A 702 20.780 -23.778 11.034 1.00 0.00 H new ATOM 0 HA LEU A 702 21.194 -25.781 12.981 1.00 0.00 H new ATOM 0 HB2 LEU A 702 21.791 -25.608 9.991 1.00 0.00 H new ATOM 0 HB3 LEU A 702 21.991 -27.082 10.918 1.00 0.00 H new ATOM 0 HG LEU A 702 19.378 -25.505 10.849 1.00 0.00 H new ATOM 0 HD11 LEU A 702 18.592 -27.247 9.260 1.00 0.00 H new ATOM 0 HD12 LEU A 702 19.965 -26.339 8.583 1.00 0.00 H new ATOM 0 HD13 LEU A 702 20.219 -27.969 9.250 1.00 0.00 H new ATOM 0 HD21 LEU A 702 18.435 -27.628 11.725 1.00 0.00 H new ATOM 0 HD22 LEU A 702 20.059 -28.355 11.712 1.00 0.00 H new ATOM 0 HD23 LEU A 702 19.700 -26.998 12.806 1.00 0.00 H new ATOM 466 N SER A 703 23.901 -24.422 11.670 1.00 0.00 N ATOM 467 CA SER A 703 25.342 -24.289 11.846 1.00 0.00 C ATOM 468 C SER A 703 25.669 -23.830 13.263 1.00 0.00 C ATOM 469 O SER A 703 26.598 -24.335 13.893 1.00 0.00 O ATOM 470 CB SER A 703 25.901 -23.284 10.840 1.00 0.00 C ATOM 471 OG SER A 703 27.305 -23.163 11.027 1.00 0.00 O ATOM 0 H SER A 703 23.503 -23.820 10.949 1.00 0.00 H new ATOM 0 HA SER A 703 25.800 -25.263 11.677 1.00 0.00 H new ATOM 0 HB2 SER A 703 25.685 -23.612 9.823 1.00 0.00 H new ATOM 0 HB3 SER A 703 25.420 -22.315 10.972 1.00 0.00 H new ATOM 0 HG SER A 703 27.667 -22.520 10.382 1.00 0.00 H new ATOM 477 N LEU A 704 24.894 -22.869 13.759 1.00 0.00 N ATOM 478 CA LEU A 704 25.106 -22.346 15.104 1.00 0.00 C ATOM 479 C LEU A 704 24.872 -23.435 16.148 1.00 0.00 C ATOM 480 O LEU A 704 25.624 -23.552 17.116 1.00 0.00 O ATOM 481 CB LEU A 704 24.154 -21.176 15.365 1.00 0.00 C ATOM 482 CG LEU A 704 24.560 -19.973 14.509 1.00 0.00 C ATOM 483 CD1 LEU A 704 23.468 -18.904 14.588 1.00 0.00 C ATOM 484 CD2 LEU A 704 25.879 -19.390 15.030 1.00 0.00 C ATOM 0 H LEU A 704 24.119 -22.440 13.253 1.00 0.00 H new ATOM 0 HA LEU A 704 26.137 -22.001 15.180 1.00 0.00 H new ATOM 0 HB2 LEU A 704 23.130 -21.470 15.133 1.00 0.00 H new ATOM 0 HB3 LEU A 704 24.176 -20.906 16.421 1.00 0.00 H new ATOM 0 HG LEU A 704 24.689 -20.292 13.475 1.00 0.00 H new ATOM 0 HD11 LEU A 704 23.754 -18.046 13.980 1.00 0.00 H new ATOM 0 HD12 LEU A 704 22.529 -19.315 14.217 1.00 0.00 H new ATOM 0 HD13 LEU A 704 23.342 -18.588 15.624 1.00 0.00 H new ATOM 0 HD21 LEU A 704 26.165 -18.534 14.419 1.00 0.00 H new ATOM 0 HD22 LEU A 704 25.752 -19.071 16.065 1.00 0.00 H new ATOM 0 HD23 LEU A 704 26.659 -20.150 14.978 1.00 0.00 H new ATOM 496 N VAL A 705 23.822 -24.226 15.949 1.00 0.00 N ATOM 497 CA VAL A 705 23.498 -25.297 16.884 1.00 0.00 C ATOM 498 C VAL A 705 24.626 -26.320 16.939 1.00 0.00 C ATOM 499 O VAL A 705 25.026 -26.757 18.018 1.00 0.00 O ATOM 500 CB VAL A 705 22.202 -25.988 16.456 1.00 0.00 C ATOM 501 CG1 VAL A 705 21.992 -27.246 17.301 1.00 0.00 C ATOM 502 CG2 VAL A 705 21.024 -25.034 16.662 1.00 0.00 C ATOM 0 H VAL A 705 23.186 -24.147 15.156 1.00 0.00 H new ATOM 0 HA VAL A 705 23.369 -24.862 17.875 1.00 0.00 H new ATOM 0 HB VAL A 705 22.267 -26.264 15.403 1.00 0.00 H new ATOM 0 HG11 VAL A 705 21.069 -27.739 16.997 1.00 0.00 H new ATOM 0 HG12 VAL A 705 22.831 -27.926 17.156 1.00 0.00 H new ATOM 0 HG13 VAL A 705 21.926 -26.971 18.354 1.00 0.00 H new ATOM 0 HG21 VAL A 705 20.100 -25.526 16.357 1.00 0.00 H new ATOM 0 HG22 VAL A 705 20.958 -24.759 17.715 1.00 0.00 H new ATOM 0 HG23 VAL A 705 21.173 -24.137 16.061 1.00 0.00 H new ATOM 512 N ASN A 706 25.134 -26.699 15.771 1.00 0.00 N ATOM 513 CA ASN A 706 26.218 -27.673 15.701 1.00 0.00 C ATOM 514 C ASN A 706 27.440 -27.171 16.464 1.00 0.00 C ATOM 515 O ASN A 706 28.086 -27.930 17.186 1.00 0.00 O ATOM 516 CB ASN A 706 26.595 -27.931 14.242 1.00 0.00 C ATOM 517 CG ASN A 706 25.493 -28.727 13.551 1.00 0.00 C ATOM 518 OD1 ASN A 706 24.685 -29.376 14.216 1.00 0.00 O ATOM 519 ND2 ASN A 706 25.410 -28.715 12.249 1.00 0.00 N ATOM 0 H ASN A 706 24.816 -26.350 14.867 1.00 0.00 H new ATOM 0 HA ASN A 706 25.876 -28.602 16.157 1.00 0.00 H new ATOM 0 HB2 ASN A 706 26.750 -26.984 13.725 1.00 0.00 H new ATOM 0 HB3 ASN A 706 27.536 -28.479 14.192 1.00 0.00 H new ATOM 0 HD21 ASN A 706 24.675 -29.244 11.780 1.00 0.00 H new ATOM 0 HD22 ASN A 706 26.080 -28.177 11.700 1.00 0.00 H new ATOM 526 N ARG A 707 27.748 -25.889 16.300 1.00 0.00 N ATOM 527 CA ARG A 707 28.893 -25.294 16.978 1.00 0.00 C ATOM 528 C ARG A 707 28.709 -25.352 18.490 1.00 0.00 C ATOM 529 O ARG A 707 29.622 -25.737 19.222 1.00 0.00 O ATOM 530 CB ARG A 707 29.061 -23.838 16.539 1.00 0.00 C ATOM 531 CG ARG A 707 30.296 -23.240 17.215 1.00 0.00 C ATOM 532 CD ARG A 707 30.450 -21.776 16.797 1.00 0.00 C ATOM 533 NE ARG A 707 30.693 -21.682 15.360 1.00 0.00 N ATOM 534 CZ ARG A 707 31.910 -21.854 14.839 1.00 0.00 C ATOM 535 NH1 ARG A 707 32.937 -22.128 15.604 1.00 0.00 N ATOM 536 NH2 ARG A 707 32.078 -21.748 13.549 1.00 0.00 N ATOM 0 H ARG A 707 27.224 -25.245 15.707 1.00 0.00 H new ATOM 0 HA ARG A 707 29.785 -25.860 16.709 1.00 0.00 H new ATOM 0 HB2 ARG A 707 29.164 -23.784 15.455 1.00 0.00 H new ATOM 0 HB3 ARG A 707 28.174 -23.263 16.804 1.00 0.00 H new ATOM 0 HG2 ARG A 707 30.201 -23.312 18.298 1.00 0.00 H new ATOM 0 HG3 ARG A 707 31.186 -23.804 16.935 1.00 0.00 H new ATOM 0 HD2 ARG A 707 29.550 -21.220 17.058 1.00 0.00 H new ATOM 0 HD3 ARG A 707 31.276 -21.320 17.343 1.00 0.00 H new ATOM 0 HE ARG A 707 29.911 -21.479 14.737 1.00 0.00 H new ATOM 0 HH11 ARG A 707 32.813 -22.213 16.613 1.00 0.00 H new ATOM 0 HH12 ARG A 707 33.861 -22.257 15.191 1.00 0.00 H new ATOM 0 HH21 ARG A 707 31.283 -21.535 12.947 1.00 0.00 H new ATOM 0 HH22 ARG A 707 33.005 -21.878 13.143 1.00 0.00 H new ATOM 550 N VAL A 708 27.524 -24.968 18.954 1.00 0.00 N ATOM 551 CA VAL A 708 27.234 -24.982 20.384 1.00 0.00 C ATOM 552 C VAL A 708 27.316 -26.402 20.932 1.00 0.00 C ATOM 553 O VAL A 708 27.855 -26.630 22.016 1.00 0.00 O ATOM 554 CB VAL A 708 25.835 -24.416 20.638 1.00 0.00 C ATOM 555 CG1 VAL A 708 25.452 -24.642 22.103 1.00 0.00 C ATOM 556 CG2 VAL A 708 25.831 -22.915 20.338 1.00 0.00 C ATOM 0 H VAL A 708 26.755 -24.646 18.367 1.00 0.00 H new ATOM 0 HA VAL A 708 27.974 -24.364 20.893 1.00 0.00 H new ATOM 0 HB VAL A 708 25.116 -24.919 19.991 1.00 0.00 H new ATOM 0 HG11 VAL A 708 24.456 -24.239 22.285 1.00 0.00 H new ATOM 0 HG12 VAL A 708 25.457 -25.710 22.320 1.00 0.00 H new ATOM 0 HG13 VAL A 708 26.171 -24.138 22.749 1.00 0.00 H new ATOM 0 HG21 VAL A 708 24.835 -22.511 20.518 1.00 0.00 H new ATOM 0 HG22 VAL A 708 26.550 -22.413 20.986 1.00 0.00 H new ATOM 0 HG23 VAL A 708 26.106 -22.752 19.296 1.00 0.00 H new ATOM 566 N ARG A 709 26.776 -27.356 20.179 1.00 0.00 N ATOM 567 CA ARG A 709 26.792 -28.750 20.601 1.00 0.00 C ATOM 568 C ARG A 709 28.216 -29.295 20.598 1.00 0.00 C ATOM 569 O ARG A 709 28.577 -30.125 21.432 1.00 0.00 O ATOM 570 CB ARG A 709 25.924 -29.589 19.659 1.00 0.00 C ATOM 571 CG ARG A 709 24.444 -29.221 19.828 1.00 0.00 C ATOM 572 CD ARG A 709 23.913 -29.751 21.165 1.00 0.00 C ATOM 573 NE ARG A 709 24.047 -31.204 21.221 1.00 0.00 N ATOM 574 CZ ARG A 709 23.156 -32.016 20.645 1.00 0.00 C ATOM 575 NH1 ARG A 709 22.127 -31.532 19.996 1.00 0.00 N ATOM 576 NH2 ARG A 709 23.314 -33.308 20.731 1.00 0.00 N ATOM 0 H ARG A 709 26.325 -27.189 19.279 1.00 0.00 H new ATOM 0 HA ARG A 709 26.394 -28.808 21.614 1.00 0.00 H new ATOM 0 HB2 ARG A 709 26.231 -29.423 18.626 1.00 0.00 H new ATOM 0 HB3 ARG A 709 26.068 -30.649 19.868 1.00 0.00 H new ATOM 0 HG2 ARG A 709 24.324 -28.138 19.785 1.00 0.00 H new ATOM 0 HG3 ARG A 709 23.862 -29.639 19.006 1.00 0.00 H new ATOM 0 HD2 ARG A 709 24.463 -29.296 21.989 1.00 0.00 H new ATOM 0 HD3 ARG A 709 22.867 -29.470 21.286 1.00 0.00 H new ATOM 0 HE ARG A 709 24.843 -31.610 21.713 1.00 0.00 H new ATOM 0 HH11 ARG A 709 21.998 -30.523 19.925 1.00 0.00 H new ATOM 0 HH12 ARG A 709 21.455 -32.164 19.561 1.00 0.00 H new ATOM 0 HH21 ARG A 709 24.113 -33.692 21.235 1.00 0.00 H new ATOM 0 HH22 ARG A 709 22.638 -33.935 20.294 1.00 0.00 H new