USER MOD reduce.3.24.130724 H: found=0, std=0, add=787, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 785 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 1 MET CE :methyl -141:sc= -0.145 (180deg=-0.823) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot -140:sc= 1.14 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ -170:sc=-0.00841 (180deg=-0.158) USER MOD Single : A 35 THR OG1 : rot 180:sc= -2.04! USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot 34:sc= 0.222 USER MOD Single : A 66 LYS NZ :NH3+ -140:sc= -2.62! (180deg=-5.52!) USER MOD Single : A 68 SER OG : rot 20:sc= 0.663 USER MOD Single : A 70 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 LYS NZ :NH3+ -167:sc= -0.0534 (180deg=-0.28) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 8:sc= 0.682 USER MOD Single : A 98 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.1) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.053 -17.908 5.716 1.00 0.00 N ATOM 2 CA MET A 1 0.238 -16.809 6.225 1.00 0.00 C ATOM 3 C MET A 1 1.061 -15.526 6.360 1.00 0.00 C ATOM 4 O MET A 1 1.028 -14.862 7.395 1.00 0.00 O ATOM 5 CB MET A 1 -0.373 -17.191 7.577 1.00 0.00 C ATOM 6 CG MET A 1 -1.387 -16.184 8.100 1.00 0.00 C ATOM 7 SD MET A 1 -2.094 -16.673 9.685 1.00 0.00 S ATOM 8 CE MET A 1 -2.842 -18.243 9.255 1.00 0.00 C ATOM 0 H1 MET A 1 0.469 -18.765 5.635 1.00 0.00 H new ATOM 0 H2 MET A 1 1.430 -17.656 4.780 1.00 0.00 H new ATOM 0 H3 MET A 1 1.841 -18.087 6.370 1.00 0.00 H new ATOM 0 HA MET A 1 -0.563 -16.621 5.510 1.00 0.00 H new ATOM 0 HB2 MET A 1 -0.856 -18.164 7.485 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.427 -17.300 8.309 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.907 -15.211 8.205 1.00 0.00 H new ATOM 0 HG3 MET A 1 -2.188 -16.067 7.370 1.00 0.00 H new ATOM 0 HE1 MET A 1 -3.799 -18.343 9.768 1.00 0.00 H new ATOM 0 HE2 MET A 1 -3.002 -18.287 8.178 1.00 0.00 H new ATOM 0 HE3 MET A 1 -2.182 -19.056 9.557 1.00 0.00 H new ATOM 18 N ARG A 2 1.800 -15.181 5.308 1.00 0.00 N ATOM 19 CA ARG A 2 2.625 -13.979 5.317 1.00 0.00 C ATOM 20 C ARG A 2 1.896 -12.813 4.656 1.00 0.00 C ATOM 21 O ARG A 2 1.340 -12.956 3.568 1.00 0.00 O ATOM 22 CB ARG A 2 3.950 -14.239 4.599 1.00 0.00 C ATOM 23 CG ARG A 2 4.790 -15.327 5.247 1.00 0.00 C ATOM 24 CD ARG A 2 6.100 -15.535 4.504 1.00 0.00 C ATOM 25 NE ARG A 2 6.928 -16.563 5.131 1.00 0.00 N ATOM 26 CZ ARG A 2 8.126 -16.930 4.679 1.00 0.00 C ATOM 27 NH1 ARG A 2 8.638 -16.354 3.598 1.00 0.00 N ATOM 28 NH2 ARG A 2 8.812 -17.873 5.307 1.00 0.00 N ATOM 0 H ARG A 2 1.843 -15.717 4.441 1.00 0.00 H new ATOM 0 HA ARG A 2 2.827 -13.716 6.355 1.00 0.00 H new ATOM 0 HB2 ARG A 2 3.745 -14.517 3.565 1.00 0.00 H new ATOM 0 HB3 ARG A 2 4.526 -13.314 4.572 1.00 0.00 H new ATOM 0 HG2 ARG A 2 4.997 -15.060 6.283 1.00 0.00 H new ATOM 0 HG3 ARG A 2 4.228 -16.261 5.264 1.00 0.00 H new ATOM 0 HD2 ARG A 2 5.891 -15.818 3.472 1.00 0.00 H new ATOM 0 HD3 ARG A 2 6.651 -14.595 4.471 1.00 0.00 H new ATOM 0 HE ARG A 2 6.567 -17.027 5.964 1.00 0.00 H new ATOM 0 HH11 ARG A 2 8.114 -15.628 3.110 1.00 0.00 H new ATOM 0 HH12 ARG A 2 9.556 -16.638 3.255 1.00 0.00 H new ATOM 0 HH21 ARG A 2 8.423 -18.319 6.138 1.00 0.00 H new ATOM 0 HH22 ARG A 2 9.729 -18.153 4.960 1.00 0.00 H new ATOM 42 N VAL A 3 1.904 -11.659 5.317 1.00 0.00 N ATOM 43 CA VAL A 3 1.241 -10.473 4.783 1.00 0.00 C ATOM 44 C VAL A 3 2.202 -9.288 4.726 1.00 0.00 C ATOM 45 O VAL A 3 2.898 -8.997 5.698 1.00 0.00 O ATOM 46 CB VAL A 3 0.009 -10.084 5.630 1.00 0.00 C ATOM 47 CG1 VAL A 3 0.422 -9.654 7.030 1.00 0.00 C ATOM 48 CG2 VAL A 3 -0.789 -8.989 4.940 1.00 0.00 C ATOM 0 H VAL A 3 2.360 -11.520 6.219 1.00 0.00 H new ATOM 0 HA VAL A 3 0.912 -10.721 3.774 1.00 0.00 H new ATOM 0 HB VAL A 3 -0.628 -10.963 5.726 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -0.465 -9.386 7.605 1.00 0.00 H new ATOM 0 HG12 VAL A 3 0.940 -10.475 7.525 1.00 0.00 H new ATOM 0 HG13 VAL A 3 1.087 -8.792 6.965 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -1.653 -8.728 5.551 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -0.160 -8.109 4.807 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -1.127 -9.344 3.966 1.00 0.00 H new ATOM 58 N GLY A 4 2.227 -8.604 3.588 1.00 0.00 N ATOM 59 CA GLY A 4 3.100 -7.454 3.437 1.00 0.00 C ATOM 60 C GLY A 4 2.517 -6.210 4.078 1.00 0.00 C ATOM 61 O GLY A 4 1.382 -5.832 3.790 1.00 0.00 O ATOM 0 H GLY A 4 1.660 -8.824 2.769 1.00 0.00 H new ATOM 0 HA2 GLY A 4 4.069 -7.673 3.886 1.00 0.00 H new ATOM 0 HA3 GLY A 4 3.274 -7.268 2.377 1.00 0.00 H new ATOM 65 N ALA A 5 3.290 -5.565 4.946 1.00 0.00 N ATOM 66 CA ALA A 5 2.834 -4.358 5.623 1.00 0.00 C ATOM 67 C ALA A 5 3.572 -3.127 5.107 1.00 0.00 C ATOM 68 O ALA A 5 4.799 -3.119 5.026 1.00 0.00 O ATOM 69 CB ALA A 5 3.018 -4.495 7.127 1.00 0.00 C ATOM 0 H ALA A 5 4.234 -5.858 5.196 1.00 0.00 H new ATOM 0 HA ALA A 5 1.773 -4.229 5.408 1.00 0.00 H new ATOM 0 HB1 ALA A 5 2.673 -3.586 7.620 1.00 0.00 H new ATOM 0 HB2 ALA A 5 2.440 -5.345 7.488 1.00 0.00 H new ATOM 0 HB3 ALA A 5 4.073 -4.652 7.352 1.00 0.00 H new ATOM 75 N LEU A 6 2.816 -2.091 4.759 1.00 0.00 N ATOM 76 CA LEU A 6 3.405 -0.856 4.250 1.00 0.00 C ATOM 77 C LEU A 6 3.042 0.334 5.132 1.00 0.00 C ATOM 78 O LEU A 6 1.895 0.486 5.553 1.00 0.00 O ATOM 79 CB LEU A 6 2.944 -0.599 2.815 1.00 0.00 C ATOM 80 CG LEU A 6 3.418 -1.629 1.787 1.00 0.00 C ATOM 81 CD1 LEU A 6 2.849 -1.311 0.414 1.00 0.00 C ATOM 82 CD2 LEU A 6 4.939 -1.673 1.738 1.00 0.00 C ATOM 0 H LEU A 6 1.798 -2.081 4.819 1.00 0.00 H new ATOM 0 HA LEU A 6 4.489 -0.974 4.263 1.00 0.00 H new ATOM 0 HB2 LEU A 6 1.855 -0.568 2.800 1.00 0.00 H new ATOM 0 HB3 LEU A 6 3.295 0.386 2.508 1.00 0.00 H new ATOM 0 HG LEU A 6 3.055 -2.611 2.091 1.00 0.00 H new ATOM 0 HD11 LEU A 6 3.196 -2.053 -0.305 1.00 0.00 H new ATOM 0 HD12 LEU A 6 1.760 -1.330 0.458 1.00 0.00 H new ATOM 0 HD13 LEU A 6 3.182 -0.321 0.102 1.00 0.00 H new ATOM 0 HD21 LEU A 6 5.258 -2.411 1.002 1.00 0.00 H new ATOM 0 HD22 LEU A 6 5.323 -0.692 1.458 1.00 0.00 H new ATOM 0 HD23 LEU A 6 5.327 -1.948 2.719 1.00 0.00 H new ATOM 94 N ASP A 7 4.032 1.178 5.403 1.00 0.00 N ATOM 95 CA ASP A 7 3.832 2.364 6.230 1.00 0.00 C ATOM 96 C ASP A 7 4.738 3.495 5.755 1.00 0.00 C ATOM 97 O ASP A 7 5.892 3.266 5.409 1.00 0.00 O ATOM 98 CB ASP A 7 4.115 2.045 7.699 1.00 0.00 C ATOM 99 CG ASP A 7 5.555 1.631 7.938 1.00 0.00 C ATOM 100 OD1 ASP A 7 6.459 2.451 7.675 1.00 0.00 O ATOM 101 OD2 ASP A 7 5.778 0.487 8.388 1.00 0.00 O ATOM 0 H ASP A 7 4.986 1.062 5.060 1.00 0.00 H new ATOM 0 HA ASP A 7 2.793 2.681 6.137 1.00 0.00 H new ATOM 0 HB2 ASP A 7 3.886 2.920 8.308 1.00 0.00 H new ATOM 0 HB3 ASP A 7 3.451 1.245 8.028 1.00 0.00 H new ATOM 106 N VAL A 8 4.207 4.714 5.737 1.00 0.00 N ATOM 107 CA VAL A 8 4.978 5.872 5.294 1.00 0.00 C ATOM 108 C VAL A 8 5.336 6.789 6.461 1.00 0.00 C ATOM 109 O VAL A 8 4.489 7.104 7.297 1.00 0.00 O ATOM 110 CB VAL A 8 4.209 6.685 4.234 1.00 0.00 C ATOM 111 CG1 VAL A 8 3.949 5.836 2.998 1.00 0.00 C ATOM 112 CG2 VAL A 8 2.902 7.219 4.808 1.00 0.00 C ATOM 0 H VAL A 8 3.251 4.925 6.022 1.00 0.00 H new ATOM 0 HA VAL A 8 5.896 5.484 4.854 1.00 0.00 H new ATOM 0 HB VAL A 8 4.823 7.537 3.942 1.00 0.00 H new ATOM 0 HG11 VAL A 8 3.405 6.425 2.260 1.00 0.00 H new ATOM 0 HG12 VAL A 8 4.899 5.510 2.574 1.00 0.00 H new ATOM 0 HG13 VAL A 8 3.356 4.964 3.274 1.00 0.00 H new ATOM 0 HG21 VAL A 8 2.375 7.790 4.043 1.00 0.00 H new ATOM 0 HG22 VAL A 8 2.279 6.385 5.132 1.00 0.00 H new ATOM 0 HG23 VAL A 8 3.116 7.865 5.660 1.00 0.00 H new ATOM 122 N GLY A 9 6.595 7.218 6.508 1.00 0.00 N ATOM 123 CA GLY A 9 7.038 8.097 7.574 1.00 0.00 C ATOM 124 C GLY A 9 8.490 8.516 7.431 1.00 0.00 C ATOM 125 O GLY A 9 9.369 7.679 7.216 1.00 0.00 O ATOM 0 H GLY A 9 7.314 6.972 5.828 1.00 0.00 H new ATOM 0 HA2 GLY A 9 6.408 8.987 7.589 1.00 0.00 H new ATOM 0 HA3 GLY A 9 6.903 7.594 8.532 1.00 0.00 H new ATOM 129 N GLU A 10 8.740 9.816 7.558 1.00 0.00 N ATOM 130 CA GLU A 10 10.092 10.359 7.451 1.00 0.00 C ATOM 131 C GLU A 10 10.734 9.994 6.119 1.00 0.00 C ATOM 132 O GLU A 10 11.835 9.447 6.072 1.00 0.00 O ATOM 133 CB GLU A 10 10.958 9.865 8.614 1.00 0.00 C ATOM 134 CG GLU A 10 12.335 10.513 8.672 1.00 0.00 C ATOM 135 CD GLU A 10 13.159 10.021 9.845 1.00 0.00 C ATOM 136 OE1 GLU A 10 13.421 8.803 9.919 1.00 0.00 O ATOM 137 OE2 GLU A 10 13.545 10.857 10.690 1.00 0.00 O ATOM 0 H GLU A 10 8.020 10.517 7.736 1.00 0.00 H new ATOM 0 HA GLU A 10 10.021 11.446 7.500 1.00 0.00 H new ATOM 0 HB2 GLU A 10 10.436 10.058 9.551 1.00 0.00 H new ATOM 0 HB3 GLU A 10 11.078 8.785 8.532 1.00 0.00 H new ATOM 0 HG2 GLU A 10 12.869 10.307 7.745 1.00 0.00 H new ATOM 0 HG3 GLU A 10 12.221 11.595 8.740 1.00 0.00 H new ATOM 144 N ALA A 11 10.036 10.307 5.037 1.00 0.00 N ATOM 145 CA ALA A 11 10.527 10.026 3.694 1.00 0.00 C ATOM 146 C ALA A 11 11.019 8.587 3.569 1.00 0.00 C ATOM 147 O ALA A 11 11.989 8.311 2.865 1.00 0.00 O ATOM 148 CB ALA A 11 11.637 10.998 3.325 1.00 0.00 C ATOM 0 H ALA A 11 9.122 10.759 5.063 1.00 0.00 H new ATOM 0 HA ALA A 11 9.696 10.155 3.000 1.00 0.00 H new ATOM 0 HB1 ALA A 11 11.995 10.777 2.319 1.00 0.00 H new ATOM 0 HB2 ALA A 11 11.253 12.018 3.358 1.00 0.00 H new ATOM 0 HB3 ALA A 11 12.459 10.897 4.033 1.00 0.00 H new ATOM 154 N ARG A 12 10.339 7.675 4.254 1.00 0.00 N ATOM 155 CA ARG A 12 10.707 6.267 4.222 1.00 0.00 C ATOM 156 C ARG A 12 9.487 5.387 4.456 1.00 0.00 C ATOM 157 O ARG A 12 8.627 5.704 5.278 1.00 0.00 O ATOM 158 CB ARG A 12 11.771 5.977 5.284 1.00 0.00 C ATOM 159 CG ARG A 12 12.212 4.522 5.327 1.00 0.00 C ATOM 160 CD ARG A 12 13.237 4.285 6.422 1.00 0.00 C ATOM 161 NE ARG A 12 12.712 4.621 7.744 1.00 0.00 N ATOM 162 CZ ARG A 12 13.410 4.508 8.872 1.00 0.00 C ATOM 163 NH1 ARG A 12 14.661 4.067 8.845 1.00 0.00 N ATOM 164 NH2 ARG A 12 12.855 4.835 10.032 1.00 0.00 N ATOM 0 H ARG A 12 9.530 7.887 4.838 1.00 0.00 H new ATOM 0 HA ARG A 12 11.114 6.041 3.237 1.00 0.00 H new ATOM 0 HB2 ARG A 12 12.641 6.606 5.095 1.00 0.00 H new ATOM 0 HB3 ARG A 12 11.381 6.258 6.262 1.00 0.00 H new ATOM 0 HG2 ARG A 12 11.345 3.882 5.494 1.00 0.00 H new ATOM 0 HG3 ARG A 12 12.636 4.240 4.363 1.00 0.00 H new ATOM 0 HD2 ARG A 12 13.546 3.240 6.409 1.00 0.00 H new ATOM 0 HD3 ARG A 12 14.126 4.883 6.222 1.00 0.00 H new ATOM 0 HE ARG A 12 11.753 4.963 7.806 1.00 0.00 H new ATOM 0 HH11 ARG A 12 15.093 3.812 7.957 1.00 0.00 H new ATOM 0 HH12 ARG A 12 15.191 3.983 9.713 1.00 0.00 H new ATOM 0 HH21 ARG A 12 11.893 5.173 10.060 1.00 0.00 H new ATOM 0 HH22 ARG A 12 13.390 4.748 10.896 1.00 0.00 H new ATOM 178 N ILE A 13 9.420 4.277 3.731 1.00 0.00 N ATOM 179 CA ILE A 13 8.306 3.351 3.865 1.00 0.00 C ATOM 180 C ILE A 13 8.727 2.101 4.634 1.00 0.00 C ATOM 181 O ILE A 13 9.716 1.454 4.292 1.00 0.00 O ATOM 182 CB ILE A 13 7.744 2.946 2.486 1.00 0.00 C ATOM 183 CG1 ILE A 13 7.283 4.186 1.718 1.00 0.00 C ATOM 184 CG2 ILE A 13 6.594 1.960 2.643 1.00 0.00 C ATOM 185 CD1 ILE A 13 6.727 3.875 0.345 1.00 0.00 C ATOM 0 H ILE A 13 10.123 3.998 3.046 1.00 0.00 H new ATOM 0 HA ILE A 13 7.523 3.865 4.422 1.00 0.00 H new ATOM 0 HB ILE A 13 8.537 2.458 1.919 1.00 0.00 H new ATOM 0 HG12 ILE A 13 6.521 4.702 2.301 1.00 0.00 H new ATOM 0 HG13 ILE A 13 8.123 4.872 1.614 1.00 0.00 H new ATOM 0 HG21 ILE A 13 6.212 1.687 1.659 1.00 0.00 H new ATOM 0 HG22 ILE A 13 6.949 1.066 3.155 1.00 0.00 H new ATOM 0 HG23 ILE A 13 5.797 2.421 3.227 1.00 0.00 H new ATOM 0 HD11 ILE A 13 6.420 4.801 -0.142 1.00 0.00 H new ATOM 0 HD12 ILE A 13 7.494 3.386 -0.256 1.00 0.00 H new ATOM 0 HD13 ILE A 13 5.866 3.214 0.442 1.00 0.00 H new ATOM 197 N GLY A 14 7.971 1.768 5.677 1.00 0.00 N ATOM 198 CA GLY A 14 8.286 0.599 6.479 1.00 0.00 C ATOM 199 C GLY A 14 7.810 -0.693 5.845 1.00 0.00 C ATOM 200 O GLY A 14 6.676 -0.779 5.371 1.00 0.00 O ATOM 0 H GLY A 14 7.147 2.287 5.981 1.00 0.00 H new ATOM 0 HA2 GLY A 14 9.364 0.548 6.631 1.00 0.00 H new ATOM 0 HA3 GLY A 14 7.830 0.705 7.463 1.00 0.00 H new ATOM 204 N LEU A 15 8.679 -1.700 5.841 1.00 0.00 N ATOM 205 CA LEU A 15 8.346 -3.000 5.268 1.00 0.00 C ATOM 206 C LEU A 15 8.288 -4.073 6.350 1.00 0.00 C ATOM 207 O LEU A 15 9.169 -4.158 7.204 1.00 0.00 O ATOM 208 CB LEU A 15 9.370 -3.395 4.204 1.00 0.00 C ATOM 209 CG LEU A 15 9.422 -2.477 2.982 1.00 0.00 C ATOM 210 CD1 LEU A 15 10.471 -2.965 1.995 1.00 0.00 C ATOM 211 CD2 LEU A 15 8.055 -2.401 2.318 1.00 0.00 C ATOM 0 H LEU A 15 9.620 -1.640 6.229 1.00 0.00 H new ATOM 0 HA LEU A 15 7.363 -2.919 4.804 1.00 0.00 H new ATOM 0 HB2 LEU A 15 10.358 -3.419 4.664 1.00 0.00 H new ATOM 0 HB3 LEU A 15 9.150 -4.409 3.869 1.00 0.00 H new ATOM 0 HG LEU A 15 9.701 -1.476 3.311 1.00 0.00 H new ATOM 0 HD11 LEU A 15 10.495 -2.301 1.131 1.00 0.00 H new ATOM 0 HD12 LEU A 15 11.449 -2.970 2.476 1.00 0.00 H new ATOM 0 HD13 LEU A 15 10.222 -3.975 1.669 1.00 0.00 H new ATOM 0 HD21 LEU A 15 8.108 -1.744 1.450 1.00 0.00 H new ATOM 0 HD22 LEU A 15 7.749 -3.398 2.000 1.00 0.00 H new ATOM 0 HD23 LEU A 15 7.327 -2.007 3.027 1.00 0.00 H new ATOM 223 N ALA A 16 7.238 -4.887 6.313 1.00 0.00 N ATOM 224 CA ALA A 16 7.059 -5.952 7.292 1.00 0.00 C ATOM 225 C ALA A 16 6.293 -7.126 6.689 1.00 0.00 C ATOM 226 O ALA A 16 5.454 -6.944 5.807 1.00 0.00 O ATOM 227 CB ALA A 16 6.335 -5.422 8.520 1.00 0.00 C ATOM 0 H ALA A 16 6.497 -4.829 5.614 1.00 0.00 H new ATOM 0 HA ALA A 16 8.045 -6.309 7.591 1.00 0.00 H new ATOM 0 HB1 ALA A 16 6.208 -6.227 9.243 1.00 0.00 H new ATOM 0 HB2 ALA A 16 6.920 -4.620 8.969 1.00 0.00 H new ATOM 0 HB3 ALA A 16 5.357 -5.038 8.229 1.00 0.00 H new ATOM 233 N VAL A 17 6.592 -8.329 7.168 1.00 0.00 N ATOM 234 CA VAL A 17 5.932 -9.528 6.670 1.00 0.00 C ATOM 235 C VAL A 17 5.629 -10.505 7.803 1.00 0.00 C ATOM 236 O VAL A 17 6.530 -10.946 8.515 1.00 0.00 O ATOM 237 CB VAL A 17 6.794 -10.240 5.608 1.00 0.00 C ATOM 238 CG1 VAL A 17 6.067 -11.451 5.043 1.00 0.00 C ATOM 239 CG2 VAL A 17 7.176 -9.274 4.497 1.00 0.00 C ATOM 0 H VAL A 17 7.284 -8.498 7.898 1.00 0.00 H new ATOM 0 HA VAL A 17 4.995 -9.207 6.215 1.00 0.00 H new ATOM 0 HB VAL A 17 7.708 -10.590 6.088 1.00 0.00 H new ATOM 0 HG11 VAL A 17 6.695 -11.937 4.296 1.00 0.00 H new ATOM 0 HG12 VAL A 17 5.851 -12.154 5.848 1.00 0.00 H new ATOM 0 HG13 VAL A 17 5.133 -11.132 4.580 1.00 0.00 H new ATOM 0 HG21 VAL A 17 7.784 -9.793 3.756 1.00 0.00 H new ATOM 0 HG22 VAL A 17 6.273 -8.891 4.021 1.00 0.00 H new ATOM 0 HG23 VAL A 17 7.745 -8.444 4.916 1.00 0.00 H new ATOM 249 N GLY A 18 4.351 -10.840 7.959 1.00 0.00 N ATOM 250 CA GLY A 18 3.943 -11.764 9.001 1.00 0.00 C ATOM 251 C GLY A 18 2.445 -12.000 9.008 1.00 0.00 C ATOM 252 O GLY A 18 1.794 -11.929 7.966 1.00 0.00 O ATOM 0 H GLY A 18 3.589 -10.486 7.380 1.00 0.00 H new ATOM 0 HA2 GLY A 18 4.458 -12.715 8.862 1.00 0.00 H new ATOM 0 HA3 GLY A 18 4.251 -11.373 9.971 1.00 0.00 H new ATOM 256 N GLU A 19 1.894 -12.272 10.187 1.00 0.00 N ATOM 257 CA GLU A 19 0.463 -12.509 10.326 1.00 0.00 C ATOM 258 C GLU A 19 -0.328 -11.244 10.006 1.00 0.00 C ATOM 259 O GLU A 19 0.189 -10.134 10.120 1.00 0.00 O ATOM 260 CB GLU A 19 0.133 -12.993 11.741 1.00 0.00 C ATOM 261 CG GLU A 19 0.828 -14.291 12.117 1.00 0.00 C ATOM 262 CD GLU A 19 0.485 -14.749 13.521 1.00 0.00 C ATOM 263 OE1 GLU A 19 0.767 -13.996 14.476 1.00 0.00 O ATOM 264 OE2 GLU A 19 -0.066 -15.861 13.664 1.00 0.00 O ATOM 0 H GLU A 19 2.418 -12.334 11.060 1.00 0.00 H new ATOM 0 HA GLU A 19 0.178 -13.285 9.615 1.00 0.00 H new ATOM 0 HB2 GLU A 19 0.415 -12.220 12.456 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -0.945 -13.129 11.827 1.00 0.00 H new ATOM 0 HG2 GLU A 19 0.548 -15.068 11.406 1.00 0.00 H new ATOM 0 HG3 GLU A 19 1.907 -14.158 12.035 1.00 0.00 H new ATOM 271 N GLU A 20 -1.576 -11.417 9.591 1.00 0.00 N ATOM 272 CA GLU A 20 -2.424 -10.284 9.245 1.00 0.00 C ATOM 273 C GLU A 20 -2.718 -9.423 10.473 1.00 0.00 C ATOM 274 O GLU A 20 -3.195 -9.918 11.494 1.00 0.00 O ATOM 275 CB GLU A 20 -3.734 -10.781 8.620 1.00 0.00 C ATOM 276 CG GLU A 20 -4.618 -9.673 8.060 1.00 0.00 C ATOM 277 CD GLU A 20 -5.187 -8.766 9.134 1.00 0.00 C ATOM 278 OE1 GLU A 20 -5.907 -9.272 10.019 1.00 0.00 O ATOM 279 OE2 GLU A 20 -4.908 -7.549 9.090 1.00 0.00 O ATOM 0 H GLU A 20 -2.022 -12.328 9.486 1.00 0.00 H new ATOM 0 HA GLU A 20 -1.893 -9.668 8.520 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -3.499 -11.482 7.819 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -4.296 -11.334 9.373 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -4.039 -9.075 7.357 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -5.438 -10.120 7.498 1.00 0.00 H new ATOM 286 N GLY A 21 -2.446 -8.126 10.354 1.00 0.00 N ATOM 287 CA GLY A 21 -2.700 -7.199 11.443 1.00 0.00 C ATOM 288 C GLY A 21 -1.961 -7.545 12.725 1.00 0.00 C ATOM 289 O GLY A 21 -2.557 -7.550 13.802 1.00 0.00 O ATOM 0 H GLY A 21 -2.051 -7.698 9.516 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -2.413 -6.196 11.128 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -3.771 -7.176 11.646 1.00 0.00 H new ATOM 293 N VAL A 22 -0.664 -7.821 12.621 1.00 0.00 N ATOM 294 CA VAL A 22 0.135 -8.148 13.798 1.00 0.00 C ATOM 295 C VAL A 22 0.359 -6.909 14.664 1.00 0.00 C ATOM 296 O VAL A 22 0.724 -5.849 14.154 1.00 0.00 O ATOM 297 CB VAL A 22 1.507 -8.740 13.413 1.00 0.00 C ATOM 298 CG1 VAL A 22 2.310 -9.093 14.658 1.00 0.00 C ATOM 299 CG2 VAL A 22 1.336 -9.960 12.521 1.00 0.00 C ATOM 0 H VAL A 22 -0.147 -7.825 11.742 1.00 0.00 H new ATOM 0 HA VAL A 22 -0.426 -8.895 14.359 1.00 0.00 H new ATOM 0 HB VAL A 22 2.059 -7.984 12.854 1.00 0.00 H new ATOM 0 HG11 VAL A 22 3.274 -9.509 14.364 1.00 0.00 H new ATOM 0 HG12 VAL A 22 2.469 -8.195 15.255 1.00 0.00 H new ATOM 0 HG13 VAL A 22 1.763 -9.828 15.248 1.00 0.00 H new ATOM 0 HG21 VAL A 22 2.316 -10.361 12.262 1.00 0.00 H new ATOM 0 HG22 VAL A 22 0.761 -10.720 13.050 1.00 0.00 H new ATOM 0 HG23 VAL A 22 0.808 -9.674 11.611 1.00 0.00 H new ATOM 309 N PRO A 23 0.149 -7.020 15.989 1.00 0.00 N ATOM 310 CA PRO A 23 0.336 -5.902 16.914 1.00 0.00 C ATOM 311 C PRO A 23 1.791 -5.734 17.351 1.00 0.00 C ATOM 312 O PRO A 23 2.064 -5.404 18.503 1.00 0.00 O ATOM 313 CB PRO A 23 -0.533 -6.306 18.101 1.00 0.00 C ATOM 314 CG PRO A 23 -0.460 -7.797 18.124 1.00 0.00 C ATOM 315 CD PRO A 23 -0.286 -8.242 16.692 1.00 0.00 C ATOM 0 HA PRO A 23 0.071 -4.945 16.464 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -0.161 -5.876 19.031 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -1.559 -5.960 17.978 1.00 0.00 H new ATOM 0 HG2 PRO A 23 0.374 -8.135 18.739 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -1.366 -8.223 18.555 1.00 0.00 H new ATOM 0 HD2 PRO A 23 0.456 -9.036 16.608 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -1.217 -8.630 16.279 1.00 0.00 H new ATOM 323 N LEU A 24 2.719 -5.960 16.422 1.00 0.00 N ATOM 324 CA LEU A 24 4.147 -5.837 16.706 1.00 0.00 C ATOM 325 C LEU A 24 4.943 -5.705 15.410 1.00 0.00 C ATOM 326 O LEU A 24 5.869 -4.898 15.315 1.00 0.00 O ATOM 327 CB LEU A 24 4.651 -7.054 17.490 1.00 0.00 C ATOM 328 CG LEU A 24 4.065 -7.232 18.893 1.00 0.00 C ATOM 329 CD1 LEU A 24 4.603 -8.501 19.535 1.00 0.00 C ATOM 330 CD2 LEU A 24 4.377 -6.022 19.764 1.00 0.00 C ATOM 0 H LEU A 24 2.505 -6.230 15.462 1.00 0.00 H new ATOM 0 HA LEU A 24 4.291 -4.940 17.309 1.00 0.00 H new ATOM 0 HB2 LEU A 24 4.435 -7.951 16.910 1.00 0.00 H new ATOM 0 HB3 LEU A 24 5.735 -6.984 17.576 1.00 0.00 H new ATOM 0 HG LEU A 24 2.982 -7.320 18.804 1.00 0.00 H new ATOM 0 HD11 LEU A 24 4.177 -8.613 20.532 1.00 0.00 H new ATOM 0 HD12 LEU A 24 4.330 -9.362 18.925 1.00 0.00 H new ATOM 0 HD13 LEU A 24 5.689 -8.439 19.609 1.00 0.00 H new ATOM 0 HD21 LEU A 24 3.952 -6.169 20.757 1.00 0.00 H new ATOM 0 HD22 LEU A 24 5.457 -5.902 19.846 1.00 0.00 H new ATOM 0 HD23 LEU A 24 3.946 -5.128 19.313 1.00 0.00 H new ATOM 342 N ALA A 25 4.578 -6.510 14.414 1.00 0.00 N ATOM 343 CA ALA A 25 5.251 -6.496 13.121 1.00 0.00 C ATOM 344 C ALA A 25 6.665 -7.057 13.232 1.00 0.00 C ATOM 345 O ALA A 25 7.466 -6.600 14.047 1.00 0.00 O ATOM 346 CB ALA A 25 5.284 -5.084 12.551 1.00 0.00 C ATOM 0 H ALA A 25 3.815 -7.183 14.481 1.00 0.00 H new ATOM 0 HA ALA A 25 4.686 -7.134 12.441 1.00 0.00 H new ATOM 0 HB1 ALA A 25 5.790 -5.093 11.586 1.00 0.00 H new ATOM 0 HB2 ALA A 25 4.265 -4.719 12.423 1.00 0.00 H new ATOM 0 HB3 ALA A 25 5.821 -4.428 13.236 1.00 0.00 H new ATOM 352 N SER A 26 6.963 -8.052 12.401 1.00 0.00 N ATOM 353 CA SER A 26 8.278 -8.682 12.397 1.00 0.00 C ATOM 354 C SER A 26 9.324 -7.765 11.774 1.00 0.00 C ATOM 355 O SER A 26 10.471 -7.719 12.221 1.00 0.00 O ATOM 356 CB SER A 26 8.227 -10.007 11.634 1.00 0.00 C ATOM 357 OG SER A 26 7.836 -9.806 10.287 1.00 0.00 O ATOM 0 H SER A 26 6.309 -8.439 11.721 1.00 0.00 H new ATOM 0 HA SER A 26 8.563 -8.874 13.432 1.00 0.00 H new ATOM 0 HB2 SER A 26 9.206 -10.485 11.664 1.00 0.00 H new ATOM 0 HB3 SER A 26 7.526 -10.684 12.122 1.00 0.00 H new ATOM 0 HG SER A 26 7.231 -10.526 10.011 1.00 0.00 H new ATOM 363 N GLY A 27 8.925 -7.039 10.735 1.00 0.00 N ATOM 364 CA GLY A 27 9.842 -6.140 10.062 1.00 0.00 C ATOM 365 C GLY A 27 10.782 -6.872 9.124 1.00 0.00 C ATOM 366 O GLY A 27 11.284 -7.947 9.453 1.00 0.00 O ATOM 0 H GLY A 27 7.982 -7.058 10.347 1.00 0.00 H new ATOM 0 HA2 GLY A 27 9.274 -5.400 9.499 1.00 0.00 H new ATOM 0 HA3 GLY A 27 10.425 -5.596 10.805 1.00 0.00 H new ATOM 370 N ARG A 28 11.017 -6.291 7.952 1.00 0.00 N ATOM 371 CA ARG A 28 11.898 -6.899 6.961 1.00 0.00 C ATOM 372 C ARG A 28 12.897 -5.883 6.418 1.00 0.00 C ATOM 373 O ARG A 28 14.081 -6.185 6.264 1.00 0.00 O ATOM 374 CB ARG A 28 11.076 -7.486 5.812 1.00 0.00 C ATOM 375 CG ARG A 28 10.108 -8.573 6.250 1.00 0.00 C ATOM 376 CD ARG A 28 10.838 -9.758 6.859 1.00 0.00 C ATOM 377 NE ARG A 28 11.766 -10.375 5.912 1.00 0.00 N ATOM 378 CZ ARG A 28 12.522 -11.432 6.197 1.00 0.00 C ATOM 379 NH1 ARG A 28 12.464 -11.994 7.398 1.00 0.00 N ATOM 380 NH2 ARG A 28 13.339 -11.928 5.277 1.00 0.00 N ATOM 0 H ARG A 28 10.610 -5.401 7.665 1.00 0.00 H new ATOM 0 HA ARG A 28 12.454 -7.699 7.450 1.00 0.00 H new ATOM 0 HB2 ARG A 28 10.516 -6.684 5.331 1.00 0.00 H new ATOM 0 HB3 ARG A 28 11.754 -7.895 5.063 1.00 0.00 H new ATOM 0 HG2 ARG A 28 9.406 -8.165 6.977 1.00 0.00 H new ATOM 0 HG3 ARG A 28 9.522 -8.907 5.393 1.00 0.00 H new ATOM 0 HD2 ARG A 28 11.386 -9.431 7.743 1.00 0.00 H new ATOM 0 HD3 ARG A 28 10.112 -10.500 7.191 1.00 0.00 H new ATOM 0 HE ARG A 28 11.838 -9.971 4.978 1.00 0.00 H new ATOM 0 HH11 ARG A 28 11.837 -11.616 8.108 1.00 0.00 H new ATOM 0 HH12 ARG A 28 13.046 -12.804 7.611 1.00 0.00 H new ATOM 0 HH21 ARG A 28 13.387 -11.499 4.353 1.00 0.00 H new ATOM 0 HH22 ARG A 28 13.919 -12.738 5.494 1.00 0.00 H new ATOM 394 N GLY A 29 12.416 -4.679 6.127 1.00 0.00 N ATOM 395 CA GLY A 29 13.287 -3.642 5.605 1.00 0.00 C ATOM 396 C GLY A 29 12.602 -2.292 5.519 1.00 0.00 C ATOM 397 O GLY A 29 11.882 -1.895 6.435 1.00 0.00 O ATOM 0 H GLY A 29 11.441 -4.403 6.243 1.00 0.00 H new ATOM 0 HA2 GLY A 29 14.168 -3.558 6.242 1.00 0.00 H new ATOM 0 HA3 GLY A 29 13.637 -3.931 4.614 1.00 0.00 H new ATOM 401 N TYR A 30 12.830 -1.584 4.417 1.00 0.00 N ATOM 402 CA TYR A 30 12.233 -0.268 4.215 1.00 0.00 C ATOM 403 C TYR A 30 12.656 0.320 2.873 1.00 0.00 C ATOM 404 O TYR A 30 13.742 0.033 2.371 1.00 0.00 O ATOM 405 CB TYR A 30 12.623 0.677 5.357 1.00 0.00 C ATOM 406 CG TYR A 30 14.117 0.820 5.557 1.00 0.00 C ATOM 407 CD1 TYR A 30 14.924 1.374 4.570 1.00 0.00 C ATOM 408 CD2 TYR A 30 14.717 0.405 6.738 1.00 0.00 C ATOM 409 CE1 TYR A 30 16.288 1.508 4.757 1.00 0.00 C ATOM 410 CE2 TYR A 30 16.079 0.536 6.933 1.00 0.00 C ATOM 411 CZ TYR A 30 16.859 1.086 5.939 1.00 0.00 C ATOM 412 OH TYR A 30 18.215 1.219 6.128 1.00 0.00 O ATOM 0 H TYR A 30 13.424 -1.900 3.650 1.00 0.00 H new ATOM 0 HA TYR A 30 11.149 -0.383 4.211 1.00 0.00 H new ATOM 0 HB2 TYR A 30 12.197 1.661 5.161 1.00 0.00 H new ATOM 0 HB3 TYR A 30 12.176 0.315 6.283 1.00 0.00 H new ATOM 0 HD1 TYR A 30 14.479 1.705 3.643 1.00 0.00 H new ATOM 0 HD2 TYR A 30 14.109 -0.028 7.518 1.00 0.00 H new ATOM 0 HE1 TYR A 30 16.902 1.941 3.981 1.00 0.00 H new ATOM 0 HE2 TYR A 30 16.529 0.209 7.859 1.00 0.00 H new ATOM 0 HH TYR A 30 18.457 0.875 7.013 1.00 0.00 H new ATOM 422 N LEU A 31 11.789 1.150 2.299 1.00 0.00 N ATOM 423 CA LEU A 31 12.073 1.782 1.016 1.00 0.00 C ATOM 424 C LEU A 31 11.723 3.268 1.052 1.00 0.00 C ATOM 425 O LEU A 31 10.666 3.657 1.552 1.00 0.00 O ATOM 426 CB LEU A 31 11.303 1.088 -0.115 1.00 0.00 C ATOM 427 CG LEU A 31 9.779 1.051 0.044 1.00 0.00 C ATOM 428 CD1 LEU A 31 9.125 0.564 -1.239 1.00 0.00 C ATOM 429 CD2 LEU A 31 9.382 0.155 1.209 1.00 0.00 C ATOM 0 H LEU A 31 10.886 1.400 2.702 1.00 0.00 H new ATOM 0 HA LEU A 31 13.141 1.681 0.824 1.00 0.00 H new ATOM 0 HB2 LEU A 31 11.540 1.591 -1.053 1.00 0.00 H new ATOM 0 HB3 LEU A 31 11.666 0.064 -0.202 1.00 0.00 H new ATOM 0 HG LEU A 31 9.432 2.063 0.253 1.00 0.00 H new ATOM 0 HD11 LEU A 31 8.043 0.543 -1.111 1.00 0.00 H new ATOM 0 HD12 LEU A 31 9.380 1.238 -2.056 1.00 0.00 H new ATOM 0 HD13 LEU A 31 9.482 -0.439 -1.471 1.00 0.00 H new ATOM 0 HD21 LEU A 31 8.296 0.142 1.305 1.00 0.00 H new ATOM 0 HD22 LEU A 31 9.742 -0.858 1.028 1.00 0.00 H new ATOM 0 HD23 LEU A 31 9.823 0.538 2.129 1.00 0.00 H new ATOM 441 N VAL A 32 12.619 4.092 0.518 1.00 0.00 N ATOM 442 CA VAL A 32 12.413 5.536 0.483 1.00 0.00 C ATOM 443 C VAL A 32 11.197 5.892 -0.366 1.00 0.00 C ATOM 444 O VAL A 32 10.919 5.231 -1.366 1.00 0.00 O ATOM 445 CB VAL A 32 13.650 6.267 -0.074 1.00 0.00 C ATOM 446 CG1 VAL A 32 13.445 7.774 -0.049 1.00 0.00 C ATOM 447 CG2 VAL A 32 14.894 5.879 0.711 1.00 0.00 C ATOM 0 H VAL A 32 13.498 3.783 0.102 1.00 0.00 H new ATOM 0 HA VAL A 32 12.245 5.860 1.510 1.00 0.00 H new ATOM 0 HB VAL A 32 13.789 5.964 -1.112 1.00 0.00 H new ATOM 0 HG11 VAL A 32 14.331 8.268 -0.447 1.00 0.00 H new ATOM 0 HG12 VAL A 32 12.580 8.034 -0.659 1.00 0.00 H new ATOM 0 HG13 VAL A 32 13.277 8.101 0.977 1.00 0.00 H new ATOM 0 HG21 VAL A 32 15.759 6.404 0.305 1.00 0.00 H new ATOM 0 HG22 VAL A 32 14.763 6.151 1.758 1.00 0.00 H new ATOM 0 HG23 VAL A 32 15.053 4.803 0.633 1.00 0.00 H new ATOM 457 N ARG A 33 10.472 6.934 0.034 1.00 0.00 N ATOM 458 CA ARG A 33 9.284 7.359 -0.702 1.00 0.00 C ATOM 459 C ARG A 33 9.602 7.607 -2.173 1.00 0.00 C ATOM 460 O ARG A 33 10.725 7.961 -2.531 1.00 0.00 O ATOM 461 CB ARG A 33 8.682 8.625 -0.087 1.00 0.00 C ATOM 462 CG ARG A 33 8.240 8.457 1.357 1.00 0.00 C ATOM 463 CD ARG A 33 7.412 9.646 1.822 1.00 0.00 C ATOM 464 NE ARG A 33 8.103 10.915 1.614 1.00 0.00 N ATOM 465 CZ ARG A 33 7.587 12.101 1.931 1.00 0.00 C ATOM 466 NH1 ARG A 33 6.379 12.182 2.474 1.00 0.00 N ATOM 467 NH2 ARG A 33 8.283 13.207 1.708 1.00 0.00 N ATOM 0 H ARG A 33 10.684 7.496 0.858 1.00 0.00 H new ATOM 0 HA ARG A 33 8.556 6.550 -0.634 1.00 0.00 H new ATOM 0 HB2 ARG A 33 9.417 9.428 -0.141 1.00 0.00 H new ATOM 0 HB3 ARG A 33 7.826 8.936 -0.685 1.00 0.00 H new ATOM 0 HG2 ARG A 33 7.656 7.542 1.457 1.00 0.00 H new ATOM 0 HG3 ARG A 33 9.115 8.348 1.997 1.00 0.00 H new ATOM 0 HD2 ARG A 33 6.464 9.658 1.285 1.00 0.00 H new ATOM 0 HD3 ARG A 33 7.177 9.531 2.880 1.00 0.00 H new ATOM 0 HE ARG A 33 9.036 10.892 1.202 1.00 0.00 H new ATOM 0 HH11 ARG A 33 5.841 11.333 2.650 1.00 0.00 H new ATOM 0 HH12 ARG A 33 5.988 13.093 2.715 1.00 0.00 H new ATOM 0 HH21 ARG A 33 9.213 13.149 1.294 1.00 0.00 H new ATOM 0 HH22 ARG A 33 7.888 14.116 1.951 1.00 0.00 H new ATOM 481 N LYS A 34 8.596 7.419 -3.019 1.00 0.00 N ATOM 482 CA LYS A 34 8.742 7.616 -4.456 1.00 0.00 C ATOM 483 C LYS A 34 7.426 8.143 -5.042 1.00 0.00 C ATOM 484 O LYS A 34 6.924 9.178 -4.608 1.00 0.00 O ATOM 485 CB LYS A 34 9.157 6.301 -5.127 1.00 0.00 C ATOM 486 CG LYS A 34 10.397 5.665 -4.523 1.00 0.00 C ATOM 487 CD LYS A 34 10.706 4.329 -5.180 1.00 0.00 C ATOM 488 CE LYS A 34 11.884 3.638 -4.512 1.00 0.00 C ATOM 489 NZ LYS A 34 13.123 4.460 -4.578 1.00 0.00 N ATOM 0 H LYS A 34 7.662 7.128 -2.731 1.00 0.00 H new ATOM 0 HA LYS A 34 9.523 8.353 -4.645 1.00 0.00 H new ATOM 0 HB2 LYS A 34 8.330 5.594 -5.061 1.00 0.00 H new ATOM 0 HB3 LYS A 34 9.335 6.486 -6.186 1.00 0.00 H new ATOM 0 HG2 LYS A 34 11.247 6.337 -4.641 1.00 0.00 H new ATOM 0 HG3 LYS A 34 10.250 5.521 -3.452 1.00 0.00 H new ATOM 0 HD2 LYS A 34 9.828 3.685 -5.128 1.00 0.00 H new ATOM 0 HD3 LYS A 34 10.925 4.484 -6.236 1.00 0.00 H new ATOM 0 HE2 LYS A 34 11.640 3.433 -3.470 1.00 0.00 H new ATOM 0 HE3 LYS A 34 12.061 2.676 -4.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 13.935 3.890 -4.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 13.277 4.777 -5.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 13.024 5.288 -3.957 1.00 0.00 H new ATOM 503 N THR A 35 6.859 7.429 -6.016 1.00 0.00 N ATOM 504 CA THR A 35 5.601 7.840 -6.626 1.00 0.00 C ATOM 505 C THR A 35 4.794 6.629 -7.076 1.00 0.00 C ATOM 506 O THR A 35 5.352 5.648 -7.562 1.00 0.00 O ATOM 507 CB THR A 35 5.822 8.792 -7.816 1.00 0.00 C ATOM 508 OG1 THR A 35 6.736 8.213 -8.752 1.00 0.00 O ATOM 509 CG2 THR A 35 6.354 10.132 -7.337 1.00 0.00 C ATOM 0 H THR A 35 7.252 6.568 -6.396 1.00 0.00 H new ATOM 0 HA THR A 35 5.040 8.379 -5.862 1.00 0.00 H new ATOM 0 HB THR A 35 4.863 8.952 -8.308 1.00 0.00 H new ATOM 0 HG1 THR A 35 6.867 8.827 -9.504 1.00 0.00 H new ATOM 0 HG21 THR A 35 6.504 10.791 -8.192 1.00 0.00 H new ATOM 0 HG22 THR A 35 5.637 10.584 -6.652 1.00 0.00 H new ATOM 0 HG23 THR A 35 7.304 9.984 -6.823 1.00 0.00 H new ATOM 517 N LEU A 36 3.482 6.702 -6.857 1.00 0.00 N ATOM 518 CA LEU A 36 2.543 5.621 -7.181 1.00 0.00 C ATOM 519 C LEU A 36 3.054 4.639 -8.244 1.00 0.00 C ATOM 520 O LEU A 36 2.886 3.434 -8.091 1.00 0.00 O ATOM 521 CB LEU A 36 1.177 6.197 -7.591 1.00 0.00 C ATOM 522 CG LEU A 36 1.150 7.121 -8.819 1.00 0.00 C ATOM 523 CD1 LEU A 36 2.181 8.235 -8.696 1.00 0.00 C ATOM 524 CD2 LEU A 36 1.353 6.332 -10.105 1.00 0.00 C ATOM 0 H LEU A 36 3.033 7.520 -6.446 1.00 0.00 H new ATOM 0 HA LEU A 36 2.438 5.038 -6.266 1.00 0.00 H new ATOM 0 HB2 LEU A 36 0.500 5.363 -7.779 1.00 0.00 H new ATOM 0 HB3 LEU A 36 0.774 6.749 -6.742 1.00 0.00 H new ATOM 0 HG LEU A 36 0.164 7.583 -8.861 1.00 0.00 H new ATOM 0 HD11 LEU A 36 2.137 8.871 -9.580 1.00 0.00 H new ATOM 0 HD12 LEU A 36 1.968 8.831 -7.809 1.00 0.00 H new ATOM 0 HD13 LEU A 36 3.177 7.801 -8.611 1.00 0.00 H new ATOM 0 HD21 LEU A 36 1.329 7.012 -10.957 1.00 0.00 H new ATOM 0 HD22 LEU A 36 2.317 5.825 -10.072 1.00 0.00 H new ATOM 0 HD23 LEU A 36 0.558 5.593 -10.208 1.00 0.00 H new ATOM 536 N GLU A 37 3.669 5.141 -9.312 1.00 0.00 N ATOM 537 CA GLU A 37 4.177 4.266 -10.372 1.00 0.00 C ATOM 538 C GLU A 37 5.432 3.520 -9.927 1.00 0.00 C ATOM 539 O GLU A 37 5.526 2.303 -10.077 1.00 0.00 O ATOM 540 CB GLU A 37 4.457 5.072 -11.642 1.00 0.00 C ATOM 541 CG GLU A 37 5.458 6.198 -11.445 1.00 0.00 C ATOM 542 CD GLU A 37 5.699 6.991 -12.714 1.00 0.00 C ATOM 543 OE1 GLU A 37 4.729 7.571 -13.245 1.00 0.00 O ATOM 544 OE2 GLU A 37 6.857 7.033 -13.178 1.00 0.00 O ATOM 0 H GLU A 37 3.828 6.136 -9.468 1.00 0.00 H new ATOM 0 HA GLU A 37 3.408 3.524 -10.588 1.00 0.00 H new ATOM 0 HB2 GLU A 37 4.829 4.398 -12.414 1.00 0.00 H new ATOM 0 HB3 GLU A 37 3.520 5.491 -12.009 1.00 0.00 H new ATOM 0 HG2 GLU A 37 5.097 6.868 -10.665 1.00 0.00 H new ATOM 0 HG3 GLU A 37 6.403 5.782 -11.096 1.00 0.00 H new ATOM 551 N GLU A 38 6.389 4.252 -9.366 1.00 0.00 N ATOM 552 CA GLU A 38 7.629 3.643 -8.884 1.00 0.00 C ATOM 553 C GLU A 38 7.296 2.654 -7.790 1.00 0.00 C ATOM 554 O GLU A 38 7.757 1.511 -7.789 1.00 0.00 O ATOM 555 CB GLU A 38 8.572 4.701 -8.314 1.00 0.00 C ATOM 556 CG GLU A 38 8.600 5.982 -9.112 1.00 0.00 C ATOM 557 CD GLU A 38 9.190 5.800 -10.499 1.00 0.00 C ATOM 558 OE1 GLU A 38 10.350 5.345 -10.593 1.00 0.00 O ATOM 559 OE2 GLU A 38 8.497 6.117 -11.487 1.00 0.00 O ATOM 0 H GLU A 38 6.333 5.262 -9.233 1.00 0.00 H new ATOM 0 HA GLU A 38 8.120 3.147 -9.721 1.00 0.00 H new ATOM 0 HB2 GLU A 38 8.274 4.927 -7.290 1.00 0.00 H new ATOM 0 HB3 GLU A 38 9.580 4.290 -8.268 1.00 0.00 H new ATOM 0 HG2 GLU A 38 7.586 6.370 -9.202 1.00 0.00 H new ATOM 0 HG3 GLU A 38 9.181 6.729 -8.571 1.00 0.00 H new ATOM 566 N ASP A 39 6.478 3.121 -6.859 1.00 0.00 N ATOM 567 CA ASP A 39 6.043 2.307 -5.730 1.00 0.00 C ATOM 568 C ASP A 39 5.614 0.919 -6.196 1.00 0.00 C ATOM 569 O ASP A 39 5.921 -0.086 -5.554 1.00 0.00 O ATOM 570 CB ASP A 39 4.880 2.986 -5.001 1.00 0.00 C ATOM 571 CG ASP A 39 5.239 4.364 -4.482 1.00 0.00 C ATOM 572 OD1 ASP A 39 6.394 4.792 -4.683 1.00 0.00 O ATOM 573 OD2 ASP A 39 4.364 5.016 -3.872 1.00 0.00 O ATOM 0 H ASP A 39 6.098 4.068 -6.862 1.00 0.00 H new ATOM 0 HA ASP A 39 6.885 2.203 -5.045 1.00 0.00 H new ATOM 0 HB2 ASP A 39 4.030 3.068 -5.679 1.00 0.00 H new ATOM 0 HB3 ASP A 39 4.564 2.359 -4.167 1.00 0.00 H new ATOM 578 N VAL A 40 4.908 0.869 -7.322 1.00 0.00 N ATOM 579 CA VAL A 40 4.443 -0.401 -7.874 1.00 0.00 C ATOM 580 C VAL A 40 5.624 -1.311 -8.176 1.00 0.00 C ATOM 581 O VAL A 40 5.662 -2.466 -7.755 1.00 0.00 O ATOM 582 CB VAL A 40 3.656 -0.206 -9.186 1.00 0.00 C ATOM 583 CG1 VAL A 40 2.794 -1.417 -9.485 1.00 0.00 C ATOM 584 CG2 VAL A 40 2.818 1.053 -9.139 1.00 0.00 C ATOM 0 H VAL A 40 4.646 1.689 -7.869 1.00 0.00 H new ATOM 0 HA VAL A 40 3.790 -0.846 -7.123 1.00 0.00 H new ATOM 0 HB VAL A 40 4.379 -0.096 -9.994 1.00 0.00 H new ATOM 0 HG11 VAL A 40 2.249 -1.255 -10.415 1.00 0.00 H new ATOM 0 HG12 VAL A 40 3.427 -2.299 -9.584 1.00 0.00 H new ATOM 0 HG13 VAL A 40 2.085 -1.569 -8.671 1.00 0.00 H new ATOM 0 HG21 VAL A 40 2.275 1.164 -10.077 1.00 0.00 H new ATOM 0 HG22 VAL A 40 2.108 0.987 -8.314 1.00 0.00 H new ATOM 0 HG23 VAL A 40 3.467 1.916 -8.991 1.00 0.00 H new ATOM 594 N GLU A 41 6.584 -0.772 -8.919 1.00 0.00 N ATOM 595 CA GLU A 41 7.777 -1.522 -9.300 1.00 0.00 C ATOM 596 C GLU A 41 8.506 -2.067 -8.074 1.00 0.00 C ATOM 597 O GLU A 41 8.807 -3.258 -8.000 1.00 0.00 O ATOM 598 CB GLU A 41 8.721 -0.636 -10.116 1.00 0.00 C ATOM 599 CG GLU A 41 8.111 -0.128 -11.412 1.00 0.00 C ATOM 600 CD GLU A 41 9.065 0.752 -12.197 1.00 0.00 C ATOM 601 OE1 GLU A 41 9.486 1.798 -11.661 1.00 0.00 O ATOM 602 OE2 GLU A 41 9.391 0.393 -13.349 1.00 0.00 O ATOM 0 H GLU A 41 6.560 0.185 -9.271 1.00 0.00 H new ATOM 0 HA GLU A 41 7.459 -2.368 -9.910 1.00 0.00 H new ATOM 0 HB2 GLU A 41 9.022 0.217 -9.507 1.00 0.00 H new ATOM 0 HB3 GLU A 41 9.626 -1.199 -10.346 1.00 0.00 H new ATOM 0 HG2 GLU A 41 7.815 -0.977 -12.028 1.00 0.00 H new ATOM 0 HG3 GLU A 41 7.205 0.434 -11.187 1.00 0.00 H new ATOM 609 N ALA A 42 8.790 -1.190 -7.116 1.00 0.00 N ATOM 610 CA ALA A 42 9.486 -1.592 -5.898 1.00 0.00 C ATOM 611 C ALA A 42 8.647 -2.576 -5.089 1.00 0.00 C ATOM 612 O ALA A 42 9.155 -3.578 -4.588 1.00 0.00 O ATOM 613 CB ALA A 42 9.827 -0.370 -5.056 1.00 0.00 C ATOM 0 H ALA A 42 8.550 -0.200 -7.159 1.00 0.00 H new ATOM 0 HA ALA A 42 10.412 -2.091 -6.185 1.00 0.00 H new ATOM 0 HB1 ALA A 42 10.346 -0.685 -4.151 1.00 0.00 H new ATOM 0 HB2 ALA A 42 10.470 0.299 -5.629 1.00 0.00 H new ATOM 0 HB3 ALA A 42 8.910 0.153 -4.785 1.00 0.00 H new ATOM 619 N LEU A 43 7.358 -2.278 -4.967 1.00 0.00 N ATOM 620 CA LEU A 43 6.437 -3.126 -4.221 1.00 0.00 C ATOM 621 C LEU A 43 6.272 -4.490 -4.879 1.00 0.00 C ATOM 622 O LEU A 43 6.395 -5.524 -4.222 1.00 0.00 O ATOM 623 CB LEU A 43 5.077 -2.439 -4.107 1.00 0.00 C ATOM 624 CG LEU A 43 5.040 -1.214 -3.193 1.00 0.00 C ATOM 625 CD1 LEU A 43 3.753 -0.430 -3.407 1.00 0.00 C ATOM 626 CD2 LEU A 43 5.171 -1.640 -1.739 1.00 0.00 C ATOM 0 H LEU A 43 6.926 -1.450 -5.378 1.00 0.00 H new ATOM 0 HA LEU A 43 6.856 -3.282 -3.227 1.00 0.00 H new ATOM 0 HB2 LEU A 43 4.755 -2.138 -5.104 1.00 0.00 H new ATOM 0 HB3 LEU A 43 4.350 -3.166 -3.743 1.00 0.00 H new ATOM 0 HG LEU A 43 5.881 -0.566 -3.442 1.00 0.00 H new ATOM 0 HD11 LEU A 43 3.742 0.439 -2.749 1.00 0.00 H new ATOM 0 HD12 LEU A 43 3.696 -0.100 -4.444 1.00 0.00 H new ATOM 0 HD13 LEU A 43 2.897 -1.067 -3.181 1.00 0.00 H new ATOM 0 HD21 LEU A 43 5.143 -0.759 -1.098 1.00 0.00 H new ATOM 0 HD22 LEU A 43 4.347 -2.304 -1.479 1.00 0.00 H new ATOM 0 HD23 LEU A 43 6.117 -2.163 -1.597 1.00 0.00 H new ATOM 638 N LEU A 44 5.993 -4.491 -6.178 1.00 0.00 N ATOM 639 CA LEU A 44 5.814 -5.736 -6.913 1.00 0.00 C ATOM 640 C LEU A 44 7.065 -6.598 -6.831 1.00 0.00 C ATOM 641 O LEU A 44 6.991 -7.788 -6.532 1.00 0.00 O ATOM 642 CB LEU A 44 5.469 -5.451 -8.373 1.00 0.00 C ATOM 643 CG LEU A 44 4.078 -4.864 -8.602 1.00 0.00 C ATOM 644 CD1 LEU A 44 3.835 -4.635 -10.087 1.00 0.00 C ATOM 645 CD2 LEU A 44 3.017 -5.785 -8.021 1.00 0.00 C ATOM 0 H LEU A 44 5.886 -3.647 -6.741 1.00 0.00 H new ATOM 0 HA LEU A 44 4.988 -6.281 -6.456 1.00 0.00 H new ATOM 0 HB2 LEU A 44 6.210 -4.762 -8.778 1.00 0.00 H new ATOM 0 HB3 LEU A 44 5.554 -6.379 -8.939 1.00 0.00 H new ATOM 0 HG LEU A 44 4.017 -3.902 -8.094 1.00 0.00 H new ATOM 0 HD11 LEU A 44 2.839 -4.216 -10.232 1.00 0.00 H new ATOM 0 HD12 LEU A 44 4.581 -3.941 -10.475 1.00 0.00 H new ATOM 0 HD13 LEU A 44 3.911 -5.584 -10.619 1.00 0.00 H new ATOM 0 HD21 LEU A 44 2.030 -5.355 -8.191 1.00 0.00 H new ATOM 0 HD22 LEU A 44 3.077 -6.760 -8.505 1.00 0.00 H new ATOM 0 HD23 LEU A 44 3.183 -5.901 -6.950 1.00 0.00 H new ATOM 657 N ASP A 45 8.216 -5.987 -7.086 1.00 0.00 N ATOM 658 CA ASP A 45 9.486 -6.699 -7.032 1.00 0.00 C ATOM 659 C ASP A 45 9.603 -7.489 -5.733 1.00 0.00 C ATOM 660 O ASP A 45 10.106 -8.613 -5.720 1.00 0.00 O ATOM 661 CB ASP A 45 10.650 -5.712 -7.158 1.00 0.00 C ATOM 662 CG ASP A 45 12.002 -6.393 -7.086 1.00 0.00 C ATOM 663 OD1 ASP A 45 12.303 -7.005 -6.041 1.00 0.00 O ATOM 664 OD2 ASP A 45 12.759 -6.317 -8.077 1.00 0.00 O ATOM 0 H ASP A 45 8.295 -5.000 -7.332 1.00 0.00 H new ATOM 0 HA ASP A 45 9.526 -7.399 -7.866 1.00 0.00 H new ATOM 0 HB2 ASP A 45 10.567 -5.177 -8.104 1.00 0.00 H new ATOM 0 HB3 ASP A 45 10.579 -4.969 -6.364 1.00 0.00 H new ATOM 669 N PHE A 46 9.127 -6.893 -4.644 1.00 0.00 N ATOM 670 CA PHE A 46 9.173 -7.539 -3.339 1.00 0.00 C ATOM 671 C PHE A 46 8.085 -8.604 -3.210 1.00 0.00 C ATOM 672 O PHE A 46 8.332 -9.695 -2.700 1.00 0.00 O ATOM 673 CB PHE A 46 9.015 -6.497 -2.229 1.00 0.00 C ATOM 674 CG PHE A 46 9.049 -7.080 -0.845 1.00 0.00 C ATOM 675 CD1 PHE A 46 10.005 -8.022 -0.497 1.00 0.00 C ATOM 676 CD2 PHE A 46 8.124 -6.686 0.110 1.00 0.00 C ATOM 677 CE1 PHE A 46 10.036 -8.560 0.776 1.00 0.00 C ATOM 678 CE2 PHE A 46 8.151 -7.220 1.384 1.00 0.00 C ATOM 679 CZ PHE A 46 9.109 -8.158 1.717 1.00 0.00 C ATOM 0 H PHE A 46 8.705 -5.964 -4.641 1.00 0.00 H new ATOM 0 HA PHE A 46 10.142 -8.028 -3.240 1.00 0.00 H new ATOM 0 HB2 PHE A 46 9.810 -5.757 -2.322 1.00 0.00 H new ATOM 0 HB3 PHE A 46 8.071 -5.970 -2.369 1.00 0.00 H new ATOM 0 HD1 PHE A 46 10.734 -8.339 -1.229 1.00 0.00 H new ATOM 0 HD2 PHE A 46 7.373 -5.953 -0.145 1.00 0.00 H new ATOM 0 HE1 PHE A 46 10.785 -9.294 1.034 1.00 0.00 H new ATOM 0 HE2 PHE A 46 7.424 -6.905 2.118 1.00 0.00 H new ATOM 0 HZ PHE A 46 9.133 -8.576 2.712 1.00 0.00 H new ATOM 689 N VAL A 47 6.879 -8.275 -3.661 1.00 0.00 N ATOM 690 CA VAL A 47 5.750 -9.198 -3.579 1.00 0.00 C ATOM 691 C VAL A 47 6.026 -10.518 -4.302 1.00 0.00 C ATOM 692 O VAL A 47 5.847 -11.592 -3.727 1.00 0.00 O ATOM 693 CB VAL A 47 4.466 -8.556 -4.148 1.00 0.00 C ATOM 694 CG1 VAL A 47 3.298 -9.532 -4.096 1.00 0.00 C ATOM 695 CG2 VAL A 47 4.129 -7.278 -3.390 1.00 0.00 C ATOM 0 H VAL A 47 6.657 -7.375 -4.088 1.00 0.00 H new ATOM 0 HA VAL A 47 5.606 -9.416 -2.521 1.00 0.00 H new ATOM 0 HB VAL A 47 4.648 -8.303 -5.193 1.00 0.00 H new ATOM 0 HG11 VAL A 47 2.406 -9.055 -4.503 1.00 0.00 H new ATOM 0 HG12 VAL A 47 3.537 -10.417 -4.686 1.00 0.00 H new ATOM 0 HG13 VAL A 47 3.114 -9.824 -3.062 1.00 0.00 H new ATOM 0 HG21 VAL A 47 3.221 -6.838 -3.804 1.00 0.00 H new ATOM 0 HG22 VAL A 47 3.972 -7.510 -2.337 1.00 0.00 H new ATOM 0 HG23 VAL A 47 4.952 -6.570 -3.487 1.00 0.00 H new ATOM 705 N ARG A 48 6.452 -10.442 -5.560 1.00 0.00 N ATOM 706 CA ARG A 48 6.733 -11.654 -6.335 1.00 0.00 C ATOM 707 C ARG A 48 7.945 -12.412 -5.799 1.00 0.00 C ATOM 708 O ARG A 48 7.828 -13.557 -5.363 1.00 0.00 O ATOM 709 CB ARG A 48 6.952 -11.340 -7.823 1.00 0.00 C ATOM 710 CG ARG A 48 7.472 -9.942 -8.119 1.00 0.00 C ATOM 711 CD ARG A 48 8.158 -9.891 -9.477 1.00 0.00 C ATOM 712 NE ARG A 48 8.500 -8.529 -9.875 1.00 0.00 N ATOM 713 CZ ARG A 48 7.605 -7.627 -10.272 1.00 0.00 C ATOM 714 NH1 ARG A 48 6.323 -7.956 -10.367 1.00 0.00 N ATOM 715 NH2 ARG A 48 7.996 -6.401 -10.588 1.00 0.00 N ATOM 0 H ARG A 48 6.610 -9.568 -6.062 1.00 0.00 H new ATOM 0 HA ARG A 48 5.852 -12.287 -6.230 1.00 0.00 H new ATOM 0 HB2 ARG A 48 7.655 -12.066 -8.232 1.00 0.00 H new ATOM 0 HB3 ARG A 48 6.008 -11.479 -8.350 1.00 0.00 H new ATOM 0 HG2 ARG A 48 6.646 -9.231 -8.098 1.00 0.00 H new ATOM 0 HG3 ARG A 48 8.173 -9.639 -7.342 1.00 0.00 H new ATOM 0 HD2 ARG A 48 9.064 -10.496 -9.447 1.00 0.00 H new ATOM 0 HD3 ARG A 48 7.504 -10.333 -10.229 1.00 0.00 H new ATOM 0 HE ARG A 48 9.481 -8.252 -9.847 1.00 0.00 H new ATOM 0 HH11 ARG A 48 6.021 -8.902 -10.136 1.00 0.00 H new ATOM 0 HH12 ARG A 48 5.640 -7.263 -10.671 1.00 0.00 H new ATOM 0 HH21 ARG A 48 8.982 -6.149 -10.527 1.00 0.00 H new ATOM 0 HH22 ARG A 48 7.311 -5.710 -10.892 1.00 0.00 H new ATOM 729 N ARG A 49 9.107 -11.775 -5.853 1.00 0.00 N ATOM 730 CA ARG A 49 10.347 -12.399 -5.392 1.00 0.00 C ATOM 731 C ARG A 49 10.207 -12.970 -3.983 1.00 0.00 C ATOM 732 O ARG A 49 10.561 -14.122 -3.735 1.00 0.00 O ATOM 733 CB ARG A 49 11.498 -11.392 -5.437 1.00 0.00 C ATOM 734 CG ARG A 49 11.766 -10.842 -6.827 1.00 0.00 C ATOM 735 CD ARG A 49 12.985 -9.932 -6.839 1.00 0.00 C ATOM 736 NE ARG A 49 14.210 -10.649 -6.491 1.00 0.00 N ATOM 737 CZ ARG A 49 14.749 -11.606 -7.244 1.00 0.00 C ATOM 738 NH1 ARG A 49 14.205 -11.931 -8.410 1.00 0.00 N ATOM 739 NH2 ARG A 49 15.845 -12.230 -6.836 1.00 0.00 N ATOM 0 H ARG A 49 9.220 -10.827 -6.211 1.00 0.00 H new ATOM 0 HA ARG A 49 10.565 -13.227 -6.066 1.00 0.00 H new ATOM 0 HB2 ARG A 49 11.273 -10.564 -4.764 1.00 0.00 H new ATOM 0 HB3 ARG A 49 12.403 -11.870 -5.063 1.00 0.00 H new ATOM 0 HG2 ARG A 49 11.919 -11.667 -7.523 1.00 0.00 H new ATOM 0 HG3 ARG A 49 10.894 -10.289 -7.175 1.00 0.00 H new ATOM 0 HD2 ARG A 49 13.095 -9.487 -7.828 1.00 0.00 H new ATOM 0 HD3 ARG A 49 12.833 -9.113 -6.136 1.00 0.00 H new ATOM 0 HE ARG A 49 14.680 -10.402 -5.620 1.00 0.00 H new ATOM 0 HH11 ARG A 49 13.368 -11.447 -8.735 1.00 0.00 H new ATOM 0 HH12 ARG A 49 14.624 -12.665 -8.981 1.00 0.00 H new ATOM 0 HH21 ARG A 49 16.275 -11.977 -5.946 1.00 0.00 H new ATOM 0 HH22 ARG A 49 16.259 -12.963 -7.412 1.00 0.00 H new ATOM 753 N GLU A 50 9.692 -12.162 -3.061 1.00 0.00 N ATOM 754 CA GLU A 50 9.511 -12.604 -1.679 1.00 0.00 C ATOM 755 C GLU A 50 8.365 -13.609 -1.564 1.00 0.00 C ATOM 756 O GLU A 50 8.183 -14.233 -0.519 1.00 0.00 O ATOM 757 CB GLU A 50 9.248 -11.410 -0.763 1.00 0.00 C ATOM 758 CG GLU A 50 9.192 -11.776 0.712 1.00 0.00 C ATOM 759 CD GLU A 50 10.486 -12.394 1.206 1.00 0.00 C ATOM 760 OE1 GLU A 50 11.536 -11.719 1.125 1.00 0.00 O ATOM 761 OE2 GLU A 50 10.450 -13.551 1.674 1.00 0.00 O ATOM 0 H GLU A 50 9.394 -11.204 -3.242 1.00 0.00 H new ATOM 0 HA GLU A 50 10.432 -13.096 -1.367 1.00 0.00 H new ATOM 0 HB2 GLU A 50 10.031 -10.667 -0.915 1.00 0.00 H new ATOM 0 HB3 GLU A 50 8.305 -10.944 -1.049 1.00 0.00 H new ATOM 0 HG2 GLU A 50 8.973 -10.883 1.297 1.00 0.00 H new ATOM 0 HG3 GLU A 50 8.372 -12.475 0.879 1.00 0.00 H new ATOM 768 N GLY A 51 7.596 -13.762 -2.640 1.00 0.00 N ATOM 769 CA GLY A 51 6.483 -14.693 -2.628 1.00 0.00 C ATOM 770 C GLY A 51 5.445 -14.342 -1.579 1.00 0.00 C ATOM 771 O GLY A 51 4.898 -15.225 -0.919 1.00 0.00 O ATOM 0 H GLY A 51 7.725 -13.258 -3.518 1.00 0.00 H new ATOM 0 HA2 GLY A 51 6.012 -14.705 -3.611 1.00 0.00 H new ATOM 0 HA3 GLY A 51 6.857 -15.700 -2.442 1.00 0.00 H new ATOM 775 N LEU A 52 5.175 -13.049 -1.427 1.00 0.00 N ATOM 776 CA LEU A 52 4.196 -12.585 -0.451 1.00 0.00 C ATOM 777 C LEU A 52 2.779 -12.914 -0.904 1.00 0.00 C ATOM 778 O LEU A 52 2.004 -13.517 -0.161 1.00 0.00 O ATOM 779 CB LEU A 52 4.335 -11.078 -0.230 1.00 0.00 C ATOM 780 CG LEU A 52 5.694 -10.623 0.303 1.00 0.00 C ATOM 781 CD1 LEU A 52 5.725 -9.109 0.471 1.00 0.00 C ATOM 782 CD2 LEU A 52 6.007 -11.316 1.620 1.00 0.00 C ATOM 0 H LEU A 52 5.619 -12.306 -1.966 1.00 0.00 H new ATOM 0 HA LEU A 52 4.388 -13.101 0.490 1.00 0.00 H new ATOM 0 HB2 LEU A 52 4.144 -10.569 -1.175 1.00 0.00 H new ATOM 0 HB3 LEU A 52 3.562 -10.756 0.468 1.00 0.00 H new ATOM 0 HG LEU A 52 6.459 -10.901 -0.422 1.00 0.00 H new ATOM 0 HD11 LEU A 52 6.700 -8.805 0.851 1.00 0.00 H new ATOM 0 HD12 LEU A 52 5.547 -8.632 -0.493 1.00 0.00 H new ATOM 0 HD13 LEU A 52 4.950 -8.805 1.175 1.00 0.00 H new ATOM 0 HD21 LEU A 52 6.978 -10.981 1.986 1.00 0.00 H new ATOM 0 HD22 LEU A 52 5.238 -11.069 2.353 1.00 0.00 H new ATOM 0 HD23 LEU A 52 6.030 -12.395 1.467 1.00 0.00 H new ATOM 794 N GLY A 53 2.446 -12.510 -2.123 1.00 0.00 N ATOM 795 CA GLY A 53 1.122 -12.768 -2.650 1.00 0.00 C ATOM 796 C GLY A 53 0.029 -12.265 -1.728 1.00 0.00 C ATOM 797 O GLY A 53 -1.024 -12.890 -1.598 1.00 0.00 O ATOM 0 H GLY A 53 3.070 -12.008 -2.755 1.00 0.00 H new ATOM 0 HA2 GLY A 53 1.021 -12.290 -3.624 1.00 0.00 H new ATOM 0 HA3 GLY A 53 0.998 -13.840 -2.807 1.00 0.00 H new ATOM 801 N LYS A 54 0.286 -11.131 -1.083 1.00 0.00 N ATOM 802 CA LYS A 54 -0.672 -10.532 -0.158 1.00 0.00 C ATOM 803 C LYS A 54 -0.089 -9.269 0.461 1.00 0.00 C ATOM 804 O LYS A 54 1.044 -9.275 0.938 1.00 0.00 O ATOM 805 CB LYS A 54 -1.028 -11.522 0.946 1.00 0.00 C ATOM 806 CG LYS A 54 -2.065 -10.998 1.926 1.00 0.00 C ATOM 807 CD LYS A 54 -2.548 -12.092 2.867 1.00 0.00 C ATOM 808 CE LYS A 54 -1.394 -12.755 3.599 1.00 0.00 C ATOM 809 NZ LYS A 54 -1.863 -13.792 4.557 1.00 0.00 N ATOM 0 H LYS A 54 1.154 -10.606 -1.184 1.00 0.00 H new ATOM 0 HA LYS A 54 -1.573 -10.275 -0.714 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -1.401 -12.440 0.492 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -0.122 -11.783 1.494 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -1.638 -10.180 2.506 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -2.913 -10.590 1.376 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -3.243 -11.668 3.592 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -3.098 -12.843 2.300 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -0.719 -13.210 2.874 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -0.822 -11.998 4.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -1.044 -14.219 5.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -2.487 -13.354 5.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -2.386 -14.529 4.042 1.00 0.00 H new ATOM 823 N LEU A 55 -0.860 -8.188 0.451 1.00 0.00 N ATOM 824 CA LEU A 55 -0.389 -6.925 1.006 1.00 0.00 C ATOM 825 C LEU A 55 -1.473 -6.227 1.823 1.00 0.00 C ATOM 826 O LEU A 55 -2.635 -6.177 1.424 1.00 0.00 O ATOM 827 CB LEU A 55 0.091 -6.007 -0.121 1.00 0.00 C ATOM 828 CG LEU A 55 1.167 -6.606 -1.037 1.00 0.00 C ATOM 829 CD1 LEU A 55 2.306 -7.201 -0.221 1.00 0.00 C ATOM 830 CD2 LEU A 55 0.564 -7.657 -1.963 1.00 0.00 C ATOM 0 H LEU A 55 -1.805 -8.160 0.069 1.00 0.00 H new ATOM 0 HA LEU A 55 0.441 -7.145 1.677 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -0.768 -5.727 -0.731 1.00 0.00 H new ATOM 0 HB3 LEU A 55 0.481 -5.090 0.320 1.00 0.00 H new ATOM 0 HG LEU A 55 1.573 -5.801 -1.650 1.00 0.00 H new ATOM 0 HD11 LEU A 55 3.055 -7.619 -0.893 1.00 0.00 H new ATOM 0 HD12 LEU A 55 2.761 -6.422 0.391 1.00 0.00 H new ATOM 0 HD13 LEU A 55 1.918 -7.989 0.425 1.00 0.00 H new ATOM 0 HD21 LEU A 55 1.344 -8.068 -2.603 1.00 0.00 H new ATOM 0 HD22 LEU A 55 0.124 -8.457 -1.368 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -0.208 -7.198 -2.581 1.00 0.00 H new ATOM 842 N VAL A 56 -1.077 -5.686 2.972 1.00 0.00 N ATOM 843 CA VAL A 56 -2.004 -4.987 3.856 1.00 0.00 C ATOM 844 C VAL A 56 -1.475 -3.603 4.224 1.00 0.00 C ATOM 845 O VAL A 56 -0.310 -3.452 4.596 1.00 0.00 O ATOM 846 CB VAL A 56 -2.251 -5.788 5.152 1.00 0.00 C ATOM 847 CG1 VAL A 56 -0.963 -5.924 5.953 1.00 0.00 C ATOM 848 CG2 VAL A 56 -3.343 -5.135 5.987 1.00 0.00 C ATOM 0 H VAL A 56 -0.116 -5.719 3.313 1.00 0.00 H new ATOM 0 HA VAL A 56 -2.943 -4.882 3.313 1.00 0.00 H new ATOM 0 HB VAL A 56 -2.587 -6.788 4.878 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -1.159 -6.492 6.863 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -0.215 -6.444 5.354 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -0.592 -4.933 6.216 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -3.502 -5.715 6.896 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -3.042 -4.121 6.251 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -4.269 -5.100 5.412 1.00 0.00 H new ATOM 858 N VAL A 57 -2.335 -2.593 4.122 1.00 0.00 N ATOM 859 CA VAL A 57 -1.940 -1.227 4.451 1.00 0.00 C ATOM 860 C VAL A 57 -1.915 -1.021 5.960 1.00 0.00 C ATOM 861 O VAL A 57 -2.766 -1.541 6.681 1.00 0.00 O ATOM 862 CB VAL A 57 -2.885 -0.183 3.825 1.00 0.00 C ATOM 863 CG1 VAL A 57 -2.301 1.214 3.967 1.00 0.00 C ATOM 864 CG2 VAL A 57 -3.160 -0.513 2.365 1.00 0.00 C ATOM 0 H VAL A 57 -3.303 -2.693 3.816 1.00 0.00 H new ATOM 0 HA VAL A 57 -0.941 -1.085 4.038 1.00 0.00 H new ATOM 0 HB VAL A 57 -3.834 -0.211 4.360 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -2.980 1.940 3.520 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -2.166 1.446 5.023 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -1.337 1.259 3.460 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -3.829 0.236 1.942 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -2.222 -0.516 1.810 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -3.626 -1.496 2.296 1.00 0.00 H new ATOM 874 N GLY A 58 -0.936 -0.260 6.430 1.00 0.00 N ATOM 875 CA GLY A 58 -0.820 0.004 7.850 1.00 0.00 C ATOM 876 C GLY A 58 -0.141 1.327 8.132 1.00 0.00 C ATOM 877 O GLY A 58 0.887 1.643 7.534 1.00 0.00 O ATOM 0 H GLY A 58 -0.219 0.180 5.852 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -1.813 0.004 8.300 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -0.256 -0.800 8.322 1.00 0.00 H new ATOM 881 N LEU A 59 -0.718 2.103 9.042 1.00 0.00 N ATOM 882 CA LEU A 59 -0.165 3.404 9.395 1.00 0.00 C ATOM 883 C LEU A 59 -0.477 3.743 10.852 1.00 0.00 C ATOM 884 O LEU A 59 -1.638 3.929 11.216 1.00 0.00 O ATOM 885 CB LEU A 59 -0.755 4.483 8.486 1.00 0.00 C ATOM 886 CG LEU A 59 -0.600 4.233 6.983 1.00 0.00 C ATOM 887 CD1 LEU A 59 -1.315 5.316 6.188 1.00 0.00 C ATOM 888 CD2 LEU A 59 0.871 4.178 6.599 1.00 0.00 C ATOM 0 H LEU A 59 -1.568 1.854 9.548 1.00 0.00 H new ATOM 0 HA LEU A 59 0.917 3.365 9.265 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -1.816 4.584 8.713 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -0.285 5.436 8.729 1.00 0.00 H new ATOM 0 HG LEU A 59 -1.054 3.271 6.746 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -1.195 5.124 5.122 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -2.375 5.313 6.440 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -0.887 6.289 6.432 1.00 0.00 H new ATOM 0 HD21 LEU A 59 0.961 4.000 5.527 1.00 0.00 H new ATOM 0 HD22 LEU A 59 1.348 5.125 6.851 1.00 0.00 H new ATOM 0 HD23 LEU A 59 1.359 3.370 7.144 1.00 0.00 H new ATOM 900 N PRO A 60 0.554 3.828 11.715 1.00 0.00 N ATOM 901 CA PRO A 60 0.367 4.144 13.132 1.00 0.00 C ATOM 902 C PRO A 60 -0.002 5.606 13.359 1.00 0.00 C ATOM 903 O PRO A 60 -1.035 5.911 13.956 1.00 0.00 O ATOM 904 CB PRO A 60 1.733 3.834 13.767 1.00 0.00 C ATOM 905 CG PRO A 60 2.537 3.159 12.703 1.00 0.00 C ATOM 906 CD PRO A 60 1.970 3.617 11.393 1.00 0.00 C ATOM 0 HA PRO A 60 -0.454 3.570 13.563 1.00 0.00 H new ATOM 0 HB2 PRO A 60 2.222 4.747 14.106 1.00 0.00 H new ATOM 0 HB3 PRO A 60 1.621 3.190 14.639 1.00 0.00 H new ATOM 0 HG2 PRO A 60 3.591 3.425 12.785 1.00 0.00 H new ATOM 0 HG3 PRO A 60 2.473 2.075 12.796 1.00 0.00 H new ATOM 0 HD2 PRO A 60 2.447 4.532 11.042 1.00 0.00 H new ATOM 0 HD3 PRO A 60 2.101 2.869 10.611 1.00 0.00 H new ATOM 914 N LEU A 61 0.852 6.508 12.885 1.00 0.00 N ATOM 915 CA LEU A 61 0.616 7.938 13.042 1.00 0.00 C ATOM 916 C LEU A 61 -0.428 8.441 12.051 1.00 0.00 C ATOM 917 O LEU A 61 -0.310 8.226 10.845 1.00 0.00 O ATOM 918 CB LEU A 61 1.924 8.713 12.857 1.00 0.00 C ATOM 919 CG LEU A 61 1.804 10.230 13.004 1.00 0.00 C ATOM 920 CD1 LEU A 61 1.293 10.594 14.389 1.00 0.00 C ATOM 921 CD2 LEU A 61 3.143 10.899 12.736 1.00 0.00 C ATOM 0 H LEU A 61 1.712 6.274 12.390 1.00 0.00 H new ATOM 0 HA LEU A 61 0.236 8.104 14.050 1.00 0.00 H new ATOM 0 HB2 LEU A 61 2.650 8.349 13.584 1.00 0.00 H new ATOM 0 HB3 LEU A 61 2.324 8.490 11.868 1.00 0.00 H new ATOM 0 HG LEU A 61 1.086 10.591 12.268 1.00 0.00 H new ATOM 0 HD11 LEU A 61 1.214 11.678 14.475 1.00 0.00 H new ATOM 0 HD12 LEU A 61 0.312 10.145 14.544 1.00 0.00 H new ATOM 0 HD13 LEU A 61 1.986 10.220 15.142 1.00 0.00 H new ATOM 0 HD21 LEU A 61 3.039 11.978 12.845 1.00 0.00 H new ATOM 0 HD22 LEU A 61 3.882 10.532 13.448 1.00 0.00 H new ATOM 0 HD23 LEU A 61 3.469 10.667 11.722 1.00 0.00 H new ATOM 933 N ARG A 62 -1.447 9.118 12.569 1.00 0.00 N ATOM 934 CA ARG A 62 -2.511 9.662 11.731 1.00 0.00 C ATOM 935 C ARG A 62 -2.097 11.007 11.141 1.00 0.00 C ATOM 936 O ARG A 62 -1.577 11.869 11.848 1.00 0.00 O ATOM 937 CB ARG A 62 -3.799 9.821 12.544 1.00 0.00 C ATOM 938 CG ARG A 62 -4.959 10.381 11.741 1.00 0.00 C ATOM 939 CD ARG A 62 -5.308 9.484 10.564 1.00 0.00 C ATOM 940 NE ARG A 62 -6.432 10.007 9.788 1.00 0.00 N ATOM 941 CZ ARG A 62 -7.675 10.105 10.254 1.00 0.00 C ATOM 942 NH1 ARG A 62 -7.973 9.670 11.472 1.00 0.00 N ATOM 943 NH2 ARG A 62 -8.628 10.624 9.492 1.00 0.00 N ATOM 0 H ARG A 62 -1.559 9.304 13.566 1.00 0.00 H new ATOM 0 HA ARG A 62 -2.692 8.965 10.913 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -4.084 8.851 12.951 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -3.605 10.477 13.392 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -5.830 10.491 12.387 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -4.704 11.377 11.378 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -4.437 9.381 9.916 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -5.553 8.487 10.929 1.00 0.00 H new ATOM 0 HE ARG A 62 -6.253 10.315 8.832 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -7.247 9.257 12.058 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -8.928 9.749 11.822 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -8.408 10.948 8.550 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -9.581 10.700 9.848 1.00 0.00 H new ATOM 957 N THR A 63 -2.333 11.182 9.845 1.00 0.00 N ATOM 958 CA THR A 63 -1.983 12.426 9.171 1.00 0.00 C ATOM 959 C THR A 63 -2.742 13.604 9.774 1.00 0.00 C ATOM 960 O THR A 63 -3.967 13.569 9.893 1.00 0.00 O ATOM 961 CB THR A 63 -2.285 12.354 7.663 1.00 0.00 C ATOM 962 OG1 THR A 63 -3.681 12.108 7.453 1.00 0.00 O ATOM 963 CG2 THR A 63 -1.467 11.256 6.999 1.00 0.00 C ATOM 0 H THR A 63 -2.764 10.481 9.243 1.00 0.00 H new ATOM 0 HA THR A 63 -0.912 12.573 9.311 1.00 0.00 H new ATOM 0 HB THR A 63 -2.013 13.310 7.215 1.00 0.00 H new ATOM 0 HG1 THR A 63 -4.200 12.548 8.158 1.00 0.00 H new ATOM 0 HG21 THR A 63 -1.697 11.224 5.934 1.00 0.00 H new ATOM 0 HG22 THR A 63 -0.405 11.461 7.135 1.00 0.00 H new ATOM 0 HG23 THR A 63 -1.712 10.295 7.452 1.00 0.00 H new ATOM 971 N ASP A 64 -2.008 14.643 10.156 1.00 0.00 N ATOM 972 CA ASP A 64 -2.617 15.829 10.750 1.00 0.00 C ATOM 973 C ASP A 64 -3.345 16.658 9.695 1.00 0.00 C ATOM 974 O ASP A 64 -4.543 16.912 9.810 1.00 0.00 O ATOM 975 CB ASP A 64 -1.550 16.682 11.440 1.00 0.00 C ATOM 976 CG ASP A 64 -2.135 17.913 12.108 1.00 0.00 C ATOM 977 OD1 ASP A 64 -2.738 18.743 11.397 1.00 0.00 O ATOM 978 OD2 ASP A 64 -1.986 18.046 13.341 1.00 0.00 O ATOM 0 H ASP A 64 -0.993 14.689 10.066 1.00 0.00 H new ATOM 0 HA ASP A 64 -3.346 15.500 11.490 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -1.033 16.078 12.186 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -0.805 16.990 10.707 1.00 0.00 H new ATOM 983 N LEU A 65 -2.610 17.080 8.670 1.00 0.00 N ATOM 984 CA LEU A 65 -3.190 17.886 7.600 1.00 0.00 C ATOM 985 C LEU A 65 -4.216 17.083 6.806 1.00 0.00 C ATOM 986 O LEU A 65 -3.916 16.000 6.300 1.00 0.00 O ATOM 987 CB LEU A 65 -2.097 18.407 6.658 1.00 0.00 C ATOM 988 CG LEU A 65 -1.461 17.361 5.735 1.00 0.00 C ATOM 989 CD1 LEU A 65 -0.437 18.014 4.820 1.00 0.00 C ATOM 990 CD2 LEU A 65 -0.813 16.245 6.543 1.00 0.00 C ATOM 0 H LEU A 65 -1.616 16.879 8.558 1.00 0.00 H new ATOM 0 HA LEU A 65 -3.693 18.736 8.062 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -2.522 19.199 6.041 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -1.310 18.860 7.260 1.00 0.00 H new ATOM 0 HG LEU A 65 -2.250 16.924 5.123 1.00 0.00 H new ATOM 0 HD11 LEU A 65 0.005 17.258 4.171 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -0.926 18.774 4.211 1.00 0.00 H new ATOM 0 HD13 LEU A 65 0.345 18.478 5.421 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -0.369 15.516 5.865 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -0.037 16.663 7.185 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -1.568 15.756 7.158 1.00 0.00 H new ATOM 1002 N LYS A 66 -5.425 17.620 6.696 1.00 0.00 N ATOM 1003 CA LYS A 66 -6.493 16.956 5.958 1.00 0.00 C ATOM 1004 C LYS A 66 -6.398 17.271 4.469 1.00 0.00 C ATOM 1005 O LYS A 66 -6.218 18.425 4.080 1.00 0.00 O ATOM 1006 CB LYS A 66 -7.860 17.385 6.496 1.00 0.00 C ATOM 1007 CG LYS A 66 -8.112 18.880 6.390 1.00 0.00 C ATOM 1008 CD LYS A 66 -9.529 19.253 6.805 1.00 0.00 C ATOM 1009 CE LYS A 66 -9.802 18.941 8.271 1.00 0.00 C ATOM 1010 NZ LYS A 66 -9.923 17.478 8.528 1.00 0.00 N ATOM 0 H LYS A 66 -5.691 18.514 7.109 1.00 0.00 H new ATOM 0 HA LYS A 66 -6.381 15.880 6.094 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -8.639 16.854 5.950 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -7.941 17.084 7.541 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -7.399 19.413 7.019 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -7.938 19.205 5.364 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -9.690 20.316 6.626 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -10.242 18.713 6.182 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -8.997 19.349 8.882 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -10.721 19.439 8.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -10.692 17.307 9.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -10.133 16.985 7.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -9.029 17.119 8.919 1.00 0.00 H new ATOM 1024 N GLU A 67 -6.524 16.240 3.638 1.00 0.00 N ATOM 1025 CA GLU A 67 -6.453 16.414 2.191 1.00 0.00 C ATOM 1026 C GLU A 67 -6.687 15.083 1.475 1.00 0.00 C ATOM 1027 O GLU A 67 -7.192 14.135 2.074 1.00 0.00 O ATOM 1028 CB GLU A 67 -5.091 16.993 1.798 1.00 0.00 C ATOM 1029 CG GLU A 67 -3.923 16.083 2.138 1.00 0.00 C ATOM 1030 CD GLU A 67 -2.585 16.677 1.741 1.00 0.00 C ATOM 1031 OE1 GLU A 67 -2.246 17.767 2.248 1.00 0.00 O ATOM 1032 OE2 GLU A 67 -1.877 16.053 0.924 1.00 0.00 O ATOM 0 H GLU A 67 -6.675 15.278 3.941 1.00 0.00 H new ATOM 0 HA GLU A 67 -7.235 17.110 1.887 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -5.086 17.192 0.726 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -4.954 17.950 2.301 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -3.924 15.882 3.209 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -4.055 15.125 1.634 1.00 0.00 H new ATOM 1039 N SER A 68 -6.313 15.026 0.196 1.00 0.00 N ATOM 1040 CA SER A 68 -6.476 13.818 -0.612 1.00 0.00 C ATOM 1041 C SER A 68 -7.929 13.350 -0.634 1.00 0.00 C ATOM 1042 O SER A 68 -8.573 13.229 0.408 1.00 0.00 O ATOM 1043 CB SER A 68 -5.569 12.696 -0.097 1.00 0.00 C ATOM 1044 OG SER A 68 -5.913 12.320 1.224 1.00 0.00 O ATOM 0 H SER A 68 -5.892 15.809 -0.305 1.00 0.00 H new ATOM 0 HA SER A 68 -6.186 14.067 -1.633 1.00 0.00 H new ATOM 0 HB2 SER A 68 -5.648 11.831 -0.756 1.00 0.00 H new ATOM 0 HB3 SER A 68 -4.530 13.024 -0.125 1.00 0.00 H new ATOM 0 HG SER A 68 -6.826 12.618 1.422 1.00 0.00 H new ATOM 1050 N ALA A 69 -8.439 13.081 -1.831 1.00 0.00 N ATOM 1051 CA ALA A 69 -9.814 12.621 -1.988 1.00 0.00 C ATOM 1052 C ALA A 69 -10.019 11.278 -1.297 1.00 0.00 C ATOM 1053 O ALA A 69 -11.022 11.066 -0.614 1.00 0.00 O ATOM 1054 CB ALA A 69 -10.171 12.520 -3.463 1.00 0.00 C ATOM 0 H ALA A 69 -7.922 13.173 -2.705 1.00 0.00 H new ATOM 0 HA ALA A 69 -10.475 13.349 -1.517 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -11.200 12.176 -3.566 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -10.068 13.499 -3.930 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -9.501 11.813 -3.952 1.00 0.00 H new ATOM 1060 N GLN A 70 -9.062 10.375 -1.480 1.00 0.00 N ATOM 1061 CA GLN A 70 -9.131 9.049 -0.876 1.00 0.00 C ATOM 1062 C GLN A 70 -7.893 8.237 -1.210 1.00 0.00 C ATOM 1063 O GLN A 70 -7.480 8.148 -2.366 1.00 0.00 O ATOM 1064 CB GLN A 70 -10.387 8.311 -1.344 1.00 0.00 C ATOM 1065 CG GLN A 70 -10.449 8.113 -2.850 1.00 0.00 C ATOM 1066 CD GLN A 70 -11.703 7.383 -3.291 1.00 0.00 C ATOM 1067 OE1 GLN A 70 -12.819 7.848 -3.060 1.00 0.00 O ATOM 1068 NE2 GLN A 70 -11.524 6.232 -3.928 1.00 0.00 N ATOM 0 H GLN A 70 -8.227 10.537 -2.043 1.00 0.00 H new ATOM 0 HA GLN A 70 -9.179 9.174 0.206 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -10.430 7.337 -0.856 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -11.267 8.868 -1.022 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -10.406 9.084 -3.343 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -9.573 7.552 -3.175 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -10.580 5.885 -4.098 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -12.330 5.695 -4.248 1.00 0.00 H new ATOM 1077 N ALA A 71 -7.306 7.650 -0.179 1.00 0.00 N ATOM 1078 CA ALA A 71 -6.111 6.842 -0.335 1.00 0.00 C ATOM 1079 C ALA A 71 -4.967 7.666 -0.938 1.00 0.00 C ATOM 1080 O ALA A 71 -4.832 8.853 -0.641 1.00 0.00 O ATOM 1081 CB ALA A 71 -6.419 5.615 -1.183 1.00 0.00 C ATOM 0 H ALA A 71 -7.642 7.720 0.781 1.00 0.00 H new ATOM 0 HA ALA A 71 -5.784 6.505 0.649 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -5.516 5.014 -1.295 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -7.192 5.021 -0.696 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -6.769 5.931 -2.166 1.00 0.00 H new ATOM 1087 N GLY A 72 -4.148 7.037 -1.781 1.00 0.00 N ATOM 1088 CA GLY A 72 -3.040 7.746 -2.396 1.00 0.00 C ATOM 1089 C GLY A 72 -2.233 6.860 -3.328 1.00 0.00 C ATOM 1090 O GLY A 72 -2.797 6.112 -4.122 1.00 0.00 O ATOM 0 H GLY A 72 -4.232 6.056 -2.046 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -3.423 8.601 -2.953 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -2.387 8.140 -1.617 1.00 0.00 H new ATOM 1094 N LYS A 73 -0.910 6.949 -3.226 1.00 0.00 N ATOM 1095 CA LYS A 73 -0.019 6.152 -4.062 1.00 0.00 C ATOM 1096 C LYS A 73 -0.174 4.659 -3.776 1.00 0.00 C ATOM 1097 O LYS A 73 0.119 3.821 -4.627 1.00 0.00 O ATOM 1098 CB LYS A 73 1.436 6.575 -3.844 1.00 0.00 C ATOM 1099 CG LYS A 73 1.729 8.004 -4.278 1.00 0.00 C ATOM 1100 CD LYS A 73 3.184 8.372 -4.040 1.00 0.00 C ATOM 1101 CE LYS A 73 3.531 8.345 -2.559 1.00 0.00 C ATOM 1102 NZ LYS A 73 2.700 9.301 -1.777 1.00 0.00 N ATOM 0 H LYS A 73 -0.431 7.567 -2.571 1.00 0.00 H new ATOM 0 HA LYS A 73 -0.293 6.330 -5.102 1.00 0.00 H new ATOM 0 HB2 LYS A 73 1.682 6.468 -2.788 1.00 0.00 H new ATOM 0 HB3 LYS A 73 2.089 5.897 -4.394 1.00 0.00 H new ATOM 0 HG2 LYS A 73 1.492 8.120 -5.336 1.00 0.00 H new ATOM 0 HG3 LYS A 73 1.085 8.691 -3.730 1.00 0.00 H new ATOM 0 HD2 LYS A 73 3.829 7.677 -4.579 1.00 0.00 H new ATOM 0 HD3 LYS A 73 3.380 9.366 -4.443 1.00 0.00 H new ATOM 0 HE2 LYS A 73 3.387 7.337 -2.171 1.00 0.00 H new ATOM 0 HE3 LYS A 73 4.585 8.589 -2.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 3.106 9.417 -0.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 2.682 10.222 -2.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 1.731 8.933 -1.697 1.00 0.00 H new ATOM 1116 N VAL A 74 -0.622 4.334 -2.567 1.00 0.00 N ATOM 1117 CA VAL A 74 -0.802 2.944 -2.160 1.00 0.00 C ATOM 1118 C VAL A 74 -1.942 2.255 -2.919 1.00 0.00 C ATOM 1119 O VAL A 74 -1.824 1.089 -3.300 1.00 0.00 O ATOM 1120 CB VAL A 74 -1.076 2.840 -0.646 1.00 0.00 C ATOM 1121 CG1 VAL A 74 -1.184 1.385 -0.215 1.00 0.00 C ATOM 1122 CG2 VAL A 74 0.010 3.556 0.141 1.00 0.00 C ATOM 0 H VAL A 74 -0.868 5.017 -1.850 1.00 0.00 H new ATOM 0 HA VAL A 74 0.131 2.435 -2.403 1.00 0.00 H new ATOM 0 HB VAL A 74 -2.029 3.325 -0.436 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -1.377 1.336 0.857 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -2.002 0.906 -0.753 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -0.250 0.869 -0.439 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -0.199 3.473 1.208 1.00 0.00 H new ATOM 0 HG22 VAL A 74 0.977 3.101 -0.076 1.00 0.00 H new ATOM 0 HG23 VAL A 74 0.032 4.608 -0.143 1.00 0.00 H new ATOM 1132 N LEU A 75 -3.052 2.964 -3.120 1.00 0.00 N ATOM 1133 CA LEU A 75 -4.206 2.388 -3.812 1.00 0.00 C ATOM 1134 C LEU A 75 -3.823 1.825 -5.185 1.00 0.00 C ATOM 1135 O LEU A 75 -4.123 0.670 -5.487 1.00 0.00 O ATOM 1136 CB LEU A 75 -5.328 3.423 -3.947 1.00 0.00 C ATOM 1137 CG LEU A 75 -6.583 2.926 -4.663 1.00 0.00 C ATOM 1138 CD1 LEU A 75 -7.199 1.756 -3.910 1.00 0.00 C ATOM 1139 CD2 LEU A 75 -7.591 4.055 -4.812 1.00 0.00 C ATOM 0 H LEU A 75 -3.177 3.930 -2.817 1.00 0.00 H new ATOM 0 HA LEU A 75 -4.569 1.557 -3.207 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -5.608 3.765 -2.951 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -4.940 4.289 -4.484 1.00 0.00 H new ATOM 0 HG LEU A 75 -6.300 2.583 -5.658 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -8.092 1.415 -4.434 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -6.478 0.940 -3.853 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -7.469 2.073 -2.903 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -8.479 3.685 -5.324 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -7.869 4.427 -3.826 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -7.148 4.864 -5.393 1.00 0.00 H new ATOM 1151 N PRO A 76 -3.150 2.623 -6.038 1.00 0.00 N ATOM 1152 CA PRO A 76 -2.732 2.173 -7.368 1.00 0.00 C ATOM 1153 C PRO A 76 -2.136 0.770 -7.341 1.00 0.00 C ATOM 1154 O PRO A 76 -2.396 -0.045 -8.227 1.00 0.00 O ATOM 1155 CB PRO A 76 -1.663 3.190 -7.762 1.00 0.00 C ATOM 1156 CG PRO A 76 -2.040 4.438 -7.042 1.00 0.00 C ATOM 1157 CD PRO A 76 -2.744 4.015 -5.778 1.00 0.00 C ATOM 0 HA PRO A 76 -3.570 2.118 -8.063 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -0.669 2.851 -7.472 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -1.644 3.346 -8.841 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -1.157 5.034 -6.812 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -2.691 5.058 -7.658 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -2.084 4.082 -4.913 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -3.606 4.649 -5.571 1.00 0.00 H new ATOM 1165 N LEU A 77 -1.344 0.492 -6.311 1.00 0.00 N ATOM 1166 CA LEU A 77 -0.717 -0.815 -6.162 1.00 0.00 C ATOM 1167 C LEU A 77 -1.770 -1.899 -5.988 1.00 0.00 C ATOM 1168 O LEU A 77 -1.670 -2.975 -6.577 1.00 0.00 O ATOM 1169 CB LEU A 77 0.227 -0.832 -4.958 1.00 0.00 C ATOM 1170 CG LEU A 77 0.862 -2.193 -4.666 1.00 0.00 C ATOM 1171 CD1 LEU A 77 1.910 -2.537 -5.715 1.00 0.00 C ATOM 1172 CD2 LEU A 77 1.454 -2.227 -3.264 1.00 0.00 C ATOM 0 H LEU A 77 -1.121 1.154 -5.568 1.00 0.00 H new ATOM 0 HA LEU A 77 -0.144 -1.011 -7.068 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.021 -0.104 -5.125 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.324 -0.506 -4.076 1.00 0.00 H new ATOM 0 HG LEU A 77 0.080 -2.950 -4.714 1.00 0.00 H new ATOM 0 HD11 LEU A 77 2.348 -3.509 -5.487 1.00 0.00 H new ATOM 0 HD12 LEU A 77 1.442 -2.572 -6.699 1.00 0.00 H new ATOM 0 HD13 LEU A 77 2.691 -1.777 -5.711 1.00 0.00 H new ATOM 0 HD21 LEU A 77 1.899 -3.205 -3.081 1.00 0.00 H new ATOM 0 HD22 LEU A 77 2.220 -1.457 -3.174 1.00 0.00 H new ATOM 0 HD23 LEU A 77 0.667 -2.044 -2.532 1.00 0.00 H new ATOM 1184 N VAL A 78 -2.779 -1.607 -5.176 1.00 0.00 N ATOM 1185 CA VAL A 78 -3.852 -2.560 -4.923 1.00 0.00 C ATOM 1186 C VAL A 78 -4.439 -3.070 -6.233 1.00 0.00 C ATOM 1187 O VAL A 78 -4.820 -4.235 -6.344 1.00 0.00 O ATOM 1188 CB VAL A 78 -4.974 -1.940 -4.072 1.00 0.00 C ATOM 1189 CG1 VAL A 78 -5.998 -2.997 -3.691 1.00 0.00 C ATOM 1190 CG2 VAL A 78 -4.397 -1.273 -2.832 1.00 0.00 C ATOM 0 H VAL A 78 -2.876 -0.720 -4.683 1.00 0.00 H new ATOM 0 HA VAL A 78 -3.416 -3.392 -4.370 1.00 0.00 H new ATOM 0 HB VAL A 78 -5.477 -1.176 -4.665 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -6.785 -2.541 -3.089 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -6.433 -3.424 -4.594 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -5.511 -3.785 -3.116 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -5.205 -0.840 -2.242 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -3.868 -2.014 -2.233 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -3.704 -0.486 -3.131 1.00 0.00 H new ATOM 1200 N GLU A 79 -4.500 -2.190 -7.227 1.00 0.00 N ATOM 1201 CA GLU A 79 -5.034 -2.551 -8.534 1.00 0.00 C ATOM 1202 C GLU A 79 -4.225 -3.689 -9.147 1.00 0.00 C ATOM 1203 O GLU A 79 -4.784 -4.631 -9.712 1.00 0.00 O ATOM 1204 CB GLU A 79 -5.025 -1.338 -9.467 1.00 0.00 C ATOM 1205 CG GLU A 79 -5.557 -1.635 -10.862 1.00 0.00 C ATOM 1206 CD GLU A 79 -6.997 -2.109 -10.850 1.00 0.00 C ATOM 1207 OE1 GLU A 79 -7.273 -3.159 -10.231 1.00 0.00 O ATOM 1208 OE2 GLU A 79 -7.850 -1.430 -11.460 1.00 0.00 O ATOM 0 H GLU A 79 -4.186 -1.222 -7.152 1.00 0.00 H new ATOM 0 HA GLU A 79 -6.063 -2.886 -8.403 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -5.623 -0.543 -9.021 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -4.005 -0.961 -9.549 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -5.479 -0.737 -11.475 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -4.932 -2.396 -11.330 1.00 0.00 H new ATOM 1215 N ALA A 80 -2.903 -3.599 -9.026 1.00 0.00 N ATOM 1216 CA ALA A 80 -2.013 -4.621 -9.561 1.00 0.00 C ATOM 1217 C ALA A 80 -2.180 -5.935 -8.811 1.00 0.00 C ATOM 1218 O ALA A 80 -2.324 -6.997 -9.415 1.00 0.00 O ATOM 1219 CB ALA A 80 -0.567 -4.156 -9.480 1.00 0.00 C ATOM 0 H ALA A 80 -2.426 -2.827 -8.561 1.00 0.00 H new ATOM 0 HA ALA A 80 -2.276 -4.786 -10.606 1.00 0.00 H new ATOM 0 HB1 ALA A 80 0.087 -4.929 -9.883 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -0.446 -3.240 -10.059 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -0.304 -3.965 -8.440 1.00 0.00 H new ATOM 1225 N LEU A 81 -2.148 -5.852 -7.485 1.00 0.00 N ATOM 1226 CA LEU A 81 -2.281 -7.027 -6.634 1.00 0.00 C ATOM 1227 C LEU A 81 -3.593 -7.757 -6.907 1.00 0.00 C ATOM 1228 O LEU A 81 -3.607 -8.967 -7.131 1.00 0.00 O ATOM 1229 CB LEU A 81 -2.208 -6.607 -5.165 1.00 0.00 C ATOM 1230 CG LEU A 81 -1.059 -5.655 -4.826 1.00 0.00 C ATOM 1231 CD1 LEU A 81 -1.047 -5.332 -3.340 1.00 0.00 C ATOM 1232 CD2 LEU A 81 0.274 -6.248 -5.262 1.00 0.00 C ATOM 0 H LEU A 81 -2.030 -4.977 -6.975 1.00 0.00 H new ATOM 0 HA LEU A 81 -1.463 -7.711 -6.858 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -3.149 -6.130 -4.891 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -2.113 -7.502 -4.550 1.00 0.00 H new ATOM 0 HG LEU A 81 -1.213 -4.725 -5.372 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -0.222 -4.654 -3.122 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -1.989 -4.859 -3.063 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -0.921 -6.252 -2.769 1.00 0.00 H new ATOM 0 HD21 LEU A 81 1.079 -5.557 -5.013 1.00 0.00 H new ATOM 0 HD22 LEU A 81 0.437 -7.195 -4.747 1.00 0.00 H new ATOM 0 HD23 LEU A 81 0.262 -6.418 -6.339 1.00 0.00 H new ATOM 1244 N ARG A 82 -4.694 -7.011 -6.890 1.00 0.00 N ATOM 1245 CA ARG A 82 -6.012 -7.587 -7.139 1.00 0.00 C ATOM 1246 C ARG A 82 -6.063 -8.256 -8.509 1.00 0.00 C ATOM 1247 O ARG A 82 -6.684 -9.306 -8.675 1.00 0.00 O ATOM 1248 CB ARG A 82 -7.091 -6.508 -7.042 1.00 0.00 C ATOM 1249 CG ARG A 82 -7.256 -5.933 -5.645 1.00 0.00 C ATOM 1250 CD ARG A 82 -7.698 -6.999 -4.653 1.00 0.00 C ATOM 1251 NE ARG A 82 -7.904 -6.453 -3.313 1.00 0.00 N ATOM 1252 CZ ARG A 82 -8.858 -5.577 -3.004 1.00 0.00 C ATOM 1253 NH1 ARG A 82 -9.730 -5.182 -3.923 1.00 0.00 N ATOM 1254 NH2 ARG A 82 -8.952 -5.108 -1.768 1.00 0.00 N ATOM 0 H ARG A 82 -4.700 -6.008 -6.707 1.00 0.00 H new ATOM 0 HA ARG A 82 -6.200 -8.345 -6.378 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -6.847 -5.700 -7.732 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -8.043 -6.928 -7.367 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -6.313 -5.497 -5.316 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -7.990 -5.127 -5.666 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -8.623 -7.458 -5.003 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -6.947 -7.788 -4.611 1.00 0.00 H new ATOM 0 HE ARG A 82 -7.279 -6.762 -2.569 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -9.672 -5.550 -4.873 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -10.458 -4.511 -3.680 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -8.294 -5.418 -1.053 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -9.683 -4.437 -1.531 1.00 0.00 H new ATOM 1268 N ALA A 83 -5.413 -7.636 -9.488 1.00 0.00 N ATOM 1269 CA ALA A 83 -5.386 -8.167 -10.848 1.00 0.00 C ATOM 1270 C ALA A 83 -4.911 -9.616 -10.871 1.00 0.00 C ATOM 1271 O ALA A 83 -5.486 -10.456 -11.564 1.00 0.00 O ATOM 1272 CB ALA A 83 -4.496 -7.306 -11.731 1.00 0.00 C ATOM 0 H ALA A 83 -4.897 -6.765 -9.366 1.00 0.00 H new ATOM 0 HA ALA A 83 -6.404 -8.143 -11.237 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -4.484 -7.713 -12.742 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -4.883 -6.287 -11.754 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -3.482 -7.300 -11.330 1.00 0.00 H new ATOM 1278 N ARG A 84 -3.860 -9.909 -10.109 1.00 0.00 N ATOM 1279 CA ARG A 84 -3.316 -11.262 -10.050 1.00 0.00 C ATOM 1280 C ARG A 84 -3.983 -12.087 -8.948 1.00 0.00 C ATOM 1281 O ARG A 84 -3.432 -13.093 -8.501 1.00 0.00 O ATOM 1282 CB ARG A 84 -1.804 -11.216 -9.821 1.00 0.00 C ATOM 1283 CG ARG A 84 -1.043 -10.497 -10.922 1.00 0.00 C ATOM 1284 CD ARG A 84 0.457 -10.520 -10.670 1.00 0.00 C ATOM 1285 NE ARG A 84 0.814 -9.864 -9.413 1.00 0.00 N ATOM 1286 CZ ARG A 84 0.667 -8.561 -9.187 1.00 0.00 C ATOM 1287 NH1 ARG A 84 0.215 -7.760 -10.143 1.00 0.00 N ATOM 1288 NH2 ARG A 84 0.986 -8.055 -8.004 1.00 0.00 N ATOM 0 H ARG A 84 -3.370 -9.230 -9.526 1.00 0.00 H new ATOM 0 HA ARG A 84 -3.523 -11.743 -11.006 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -1.604 -10.722 -8.870 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -1.427 -12.235 -9.736 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -1.259 -10.967 -11.882 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -1.386 -9.465 -10.988 1.00 0.00 H new ATOM 0 HD2 ARG A 84 0.805 -11.553 -10.651 1.00 0.00 H new ATOM 0 HD3 ARG A 84 0.970 -10.026 -11.495 1.00 0.00 H new ATOM 0 HE ARG A 84 1.199 -10.440 -8.664 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -0.022 -8.142 -11.058 1.00 0.00 H new ATOM 0 HH12 ARG A 84 0.105 -6.762 -9.963 1.00 0.00 H new ATOM 0 HH21 ARG A 84 1.344 -8.664 -7.268 1.00 0.00 H new ATOM 0 HH22 ARG A 84 0.874 -7.056 -7.829 1.00 0.00 H new ATOM 1302 N GLY A 85 -5.165 -11.661 -8.513 1.00 0.00 N ATOM 1303 CA GLY A 85 -5.871 -12.380 -7.471 1.00 0.00 C ATOM 1304 C GLY A 85 -5.090 -12.408 -6.178 1.00 0.00 C ATOM 1305 O GLY A 85 -5.061 -13.422 -5.480 1.00 0.00 O ATOM 0 H GLY A 85 -5.645 -10.832 -8.864 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -6.840 -11.912 -7.300 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -6.064 -13.401 -7.801 1.00 0.00 H new ATOM 1309 N VAL A 86 -4.457 -11.287 -5.857 1.00 0.00 N ATOM 1310 CA VAL A 86 -3.669 -11.176 -4.636 1.00 0.00 C ATOM 1311 C VAL A 86 -4.489 -10.557 -3.508 1.00 0.00 C ATOM 1312 O VAL A 86 -5.148 -9.534 -3.696 1.00 0.00 O ATOM 1313 CB VAL A 86 -2.401 -10.327 -4.862 1.00 0.00 C ATOM 1314 CG1 VAL A 86 -1.558 -10.269 -3.596 1.00 0.00 C ATOM 1315 CG2 VAL A 86 -1.591 -10.880 -6.026 1.00 0.00 C ATOM 0 H VAL A 86 -4.474 -10.441 -6.426 1.00 0.00 H new ATOM 0 HA VAL A 86 -3.375 -12.187 -4.355 1.00 0.00 H new ATOM 0 HB VAL A 86 -2.707 -9.311 -5.110 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -0.669 -9.665 -3.778 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -2.141 -9.822 -2.791 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -1.259 -11.278 -3.311 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -0.700 -10.269 -6.172 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.296 -11.907 -5.809 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -2.196 -10.861 -6.932 1.00 0.00 H new ATOM 1325 N GLU A 87 -4.443 -11.182 -2.335 1.00 0.00 N ATOM 1326 CA GLU A 87 -5.180 -10.686 -1.178 1.00 0.00 C ATOM 1327 C GLU A 87 -4.646 -9.327 -0.742 1.00 0.00 C ATOM 1328 O GLU A 87 -3.438 -9.148 -0.581 1.00 0.00 O ATOM 1329 CB GLU A 87 -5.082 -11.680 -0.020 1.00 0.00 C ATOM 1330 CG GLU A 87 -5.643 -13.054 -0.345 1.00 0.00 C ATOM 1331 CD GLU A 87 -7.112 -13.009 -0.716 1.00 0.00 C ATOM 1332 OE1 GLU A 87 -7.923 -12.571 0.127 1.00 0.00 O ATOM 1333 OE2 GLU A 87 -7.452 -13.412 -1.847 1.00 0.00 O ATOM 0 H GLU A 87 -3.905 -12.031 -2.161 1.00 0.00 H new ATOM 0 HA GLU A 87 -6.226 -10.574 -1.463 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -4.037 -11.784 0.271 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -5.614 -11.275 0.841 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -5.077 -13.488 -1.169 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -5.509 -13.710 0.515 1.00 0.00 H new ATOM 1340 N VAL A 88 -5.545 -8.367 -0.557 1.00 0.00 N ATOM 1341 CA VAL A 88 -5.150 -7.024 -0.147 1.00 0.00 C ATOM 1342 C VAL A 88 -6.294 -6.300 0.554 1.00 0.00 C ATOM 1343 O VAL A 88 -7.460 -6.465 0.198 1.00 0.00 O ATOM 1344 CB VAL A 88 -4.682 -6.175 -1.348 1.00 0.00 C ATOM 1345 CG1 VAL A 88 -4.282 -4.777 -0.900 1.00 0.00 C ATOM 1346 CG2 VAL A 88 -3.528 -6.851 -2.070 1.00 0.00 C ATOM 0 H VAL A 88 -6.549 -8.493 -0.684 1.00 0.00 H new ATOM 0 HA VAL A 88 -4.318 -7.145 0.547 1.00 0.00 H new ATOM 0 HB VAL A 88 -5.518 -6.087 -2.042 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -3.956 -4.198 -1.764 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -5.137 -4.285 -0.435 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -3.467 -4.845 -0.180 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -3.215 -6.235 -2.913 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -2.692 -6.977 -1.382 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -3.848 -7.827 -2.434 1.00 0.00 H new ATOM 1356 N GLU A 89 -5.946 -5.493 1.551 1.00 0.00 N ATOM 1357 CA GLU A 89 -6.942 -4.737 2.301 1.00 0.00 C ATOM 1358 C GLU A 89 -6.282 -3.744 3.254 1.00 0.00 C ATOM 1359 O GLU A 89 -5.393 -4.100 4.029 1.00 0.00 O ATOM 1360 CB GLU A 89 -7.847 -5.687 3.086 1.00 0.00 C ATOM 1361 CG GLU A 89 -7.101 -6.546 4.094 1.00 0.00 C ATOM 1362 CD GLU A 89 -8.022 -7.477 4.859 1.00 0.00 C ATOM 1363 OE1 GLU A 89 -8.686 -8.317 4.217 1.00 0.00 O ATOM 1364 OE2 GLU A 89 -8.077 -7.367 6.102 1.00 0.00 O ATOM 0 H GLU A 89 -4.984 -5.346 1.858 1.00 0.00 H new ATOM 0 HA GLU A 89 -7.543 -4.176 1.586 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -8.605 -5.104 3.609 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -8.372 -6.337 2.386 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -6.344 -7.134 3.575 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -6.576 -5.901 4.798 1.00 0.00 H new ATOM 1371 N LEU A 90 -6.731 -2.495 3.190 1.00 0.00 N ATOM 1372 CA LEU A 90 -6.201 -1.442 4.046 1.00 0.00 C ATOM 1373 C LEU A 90 -6.785 -1.545 5.452 1.00 0.00 C ATOM 1374 O LEU A 90 -7.915 -2.002 5.629 1.00 0.00 O ATOM 1375 CB LEU A 90 -6.488 -0.063 3.439 1.00 0.00 C ATOM 1376 CG LEU A 90 -7.958 0.227 3.120 1.00 0.00 C ATOM 1377 CD1 LEU A 90 -8.781 0.329 4.395 1.00 0.00 C ATOM 1378 CD2 LEU A 90 -8.078 1.503 2.300 1.00 0.00 C ATOM 0 H LEU A 90 -7.464 -2.187 2.551 1.00 0.00 H new ATOM 0 HA LEU A 90 -5.121 -1.568 4.118 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -6.127 0.700 4.129 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -5.909 0.038 2.521 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.351 -0.603 2.532 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -9.821 0.535 4.141 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -8.721 -0.611 4.943 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -8.392 1.136 5.016 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -9.128 1.697 2.080 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -7.665 2.339 2.865 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -7.527 1.389 1.366 1.00 0.00 H new ATOM 1390 N TRP A 91 -6.013 -1.127 6.450 1.00 0.00 N ATOM 1391 CA TRP A 91 -6.470 -1.187 7.834 1.00 0.00 C ATOM 1392 C TRP A 91 -5.711 -0.204 8.719 1.00 0.00 C ATOM 1393 O TRP A 91 -4.492 -0.068 8.617 1.00 0.00 O ATOM 1394 CB TRP A 91 -6.312 -2.607 8.382 1.00 0.00 C ATOM 1395 CG TRP A 91 -6.812 -2.762 9.785 1.00 0.00 C ATOM 1396 CD1 TRP A 91 -8.006 -2.324 10.283 1.00 0.00 C ATOM 1397 CD2 TRP A 91 -6.131 -3.397 10.874 1.00 0.00 C ATOM 1398 NE1 TRP A 91 -8.110 -2.649 11.614 1.00 0.00 N ATOM 1399 CE2 TRP A 91 -6.973 -3.308 12.000 1.00 0.00 C ATOM 1400 CE3 TRP A 91 -4.894 -4.032 11.007 1.00 0.00 C ATOM 1401 CZ2 TRP A 91 -6.615 -3.831 13.240 1.00 0.00 C ATOM 1402 CZ3 TRP A 91 -4.539 -4.550 12.238 1.00 0.00 C ATOM 1403 CH2 TRP A 91 -5.397 -4.448 13.340 1.00 0.00 C ATOM 0 H TRP A 91 -5.075 -0.746 6.328 1.00 0.00 H new ATOM 0 HA TRP A 91 -7.524 -0.908 7.846 1.00 0.00 H new ATOM 0 HB2 TRP A 91 -6.849 -3.300 7.734 1.00 0.00 H new ATOM 0 HB3 TRP A 91 -5.259 -2.887 8.346 1.00 0.00 H new ATOM 0 HD1 TRP A 91 -8.759 -1.799 9.714 1.00 0.00 H new ATOM 0 HE1 TRP A 91 -8.905 -2.434 12.217 1.00 0.00 H new ATOM 0 HE3 TRP A 91 -4.226 -4.117 10.162 1.00 0.00 H new ATOM 0 HZ2 TRP A 91 -7.274 -3.753 14.092 1.00 0.00 H new ATOM 0 HZ3 TRP A 91 -3.584 -5.042 12.352 1.00 0.00 H new ATOM 0 HH2 TRP A 91 -5.092 -4.865 14.288 1.00 0.00 H new ATOM 1414 N ASP A 92 -6.449 0.472 9.595 1.00 0.00 N ATOM 1415 CA ASP A 92 -5.865 1.441 10.514 1.00 0.00 C ATOM 1416 C ASP A 92 -6.942 2.019 11.430 1.00 0.00 C ATOM 1417 O ASP A 92 -6.720 2.205 12.625 1.00 0.00 O ATOM 1418 CB ASP A 92 -5.156 2.561 9.746 1.00 0.00 C ATOM 1419 CG ASP A 92 -6.097 3.358 8.865 1.00 0.00 C ATOM 1420 OD1 ASP A 92 -6.983 4.046 9.414 1.00 0.00 O ATOM 1421 OD2 ASP A 92 -5.948 3.296 7.627 1.00 0.00 O ATOM 0 H ASP A 92 -7.459 0.364 9.687 1.00 0.00 H new ATOM 0 HA ASP A 92 -5.124 0.928 11.127 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -4.674 3.233 10.456 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -4.367 2.129 9.130 1.00 0.00 H new ATOM 1426 N GLU A 93 -8.114 2.288 10.859 1.00 0.00 N ATOM 1427 CA GLU A 93 -9.232 2.830 11.625 1.00 0.00 C ATOM 1428 C GLU A 93 -9.789 1.788 12.573 1.00 0.00 C ATOM 1429 O GLU A 93 -10.033 0.645 12.186 1.00 0.00 O ATOM 1430 CB GLU A 93 -10.339 3.325 10.690 1.00 0.00 C ATOM 1431 CG GLU A 93 -9.886 4.404 9.720 1.00 0.00 C ATOM 1432 CD GLU A 93 -11.018 4.924 8.855 1.00 0.00 C ATOM 1433 OE1 GLU A 93 -11.617 4.115 8.114 1.00 0.00 O ATOM 1434 OE2 GLU A 93 -11.306 6.137 8.920 1.00 0.00 O ATOM 0 H GLU A 93 -8.313 2.139 9.870 1.00 0.00 H new ATOM 0 HA GLU A 93 -8.860 3.672 12.208 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -10.728 2.479 10.123 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -11.163 3.712 11.290 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -9.452 5.232 10.280 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -9.099 4.005 9.080 1.00 0.00 H new ATOM 1441 N ARG A 94 -9.995 2.192 13.816 1.00 0.00 N ATOM 1442 CA ARG A 94 -10.532 1.289 14.812 1.00 0.00 C ATOM 1443 C ARG A 94 -11.037 2.049 16.036 1.00 0.00 C ATOM 1444 O ARG A 94 -12.147 1.806 16.512 1.00 0.00 O ATOM 1445 CB ARG A 94 -9.476 0.265 15.229 1.00 0.00 C ATOM 1446 CG ARG A 94 -9.980 -0.751 16.241 1.00 0.00 C ATOM 1447 CD ARG A 94 -11.148 -1.554 15.689 1.00 0.00 C ATOM 1448 NE ARG A 94 -11.639 -2.537 16.650 1.00 0.00 N ATOM 1449 CZ ARG A 94 -12.655 -3.364 16.409 1.00 0.00 C ATOM 1450 NH1 ARG A 94 -13.285 -3.331 15.243 1.00 0.00 N ATOM 1451 NH2 ARG A 94 -13.038 -4.229 17.339 1.00 0.00 N ATOM 0 H ARG A 94 -9.799 3.134 14.155 1.00 0.00 H new ATOM 0 HA ARG A 94 -11.378 0.766 14.365 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -9.123 -0.262 14.343 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -8.619 0.790 15.650 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -9.170 -1.427 16.515 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -10.288 -0.237 17.152 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -11.958 -0.876 15.418 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -10.839 -2.063 14.776 1.00 0.00 H new ATOM 0 HE ARG A 94 -11.178 -2.594 17.558 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -12.992 -2.670 14.524 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -14.062 -3.967 15.065 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -12.555 -4.260 18.237 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -13.816 -4.863 17.156 1.00 0.00 H new ATOM 1465 N PHE A 95 -10.220 2.966 16.540 1.00 0.00 N ATOM 1466 CA PHE A 95 -10.593 3.757 17.708 1.00 0.00 C ATOM 1467 C PHE A 95 -9.500 4.767 18.048 1.00 0.00 C ATOM 1468 O PHE A 95 -8.325 4.415 18.143 1.00 0.00 O ATOM 1469 CB PHE A 95 -10.849 2.843 18.909 1.00 0.00 C ATOM 1470 CG PHE A 95 -11.354 3.565 20.124 1.00 0.00 C ATOM 1471 CD1 PHE A 95 -12.358 4.514 20.013 1.00 0.00 C ATOM 1472 CD2 PHE A 95 -10.827 3.294 21.376 1.00 0.00 C ATOM 1473 CE1 PHE A 95 -12.827 5.177 21.130 1.00 0.00 C ATOM 1474 CE2 PHE A 95 -11.294 3.955 22.496 1.00 0.00 C ATOM 1475 CZ PHE A 95 -12.295 4.898 22.373 1.00 0.00 C ATOM 0 H PHE A 95 -9.298 3.180 16.160 1.00 0.00 H new ATOM 0 HA PHE A 95 -11.508 4.300 17.473 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -11.573 2.080 18.625 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -9.924 2.326 19.164 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -12.778 4.737 19.043 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -10.043 2.558 21.478 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -13.610 5.914 21.031 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -10.876 3.734 23.467 1.00 0.00 H new ATOM 0 HZ PHE A 95 -12.661 5.416 23.247 1.00 0.00 H new ATOM 1485 N THR A 96 -9.896 6.025 18.229 1.00 0.00 N ATOM 1486 CA THR A 96 -8.948 7.084 18.556 1.00 0.00 C ATOM 1487 C THR A 96 -8.797 7.246 20.070 1.00 0.00 C ATOM 1488 O THR A 96 -8.758 8.364 20.581 1.00 0.00 O ATOM 1489 CB THR A 96 -9.383 8.430 17.940 1.00 0.00 C ATOM 1490 OG1 THR A 96 -9.592 8.277 16.530 1.00 0.00 O ATOM 1491 CG2 THR A 96 -8.334 9.505 18.182 1.00 0.00 C ATOM 0 H THR A 96 -10.865 6.334 18.155 1.00 0.00 H new ATOM 0 HA THR A 96 -7.986 6.793 18.134 1.00 0.00 H new ATOM 0 HB THR A 96 -10.313 8.737 18.419 1.00 0.00 H new ATOM 0 HG1 THR A 96 -9.870 9.135 16.145 1.00 0.00 H new ATOM 0 HG21 THR A 96 -8.666 10.443 17.738 1.00 0.00 H new ATOM 0 HG22 THR A 96 -8.193 9.641 19.254 1.00 0.00 H new ATOM 0 HG23 THR A 96 -7.391 9.202 17.728 1.00 0.00 H new ATOM 1499 N THR A 97 -8.711 6.120 20.775 1.00 0.00 N ATOM 1500 CA THR A 97 -8.560 6.119 22.230 1.00 0.00 C ATOM 1501 C THR A 97 -9.685 6.892 22.917 1.00 0.00 C ATOM 1502 O THR A 97 -10.035 7.998 22.509 1.00 0.00 O ATOM 1503 CB THR A 97 -7.204 6.708 22.667 1.00 0.00 C ATOM 1504 OG1 THR A 97 -7.106 8.083 22.277 1.00 0.00 O ATOM 1505 CG2 THR A 97 -6.052 5.920 22.058 1.00 0.00 C ATOM 0 H THR A 97 -8.744 5.189 20.359 1.00 0.00 H new ATOM 0 HA THR A 97 -8.607 5.074 22.538 1.00 0.00 H new ATOM 0 HB THR A 97 -7.142 6.640 23.753 1.00 0.00 H new ATOM 0 HG1 THR A 97 -7.972 8.388 21.933 1.00 0.00 H new ATOM 0 HG21 THR A 97 -5.105 6.353 22.380 1.00 0.00 H new ATOM 0 HG22 THR A 97 -6.107 4.882 22.387 1.00 0.00 H new ATOM 0 HG23 THR A 97 -6.119 5.960 20.971 1.00 0.00 H new ATOM 1513 N LYS A 98 -10.246 6.298 23.966 1.00 0.00 N ATOM 1514 CA LYS A 98 -11.329 6.932 24.711 1.00 0.00 C ATOM 1515 C LYS A 98 -10.875 8.243 25.341 1.00 0.00 C ATOM 1516 O LYS A 98 -9.815 8.772 25.003 1.00 0.00 O ATOM 1517 CB LYS A 98 -11.872 5.980 25.785 1.00 0.00 C ATOM 1518 CG LYS A 98 -10.804 5.359 26.682 1.00 0.00 C ATOM 1519 CD LYS A 98 -10.053 6.401 27.498 1.00 0.00 C ATOM 1520 CE LYS A 98 -11.001 7.255 28.326 1.00 0.00 C ATOM 1521 NZ LYS A 98 -11.799 6.434 29.278 1.00 0.00 N ATOM 0 H LYS A 98 -9.970 5.382 24.319 1.00 0.00 H new ATOM 0 HA LYS A 98 -12.130 7.159 24.007 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -12.581 6.524 26.409 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -12.427 5.180 25.296 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -11.272 4.642 27.356 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -10.096 4.803 26.067 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -9.341 5.904 28.157 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -9.476 7.040 26.830 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -10.429 8.000 28.880 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -11.674 7.798 27.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -12.357 7.060 29.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -12.439 5.810 28.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -11.159 5.858 29.861 1.00 0.00 H new TER 1535 LYS A 98