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 -34:sc= 1.01 USER MOD Single : A 706 ASN : amide:sc= 0 X(o=0,f=-0.0017) USER MOD ----------------------------------------------------------------- ATOM 41 N LEU A 679 1.865 -6.465 -11.220 1.00 0.00 N ATOM 42 CA LEU A 679 1.909 -6.693 -9.780 1.00 0.00 C ATOM 43 C LEU A 679 2.063 -8.179 -9.478 1.00 0.00 C ATOM 44 O LEU A 679 2.730 -8.559 -8.515 1.00 0.00 O ATOM 45 CB LEU A 679 0.626 -6.162 -9.130 1.00 0.00 C ATOM 46 CG LEU A 679 0.666 -6.398 -7.616 1.00 0.00 C ATOM 47 CD1 LEU A 679 1.838 -5.631 -6.998 1.00 0.00 C ATOM 48 CD2 LEU A 679 -0.644 -5.907 -6.994 1.00 0.00 C ATOM 0 HA LEU A 679 2.769 -6.163 -9.370 1.00 0.00 H new ATOM 0 HB2 LEU A 679 0.518 -5.097 -9.337 1.00 0.00 H new ATOM 0 HB3 LEU A 679 -0.242 -6.660 -9.561 1.00 0.00 H new ATOM 0 HG LEU A 679 0.793 -7.463 -7.422 1.00 0.00 H new ATOM 0 HD11 LEU A 679 1.859 -5.804 -5.922 1.00 0.00 H new ATOM 0 HD12 LEU A 679 2.773 -5.977 -7.440 1.00 0.00 H new ATOM 0 HD13 LEU A 679 1.718 -4.565 -7.192 1.00 0.00 H new ATOM 0 HD21 LEU A 679 -0.620 -6.073 -5.917 1.00 0.00 H new ATOM 0 HD22 LEU A 679 -0.765 -4.843 -7.195 1.00 0.00 H new ATOM 0 HD23 LEU A 679 -1.480 -6.456 -7.427 1.00 0.00 H new ATOM 60 N TRP A 680 1.444 -9.014 -10.304 1.00 0.00 N ATOM 61 CA TRP A 680 1.518 -10.458 -10.114 1.00 0.00 C ATOM 62 C TRP A 680 2.972 -10.924 -10.129 1.00 0.00 C ATOM 63 O TRP A 680 3.385 -11.728 -9.294 1.00 0.00 O ATOM 64 CB TRP A 680 0.746 -11.173 -11.226 1.00 0.00 C ATOM 65 CG TRP A 680 -0.727 -11.022 -11.005 1.00 0.00 C ATOM 66 CD1 TRP A 680 -1.300 -10.207 -10.090 1.00 0.00 C ATOM 67 CD2 TRP A 680 -1.821 -11.691 -11.698 1.00 0.00 C ATOM 68 NE1 TRP A 680 -2.675 -10.333 -10.177 1.00 0.00 N ATOM 69 CE2 TRP A 680 -3.045 -11.237 -11.154 1.00 0.00 C ATOM 70 CE3 TRP A 680 -1.868 -12.639 -12.736 1.00 0.00 C ATOM 71 CZ2 TRP A 680 -4.273 -11.706 -11.622 1.00 0.00 C ATOM 72 CZ3 TRP A 680 -3.102 -13.114 -13.211 1.00 0.00 C ATOM 73 CH2 TRP A 680 -4.302 -12.648 -12.655 1.00 0.00 C ATOM 0 H TRP A 680 0.889 -8.719 -11.107 1.00 0.00 H new ATOM 0 HA TRP A 680 1.075 -10.701 -9.148 1.00 0.00 H new ATOM 0 HB2 TRP A 680 1.021 -10.758 -12.196 1.00 0.00 H new ATOM 0 HB3 TRP A 680 1.013 -12.230 -11.244 1.00 0.00 H new ATOM 0 HD1 TRP A 680 -0.770 -9.563 -9.404 1.00 0.00 H new ATOM 0 HE1 TRP A 680 -3.335 -9.821 -9.591 1.00 0.00 H new ATOM 0 HE3 TRP A 680 -0.949 -13.004 -13.171 1.00 0.00 H new ATOM 0 HZ2 TRP A 680 -5.194 -11.344 -11.190 1.00 0.00 H new ATOM 0 HZ3 TRP A 680 -3.126 -13.842 -14.009 1.00 0.00 H new ATOM 0 HH2 TRP A 680 -5.248 -13.016 -13.024 1.00 0.00 H new ATOM 84 N TYR A 681 3.743 -10.411 -11.083 1.00 0.00 N ATOM 85 CA TYR A 681 5.149 -10.779 -11.196 1.00 0.00 C ATOM 86 C TYR A 681 5.946 -10.227 -10.019 1.00 0.00 C ATOM 87 O TYR A 681 6.873 -10.869 -9.529 1.00 0.00 O ATOM 88 CB TYR A 681 5.728 -10.238 -12.504 1.00 0.00 C ATOM 89 CG TYR A 681 7.135 -10.756 -12.685 1.00 0.00 C ATOM 90 CD1 TYR A 681 8.228 -9.944 -12.356 1.00 0.00 C ATOM 91 CD2 TYR A 681 7.347 -12.047 -13.181 1.00 0.00 C ATOM 92 CE1 TYR A 681 9.532 -10.424 -12.525 1.00 0.00 C ATOM 93 CE2 TYR A 681 8.652 -12.527 -13.349 1.00 0.00 C ATOM 94 CZ TYR A 681 9.744 -11.716 -13.021 1.00 0.00 C ATOM 95 OH TYR A 681 11.030 -12.190 -13.186 1.00 0.00 O ATOM 0 H TYR A 681 3.420 -9.744 -11.784 1.00 0.00 H new ATOM 0 HA TYR A 681 5.220 -11.867 -11.189 1.00 0.00 H new ATOM 0 HB2 TYR A 681 5.105 -10.545 -13.344 1.00 0.00 H new ATOM 0 HB3 TYR A 681 5.729 -9.148 -12.490 1.00 0.00 H new ATOM 0 HD1 TYR A 681 8.065 -8.948 -11.972 1.00 0.00 H new ATOM 0 HD2 TYR A 681 6.504 -12.673 -13.434 1.00 0.00 H new ATOM 0 HE1 TYR A 681 10.375 -9.798 -12.273 1.00 0.00 H new ATOM 0 HE2 TYR A 681 8.815 -13.524 -13.732 1.00 0.00 H new ATOM 0 HH TYR A 681 10.999 -13.104 -13.538 1.00 0.00 H new ATOM 105 N ILE A 682 5.576 -9.032 -9.567 1.00 0.00 N ATOM 106 CA ILE A 682 6.264 -8.406 -8.446 1.00 0.00 C ATOM 107 C ILE A 682 6.101 -9.246 -7.183 1.00 0.00 C ATOM 108 O ILE A 682 7.055 -9.450 -6.434 1.00 0.00 O ATOM 109 CB ILE A 682 5.692 -7.005 -8.198 1.00 0.00 C ATOM 110 CG1 ILE A 682 6.047 -6.064 -9.364 1.00 0.00 C ATOM 111 CG2 ILE A 682 6.262 -6.445 -6.895 1.00 0.00 C ATOM 112 CD1 ILE A 682 7.544 -5.721 -9.360 1.00 0.00 C ATOM 0 H ILE A 682 4.810 -8.483 -9.957 1.00 0.00 H new ATOM 0 HA ILE A 682 7.324 -8.332 -8.691 1.00 0.00 H new ATOM 0 HB ILE A 682 4.607 -7.076 -8.124 1.00 0.00 H new ATOM 0 HG12 ILE A 682 5.781 -6.536 -10.310 1.00 0.00 H new ATOM 0 HG13 ILE A 682 5.461 -5.148 -9.288 1.00 0.00 H new ATOM 0 HG21 ILE A 682 5.856 -5.449 -6.718 1.00 0.00 H new ATOM 0 HG22 ILE A 682 5.990 -7.100 -6.067 1.00 0.00 H new ATOM 0 HG23 ILE A 682 7.348 -6.386 -6.969 1.00 0.00 H new ATOM 0 HD11 ILE A 682 7.767 -5.055 -10.194 1.00 0.00 H new ATOM 0 HD12 ILE A 682 7.802 -5.228 -8.423 1.00 0.00 H new ATOM 0 HD13 ILE A 682 8.127 -6.636 -9.461 1.00 0.00 H new ATOM 124 N ARG A 683 4.884 -9.730 -6.955 1.00 0.00 N ATOM 125 CA ARG A 683 4.607 -10.548 -5.780 1.00 0.00 C ATOM 126 C ARG A 683 5.441 -11.823 -5.804 1.00 0.00 C ATOM 127 O ARG A 683 6.032 -12.209 -4.796 1.00 0.00 O ATOM 128 CB ARG A 683 3.121 -10.908 -5.733 1.00 0.00 C ATOM 129 CG ARG A 683 2.836 -11.740 -4.481 1.00 0.00 C ATOM 130 CD ARG A 683 1.330 -11.969 -4.352 1.00 0.00 C ATOM 131 NE ARG A 683 0.649 -10.706 -4.080 1.00 0.00 N ATOM 132 CZ ARG A 683 -0.681 -10.629 -4.003 1.00 0.00 C ATOM 133 NH1 ARG A 683 -1.426 -11.693 -4.172 1.00 0.00 N ATOM 134 NH2 ARG A 683 -1.247 -9.479 -3.758 1.00 0.00 N ATOM 0 H ARG A 683 4.080 -9.572 -7.563 1.00 0.00 H new ATOM 0 HA ARG A 683 4.870 -9.974 -4.892 1.00 0.00 H new ATOM 0 HB2 ARG A 683 2.516 -10.001 -5.725 1.00 0.00 H new ATOM 0 HB3 ARG A 683 2.843 -11.468 -6.626 1.00 0.00 H new ATOM 0 HG2 ARG A 683 3.356 -12.696 -4.541 1.00 0.00 H new ATOM 0 HG3 ARG A 683 3.213 -11.227 -3.597 1.00 0.00 H new ATOM 0 HD2 ARG A 683 0.942 -12.409 -5.270 1.00 0.00 H new ATOM 0 HD3 ARG A 683 1.130 -12.679 -3.549 1.00 0.00 H new ATOM 0 HE ARG A 683 1.204 -9.861 -3.945 1.00 0.00 H new ATOM 0 HH11 ARG A 683 -0.991 -12.595 -4.365 1.00 0.00 H new ATOM 0 HH12 ARG A 683 -2.441 -11.620 -4.110 1.00 0.00 H new ATOM 0 HH21 ARG A 683 -0.673 -8.646 -3.627 1.00 0.00 H new ATOM 0 HH22 ARG A 683 -2.263 -9.413 -3.698 1.00 0.00 H new ATOM 148 N ILE A 684 5.485 -12.476 -6.963 1.00 0.00 N ATOM 149 CA ILE A 684 6.251 -13.709 -7.105 1.00 0.00 C ATOM 150 C ILE A 684 7.717 -13.471 -6.764 1.00 0.00 C ATOM 151 O ILE A 684 8.312 -14.217 -5.985 1.00 0.00 O ATOM 152 CB ILE A 684 6.137 -14.232 -8.538 1.00 0.00 C ATOM 153 CG1 ILE A 684 4.706 -14.713 -8.791 1.00 0.00 C ATOM 154 CG2 ILE A 684 7.108 -15.398 -8.735 1.00 0.00 C ATOM 155 CD1 ILE A 684 4.513 -14.977 -10.286 1.00 0.00 C ATOM 0 H ILE A 684 5.003 -12.174 -7.810 1.00 0.00 H new ATOM 0 HA ILE A 684 5.845 -14.448 -6.415 1.00 0.00 H new ATOM 0 HB ILE A 684 6.383 -13.433 -9.237 1.00 0.00 H new ATOM 0 HG12 ILE A 684 4.511 -15.622 -8.222 1.00 0.00 H new ATOM 0 HG13 ILE A 684 3.993 -13.963 -8.448 1.00 0.00 H new ATOM 0 HG21 ILE A 684 7.027 -15.771 -9.756 1.00 0.00 H new ATOM 0 HG22 ILE A 684 8.127 -15.057 -8.553 1.00 0.00 H new ATOM 0 HG23 ILE A 684 6.863 -16.198 -8.036 1.00 0.00 H new ATOM 0 HD11 ILE A 684 3.494 -15.320 -10.466 1.00 0.00 H new ATOM 0 HD12 ILE A 684 4.691 -14.058 -10.844 1.00 0.00 H new ATOM 0 HD13 ILE A 684 5.216 -15.742 -10.614 1.00 0.00 H new ATOM 167 N PHE A 685 8.297 -12.430 -7.351 1.00 0.00 N ATOM 168 CA PHE A 685 9.696 -12.105 -7.099 1.00 0.00 C ATOM 169 C PHE A 685 9.929 -11.870 -5.611 1.00 0.00 C ATOM 170 O PHE A 685 10.930 -12.320 -5.050 1.00 0.00 O ATOM 171 CB PHE A 685 10.093 -10.854 -7.885 1.00 0.00 C ATOM 172 CG PHE A 685 11.540 -10.524 -7.610 1.00 0.00 C ATOM 173 CD1 PHE A 685 12.556 -11.236 -8.259 1.00 0.00 C ATOM 174 CD2 PHE A 685 11.867 -9.506 -6.706 1.00 0.00 C ATOM 175 CE1 PHE A 685 13.898 -10.930 -8.006 1.00 0.00 C ATOM 176 CE2 PHE A 685 13.208 -9.199 -6.452 1.00 0.00 C ATOM 177 CZ PHE A 685 14.225 -9.911 -7.101 1.00 0.00 C ATOM 0 H PHE A 685 7.824 -11.801 -8.000 1.00 0.00 H new ATOM 0 HA PHE A 685 10.310 -12.945 -7.424 1.00 0.00 H new ATOM 0 HB2 PHE A 685 9.943 -11.019 -8.952 1.00 0.00 H new ATOM 0 HB3 PHE A 685 9.457 -10.016 -7.600 1.00 0.00 H new ATOM 0 HD1 PHE A 685 12.304 -12.022 -8.955 1.00 0.00 H new ATOM 0 HD2 PHE A 685 11.083 -8.957 -6.204 1.00 0.00 H new ATOM 0 HE1 PHE A 685 14.681 -11.479 -8.508 1.00 0.00 H new ATOM 0 HE2 PHE A 685 13.459 -8.413 -5.755 1.00 0.00 H new ATOM 0 HZ PHE A 685 15.260 -9.675 -6.904 1.00 0.00 H new ATOM 187 N ILE A 686 9.001 -11.164 -4.975 1.00 0.00 N ATOM 188 CA ILE A 686 9.116 -10.878 -3.551 1.00 0.00 C ATOM 189 C ILE A 686 9.131 -12.172 -2.743 1.00 0.00 C ATOM 190 O ILE A 686 9.963 -12.354 -1.854 1.00 0.00 O ATOM 191 CB ILE A 686 7.957 -9.993 -3.090 1.00 0.00 C ATOM 192 CG1 ILE A 686 8.121 -8.590 -3.678 1.00 0.00 C ATOM 193 CG2 ILE A 686 7.954 -9.908 -1.563 1.00 0.00 C ATOM 194 CD1 ILE A 686 6.825 -7.799 -3.488 1.00 0.00 C ATOM 0 H ILE A 686 8.166 -10.782 -5.420 1.00 0.00 H new ATOM 0 HA ILE A 686 10.055 -10.349 -3.385 1.00 0.00 H new ATOM 0 HB ILE A 686 7.015 -10.423 -3.431 1.00 0.00 H new ATOM 0 HG12 ILE A 686 8.948 -8.075 -3.190 1.00 0.00 H new ATOM 0 HG13 ILE A 686 8.367 -8.655 -4.738 1.00 0.00 H new ATOM 0 HG21 ILE A 686 7.128 -9.277 -1.235 1.00 0.00 H new ATOM 0 HG22 ILE A 686 7.836 -10.907 -1.143 1.00 0.00 H new ATOM 0 HG23 ILE A 686 8.896 -9.479 -1.221 1.00 0.00 H new ATOM 0 HD11 ILE A 686 6.944 -6.800 -3.907 1.00 0.00 H new ATOM 0 HD12 ILE A 686 6.008 -8.311 -3.996 1.00 0.00 H new ATOM 0 HD13 ILE A 686 6.599 -7.722 -2.425 1.00 0.00 H new ATOM 206 N ILE A 687 8.205 -13.072 -3.063 1.00 0.00 N ATOM 207 CA ILE A 687 8.119 -14.347 -2.363 1.00 0.00 C ATOM 208 C ILE A 687 9.408 -15.144 -2.541 1.00 0.00 C ATOM 209 O ILE A 687 9.913 -15.747 -1.595 1.00 0.00 O ATOM 210 CB ILE A 687 6.939 -15.159 -2.897 1.00 0.00 C ATOM 211 CG1 ILE A 687 5.628 -14.482 -2.486 1.00 0.00 C ATOM 212 CG2 ILE A 687 6.984 -16.573 -2.315 1.00 0.00 C ATOM 213 CD1 ILE A 687 4.464 -15.124 -3.241 1.00 0.00 C ATOM 0 H ILE A 687 7.509 -12.942 -3.797 1.00 0.00 H new ATOM 0 HA ILE A 687 7.971 -14.147 -1.302 1.00 0.00 H new ATOM 0 HB ILE A 687 6.998 -15.212 -3.984 1.00 0.00 H new ATOM 0 HG12 ILE A 687 5.477 -14.581 -1.411 1.00 0.00 H new ATOM 0 HG13 ILE A 687 5.673 -13.415 -2.705 1.00 0.00 H new ATOM 0 HG21 ILE A 687 6.142 -17.151 -2.697 1.00 0.00 H new ATOM 0 HG22 ILE A 687 7.917 -17.056 -2.605 1.00 0.00 H new ATOM 0 HG23 ILE A 687 6.925 -16.521 -1.228 1.00 0.00 H new ATOM 0 HD11 ILE A 687 3.531 -14.642 -2.949 1.00 0.00 H new ATOM 0 HD12 ILE A 687 4.615 -15.002 -4.314 1.00 0.00 H new ATOM 0 HD13 ILE A 687 4.415 -16.186 -3.000 1.00 0.00 H new ATOM 225 N ILE A 688 9.934 -15.140 -3.762 1.00 0.00 N ATOM 226 CA ILE A 688 11.166 -15.864 -4.055 1.00 0.00 C ATOM 227 C ILE A 688 12.315 -15.340 -3.199 1.00 0.00 C ATOM 228 O ILE A 688 13.079 -16.115 -2.625 1.00 0.00 O ATOM 229 CB ILE A 688 11.521 -15.712 -5.535 1.00 0.00 C ATOM 230 CG1 ILE A 688 10.495 -16.469 -6.384 1.00 0.00 C ATOM 231 CG2 ILE A 688 12.915 -16.289 -5.788 1.00 0.00 C ATOM 232 CD1 ILE A 688 10.679 -16.098 -7.856 1.00 0.00 C ATOM 0 H ILE A 688 9.530 -14.648 -4.559 1.00 0.00 H new ATOM 0 HA ILE A 688 11.008 -16.918 -3.824 1.00 0.00 H new ATOM 0 HB ILE A 688 11.511 -14.656 -5.805 1.00 0.00 H new ATOM 0 HG12 ILE A 688 10.619 -17.544 -6.251 1.00 0.00 H new ATOM 0 HG13 ILE A 688 9.484 -16.221 -6.059 1.00 0.00 H new ATOM 0 HG21 ILE A 688 13.168 -16.181 -6.843 1.00 0.00 H new ATOM 0 HG22 ILE A 688 13.646 -15.753 -5.183 1.00 0.00 H new ATOM 0 HG23 ILE A 688 12.926 -17.345 -5.519 1.00 0.00 H new ATOM 0 HD11 ILE A 688 9.949 -16.636 -8.461 1.00 0.00 H new ATOM 0 HD12 ILE A 688 10.534 -15.025 -7.982 1.00 0.00 H new ATOM 0 HD13 ILE A 688 11.685 -16.368 -8.176 1.00 0.00 H new ATOM 244 N VAL A 689 12.431 -14.016 -3.119 1.00 0.00 N ATOM 245 CA VAL A 689 13.492 -13.399 -2.331 1.00 0.00 C ATOM 246 C VAL A 689 13.340 -13.753 -0.856 1.00 0.00 C ATOM 247 O VAL A 689 14.325 -13.990 -0.159 1.00 0.00 O ATOM 248 CB VAL A 689 13.452 -11.880 -2.502 1.00 0.00 C ATOM 249 CG1 VAL A 689 14.415 -11.228 -1.508 1.00 0.00 C ATOM 250 CG2 VAL A 689 13.871 -11.517 -3.928 1.00 0.00 C ATOM 0 H VAL A 689 11.809 -13.356 -3.586 1.00 0.00 H new ATOM 0 HA VAL A 689 14.450 -13.779 -2.685 1.00 0.00 H new ATOM 0 HB VAL A 689 12.440 -11.521 -2.316 1.00 0.00 H new ATOM 0 HG11 VAL A 689 14.386 -10.145 -1.630 1.00 0.00 H new ATOM 0 HG12 VAL A 689 14.119 -11.486 -0.491 1.00 0.00 H new ATOM 0 HG13 VAL A 689 15.427 -11.587 -1.693 1.00 0.00 H new ATOM 0 HG21 VAL A 689 13.843 -10.434 -4.051 1.00 0.00 H new ATOM 0 HG22 VAL A 689 14.883 -11.877 -4.113 1.00 0.00 H new ATOM 0 HG23 VAL A 689 13.186 -11.981 -4.638 1.00 0.00 H new ATOM 260 N GLY A 690 12.098 -13.783 -0.384 1.00 0.00 N ATOM 261 CA GLY A 690 11.830 -14.107 1.012 1.00 0.00 C ATOM 262 C GLY A 690 12.207 -15.555 1.310 1.00 0.00 C ATOM 263 O GLY A 690 12.742 -15.862 2.375 1.00 0.00 O ATOM 0 H GLY A 690 11.267 -13.588 -0.943 1.00 0.00 H new ATOM 0 HA2 GLY A 690 12.395 -13.438 1.661 1.00 0.00 H new ATOM 0 HA3 GLY A 690 10.774 -13.948 1.231 1.00 0.00 H new ATOM 267 N SER A 691 11.925 -16.441 0.360 1.00 0.00 N ATOM 268 CA SER A 691 12.240 -17.854 0.531 1.00 0.00 C ATOM 269 C SER A 691 13.748 -18.053 0.676 1.00 0.00 C ATOM 270 O SER A 691 14.204 -18.807 1.534 1.00 0.00 O ATOM 271 CB SER A 691 11.732 -18.651 -0.670 1.00 0.00 C ATOM 272 OG SER A 691 12.053 -20.024 -0.491 1.00 0.00 O ATOM 0 H SER A 691 11.483 -16.208 -0.529 1.00 0.00 H new ATOM 0 HA SER A 691 11.749 -18.210 1.437 1.00 0.00 H new ATOM 0 HB2 SER A 691 10.654 -18.528 -0.773 1.00 0.00 H new ATOM 0 HB3 SER A 691 12.185 -18.276 -1.588 1.00 0.00 H new ATOM 0 HG SER A 691 11.727 -20.539 -1.259 1.00 0.00 H new ATOM 278 N LEU A 692 14.512 -17.369 -0.169 1.00 0.00 N ATOM 279 CA LEU A 692 15.965 -17.479 -0.125 1.00 0.00 C ATOM 280 C LEU A 692 16.497 -16.999 1.222 1.00 0.00 C ATOM 281 O LEU A 692 17.356 -17.641 1.827 1.00 0.00 O ATOM 282 CB LEU A 692 16.584 -16.645 -1.254 1.00 0.00 C ATOM 283 CG LEU A 692 18.114 -16.734 -1.198 1.00 0.00 C ATOM 284 CD1 LEU A 692 18.558 -18.185 -1.396 1.00 0.00 C ATOM 285 CD2 LEU A 692 18.711 -15.867 -2.308 1.00 0.00 C ATOM 0 H LEU A 692 14.154 -16.738 -0.886 1.00 0.00 H new ATOM 0 HA LEU A 692 16.239 -18.526 -0.256 1.00 0.00 H new ATOM 0 HB2 LEU A 692 16.226 -17.003 -2.219 1.00 0.00 H new ATOM 0 HB3 LEU A 692 16.269 -15.605 -1.163 1.00 0.00 H new ATOM 0 HG LEU A 692 18.460 -16.381 -0.226 1.00 0.00 H new ATOM 0 HD11 LEU A 692 19.646 -18.241 -1.355 1.00 0.00 H new ATOM 0 HD12 LEU A 692 18.133 -18.806 -0.608 1.00 0.00 H new ATOM 0 HD13 LEU A 692 18.212 -18.542 -2.366 1.00 0.00 H new ATOM 0 HD21 LEU A 692 19.799 -15.927 -2.272 1.00 0.00 H new ATOM 0 HD22 LEU A 692 18.360 -16.223 -3.276 1.00 0.00 H new ATOM 0 HD23 LEU A 692 18.400 -14.832 -2.168 1.00 0.00 H new ATOM 297 N ILE A 693 15.978 -15.866 1.686 1.00 0.00 N ATOM 298 CA ILE A 693 16.406 -15.308 2.964 1.00 0.00 C ATOM 299 C ILE A 693 16.100 -16.276 4.103 1.00 0.00 C ATOM 300 O ILE A 693 16.925 -16.481 4.994 1.00 0.00 O ATOM 301 CB ILE A 693 15.685 -13.979 3.220 1.00 0.00 C ATOM 302 CG1 ILE A 693 16.172 -12.907 2.229 1.00 0.00 C ATOM 303 CG2 ILE A 693 15.961 -13.517 4.652 1.00 0.00 C ATOM 304 CD1 ILE A 693 17.593 -12.443 2.576 1.00 0.00 C ATOM 0 H ILE A 693 15.266 -15.320 1.200 1.00 0.00 H new ATOM 0 HA ILE A 693 17.482 -15.140 2.922 1.00 0.00 H new ATOM 0 HB ILE A 693 14.614 -14.125 3.081 1.00 0.00 H new ATOM 0 HG12 ILE A 693 16.154 -13.308 1.216 1.00 0.00 H new ATOM 0 HG13 ILE A 693 15.493 -12.055 2.247 1.00 0.00 H new ATOM 0 HG21 ILE A 693 15.449 -12.572 4.835 1.00 0.00 H new ATOM 0 HG22 ILE A 693 15.598 -14.268 5.353 1.00 0.00 H new ATOM 0 HG23 ILE A 693 17.034 -13.381 4.790 1.00 0.00 H new ATOM 0 HD11 ILE A 693 17.913 -11.686 1.861 1.00 0.00 H new ATOM 0 HD12 ILE A 693 17.603 -12.020 3.581 1.00 0.00 H new ATOM 0 HD13 ILE A 693 18.274 -13.293 2.534 1.00 0.00 H new ATOM 316 N GLY A 694 14.912 -16.870 4.066 1.00 0.00 N ATOM 317 CA GLY A 694 14.507 -17.816 5.099 1.00 0.00 C ATOM 318 C GLY A 694 15.423 -19.036 5.097 1.00 0.00 C ATOM 319 O GLY A 694 15.908 -19.460 6.146 1.00 0.00 O ATOM 0 H GLY A 694 14.216 -16.714 3.336 1.00 0.00 H new ATOM 0 HA2 GLY A 694 14.538 -17.332 6.075 1.00 0.00 H new ATOM 0 HA3 GLY A 694 13.476 -18.128 4.931 1.00 0.00 H new ATOM 323 N LEU A 695 15.652 -19.597 3.914 1.00 0.00 N ATOM 324 CA LEU A 695 16.512 -20.768 3.791 1.00 0.00 C ATOM 325 C LEU A 695 17.878 -20.496 4.411 1.00 0.00 C ATOM 326 O LEU A 695 18.407 -21.319 5.159 1.00 0.00 O ATOM 327 CB LEU A 695 16.685 -21.137 2.315 1.00 0.00 C ATOM 328 CG LEU A 695 15.372 -21.701 1.762 1.00 0.00 C ATOM 329 CD1 LEU A 695 15.475 -21.824 0.240 1.00 0.00 C ATOM 330 CD2 LEU A 695 15.111 -23.086 2.367 1.00 0.00 C ATOM 0 H LEU A 695 15.258 -19.263 3.034 1.00 0.00 H new ATOM 0 HA LEU A 695 16.043 -21.597 4.320 1.00 0.00 H new ATOM 0 HB2 LEU A 695 16.983 -20.258 1.744 1.00 0.00 H new ATOM 0 HB3 LEU A 695 17.482 -21.873 2.206 1.00 0.00 H new ATOM 0 HG LEU A 695 14.552 -21.032 2.022 1.00 0.00 H new ATOM 0 HD11 LEU A 695 14.542 -22.225 -0.157 1.00 0.00 H new ATOM 0 HD12 LEU A 695 15.660 -20.841 -0.193 1.00 0.00 H new ATOM 0 HD13 LEU A 695 16.296 -22.494 -0.016 1.00 0.00 H new ATOM 0 HD21 LEU A 695 14.177 -23.485 1.972 1.00 0.00 H new ATOM 0 HD22 LEU A 695 15.930 -23.757 2.108 1.00 0.00 H new ATOM 0 HD23 LEU A 695 15.040 -23.002 3.451 1.00 0.00 H new ATOM 342 N ARG A 696 18.442 -19.334 4.099 1.00 0.00 N ATOM 343 CA ARG A 696 19.749 -18.962 4.633 1.00 0.00 C ATOM 344 C ARG A 696 19.716 -18.933 6.158 1.00 0.00 C ATOM 345 O ARG A 696 20.597 -19.485 6.816 1.00 0.00 O ATOM 346 CB ARG A 696 20.158 -17.586 4.103 1.00 0.00 C ATOM 347 CG ARG A 696 21.540 -17.220 4.647 1.00 0.00 C ATOM 348 CD ARG A 696 21.961 -15.858 4.094 1.00 0.00 C ATOM 349 NE ARG A 696 21.051 -14.818 4.565 1.00 0.00 N ATOM 350 CZ ARG A 696 21.169 -14.275 5.779 1.00 0.00 C ATOM 351 NH1 ARG A 696 22.109 -14.667 6.602 1.00 0.00 N ATOM 352 NH2 ARG A 696 20.336 -13.341 6.151 1.00 0.00 N ATOM 0 H ARG A 696 18.020 -18.638 3.484 1.00 0.00 H new ATOM 0 HA ARG A 696 20.477 -19.706 4.311 1.00 0.00 H new ATOM 0 HB2 ARG A 696 20.175 -17.595 3.013 1.00 0.00 H new ATOM 0 HB3 ARG A 696 19.427 -16.836 4.404 1.00 0.00 H new ATOM 0 HG2 ARG A 696 21.518 -17.191 5.736 1.00 0.00 H new ATOM 0 HG3 ARG A 696 22.267 -17.980 4.363 1.00 0.00 H new ATOM 0 HD2 ARG A 696 22.979 -15.629 4.408 1.00 0.00 H new ATOM 0 HD3 ARG A 696 21.962 -15.884 3.004 1.00 0.00 H new ATOM 0 HE ARG A 696 20.304 -14.497 3.949 1.00 0.00 H new ATOM 0 HH11 ARG A 696 22.763 -15.396 6.319 1.00 0.00 H new ATOM 0 HH12 ARG A 696 22.187 -14.243 7.526 1.00 0.00 H new ATOM 0 HH21 ARG A 696 19.601 -13.031 5.516 1.00 0.00 H new ATOM 0 HH22 ARG A 696 20.420 -12.922 7.077 1.00 0.00 H new ATOM 366 N ILE A 697 18.696 -18.285 6.713 1.00 0.00 N ATOM 367 CA ILE A 697 18.563 -18.192 8.163 1.00 0.00 C ATOM 368 C ILE A 697 18.482 -19.582 8.786 1.00 0.00 C ATOM 369 O ILE A 697 19.148 -19.866 9.780 1.00 0.00 O ATOM 370 CB ILE A 697 17.308 -17.395 8.521 1.00 0.00 C ATOM 371 CG1 ILE A 697 17.503 -15.929 8.124 1.00 0.00 C ATOM 372 CG2 ILE A 697 17.058 -17.485 10.028 1.00 0.00 C ATOM 373 CD1 ILE A 697 16.167 -15.191 8.222 1.00 0.00 C ATOM 0 H ILE A 697 17.956 -17.821 6.187 1.00 0.00 H new ATOM 0 HA ILE A 697 19.442 -17.682 8.558 1.00 0.00 H new ATOM 0 HB ILE A 697 16.453 -17.806 7.985 1.00 0.00 H new ATOM 0 HG12 ILE A 697 18.239 -15.459 8.777 1.00 0.00 H new ATOM 0 HG13 ILE A 697 17.892 -15.865 7.108 1.00 0.00 H new ATOM 0 HG21 ILE A 697 16.163 -16.917 10.283 1.00 0.00 H new ATOM 0 HG22 ILE A 697 16.919 -18.528 10.312 1.00 0.00 H new ATOM 0 HG23 ILE A 697 17.914 -17.074 10.564 1.00 0.00 H new ATOM 0 HD11 ILE A 697 16.306 -14.148 7.939 1.00 0.00 H new ATOM 0 HD12 ILE A 697 15.445 -15.656 7.551 1.00 0.00 H new ATOM 0 HD13 ILE A 697 15.797 -15.243 9.246 1.00 0.00 H new ATOM 385 N VAL A 698 17.662 -20.442 8.195 1.00 0.00 N ATOM 386 CA VAL A 698 17.500 -21.802 8.702 1.00 0.00 C ATOM 387 C VAL A 698 18.840 -22.527 8.714 1.00 0.00 C ATOM 388 O VAL A 698 19.189 -23.193 9.690 1.00 0.00 O ATOM 389 CB VAL A 698 16.508 -22.571 7.827 1.00 0.00 C ATOM 390 CG1 VAL A 698 16.522 -24.049 8.218 1.00 0.00 C ATOM 391 CG2 VAL A 698 15.102 -22.003 8.033 1.00 0.00 C ATOM 0 H VAL A 698 17.102 -20.226 7.370 1.00 0.00 H new ATOM 0 HA VAL A 698 17.117 -21.749 9.721 1.00 0.00 H new ATOM 0 HB VAL A 698 16.792 -22.470 6.780 1.00 0.00 H new ATOM 0 HG11 VAL A 698 15.815 -24.597 7.595 1.00 0.00 H new ATOM 0 HG12 VAL A 698 17.523 -24.454 8.073 1.00 0.00 H new ATOM 0 HG13 VAL A 698 16.237 -24.151 9.265 1.00 0.00 H new ATOM 0 HG21 VAL A 698 14.394 -22.550 7.410 1.00 0.00 H new ATOM 0 HG22 VAL A 698 14.818 -22.105 9.080 1.00 0.00 H new ATOM 0 HG23 VAL A 698 15.091 -20.949 7.755 1.00 0.00 H new ATOM 401 N PHE A 699 19.587 -22.393 7.625 1.00 0.00 N ATOM 402 CA PHE A 699 20.890 -23.040 7.519 1.00 0.00 C ATOM 403 C PHE A 699 21.843 -22.491 8.574 1.00 0.00 C ATOM 404 O PHE A 699 22.582 -23.246 9.207 1.00 0.00 O ATOM 405 CB PHE A 699 21.479 -22.807 6.126 1.00 0.00 C ATOM 406 CG PHE A 699 22.820 -23.491 6.025 1.00 0.00 C ATOM 407 CD1 PHE A 699 22.886 -24.872 5.802 1.00 0.00 C ATOM 408 CD2 PHE A 699 23.998 -22.747 6.154 1.00 0.00 C ATOM 409 CE1 PHE A 699 24.130 -25.508 5.708 1.00 0.00 C ATOM 410 CE2 PHE A 699 25.243 -23.382 6.060 1.00 0.00 C ATOM 411 CZ PHE A 699 25.308 -24.762 5.837 1.00 0.00 C ATOM 0 H PHE A 699 19.316 -21.846 6.808 1.00 0.00 H new ATOM 0 HA PHE A 699 20.759 -24.110 7.682 1.00 0.00 H new ATOM 0 HB2 PHE A 699 20.803 -23.195 5.364 1.00 0.00 H new ATOM 0 HB3 PHE A 699 21.589 -21.739 5.940 1.00 0.00 H new ATOM 0 HD1 PHE A 699 21.977 -25.447 5.702 1.00 0.00 H new ATOM 0 HD2 PHE A 699 23.947 -21.682 6.326 1.00 0.00 H new ATOM 0 HE1 PHE A 699 24.181 -26.573 5.536 1.00 0.00 H new ATOM 0 HE2 PHE A 699 26.152 -22.807 6.160 1.00 0.00 H new ATOM 0 HZ PHE A 699 26.268 -25.252 5.764 1.00 0.00 H new ATOM 421 N ALA A 700 21.819 -21.177 8.761 1.00 0.00 N ATOM 422 CA ALA A 700 22.684 -20.538 9.745 1.00 0.00 C ATOM 423 C ALA A 700 22.350 -21.031 11.149 1.00 0.00 C ATOM 424 O ALA A 700 23.242 -21.305 11.951 1.00 0.00 O ATOM 425 CB ALA A 700 22.513 -19.020 9.682 1.00 0.00 C ATOM 0 H ALA A 700 21.214 -20.536 8.248 1.00 0.00 H new ATOM 0 HA ALA A 700 23.718 -20.797 9.516 1.00 0.00 H new ATOM 0 HB1 ALA A 700 23.163 -18.550 10.420 1.00 0.00 H new ATOM 0 HB2 ALA A 700 22.779 -18.665 8.686 1.00 0.00 H new ATOM 0 HB3 ALA A 700 21.476 -18.762 9.895 1.00 0.00 H new ATOM 431 N VAL A 701 21.058 -21.138 11.440 1.00 0.00 N ATOM 432 CA VAL A 701 20.618 -21.600 12.750 1.00 0.00 C ATOM 433 C VAL A 701 21.150 -23.000 13.031 1.00 0.00 C ATOM 434 O VAL A 701 21.618 -23.287 14.131 1.00 0.00 O ATOM 435 CB VAL A 701 19.089 -21.606 12.820 1.00 0.00 C ATOM 436 CG1 VAL A 701 18.640 -22.318 14.097 1.00 0.00 C ATOM 437 CG2 VAL A 701 18.572 -20.165 12.833 1.00 0.00 C ATOM 0 H VAL A 701 20.303 -20.913 10.792 1.00 0.00 H new ATOM 0 HA VAL A 701 21.010 -20.917 13.504 1.00 0.00 H new ATOM 0 HB VAL A 701 18.689 -22.128 11.951 1.00 0.00 H new ATOM 0 HG11 VAL A 701 17.551 -22.323 14.147 1.00 0.00 H new ATOM 0 HG12 VAL A 701 19.007 -23.344 14.090 1.00 0.00 H new ATOM 0 HG13 VAL A 701 19.041 -21.795 14.965 1.00 0.00 H new ATOM 0 HG21 VAL A 701 17.483 -20.170 12.883 1.00 0.00 H new ATOM 0 HG22 VAL A 701 18.973 -19.642 13.702 1.00 0.00 H new ATOM 0 HG23 VAL A 701 18.891 -19.656 11.924 1.00 0.00 H new ATOM 447 N LEU A 702 21.076 -23.866 12.025 1.00 0.00 N ATOM 448 CA LEU A 702 21.556 -25.236 12.171 1.00 0.00 C ATOM 449 C LEU A 702 23.063 -25.256 12.410 1.00 0.00 C ATOM 450 O LEU A 702 23.559 -26.018 13.239 1.00 0.00 O ATOM 451 CB LEU A 702 21.221 -26.050 10.919 1.00 0.00 C ATOM 452 CG LEU A 702 19.897 -26.800 11.115 1.00 0.00 C ATOM 453 CD1 LEU A 702 20.107 -27.970 12.081 1.00 0.00 C ATOM 454 CD2 LEU A 702 18.833 -25.852 11.684 1.00 0.00 C ATOM 0 H LEU A 702 20.691 -23.646 11.106 1.00 0.00 H new ATOM 0 HA LEU A 702 21.059 -25.682 13.032 1.00 0.00 H new ATOM 0 HB2 LEU A 702 21.149 -25.389 10.055 1.00 0.00 H new ATOM 0 HB3 LEU A 702 22.022 -26.759 10.712 1.00 0.00 H new ATOM 0 HG LEU A 702 19.558 -27.178 10.150 1.00 0.00 H new ATOM 0 HD11 LEU A 702 19.165 -28.501 12.219 1.00 0.00 H new ATOM 0 HD12 LEU A 702 20.852 -28.652 11.670 1.00 0.00 H new ATOM 0 HD13 LEU A 702 20.454 -27.590 13.042 1.00 0.00 H new ATOM 0 HD21 LEU A 702 17.897 -26.394 11.819 1.00 0.00 H new ATOM 0 HD22 LEU A 702 19.169 -25.463 12.645 1.00 0.00 H new ATOM 0 HD23 LEU A 702 18.676 -25.024 10.992 1.00 0.00 H new ATOM 466 N SER A 703 23.785 -24.413 11.679 1.00 0.00 N ATOM 467 CA SER A 703 25.235 -24.344 11.823 1.00 0.00 C ATOM 468 C SER A 703 25.612 -23.931 13.241 1.00 0.00 C ATOM 469 O SER A 703 26.543 -24.481 13.833 1.00 0.00 O ATOM 470 CB SER A 703 25.854 -23.376 10.811 1.00 0.00 C ATOM 471 OG SER A 703 25.414 -22.058 11.076 1.00 0.00 O ATOM 0 H SER A 703 23.395 -23.773 10.987 1.00 0.00 H new ATOM 0 HA SER A 703 25.633 -25.339 11.625 1.00 0.00 H new ATOM 0 HB2 SER A 703 26.942 -23.424 10.867 1.00 0.00 H new ATOM 0 HB3 SER A 703 25.574 -23.666 9.798 1.00 0.00 H new ATOM 0 HG SER A 703 24.496 -22.082 11.419 1.00 0.00 H new ATOM 477 N LEU A 704 24.885 -22.959 13.782 1.00 0.00 N ATOM 478 CA LEU A 704 25.150 -22.478 15.134 1.00 0.00 C ATOM 479 C LEU A 704 24.903 -23.581 16.158 1.00 0.00 C ATOM 480 O LEU A 704 25.672 -23.744 17.106 1.00 0.00 O ATOM 481 CB LEU A 704 24.250 -21.280 15.446 1.00 0.00 C ATOM 482 CG LEU A 704 24.681 -20.072 14.608 1.00 0.00 C ATOM 483 CD1 LEU A 704 23.634 -18.964 14.741 1.00 0.00 C ATOM 484 CD2 LEU A 704 26.035 -19.553 15.108 1.00 0.00 C ATOM 0 H LEU A 704 24.112 -22.491 13.309 1.00 0.00 H new ATOM 0 HA LEU A 704 26.195 -22.175 15.192 1.00 0.00 H new ATOM 0 HB2 LEU A 704 23.211 -21.530 15.233 1.00 0.00 H new ATOM 0 HB3 LEU A 704 24.308 -21.037 16.507 1.00 0.00 H new ATOM 0 HG LEU A 704 24.771 -20.370 13.563 1.00 0.00 H new ATOM 0 HD11 LEU A 704 23.938 -18.103 14.146 1.00 0.00 H new ATOM 0 HD12 LEU A 704 22.671 -19.329 14.385 1.00 0.00 H new ATOM 0 HD13 LEU A 704 23.547 -18.670 15.787 1.00 0.00 H new ATOM 0 HD21 LEU A 704 26.339 -18.694 14.510 1.00 0.00 H new ATOM 0 HD22 LEU A 704 25.947 -19.255 16.153 1.00 0.00 H new ATOM 0 HD23 LEU A 704 26.783 -20.341 15.017 1.00 0.00 H new ATOM 496 N VAL A 705 23.828 -24.336 15.962 1.00 0.00 N ATOM 497 CA VAL A 705 23.491 -25.419 16.878 1.00 0.00 C ATOM 498 C VAL A 705 24.569 -26.498 16.852 1.00 0.00 C ATOM 499 O VAL A 705 24.974 -27.011 17.896 1.00 0.00 O ATOM 500 CB VAL A 705 22.144 -26.032 16.490 1.00 0.00 C ATOM 501 CG1 VAL A 705 21.905 -27.301 17.311 1.00 0.00 C ATOM 502 CG2 VAL A 705 21.027 -25.025 16.772 1.00 0.00 C ATOM 0 H VAL A 705 23.179 -24.220 15.183 1.00 0.00 H new ATOM 0 HA VAL A 705 23.427 -25.010 17.886 1.00 0.00 H new ATOM 0 HB VAL A 705 22.150 -26.282 15.429 1.00 0.00 H new ATOM 0 HG11 VAL A 705 20.945 -27.738 17.035 1.00 0.00 H new ATOM 0 HG12 VAL A 705 22.701 -28.018 17.112 1.00 0.00 H new ATOM 0 HG13 VAL A 705 21.898 -27.052 18.372 1.00 0.00 H new ATOM 0 HG21 VAL A 705 20.067 -25.460 16.496 1.00 0.00 H new ATOM 0 HG22 VAL A 705 21.021 -24.776 17.833 1.00 0.00 H new ATOM 0 HG23 VAL A 705 21.197 -24.120 16.188 1.00 0.00 H new ATOM 512 N ASN A 706 25.032 -26.837 15.654 1.00 0.00 N ATOM 513 CA ASN A 706 26.065 -27.856 15.506 1.00 0.00 C ATOM 514 C ASN A 706 27.330 -27.448 16.253 1.00 0.00 C ATOM 515 O ASN A 706 27.959 -28.266 16.926 1.00 0.00 O ATOM 516 CB ASN A 706 26.389 -28.061 14.025 1.00 0.00 C ATOM 517 CG ASN A 706 27.417 -29.176 13.865 1.00 0.00 C ATOM 518 OD1 ASN A 706 27.172 -30.311 14.275 1.00 0.00 O ATOM 519 ND2 ASN A 706 28.560 -28.918 13.292 1.00 0.00 N ATOM 0 H ASN A 706 24.712 -26.425 14.778 1.00 0.00 H new ATOM 0 HA ASN A 706 25.691 -28.789 15.928 1.00 0.00 H new ATOM 0 HB2 ASN A 706 25.481 -28.311 13.477 1.00 0.00 H new ATOM 0 HB3 ASN A 706 26.775 -27.136 13.597 1.00 0.00 H new ATOM 0 HD21 ASN A 706 29.254 -29.657 13.182 1.00 0.00 H new ATOM 0 HD22 ASN A 706 28.760 -27.977 12.953 1.00 0.00 H new ATOM 526 N ARG A 707 27.699 -26.178 16.131 1.00 0.00 N ATOM 527 CA ARG A 707 28.892 -25.670 16.798 1.00 0.00 C ATOM 528 C ARG A 707 28.738 -25.757 18.314 1.00 0.00 C ATOM 529 O ARG A 707 29.648 -26.196 19.016 1.00 0.00 O ATOM 530 CB ARG A 707 29.141 -24.217 16.390 1.00 0.00 C ATOM 531 CG ARG A 707 29.578 -24.165 14.925 1.00 0.00 C ATOM 532 CD ARG A 707 29.803 -22.711 14.509 1.00 0.00 C ATOM 533 NE ARG A 707 30.228 -22.643 13.114 1.00 0.00 N ATOM 534 CZ ARG A 707 30.492 -21.481 12.515 1.00 0.00 C ATOM 535 NH1 ARG A 707 30.378 -20.350 13.166 1.00 0.00 N ATOM 536 NH2 ARG A 707 30.868 -21.470 11.266 1.00 0.00 N ATOM 0 H ARG A 707 27.193 -25.485 15.580 1.00 0.00 H new ATOM 0 HA ARG A 707 29.742 -26.282 16.496 1.00 0.00 H new ATOM 0 HB2 ARG A 707 28.235 -23.628 16.531 1.00 0.00 H new ATOM 0 HB3 ARG A 707 29.909 -23.776 17.025 1.00 0.00 H new ATOM 0 HG2 ARG A 707 30.494 -24.739 14.788 1.00 0.00 H new ATOM 0 HG3 ARG A 707 28.818 -24.622 14.292 1.00 0.00 H new ATOM 0 HD2 ARG A 707 28.884 -22.141 14.645 1.00 0.00 H new ATOM 0 HD3 ARG A 707 30.558 -22.255 15.149 1.00 0.00 H new ATOM 0 HE ARG A 707 30.326 -23.508 12.583 1.00 0.00 H new ATOM 0 HH11 ARG A 707 30.084 -20.351 14.143 1.00 0.00 H new ATOM 0 HH12 ARG A 707 30.583 -19.468 12.696 1.00 0.00 H new ATOM 0 HH21 ARG A 707 30.959 -22.347 10.753 1.00 0.00 H new ATOM 0 HH22 ARG A 707 31.071 -20.584 10.802 1.00 0.00 H new ATOM 550 N VAL A 708 27.579 -25.333 18.811 1.00 0.00 N ATOM 551 CA VAL A 708 27.320 -25.366 20.247 1.00 0.00 C ATOM 552 C VAL A 708 27.404 -26.795 20.772 1.00 0.00 C ATOM 553 O VAL A 708 27.934 -27.036 21.856 1.00 0.00 O ATOM 554 CB VAL A 708 25.931 -24.793 20.539 1.00 0.00 C ATOM 555 CG1 VAL A 708 25.575 -25.041 22.006 1.00 0.00 C ATOM 556 CG2 VAL A 708 25.934 -23.288 20.264 1.00 0.00 C ATOM 0 H VAL A 708 26.812 -24.966 18.247 1.00 0.00 H new ATOM 0 HA VAL A 708 28.075 -24.761 20.749 1.00 0.00 H new ATOM 0 HB VAL A 708 25.195 -25.279 19.899 1.00 0.00 H new ATOM 0 HG11 VAL A 708 24.586 -24.633 22.214 1.00 0.00 H new ATOM 0 HG12 VAL A 708 25.575 -26.113 22.204 1.00 0.00 H new ATOM 0 HG13 VAL A 708 26.311 -24.554 22.646 1.00 0.00 H new ATOM 0 HG21 VAL A 708 24.945 -22.878 20.471 1.00 0.00 H new ATOM 0 HG22 VAL A 708 26.670 -22.802 20.905 1.00 0.00 H new ATOM 0 HG23 VAL A 708 26.189 -23.110 19.219 1.00 0.00 H new ATOM 566 N ARG A 709 26.878 -27.738 19.997 1.00 0.00 N ATOM 567 CA ARG A 709 26.902 -29.141 20.394 1.00 0.00 C ATOM 568 C ARG A 709 28.291 -29.733 20.192 1.00 0.00 C ATOM 569 O ARG A 709 28.693 -30.658 20.895 1.00 0.00 O ATOM 570 CB ARG A 709 25.886 -29.935 19.566 1.00 0.00 C ATOM 571 CG ARG A 709 24.470 -29.417 19.836 1.00 0.00 C ATOM 572 CD ARG A 709 24.042 -29.778 21.260 1.00 0.00 C ATOM 573 NE ARG A 709 22.636 -29.441 21.463 1.00 0.00 N ATOM 574 CZ ARG A 709 22.029 -29.641 22.634 1.00 0.00 C ATOM 575 NH1 ARG A 709 22.680 -30.150 23.649 1.00 0.00 N ATOM 576 NH2 ARG A 709 20.769 -29.324 22.769 1.00 0.00 N ATOM 0 H ARG A 709 26.433 -27.558 19.097 1.00 0.00 H new ATOM 0 HA ARG A 709 26.642 -29.203 21.451 1.00 0.00 H new ATOM 0 HB2 ARG A 709 26.119 -29.844 18.505 1.00 0.00 H new ATOM 0 HB3 ARG A 709 25.949 -30.994 19.817 1.00 0.00 H new ATOM 0 HG2 ARG A 709 24.438 -28.336 19.701 1.00 0.00 H new ATOM 0 HG3 ARG A 709 23.773 -29.849 19.118 1.00 0.00 H new ATOM 0 HD2 ARG A 709 24.198 -30.842 21.436 1.00 0.00 H new ATOM 0 HD3 ARG A 709 24.660 -29.242 21.980 1.00 0.00 H new ATOM 0 HE ARG A 709 22.104 -29.042 20.689 1.00 0.00 H new ATOM 0 HH11 ARG A 709 23.664 -30.399 23.550 1.00 0.00 H new ATOM 0 HH12 ARG A 709 22.203 -30.297 24.539 1.00 0.00 H new ATOM 0 HH21 ARG A 709 20.256 -28.926 21.982 1.00 0.00 H new ATOM 0 HH22 ARG A 709 20.298 -29.474 23.661 1.00 0.00 H new