USER MOD reduce.3.24.130724 H: found=0, std=0, add=403, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 405 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 136 TYR OH : rot 180:sc= 0 USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 164 LYS NZ :NH3+ -172:sc= -0.0135 (180deg=-0.0671) USER MOD Single : A 168 GLN : amide:sc= 0 X(o=0,f=0.0015) USER MOD Single : A 171 ASN : amide:sc= -0.172 K(o=-0.17,f=-2.1!) USER MOD Single : A 175 SER OG : rot 180:sc= 0 USER MOD Single : A 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 181 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 186 TYR OH : rot 180:sc= 0.537 USER MOD Single : A 189 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 190 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 19 N TYR A 136 -1.784 -2.055 -1.547 1.00 0.00 N ATOM 20 CA TYR A 136 -2.936 -2.745 -0.990 1.00 0.00 C ATOM 21 C TYR A 136 -4.122 -1.792 -0.834 1.00 0.00 C ATOM 22 O TYR A 136 -3.940 -0.580 -0.730 1.00 0.00 O ATOM 23 CB TYR A 136 -2.505 -3.235 0.394 1.00 0.00 C ATOM 24 CG TYR A 136 -1.482 -4.372 0.362 1.00 0.00 C ATOM 25 CD1 TYR A 136 -1.815 -5.583 -0.210 1.00 0.00 C ATOM 26 CD2 TYR A 136 -0.227 -4.186 0.904 1.00 0.00 C ATOM 27 CE1 TYR A 136 -0.852 -6.654 -0.241 1.00 0.00 C ATOM 28 CE2 TYR A 136 0.736 -5.257 0.873 1.00 0.00 C ATOM 29 CZ TYR A 136 0.376 -6.437 0.303 1.00 0.00 C ATOM 30 OH TYR A 136 1.285 -7.448 0.274 1.00 0.00 O ATOM 0 HA TYR A 136 -3.249 -3.560 -1.643 1.00 0.00 H new ATOM 0 HB2 TYR A 136 -2.084 -2.397 0.950 1.00 0.00 H new ATOM 0 HB3 TYR A 136 -3.387 -3.569 0.941 1.00 0.00 H new ATOM 0 HD1 TYR A 136 -2.798 -5.728 -0.634 1.00 0.00 H new ATOM 0 HD2 TYR A 136 0.033 -3.238 1.351 1.00 0.00 H new ATOM 0 HE1 TYR A 136 -1.099 -7.607 -0.686 1.00 0.00 H new ATOM 0 HE2 TYR A 136 1.722 -5.125 1.293 1.00 0.00 H new ATOM 0 HH TYR A 136 2.118 -7.151 0.697 1.00 0.00 H new ATOM 40 N VAL A 137 -5.312 -2.376 -0.824 1.00 0.00 N ATOM 41 CA VAL A 137 -6.528 -1.595 -0.683 1.00 0.00 C ATOM 42 C VAL A 137 -7.470 -2.297 0.296 1.00 0.00 C ATOM 43 O VAL A 137 -7.278 -3.470 0.614 1.00 0.00 O ATOM 44 CB VAL A 137 -7.161 -1.359 -2.056 1.00 0.00 C ATOM 45 CG1 VAL A 137 -6.141 -0.777 -3.037 1.00 0.00 C ATOM 46 CG2 VAL A 137 -7.777 -2.648 -2.605 1.00 0.00 C ATOM 0 H VAL A 137 -5.459 -3.382 -0.911 1.00 0.00 H new ATOM 0 HA VAL A 137 -6.304 -0.612 -0.270 1.00 0.00 H new ATOM 0 HB VAL A 137 -7.963 -0.630 -1.935 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -6.616 -0.619 -4.005 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -5.770 0.174 -2.655 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -5.308 -1.471 -3.151 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -8.220 -2.452 -3.582 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -7.002 -3.408 -2.704 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -8.548 -3.003 -1.921 1.00 0.00 H new ATOM 56 N ARG A 138 -8.467 -1.551 0.748 1.00 0.00 N ATOM 57 CA ARG A 138 -9.439 -2.087 1.685 1.00 0.00 C ATOM 58 C ARG A 138 -10.835 -1.544 1.372 1.00 0.00 C ATOM 59 O ARG A 138 -10.996 -0.353 1.106 1.00 0.00 O ATOM 60 CB ARG A 138 -9.071 -1.729 3.126 1.00 0.00 C ATOM 61 CG ARG A 138 -8.389 -2.906 3.826 1.00 0.00 C ATOM 62 CD ARG A 138 -9.010 -3.162 5.201 1.00 0.00 C ATOM 63 NE ARG A 138 -8.153 -2.583 6.260 1.00 0.00 N ATOM 64 CZ ARG A 138 -8.581 -2.284 7.493 1.00 0.00 C ATOM 65 NH1 ARG A 138 -9.858 -2.507 7.832 1.00 0.00 N ATOM 66 NH2 ARG A 138 -7.732 -1.762 8.389 1.00 0.00 N ATOM 0 H ARG A 138 -8.623 -0.579 0.482 1.00 0.00 H new ATOM 0 HA ARG A 138 -9.436 -3.172 1.580 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -8.408 -0.864 3.132 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -9.969 -1.446 3.675 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -8.479 -3.801 3.210 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -7.324 -2.700 3.937 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -10.006 -2.722 5.247 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -9.127 -4.234 5.362 1.00 0.00 H new ATOM 0 HE ARG A 138 -7.175 -2.400 6.036 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -10.505 -2.905 7.151 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -10.184 -2.279 8.771 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -6.760 -1.592 8.132 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -8.058 -1.534 9.328 1.00 0.00 H new ATOM 80 N ALA A 139 -11.809 -2.441 1.414 1.00 0.00 N ATOM 81 CA ALA A 139 -13.184 -2.066 1.138 1.00 0.00 C ATOM 82 C ALA A 139 -13.836 -1.552 2.424 1.00 0.00 C ATOM 83 O ALA A 139 -13.921 -2.277 3.414 1.00 0.00 O ATOM 84 CB ALA A 139 -13.931 -3.262 0.544 1.00 0.00 C ATOM 0 H ALA A 139 -11.672 -3.427 1.635 1.00 0.00 H new ATOM 0 HA ALA A 139 -13.222 -1.261 0.404 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -14.963 -2.980 0.337 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -13.446 -3.570 -0.382 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -13.916 -4.089 1.254 1.00 0.00 H new ATOM 90 N LEU A 140 -14.279 -0.305 2.366 1.00 0.00 N ATOM 91 CA LEU A 140 -14.921 0.315 3.514 1.00 0.00 C ATOM 92 C LEU A 140 -16.435 0.340 3.295 1.00 0.00 C ATOM 93 O LEU A 140 -17.107 1.289 3.695 1.00 0.00 O ATOM 94 CB LEU A 140 -14.315 1.694 3.786 1.00 0.00 C ATOM 95 CG LEU A 140 -12.828 1.849 3.464 1.00 0.00 C ATOM 96 CD1 LEU A 140 -12.466 3.318 3.232 1.00 0.00 C ATOM 97 CD2 LEU A 140 -11.961 1.211 4.552 1.00 0.00 C ATOM 0 H LEU A 140 -14.206 0.293 1.543 1.00 0.00 H new ATOM 0 HA LEU A 140 -14.739 -0.271 4.415 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -14.870 2.433 3.208 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -14.465 1.934 4.839 1.00 0.00 H new ATOM 0 HG LEU A 140 -12.624 1.316 2.535 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -11.403 3.399 3.005 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -13.046 3.708 2.396 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -12.690 3.894 4.130 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -10.908 1.336 4.298 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -12.163 1.694 5.508 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -12.193 0.149 4.626 1.00 0.00 H new ATOM 109 N PHE A 141 -16.926 -0.713 2.659 1.00 0.00 N ATOM 110 CA PHE A 141 -18.348 -0.823 2.382 1.00 0.00 C ATOM 111 C PHE A 141 -18.697 -2.216 1.853 1.00 0.00 C ATOM 112 O PHE A 141 -17.999 -2.749 0.991 1.00 0.00 O ATOM 113 CB PHE A 141 -18.676 0.215 1.307 1.00 0.00 C ATOM 114 CG PHE A 141 -19.831 1.149 1.675 1.00 0.00 C ATOM 115 CD1 PHE A 141 -19.986 1.564 2.961 1.00 0.00 C ATOM 116 CD2 PHE A 141 -20.701 1.564 0.717 1.00 0.00 C ATOM 117 CE1 PHE A 141 -21.057 2.431 3.303 1.00 0.00 C ATOM 118 CE2 PHE A 141 -21.773 2.431 1.058 1.00 0.00 C ATOM 119 CZ PHE A 141 -21.928 2.846 2.344 1.00 0.00 C ATOM 0 H PHE A 141 -16.365 -1.498 2.328 1.00 0.00 H new ATOM 0 HA PHE A 141 -18.919 -0.657 3.295 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -17.786 0.814 1.111 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -18.922 -0.303 0.380 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -19.294 1.234 3.722 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -20.577 1.234 -0.304 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -21.180 2.761 4.324 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -22.465 2.761 0.297 1.00 0.00 H new ATOM 0 HZ PHE A 141 -22.743 3.505 2.604 1.00 0.00 H new ATOM 129 N ASP A 142 -19.776 -2.765 2.391 1.00 0.00 N ATOM 130 CA ASP A 142 -20.227 -4.085 1.984 1.00 0.00 C ATOM 131 C ASP A 142 -20.989 -3.974 0.662 1.00 0.00 C ATOM 132 O ASP A 142 -21.793 -3.061 0.480 1.00 0.00 O ATOM 133 CB ASP A 142 -21.170 -4.690 3.025 1.00 0.00 C ATOM 134 CG ASP A 142 -21.368 -6.204 2.915 1.00 0.00 C ATOM 135 OD1 ASP A 142 -21.089 -6.735 1.819 1.00 0.00 O ATOM 136 OD2 ASP A 142 -21.795 -6.795 3.930 1.00 0.00 O ATOM 0 H ASP A 142 -20.351 -2.319 3.106 1.00 0.00 H new ATOM 0 HA ASP A 142 -19.350 -4.723 1.879 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -20.786 -4.460 4.019 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -22.142 -4.204 2.939 1.00 0.00 H new ATOM 141 N PHE A 143 -20.710 -4.918 -0.226 1.00 0.00 N ATOM 142 CA PHE A 143 -21.360 -4.937 -1.526 1.00 0.00 C ATOM 143 C PHE A 143 -21.831 -6.348 -1.882 1.00 0.00 C ATOM 144 O PHE A 143 -21.043 -7.292 -1.869 1.00 0.00 O ATOM 145 CB PHE A 143 -20.319 -4.486 -2.553 1.00 0.00 C ATOM 146 CG PHE A 143 -20.913 -3.769 -3.767 1.00 0.00 C ATOM 147 CD1 PHE A 143 -22.034 -4.257 -4.364 1.00 0.00 C ATOM 148 CD2 PHE A 143 -20.321 -2.644 -4.250 1.00 0.00 C ATOM 149 CE1 PHE A 143 -22.586 -3.593 -5.491 1.00 0.00 C ATOM 150 CE2 PHE A 143 -20.873 -1.980 -5.377 1.00 0.00 C ATOM 151 CZ PHE A 143 -21.994 -2.468 -5.974 1.00 0.00 C ATOM 0 H PHE A 143 -20.043 -5.674 -0.071 1.00 0.00 H new ATOM 0 HA PHE A 143 -22.232 -4.283 -1.516 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -19.606 -3.822 -2.065 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -19.760 -5.357 -2.896 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -22.504 -5.150 -3.980 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -19.431 -2.256 -3.776 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -23.476 -3.981 -5.965 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -20.403 -1.087 -5.761 1.00 0.00 H new ATOM 0 HZ PHE A 143 -22.413 -1.962 -6.831 1.00 0.00 H new ATOM 250 N LEU A 151 -15.184 -9.928 -7.578 1.00 0.00 N ATOM 251 CA LEU A 151 -15.158 -10.701 -6.348 1.00 0.00 C ATOM 252 C LEU A 151 -15.950 -9.959 -5.269 1.00 0.00 C ATOM 253 O LEU A 151 -16.009 -8.732 -5.271 1.00 0.00 O ATOM 254 CB LEU A 151 -13.717 -11.019 -5.945 1.00 0.00 C ATOM 255 CG LEU A 151 -12.871 -9.828 -5.488 1.00 0.00 C ATOM 256 CD1 LEU A 151 -12.247 -10.093 -4.117 1.00 0.00 C ATOM 257 CD2 LEU A 151 -11.817 -9.471 -6.538 1.00 0.00 C ATOM 0 HA LEU A 151 -15.643 -11.666 -6.494 1.00 0.00 H new ATOM 0 HB2 LEU A 151 -13.739 -11.754 -5.140 1.00 0.00 H new ATOM 0 HB3 LEU A 151 -13.219 -11.490 -6.793 1.00 0.00 H new ATOM 0 HG LEU A 151 -13.526 -8.963 -5.382 1.00 0.00 H new ATOM 0 HD11 LEU A 151 -11.651 -9.231 -3.816 1.00 0.00 H new ATOM 0 HD12 LEU A 151 -13.036 -10.262 -3.385 1.00 0.00 H new ATOM 0 HD13 LEU A 151 -11.608 -10.974 -4.172 1.00 0.00 H new ATOM 0 HD21 LEU A 151 -11.229 -8.622 -6.189 1.00 0.00 H new ATOM 0 HD22 LEU A 151 -11.160 -10.326 -6.699 1.00 0.00 H new ATOM 0 HD23 LEU A 151 -12.310 -9.211 -7.475 1.00 0.00 H new ATOM 269 N PRO A 152 -16.556 -10.758 -4.349 1.00 0.00 N ATOM 270 CA PRO A 152 -17.342 -10.190 -3.267 1.00 0.00 C ATOM 271 C PRO A 152 -16.437 -9.582 -2.193 1.00 0.00 C ATOM 272 O PRO A 152 -15.329 -10.065 -1.963 1.00 0.00 O ATOM 273 CB PRO A 152 -18.186 -11.343 -2.748 1.00 0.00 C ATOM 274 CG PRO A 152 -17.511 -12.611 -3.244 1.00 0.00 C ATOM 275 CD PRO A 152 -16.508 -12.217 -4.316 1.00 0.00 C ATOM 0 HA PRO A 152 -17.975 -9.365 -3.594 1.00 0.00 H new ATOM 0 HB2 PRO A 152 -18.239 -11.329 -1.659 1.00 0.00 H new ATOM 0 HB3 PRO A 152 -19.209 -11.275 -3.118 1.00 0.00 H new ATOM 0 HG2 PRO A 152 -17.010 -13.123 -2.422 1.00 0.00 H new ATOM 0 HG3 PRO A 152 -18.249 -13.303 -3.648 1.00 0.00 H new ATOM 0 HD2 PRO A 152 -15.508 -12.575 -4.073 1.00 0.00 H new ATOM 0 HD3 PRO A 152 -16.773 -12.644 -5.283 1.00 0.00 H new ATOM 283 N PHE A 153 -16.942 -8.530 -1.566 1.00 0.00 N ATOM 284 CA PHE A 153 -16.193 -7.850 -0.523 1.00 0.00 C ATOM 285 C PHE A 153 -17.135 -7.216 0.504 1.00 0.00 C ATOM 286 O PHE A 153 -18.176 -6.669 0.142 1.00 0.00 O ATOM 287 CB PHE A 153 -15.381 -6.746 -1.202 1.00 0.00 C ATOM 288 CG PHE A 153 -16.026 -6.192 -2.474 1.00 0.00 C ATOM 289 CD1 PHE A 153 -16.920 -5.172 -2.395 1.00 0.00 C ATOM 290 CD2 PHE A 153 -15.704 -6.721 -3.685 1.00 0.00 C ATOM 291 CE1 PHE A 153 -17.518 -4.658 -3.575 1.00 0.00 C ATOM 292 CE2 PHE A 153 -16.301 -6.207 -4.866 1.00 0.00 C ATOM 293 CZ PHE A 153 -17.196 -5.187 -4.786 1.00 0.00 C ATOM 0 H PHE A 153 -17.861 -8.132 -1.760 1.00 0.00 H new ATOM 0 HA PHE A 153 -15.554 -8.562 0.000 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -15.236 -5.929 -0.495 1.00 0.00 H new ATOM 0 HB3 PHE A 153 -14.393 -7.135 -1.448 1.00 0.00 H new ATOM 0 HD1 PHE A 153 -17.176 -4.752 -1.433 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -14.994 -7.532 -3.748 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -18.228 -3.847 -3.511 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -16.044 -6.626 -5.828 1.00 0.00 H new ATOM 0 HZ PHE A 153 -17.651 -4.797 -5.684 1.00 0.00 H new ATOM 303 N LYS A 154 -16.736 -7.311 1.763 1.00 0.00 N ATOM 304 CA LYS A 154 -17.531 -6.753 2.844 1.00 0.00 C ATOM 305 C LYS A 154 -16.794 -5.556 3.449 1.00 0.00 C ATOM 306 O LYS A 154 -15.623 -5.328 3.150 1.00 0.00 O ATOM 307 CB LYS A 154 -17.885 -7.837 3.864 1.00 0.00 C ATOM 308 CG LYS A 154 -18.827 -8.877 3.254 1.00 0.00 C ATOM 309 CD LYS A 154 -19.859 -9.350 4.281 1.00 0.00 C ATOM 310 CE LYS A 154 -20.225 -10.818 4.053 1.00 0.00 C ATOM 311 NZ LYS A 154 -21.548 -10.928 3.400 1.00 0.00 N ATOM 0 H LYS A 154 -15.873 -7.766 2.059 1.00 0.00 H new ATOM 0 HA LYS A 154 -18.483 -6.382 2.464 1.00 0.00 H new ATOM 0 HB2 LYS A 154 -16.975 -8.325 4.212 1.00 0.00 H new ATOM 0 HB3 LYS A 154 -18.355 -7.382 4.735 1.00 0.00 H new ATOM 0 HG2 LYS A 154 -19.337 -8.449 2.391 1.00 0.00 H new ATOM 0 HG3 LYS A 154 -18.250 -9.729 2.894 1.00 0.00 H new ATOM 0 HD2 LYS A 154 -19.461 -9.223 5.288 1.00 0.00 H new ATOM 0 HD3 LYS A 154 -20.755 -8.733 4.212 1.00 0.00 H new ATOM 0 HE2 LYS A 154 -19.466 -11.296 3.433 1.00 0.00 H new ATOM 0 HE3 LYS A 154 -20.238 -11.348 5.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 -21.780 -11.931 3.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 -22.271 -10.490 4.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 -21.524 -10.440 2.482 1.00 0.00 H new ATOM 325 N LYS A 155 -17.510 -4.825 4.290 1.00 0.00 N ATOM 326 CA LYS A 155 -16.938 -3.658 4.939 1.00 0.00 C ATOM 327 C LYS A 155 -15.652 -4.060 5.663 1.00 0.00 C ATOM 328 O LYS A 155 -15.616 -5.080 6.350 1.00 0.00 O ATOM 329 CB LYS A 155 -17.973 -2.990 5.849 1.00 0.00 C ATOM 330 CG LYS A 155 -17.839 -1.467 5.805 1.00 0.00 C ATOM 331 CD LYS A 155 -16.702 -0.989 6.711 1.00 0.00 C ATOM 332 CE LYS A 155 -17.072 -1.149 8.186 1.00 0.00 C ATOM 333 NZ LYS A 155 -15.972 -0.667 9.052 1.00 0.00 N ATOM 0 H LYS A 155 -18.481 -5.018 4.537 1.00 0.00 H new ATOM 0 HA LYS A 155 -16.665 -2.906 4.198 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -18.977 -3.280 5.538 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -17.843 -3.341 6.873 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -17.652 -1.144 4.781 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -18.776 -1.007 6.118 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -15.797 -1.558 6.496 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -16.479 0.057 6.500 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -17.983 -0.591 8.401 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -17.281 -2.197 8.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -16.240 -0.783 10.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -15.111 -1.217 8.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -15.791 0.338 8.857 1.00 0.00 H new ATOM 347 N GLY A 156 -14.628 -3.239 5.484 1.00 0.00 N ATOM 348 CA GLY A 156 -13.343 -3.497 6.112 1.00 0.00 C ATOM 349 C GLY A 156 -12.708 -4.774 5.557 1.00 0.00 C ATOM 350 O GLY A 156 -12.084 -5.533 6.296 1.00 0.00 O ATOM 0 H GLY A 156 -14.662 -2.394 4.913 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -12.676 -2.652 5.943 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -13.473 -3.590 7.190 1.00 0.00 H new ATOM 354 N ASP A 157 -12.892 -4.972 4.260 1.00 0.00 N ATOM 355 CA ASP A 157 -12.345 -6.145 3.598 1.00 0.00 C ATOM 356 C ASP A 157 -10.947 -5.820 3.067 1.00 0.00 C ATOM 357 O ASP A 157 -10.619 -4.657 2.842 1.00 0.00 O ATOM 358 CB ASP A 157 -13.216 -6.562 2.410 1.00 0.00 C ATOM 359 CG ASP A 157 -12.612 -7.648 1.516 1.00 0.00 C ATOM 360 OD1 ASP A 157 -12.114 -8.641 2.087 1.00 0.00 O ATOM 361 OD2 ASP A 157 -12.662 -7.458 0.282 1.00 0.00 O ATOM 0 H ASP A 157 -13.412 -4.341 3.650 1.00 0.00 H new ATOM 0 HA ASP A 157 -12.311 -6.957 4.324 1.00 0.00 H new ATOM 0 HB2 ASP A 157 -14.175 -6.916 2.788 1.00 0.00 H new ATOM 0 HB3 ASP A 157 -13.419 -5.681 1.800 1.00 0.00 H new ATOM 366 N ILE A 158 -10.160 -6.871 2.883 1.00 0.00 N ATOM 367 CA ILE A 158 -8.805 -6.713 2.385 1.00 0.00 C ATOM 368 C ILE A 158 -8.759 -7.111 0.909 1.00 0.00 C ATOM 369 O ILE A 158 -9.274 -8.162 0.529 1.00 0.00 O ATOM 370 CB ILE A 158 -7.817 -7.486 3.261 1.00 0.00 C ATOM 371 CG1 ILE A 158 -7.539 -6.735 4.566 1.00 0.00 C ATOM 372 CG2 ILE A 158 -6.532 -7.799 2.494 1.00 0.00 C ATOM 373 CD1 ILE A 158 -6.600 -5.552 4.327 1.00 0.00 C ATOM 0 H ILE A 158 -10.436 -7.835 3.070 1.00 0.00 H new ATOM 0 HA ILE A 158 -8.498 -5.669 2.444 1.00 0.00 H new ATOM 0 HB ILE A 158 -8.271 -8.440 3.529 1.00 0.00 H new ATOM 0 HG12 ILE A 158 -8.477 -6.379 4.992 1.00 0.00 H new ATOM 0 HG13 ILE A 158 -7.096 -7.415 5.294 1.00 0.00 H new ATOM 0 HG21 ILE A 158 -5.847 -8.349 3.140 1.00 0.00 H new ATOM 0 HG22 ILE A 158 -6.769 -8.403 1.618 1.00 0.00 H new ATOM 0 HG23 ILE A 158 -6.062 -6.868 2.176 1.00 0.00 H new ATOM 0 HD11 ILE A 158 -6.419 -5.035 5.269 1.00 0.00 H new ATOM 0 HD12 ILE A 158 -5.654 -5.914 3.924 1.00 0.00 H new ATOM 0 HD13 ILE A 158 -7.057 -4.862 3.617 1.00 0.00 H new ATOM 385 N LEU A 159 -8.139 -6.251 0.115 1.00 0.00 N ATOM 386 CA LEU A 159 -8.019 -6.500 -1.311 1.00 0.00 C ATOM 387 C LEU A 159 -6.689 -5.936 -1.814 1.00 0.00 C ATOM 388 O LEU A 159 -6.461 -4.728 -1.758 1.00 0.00 O ATOM 389 CB LEU A 159 -9.239 -5.952 -2.055 1.00 0.00 C ATOM 390 CG LEU A 159 -10.605 -6.348 -1.489 1.00 0.00 C ATOM 391 CD1 LEU A 159 -11.612 -5.206 -1.634 1.00 0.00 C ATOM 392 CD2 LEU A 159 -11.109 -7.643 -2.128 1.00 0.00 C ATOM 0 H LEU A 159 -7.714 -5.380 0.433 1.00 0.00 H new ATOM 0 HA LEU A 159 -8.007 -7.572 -1.510 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -9.174 -4.864 -2.066 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -9.187 -6.285 -3.092 1.00 0.00 H new ATOM 0 HG LEU A 159 -10.489 -6.540 -0.422 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -12.574 -5.515 -1.224 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -11.251 -4.331 -1.093 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -11.730 -4.957 -2.689 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -12.081 -7.902 -1.708 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -11.204 -7.504 -3.205 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -10.401 -8.447 -1.927 1.00 0.00 H new ATOM 404 N ARG A 160 -5.844 -6.838 -2.292 1.00 0.00 N ATOM 405 CA ARG A 160 -4.542 -6.444 -2.804 1.00 0.00 C ATOM 406 C ARG A 160 -4.621 -6.183 -4.310 1.00 0.00 C ATOM 407 O ARG A 160 -4.771 -7.115 -5.099 1.00 0.00 O ATOM 408 CB ARG A 160 -3.495 -7.528 -2.536 1.00 0.00 C ATOM 409 CG ARG A 160 -2.284 -7.360 -3.455 1.00 0.00 C ATOM 410 CD ARG A 160 -2.191 -8.511 -4.458 1.00 0.00 C ATOM 411 NE ARG A 160 -0.911 -9.231 -4.286 1.00 0.00 N ATOM 412 CZ ARG A 160 0.281 -8.742 -4.656 1.00 0.00 C ATOM 413 NH1 ARG A 160 0.362 -7.530 -5.221 1.00 0.00 N ATOM 414 NH2 ARG A 160 1.392 -9.466 -4.461 1.00 0.00 N ATOM 0 H ARG A 160 -6.035 -7.839 -2.336 1.00 0.00 H new ATOM 0 HA ARG A 160 -4.245 -5.531 -2.288 1.00 0.00 H new ATOM 0 HB2 ARG A 160 -3.175 -7.480 -1.495 1.00 0.00 H new ATOM 0 HB3 ARG A 160 -3.938 -8.512 -2.689 1.00 0.00 H new ATOM 0 HG2 ARG A 160 -2.358 -6.413 -3.989 1.00 0.00 H new ATOM 0 HG3 ARG A 160 -1.373 -7.319 -2.858 1.00 0.00 H new ATOM 0 HD2 ARG A 160 -3.026 -9.197 -4.315 1.00 0.00 H new ATOM 0 HD3 ARG A 160 -2.267 -8.125 -5.475 1.00 0.00 H new ATOM 0 HE ARG A 160 -0.937 -10.157 -3.859 1.00 0.00 H new ATOM 0 HH11 ARG A 160 -0.483 -6.979 -5.370 1.00 0.00 H new ATOM 0 HH12 ARG A 160 1.269 -7.158 -5.502 1.00 0.00 H new ATOM 0 HH21 ARG A 160 1.330 -10.389 -4.031 1.00 0.00 H new ATOM 0 HH22 ARG A 160 2.299 -9.094 -4.743 1.00 0.00 H new ATOM 428 N ILE A 161 -4.516 -4.909 -4.663 1.00 0.00 N ATOM 429 CA ILE A 161 -4.573 -4.513 -6.059 1.00 0.00 C ATOM 430 C ILE A 161 -3.189 -4.682 -6.690 1.00 0.00 C ATOM 431 O ILE A 161 -2.193 -4.215 -6.140 1.00 0.00 O ATOM 432 CB ILE A 161 -5.141 -3.098 -6.192 1.00 0.00 C ATOM 433 CG1 ILE A 161 -6.074 -2.994 -7.400 1.00 0.00 C ATOM 434 CG2 ILE A 161 -4.020 -2.059 -6.241 1.00 0.00 C ATOM 435 CD1 ILE A 161 -7.538 -2.939 -6.960 1.00 0.00 C ATOM 0 H ILE A 161 -4.392 -4.139 -4.006 1.00 0.00 H new ATOM 0 HA ILE A 161 -5.256 -5.159 -6.610 1.00 0.00 H new ATOM 0 HB ILE A 161 -5.738 -2.884 -5.305 1.00 0.00 H new ATOM 0 HG12 ILE A 161 -5.830 -2.102 -7.976 1.00 0.00 H new ATOM 0 HG13 ILE A 161 -5.920 -3.850 -8.057 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -4.451 -1.062 -6.336 1.00 0.00 H new ATOM 0 HG22 ILE A 161 -3.432 -2.114 -5.325 1.00 0.00 H new ATOM 0 HG23 ILE A 161 -3.376 -2.259 -7.098 1.00 0.00 H new ATOM 0 HD11 ILE A 161 -8.179 -2.865 -7.838 1.00 0.00 H new ATOM 0 HD12 ILE A 161 -7.785 -3.844 -6.405 1.00 0.00 H new ATOM 0 HD13 ILE A 161 -7.694 -2.069 -6.323 1.00 0.00 H new ATOM 447 N ARG A 162 -3.172 -5.348 -7.834 1.00 0.00 N ATOM 448 CA ARG A 162 -1.927 -5.584 -8.545 1.00 0.00 C ATOM 449 C ARG A 162 -2.055 -5.133 -10.002 1.00 0.00 C ATOM 450 O ARG A 162 -1.105 -4.603 -10.576 1.00 0.00 O ATOM 451 CB ARG A 162 -1.544 -7.064 -8.509 1.00 0.00 C ATOM 452 CG ARG A 162 -0.031 -7.243 -8.655 1.00 0.00 C ATOM 453 CD ARG A 162 0.338 -7.643 -10.084 1.00 0.00 C ATOM 454 NE ARG A 162 0.415 -9.117 -10.193 1.00 0.00 N ATOM 455 CZ ARG A 162 1.428 -9.853 -9.715 1.00 0.00 C ATOM 456 NH1 ARG A 162 2.455 -9.258 -9.094 1.00 0.00 N ATOM 457 NH2 ARG A 162 1.414 -11.185 -9.859 1.00 0.00 N ATOM 0 H ARG A 162 -4.001 -5.732 -8.287 1.00 0.00 H new ATOM 0 HA ARG A 162 -1.147 -5.007 -8.049 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -1.877 -7.507 -7.570 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -2.056 -7.595 -9.311 1.00 0.00 H new ATOM 0 HG2 ARG A 162 0.476 -6.315 -8.391 1.00 0.00 H new ATOM 0 HG3 ARG A 162 0.317 -8.006 -7.959 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -0.405 -7.257 -10.782 1.00 0.00 H new ATOM 0 HD3 ARG A 162 1.295 -7.199 -10.359 1.00 0.00 H new ATOM 0 HE ARG A 162 -0.350 -9.603 -10.661 1.00 0.00 H new ATOM 0 HH11 ARG A 162 2.467 -8.244 -8.985 1.00 0.00 H new ATOM 0 HH12 ARG A 162 3.225 -9.819 -8.731 1.00 0.00 H new ATOM 0 HH21 ARG A 162 0.633 -11.639 -10.332 1.00 0.00 H new ATOM 0 HH22 ARG A 162 2.185 -11.745 -9.495 1.00 0.00 H new ATOM 471 N ASP A 163 -3.236 -5.360 -10.557 1.00 0.00 N ATOM 472 CA ASP A 163 -3.499 -4.984 -11.935 1.00 0.00 C ATOM 473 C ASP A 163 -4.513 -3.838 -11.962 1.00 0.00 C ATOM 474 O ASP A 163 -5.644 -3.994 -11.505 1.00 0.00 O ATOM 475 CB ASP A 163 -4.089 -6.156 -12.723 1.00 0.00 C ATOM 476 CG ASP A 163 -3.078 -6.955 -13.548 1.00 0.00 C ATOM 477 OD1 ASP A 163 -2.190 -6.306 -14.141 1.00 0.00 O ATOM 478 OD2 ASP A 163 -3.217 -8.198 -13.566 1.00 0.00 O ATOM 0 H ASP A 163 -4.021 -5.800 -10.077 1.00 0.00 H new ATOM 0 HA ASP A 163 -2.554 -4.684 -12.389 1.00 0.00 H new ATOM 0 HB2 ASP A 163 -4.581 -6.833 -12.024 1.00 0.00 H new ATOM 0 HB3 ASP A 163 -4.860 -5.773 -13.392 1.00 0.00 H new ATOM 483 N LYS A 164 -4.071 -2.712 -12.502 1.00 0.00 N ATOM 484 CA LYS A 164 -4.925 -1.540 -12.594 1.00 0.00 C ATOM 485 C LYS A 164 -4.875 -0.989 -14.021 1.00 0.00 C ATOM 486 O LYS A 164 -4.332 0.090 -14.255 1.00 0.00 O ATOM 487 CB LYS A 164 -4.545 -0.515 -11.525 1.00 0.00 C ATOM 488 CG LYS A 164 -4.441 -1.172 -10.147 1.00 0.00 C ATOM 489 CD LYS A 164 -3.285 -0.576 -9.342 1.00 0.00 C ATOM 490 CE LYS A 164 -3.805 0.341 -8.232 1.00 0.00 C ATOM 491 NZ LYS A 164 -2.712 0.701 -7.302 1.00 0.00 N ATOM 0 H LYS A 164 -3.132 -2.586 -12.880 1.00 0.00 H new ATOM 0 HA LYS A 164 -5.962 -1.807 -12.391 1.00 0.00 H new ATOM 0 HB2 LYS A 164 -3.593 -0.051 -11.783 1.00 0.00 H new ATOM 0 HB3 LYS A 164 -5.290 0.280 -11.497 1.00 0.00 H new ATOM 0 HG2 LYS A 164 -5.376 -1.035 -9.603 1.00 0.00 H new ATOM 0 HG3 LYS A 164 -4.293 -2.246 -10.262 1.00 0.00 H new ATOM 0 HD2 LYS A 164 -2.689 -1.378 -8.907 1.00 0.00 H new ATOM 0 HD3 LYS A 164 -2.627 -0.014 -10.005 1.00 0.00 H new ATOM 0 HE2 LYS A 164 -4.231 1.244 -8.668 1.00 0.00 H new ATOM 0 HE3 LYS A 164 -4.606 -0.158 -7.686 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 -3.105 1.209 -6.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 -2.235 -0.164 -6.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 -2.027 1.311 -7.791 1.00 0.00 H new ATOM 505 N PRO A 165 -5.465 -1.775 -14.962 1.00 0.00 N ATOM 506 CA PRO A 165 -5.492 -1.377 -16.359 1.00 0.00 C ATOM 507 C PRO A 165 -6.519 -0.268 -16.592 1.00 0.00 C ATOM 508 O PRO A 165 -6.162 0.843 -16.984 1.00 0.00 O ATOM 509 CB PRO A 165 -5.810 -2.650 -17.125 1.00 0.00 C ATOM 510 CG PRO A 165 -6.404 -3.611 -16.108 1.00 0.00 C ATOM 511 CD PRO A 165 -6.117 -3.059 -14.721 1.00 0.00 C ATOM 0 HA PRO A 165 -4.546 -0.953 -16.694 1.00 0.00 H new ATOM 0 HB2 PRO A 165 -6.514 -2.454 -17.934 1.00 0.00 H new ATOM 0 HB3 PRO A 165 -4.911 -3.068 -17.579 1.00 0.00 H new ATOM 0 HG2 PRO A 165 -7.478 -3.715 -16.263 1.00 0.00 H new ATOM 0 HG3 PRO A 165 -5.968 -4.604 -16.221 1.00 0.00 H new ATOM 0 HD2 PRO A 165 -7.035 -2.936 -14.146 1.00 0.00 H new ATOM 0 HD3 PRO A 165 -5.473 -3.730 -14.153 1.00 0.00 H new ATOM 519 N GLU A 166 -7.776 -0.606 -16.341 1.00 0.00 N ATOM 520 CA GLU A 166 -8.858 0.348 -16.519 1.00 0.00 C ATOM 521 C GLU A 166 -8.799 1.426 -15.435 1.00 0.00 C ATOM 522 O GLU A 166 -7.864 1.457 -14.636 1.00 0.00 O ATOM 523 CB GLU A 166 -10.215 -0.357 -16.518 1.00 0.00 C ATOM 524 CG GLU A 166 -10.557 -0.888 -15.125 1.00 0.00 C ATOM 525 CD GLU A 166 -11.909 -1.605 -15.127 1.00 0.00 C ATOM 526 OE1 GLU A 166 -12.933 -0.887 -15.139 1.00 0.00 O ATOM 527 OE2 GLU A 166 -11.889 -2.854 -15.117 1.00 0.00 O ATOM 0 H GLU A 166 -8.069 -1.527 -16.016 1.00 0.00 H new ATOM 0 HA GLU A 166 -8.736 0.830 -17.489 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -10.989 0.336 -16.847 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -10.201 -1.181 -17.232 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -9.778 -1.574 -14.792 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -10.580 -0.063 -14.413 1.00 0.00 H new ATOM 534 N GLU A 167 -9.809 2.283 -15.442 1.00 0.00 N ATOM 535 CA GLU A 167 -9.884 3.359 -14.469 1.00 0.00 C ATOM 536 C GLU A 167 -11.179 3.255 -13.661 1.00 0.00 C ATOM 537 O GLU A 167 -12.083 4.073 -13.823 1.00 0.00 O ATOM 538 CB GLU A 167 -9.773 4.724 -15.152 1.00 0.00 C ATOM 539 CG GLU A 167 -8.537 5.483 -14.663 1.00 0.00 C ATOM 540 CD GLU A 167 -8.861 6.315 -13.420 1.00 0.00 C ATOM 541 OE1 GLU A 167 -9.866 7.055 -13.479 1.00 0.00 O ATOM 542 OE2 GLU A 167 -8.096 6.190 -12.439 1.00 0.00 O ATOM 0 H GLU A 167 -10.582 2.254 -16.106 1.00 0.00 H new ATOM 0 HA GLU A 167 -9.042 3.262 -13.784 1.00 0.00 H new ATOM 0 HB2 GLU A 167 -9.718 4.591 -16.232 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -10.669 5.311 -14.948 1.00 0.00 H new ATOM 0 HG2 GLU A 167 -7.739 4.777 -14.434 1.00 0.00 H new ATOM 0 HG3 GLU A 167 -8.169 6.135 -15.455 1.00 0.00 H new ATOM 549 N GLN A 168 -11.226 2.243 -12.808 1.00 0.00 N ATOM 550 CA GLN A 168 -12.395 2.021 -11.974 1.00 0.00 C ATOM 551 C GLN A 168 -12.294 0.666 -11.269 1.00 0.00 C ATOM 552 O GLN A 168 -12.172 0.607 -10.045 1.00 0.00 O ATOM 553 CB GLN A 168 -13.681 2.117 -12.796 1.00 0.00 C ATOM 554 CG GLN A 168 -14.433 3.413 -12.486 1.00 0.00 C ATOM 555 CD GLN A 168 -15.412 3.760 -13.610 1.00 0.00 C ATOM 556 OE1 GLN A 168 -15.108 4.509 -14.525 1.00 0.00 O ATOM 557 NE2 GLN A 168 -16.602 3.176 -13.492 1.00 0.00 N ATOM 0 H GLN A 168 -10.473 1.567 -12.676 1.00 0.00 H new ATOM 0 HA GLN A 168 -12.429 2.802 -11.215 1.00 0.00 H new ATOM 0 HB2 GLN A 168 -13.442 2.076 -13.859 1.00 0.00 H new ATOM 0 HB3 GLN A 168 -14.320 1.261 -12.580 1.00 0.00 H new ATOM 0 HG2 GLN A 168 -14.975 3.307 -11.546 1.00 0.00 H new ATOM 0 HG3 GLN A 168 -13.721 4.228 -12.354 1.00 0.00 H new ATOM 0 HE21 GLN A 168 -16.792 2.560 -12.702 1.00 0.00 H new ATOM 0 HE22 GLN A 168 -17.324 3.345 -14.192 1.00 0.00 H new ATOM 566 N TRP A 169 -12.349 -0.387 -12.070 1.00 0.00 N ATOM 567 CA TRP A 169 -12.266 -1.737 -11.538 1.00 0.00 C ATOM 568 C TRP A 169 -10.867 -2.278 -11.839 1.00 0.00 C ATOM 569 O TRP A 169 -10.468 -2.364 -13.000 1.00 0.00 O ATOM 570 CB TRP A 169 -13.382 -2.618 -12.101 1.00 0.00 C ATOM 571 CG TRP A 169 -14.757 -1.945 -12.120 1.00 0.00 C ATOM 572 CD1 TRP A 169 -15.169 -0.932 -12.894 1.00 0.00 C ATOM 573 CD2 TRP A 169 -15.890 -2.282 -11.292 1.00 0.00 C ATOM 574 NE1 TRP A 169 -16.480 -0.593 -12.626 1.00 0.00 N ATOM 575 CE2 TRP A 169 -16.932 -1.440 -11.621 1.00 0.00 C ATOM 576 CE3 TRP A 169 -16.029 -3.267 -10.297 1.00 0.00 C ATOM 577 CZ2 TRP A 169 -18.187 -1.496 -11.004 1.00 0.00 C ATOM 578 CZ3 TRP A 169 -17.290 -3.309 -9.690 1.00 0.00 C ATOM 579 CH2 TRP A 169 -18.349 -2.468 -10.009 1.00 0.00 C ATOM 0 H TRP A 169 -12.450 -0.333 -13.084 1.00 0.00 H new ATOM 0 HA TRP A 169 -12.414 -1.736 -10.458 1.00 0.00 H new ATOM 0 HB2 TRP A 169 -13.120 -2.914 -13.117 1.00 0.00 H new ATOM 0 HB3 TRP A 169 -13.444 -3.531 -11.509 1.00 0.00 H new ATOM 0 HD1 TRP A 169 -14.553 -0.443 -13.634 1.00 0.00 H new ATOM 0 HE1 TRP A 169 -17.018 0.144 -13.082 1.00 0.00 H new ATOM 0 HE3 TRP A 169 -15.227 -3.937 -10.023 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 -18.987 -0.826 -11.280 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 -17.451 -4.048 -8.919 1.00 0.00 H new ATOM 0 HH2 TRP A 169 -19.292 -2.563 -9.492 1.00 0.00 H new ATOM 590 N TRP A 170 -10.161 -2.629 -10.775 1.00 0.00 N ATOM 591 CA TRP A 170 -8.815 -3.160 -10.910 1.00 0.00 C ATOM 592 C TRP A 170 -8.814 -4.591 -10.366 1.00 0.00 C ATOM 593 O TRP A 170 -9.678 -4.957 -9.571 1.00 0.00 O ATOM 594 CB TRP A 170 -7.796 -2.255 -10.215 1.00 0.00 C ATOM 595 CG TRP A 170 -7.708 -0.847 -10.808 1.00 0.00 C ATOM 596 CD1 TRP A 170 -7.987 -0.460 -12.060 1.00 0.00 C ATOM 597 CD2 TRP A 170 -7.302 0.353 -10.117 1.00 0.00 C ATOM 598 NE1 TRP A 170 -7.790 0.895 -12.226 1.00 0.00 N ATOM 599 CE2 TRP A 170 -7.361 1.405 -11.006 1.00 0.00 C ATOM 600 CE3 TRP A 170 -6.898 0.541 -8.783 1.00 0.00 C ATOM 601 CZ2 TRP A 170 -7.028 2.721 -10.659 1.00 0.00 C ATOM 602 CZ3 TRP A 170 -6.570 1.862 -8.453 1.00 0.00 C ATOM 603 CH2 TRP A 170 -6.623 2.933 -9.336 1.00 0.00 C ATOM 0 H TRP A 170 -10.496 -2.556 -9.814 1.00 0.00 H new ATOM 0 HA TRP A 170 -8.514 -3.186 -11.957 1.00 0.00 H new ATOM 0 HB2 TRP A 170 -8.055 -2.178 -9.159 1.00 0.00 H new ATOM 0 HB3 TRP A 170 -6.813 -2.723 -10.269 1.00 0.00 H new ATOM 0 HD1 TRP A 170 -8.324 -1.125 -12.841 1.00 0.00 H new ATOM 0 HE1 TRP A 170 -7.933 1.425 -13.086 1.00 0.00 H new ATOM 0 HE3 TRP A 170 -6.845 -0.269 -8.070 1.00 0.00 H new ATOM 0 HZ2 TRP A 170 -7.081 3.529 -11.374 1.00 0.00 H new ATOM 0 HZ3 TRP A 170 -6.253 2.062 -7.440 1.00 0.00 H new ATOM 0 HH2 TRP A 170 -6.353 3.924 -9.003 1.00 0.00 H new ATOM 614 N ASN A 171 -7.833 -5.359 -10.816 1.00 0.00 N ATOM 615 CA ASN A 171 -7.708 -6.742 -10.384 1.00 0.00 C ATOM 616 C ASN A 171 -6.919 -6.793 -9.075 1.00 0.00 C ATOM 617 O ASN A 171 -5.739 -6.447 -9.043 1.00 0.00 O ATOM 618 CB ASN A 171 -6.957 -7.577 -11.423 1.00 0.00 C ATOM 619 CG ASN A 171 -7.875 -8.627 -12.050 1.00 0.00 C ATOM 620 OD1 ASN A 171 -8.885 -8.321 -12.661 1.00 0.00 O ATOM 621 ND2 ASN A 171 -7.468 -9.880 -11.866 1.00 0.00 N ATOM 0 H ASN A 171 -7.118 -5.051 -11.475 1.00 0.00 H new ATOM 0 HA ASN A 171 -8.711 -7.147 -10.253 1.00 0.00 H new ATOM 0 HB2 ASN A 171 -6.560 -6.925 -12.201 1.00 0.00 H new ATOM 0 HB3 ASN A 171 -6.105 -8.068 -10.953 1.00 0.00 H new ATOM 0 HD21 ASN A 171 -8.012 -10.654 -12.247 1.00 0.00 H new ATOM 0 HD22 ASN A 171 -6.612 -10.067 -11.344 1.00 0.00 H new ATOM 628 N ALA A 172 -7.603 -7.226 -8.026 1.00 0.00 N ATOM 629 CA ALA A 172 -6.980 -7.326 -6.717 1.00 0.00 C ATOM 630 C ALA A 172 -7.224 -8.725 -6.147 1.00 0.00 C ATOM 631 O ALA A 172 -8.175 -9.401 -6.537 1.00 0.00 O ATOM 632 CB ALA A 172 -7.524 -6.223 -5.807 1.00 0.00 C ATOM 0 H ALA A 172 -8.582 -7.511 -8.056 1.00 0.00 H new ATOM 0 HA ALA A 172 -5.902 -7.184 -6.793 1.00 0.00 H new ATOM 0 HB1 ALA A 172 -7.057 -6.298 -4.825 1.00 0.00 H new ATOM 0 HB2 ALA A 172 -7.300 -5.249 -6.242 1.00 0.00 H new ATOM 0 HB3 ALA A 172 -8.603 -6.335 -5.705 1.00 0.00 H new ATOM 638 N GLU A 173 -6.349 -9.117 -5.233 1.00 0.00 N ATOM 639 CA GLU A 173 -6.458 -10.424 -4.606 1.00 0.00 C ATOM 640 C GLU A 173 -7.007 -10.285 -3.184 1.00 0.00 C ATOM 641 O GLU A 173 -6.326 -9.771 -2.298 1.00 0.00 O ATOM 642 CB GLU A 173 -5.108 -11.145 -4.603 1.00 0.00 C ATOM 643 CG GLU A 173 -5.253 -12.578 -4.088 1.00 0.00 C ATOM 644 CD GLU A 173 -4.666 -12.716 -2.682 1.00 0.00 C ATOM 645 OE1 GLU A 173 -3.628 -12.065 -2.433 1.00 0.00 O ATOM 646 OE2 GLU A 173 -5.267 -13.470 -1.887 1.00 0.00 O ATOM 0 H GLU A 173 -5.562 -8.553 -4.911 1.00 0.00 H new ATOM 0 HA GLU A 173 -7.155 -11.028 -5.188 1.00 0.00 H new ATOM 0 HB2 GLU A 173 -4.696 -11.157 -5.612 1.00 0.00 H new ATOM 0 HB3 GLU A 173 -4.402 -10.600 -3.977 1.00 0.00 H new ATOM 0 HG2 GLU A 173 -6.306 -12.859 -4.076 1.00 0.00 H new ATOM 0 HG3 GLU A 173 -4.747 -13.265 -4.766 1.00 0.00 H new ATOM 653 N ASP A 174 -8.235 -10.755 -3.011 1.00 0.00 N ATOM 654 CA ASP A 174 -8.883 -10.690 -1.712 1.00 0.00 C ATOM 655 C ASP A 174 -8.069 -11.497 -0.698 1.00 0.00 C ATOM 656 O ASP A 174 -7.115 -12.180 -1.068 1.00 0.00 O ATOM 657 CB ASP A 174 -10.290 -11.286 -1.770 1.00 0.00 C ATOM 658 CG ASP A 174 -10.419 -12.563 -2.603 1.00 0.00 C ATOM 659 OD1 ASP A 174 -9.763 -13.557 -2.222 1.00 0.00 O ATOM 660 OD2 ASP A 174 -11.169 -12.517 -3.600 1.00 0.00 O ATOM 0 H ASP A 174 -8.797 -11.181 -3.748 1.00 0.00 H new ATOM 0 HA ASP A 174 -8.946 -9.642 -1.419 1.00 0.00 H new ATOM 0 HB2 ASP A 174 -10.620 -11.499 -0.753 1.00 0.00 H new ATOM 0 HB3 ASP A 174 -10.969 -10.536 -2.175 1.00 0.00 H new ATOM 665 N SER A 175 -8.475 -11.391 0.558 1.00 0.00 N ATOM 666 CA SER A 175 -7.794 -12.102 1.626 1.00 0.00 C ATOM 667 C SER A 175 -8.264 -13.557 1.668 1.00 0.00 C ATOM 668 O SER A 175 -8.311 -14.169 2.734 1.00 0.00 O ATOM 669 CB SER A 175 -8.037 -11.427 2.978 1.00 0.00 C ATOM 670 OG SER A 175 -6.824 -11.224 3.698 1.00 0.00 O ATOM 0 H SER A 175 -9.267 -10.824 0.860 1.00 0.00 H new ATOM 0 HA SER A 175 -6.723 -12.078 1.425 1.00 0.00 H new ATOM 0 HB2 SER A 175 -8.530 -10.468 2.821 1.00 0.00 H new ATOM 0 HB3 SER A 175 -8.714 -12.040 3.573 1.00 0.00 H new ATOM 0 HG SER A 175 -7.021 -10.790 4.554 1.00 0.00 H new ATOM 676 N GLU A 176 -8.601 -14.070 0.494 1.00 0.00 N ATOM 677 CA GLU A 176 -9.066 -15.443 0.382 1.00 0.00 C ATOM 678 C GLU A 176 -8.329 -16.163 -0.747 1.00 0.00 C ATOM 679 O GLU A 176 -8.458 -17.376 -0.905 1.00 0.00 O ATOM 680 CB GLU A 176 -10.581 -15.494 0.169 1.00 0.00 C ATOM 681 CG GLU A 176 -11.313 -15.726 1.491 1.00 0.00 C ATOM 682 CD GLU A 176 -12.079 -17.051 1.468 1.00 0.00 C ATOM 683 OE1 GLU A 176 -12.569 -17.404 0.374 1.00 0.00 O ATOM 684 OE2 GLU A 176 -12.156 -17.681 2.546 1.00 0.00 O ATOM 0 H GLU A 176 -8.561 -13.560 -0.388 1.00 0.00 H new ATOM 0 HA GLU A 176 -8.847 -15.957 1.318 1.00 0.00 H new ATOM 0 HB2 GLU A 176 -10.920 -14.560 -0.280 1.00 0.00 H new ATOM 0 HB3 GLU A 176 -10.827 -16.292 -0.532 1.00 0.00 H new ATOM 0 HG2 GLU A 176 -10.596 -15.730 2.312 1.00 0.00 H new ATOM 0 HG3 GLU A 176 -12.005 -14.905 1.677 1.00 0.00 H new ATOM 691 N GLY A 177 -7.570 -15.385 -1.507 1.00 0.00 N ATOM 692 CA GLY A 177 -6.811 -15.934 -2.617 1.00 0.00 C ATOM 693 C GLY A 177 -7.554 -15.733 -3.941 1.00 0.00 C ATOM 694 O GLY A 177 -7.052 -16.104 -5.000 1.00 0.00 O ATOM 0 H GLY A 177 -7.465 -14.379 -1.375 1.00 0.00 H new ATOM 0 HA2 GLY A 177 -5.834 -15.453 -2.667 1.00 0.00 H new ATOM 0 HA3 GLY A 177 -6.635 -16.997 -2.452 1.00 0.00 H new ATOM 698 N LYS A 178 -8.736 -15.145 -3.835 1.00 0.00 N ATOM 699 CA LYS A 178 -9.552 -14.890 -5.010 1.00 0.00 C ATOM 700 C LYS A 178 -9.125 -13.564 -5.644 1.00 0.00 C ATOM 701 O LYS A 178 -9.240 -12.509 -5.023 1.00 0.00 O ATOM 702 CB LYS A 178 -11.039 -14.950 -4.653 1.00 0.00 C ATOM 703 CG LYS A 178 -11.613 -16.341 -4.929 1.00 0.00 C ATOM 704 CD LYS A 178 -12.206 -16.418 -6.338 1.00 0.00 C ATOM 705 CE LYS A 178 -11.119 -16.702 -7.375 1.00 0.00 C ATOM 706 NZ LYS A 178 -11.654 -17.538 -8.473 1.00 0.00 N ATOM 0 H LYS A 178 -9.148 -14.838 -2.954 1.00 0.00 H new ATOM 0 HA LYS A 178 -9.396 -15.667 -5.758 1.00 0.00 H new ATOM 0 HB2 LYS A 178 -11.175 -14.699 -3.601 1.00 0.00 H new ATOM 0 HB3 LYS A 178 -11.586 -14.206 -5.232 1.00 0.00 H new ATOM 0 HG2 LYS A 178 -10.829 -17.091 -4.819 1.00 0.00 H new ATOM 0 HG3 LYS A 178 -12.383 -16.574 -4.193 1.00 0.00 H new ATOM 0 HD2 LYS A 178 -12.963 -17.201 -6.376 1.00 0.00 H new ATOM 0 HD3 LYS A 178 -12.706 -15.480 -6.578 1.00 0.00 H new ATOM 0 HE2 LYS A 178 -10.738 -15.763 -7.777 1.00 0.00 H new ATOM 0 HE3 LYS A 178 -10.279 -17.209 -6.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 -10.902 -17.721 -9.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 -11.996 -18.441 -8.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 -12.440 -17.040 -8.937 1.00 0.00 H new ATOM 720 N ARG A 179 -8.640 -13.663 -6.873 1.00 0.00 N ATOM 721 CA ARG A 179 -8.195 -12.486 -7.599 1.00 0.00 C ATOM 722 C ARG A 179 -9.209 -12.114 -8.681 1.00 0.00 C ATOM 723 O ARG A 179 -9.446 -12.888 -9.608 1.00 0.00 O ATOM 724 CB ARG A 179 -6.830 -12.722 -8.248 1.00 0.00 C ATOM 725 CG ARG A 179 -5.862 -13.384 -7.265 1.00 0.00 C ATOM 726 CD ARG A 179 -4.560 -13.783 -7.962 1.00 0.00 C ATOM 727 NE ARG A 179 -3.684 -14.512 -7.018 1.00 0.00 N ATOM 728 CZ ARG A 179 -2.452 -14.945 -7.319 1.00 0.00 C ATOM 729 NH1 ARG A 179 -1.943 -14.726 -8.539 1.00 0.00 N ATOM 730 NH2 ARG A 179 -1.729 -15.598 -6.400 1.00 0.00 N ATOM 0 H ARG A 179 -8.545 -14.540 -7.384 1.00 0.00 H new ATOM 0 HA ARG A 179 -8.107 -11.669 -6.883 1.00 0.00 H new ATOM 0 HB2 ARG A 179 -6.947 -13.353 -9.129 1.00 0.00 H new ATOM 0 HB3 ARG A 179 -6.416 -11.773 -8.588 1.00 0.00 H new ATOM 0 HG2 ARG A 179 -5.645 -12.699 -6.446 1.00 0.00 H new ATOM 0 HG3 ARG A 179 -6.329 -14.266 -6.827 1.00 0.00 H new ATOM 0 HD2 ARG A 179 -4.778 -14.410 -8.827 1.00 0.00 H new ATOM 0 HD3 ARG A 179 -4.049 -12.894 -8.333 1.00 0.00 H new ATOM 0 HE ARG A 179 -4.040 -14.696 -6.080 1.00 0.00 H new ATOM 0 HH11 ARG A 179 -2.493 -14.229 -9.240 1.00 0.00 H new ATOM 0 HH12 ARG A 179 -1.005 -15.056 -8.767 1.00 0.00 H new ATOM 0 HH21 ARG A 179 -2.116 -15.766 -5.471 1.00 0.00 H new ATOM 0 HH22 ARG A 179 -0.791 -15.928 -6.629 1.00 0.00 H new ATOM 744 N GLY A 180 -9.782 -10.929 -8.529 1.00 0.00 N ATOM 745 CA GLY A 180 -10.766 -10.445 -9.483 1.00 0.00 C ATOM 746 C GLY A 180 -10.783 -8.916 -9.526 1.00 0.00 C ATOM 747 O GLY A 180 -9.923 -8.265 -8.933 1.00 0.00 O ATOM 0 H GLY A 180 -9.584 -10.290 -7.759 1.00 0.00 H new ATOM 0 HA2 GLY A 180 -10.540 -10.838 -10.474 1.00 0.00 H new ATOM 0 HA3 GLY A 180 -11.754 -10.816 -9.211 1.00 0.00 H new ATOM 751 N MET A 181 -11.770 -8.386 -10.233 1.00 0.00 N ATOM 752 CA MET A 181 -11.910 -6.946 -10.361 1.00 0.00 C ATOM 753 C MET A 181 -12.712 -6.366 -9.194 1.00 0.00 C ATOM 754 O MET A 181 -13.750 -6.908 -8.820 1.00 0.00 O ATOM 755 CB MET A 181 -12.615 -6.616 -11.678 1.00 0.00 C ATOM 756 CG MET A 181 -11.617 -6.568 -12.837 1.00 0.00 C ATOM 757 SD MET A 181 -11.889 -7.950 -13.934 1.00 0.00 S ATOM 758 CE MET A 181 -12.275 -7.077 -15.442 1.00 0.00 C ATOM 0 H MET A 181 -12.481 -8.929 -10.723 1.00 0.00 H new ATOM 0 HA MET A 181 -10.915 -6.502 -10.350 1.00 0.00 H new ATOM 0 HB2 MET A 181 -13.380 -7.365 -11.883 1.00 0.00 H new ATOM 0 HB3 MET A 181 -13.124 -5.656 -11.592 1.00 0.00 H new ATOM 0 HG2 MET A 181 -11.727 -5.632 -13.384 1.00 0.00 H new ATOM 0 HG3 MET A 181 -10.598 -6.594 -12.452 1.00 0.00 H new ATOM 0 HE1 MET A 181 -12.473 -7.795 -16.238 1.00 0.00 H new ATOM 0 HE2 MET A 181 -13.156 -6.455 -15.287 1.00 0.00 H new ATOM 0 HE3 MET A 181 -11.431 -6.447 -15.724 1.00 0.00 H new ATOM 768 N ILE A 182 -12.198 -5.273 -8.650 1.00 0.00 N ATOM 769 CA ILE A 182 -12.853 -4.615 -7.532 1.00 0.00 C ATOM 770 C ILE A 182 -12.863 -3.104 -7.771 1.00 0.00 C ATOM 771 O ILE A 182 -11.997 -2.575 -8.467 1.00 0.00 O ATOM 772 CB ILE A 182 -12.199 -5.024 -6.211 1.00 0.00 C ATOM 773 CG1 ILE A 182 -10.711 -4.669 -6.202 1.00 0.00 C ATOM 774 CG2 ILE A 182 -12.436 -6.507 -5.919 1.00 0.00 C ATOM 775 CD1 ILE A 182 -10.295 -4.085 -4.851 1.00 0.00 C ATOM 0 H ILE A 182 -11.336 -4.826 -8.962 1.00 0.00 H new ATOM 0 HA ILE A 182 -13.893 -4.934 -7.458 1.00 0.00 H new ATOM 0 HB ILE A 182 -12.669 -4.458 -5.407 1.00 0.00 H new ATOM 0 HG12 ILE A 182 -10.120 -5.560 -6.415 1.00 0.00 H new ATOM 0 HG13 ILE A 182 -10.500 -3.950 -6.994 1.00 0.00 H new ATOM 0 HG21 ILE A 182 -11.961 -6.772 -4.975 1.00 0.00 H new ATOM 0 HG22 ILE A 182 -13.507 -6.698 -5.853 1.00 0.00 H new ATOM 0 HG23 ILE A 182 -12.009 -7.109 -6.721 1.00 0.00 H new ATOM 0 HD11 ILE A 182 -9.233 -3.841 -4.872 1.00 0.00 H new ATOM 0 HD12 ILE A 182 -10.871 -3.181 -4.652 1.00 0.00 H new ATOM 0 HD13 ILE A 182 -10.484 -4.816 -4.065 1.00 0.00 H new ATOM 787 N PRO A 183 -13.879 -2.432 -7.165 1.00 0.00 N ATOM 788 CA PRO A 183 -14.012 -0.992 -7.304 1.00 0.00 C ATOM 789 C PRO A 183 -12.974 -0.260 -6.453 1.00 0.00 C ATOM 790 O PRO A 183 -12.770 -0.600 -5.288 1.00 0.00 O ATOM 791 CB PRO A 183 -15.442 -0.689 -6.889 1.00 0.00 C ATOM 792 CG PRO A 183 -15.911 -1.896 -6.093 1.00 0.00 C ATOM 793 CD PRO A 183 -14.922 -3.025 -6.333 1.00 0.00 C ATOM 0 HA PRO A 183 -13.824 -0.648 -8.321 1.00 0.00 H new ATOM 0 HB2 PRO A 183 -15.490 0.218 -6.287 1.00 0.00 H new ATOM 0 HB3 PRO A 183 -16.075 -0.526 -7.761 1.00 0.00 H new ATOM 0 HG2 PRO A 183 -15.966 -1.655 -5.031 1.00 0.00 H new ATOM 0 HG3 PRO A 183 -16.912 -2.193 -6.404 1.00 0.00 H new ATOM 0 HD2 PRO A 183 -14.514 -3.401 -5.395 1.00 0.00 H new ATOM 0 HD3 PRO A 183 -15.397 -3.868 -6.834 1.00 0.00 H new ATOM 801 N VAL A 184 -12.345 0.732 -7.067 1.00 0.00 N ATOM 802 CA VAL A 184 -11.333 1.515 -6.379 1.00 0.00 C ATOM 803 C VAL A 184 -12.016 2.523 -5.453 1.00 0.00 C ATOM 804 O VAL A 184 -11.467 2.890 -4.415 1.00 0.00 O ATOM 805 CB VAL A 184 -10.401 2.175 -7.398 1.00 0.00 C ATOM 806 CG1 VAL A 184 -9.383 3.082 -6.703 1.00 0.00 C ATOM 807 CG2 VAL A 184 -9.700 1.124 -8.260 1.00 0.00 C ATOM 0 H VAL A 184 -12.517 1.011 -8.033 1.00 0.00 H new ATOM 0 HA VAL A 184 -10.710 0.872 -5.756 1.00 0.00 H new ATOM 0 HB VAL A 184 -11.009 2.796 -8.055 1.00 0.00 H new ATOM 0 HG11 VAL A 184 -8.733 3.539 -7.450 1.00 0.00 H new ATOM 0 HG12 VAL A 184 -9.908 3.863 -6.152 1.00 0.00 H new ATOM 0 HG13 VAL A 184 -8.782 2.492 -6.011 1.00 0.00 H new ATOM 0 HG21 VAL A 184 -9.044 1.619 -8.976 1.00 0.00 H new ATOM 0 HG22 VAL A 184 -9.110 0.465 -7.623 1.00 0.00 H new ATOM 0 HG23 VAL A 184 -10.446 0.538 -8.797 1.00 0.00 H new ATOM 817 N PRO A 185 -13.235 2.955 -5.873 1.00 0.00 N ATOM 818 CA PRO A 185 -14.000 3.914 -5.093 1.00 0.00 C ATOM 819 C PRO A 185 -14.620 3.249 -3.862 1.00 0.00 C ATOM 820 O PRO A 185 -14.968 3.926 -2.895 1.00 0.00 O ATOM 821 CB PRO A 185 -15.037 4.466 -6.055 1.00 0.00 C ATOM 822 CG PRO A 185 -15.118 3.468 -7.199 1.00 0.00 C ATOM 823 CD PRO A 185 -13.916 2.543 -7.097 1.00 0.00 C ATOM 0 HA PRO A 185 -13.382 4.717 -4.691 1.00 0.00 H new ATOM 0 HB2 PRO A 185 -16.004 4.577 -5.565 1.00 0.00 H new ATOM 0 HB3 PRO A 185 -14.748 5.453 -6.417 1.00 0.00 H new ATOM 0 HG2 PRO A 185 -16.045 2.897 -7.143 1.00 0.00 H new ATOM 0 HG3 PRO A 185 -15.121 3.986 -8.158 1.00 0.00 H new ATOM 0 HD2 PRO A 185 -14.223 1.498 -7.047 1.00 0.00 H new ATOM 0 HD3 PRO A 185 -13.265 2.643 -7.965 1.00 0.00 H new ATOM 831 N TYR A 186 -14.739 1.932 -3.937 1.00 0.00 N ATOM 832 CA TYR A 186 -15.311 1.168 -2.841 1.00 0.00 C ATOM 833 C TYR A 186 -14.218 0.663 -1.896 1.00 0.00 C ATOM 834 O TYR A 186 -14.507 -0.025 -0.918 1.00 0.00 O ATOM 835 CB TYR A 186 -16.008 -0.033 -3.483 1.00 0.00 C ATOM 836 CG TYR A 186 -17.420 -0.287 -2.954 1.00 0.00 C ATOM 837 CD1 TYR A 186 -18.472 0.490 -3.392 1.00 0.00 C ATOM 838 CD2 TYR A 186 -17.643 -1.296 -2.038 1.00 0.00 C ATOM 839 CE1 TYR A 186 -19.802 0.251 -2.894 1.00 0.00 C ATOM 840 CE2 TYR A 186 -18.973 -1.536 -1.540 1.00 0.00 C ATOM 841 CZ TYR A 186 -19.986 -0.751 -1.993 1.00 0.00 C ATOM 842 OH TYR A 186 -21.242 -0.977 -1.522 1.00 0.00 O ATOM 0 H TYR A 186 -14.449 1.374 -4.740 1.00 0.00 H new ATOM 0 HA TYR A 186 -15.994 1.785 -2.258 1.00 0.00 H new ATOM 0 HB2 TYR A 186 -16.057 0.122 -4.561 1.00 0.00 H new ATOM 0 HB3 TYR A 186 -15.403 -0.924 -3.316 1.00 0.00 H new ATOM 0 HD1 TYR A 186 -18.298 1.279 -4.109 1.00 0.00 H new ATOM 0 HD2 TYR A 186 -16.820 -1.905 -1.695 1.00 0.00 H new ATOM 0 HE1 TYR A 186 -20.634 0.853 -3.228 1.00 0.00 H new ATOM 0 HE2 TYR A 186 -19.161 -2.322 -0.823 1.00 0.00 H new ATOM 0 HH TYR A 186 -21.224 -1.723 -0.887 1.00 0.00 H new ATOM 852 N VAL A 187 -12.986 1.025 -2.220 1.00 0.00 N ATOM 853 CA VAL A 187 -11.849 0.617 -1.413 1.00 0.00 C ATOM 854 C VAL A 187 -10.984 1.841 -1.102 1.00 0.00 C ATOM 855 O VAL A 187 -11.249 2.934 -1.599 1.00 0.00 O ATOM 856 CB VAL A 187 -11.076 -0.497 -2.122 1.00 0.00 C ATOM 857 CG1 VAL A 187 -11.985 -1.690 -2.424 1.00 0.00 C ATOM 858 CG2 VAL A 187 -10.413 0.023 -3.399 1.00 0.00 C ATOM 0 H VAL A 187 -12.750 1.597 -3.031 1.00 0.00 H new ATOM 0 HA VAL A 187 -12.185 0.206 -0.461 1.00 0.00 H new ATOM 0 HB VAL A 187 -10.289 -0.838 -1.450 1.00 0.00 H new ATOM 0 HG11 VAL A 187 -11.410 -2.467 -2.928 1.00 0.00 H new ATOM 0 HG12 VAL A 187 -12.389 -2.085 -1.492 1.00 0.00 H new ATOM 0 HG13 VAL A 187 -12.804 -1.370 -3.068 1.00 0.00 H new ATOM 0 HG21 VAL A 187 -9.870 -0.789 -3.884 1.00 0.00 H new ATOM 0 HG22 VAL A 187 -11.177 0.404 -4.077 1.00 0.00 H new ATOM 0 HG23 VAL A 187 -9.719 0.825 -3.148 1.00 0.00 H new ATOM 868 N GLU A 188 -9.969 1.614 -0.282 1.00 0.00 N ATOM 869 CA GLU A 188 -9.063 2.685 0.101 1.00 0.00 C ATOM 870 C GLU A 188 -7.611 2.219 -0.017 1.00 0.00 C ATOM 871 O GLU A 188 -7.346 1.024 -0.137 1.00 0.00 O ATOM 872 CB GLU A 188 -9.368 3.180 1.516 1.00 0.00 C ATOM 873 CG GLU A 188 -8.961 2.139 2.560 1.00 0.00 C ATOM 874 CD GLU A 188 -9.112 2.695 3.978 1.00 0.00 C ATOM 875 OE1 GLU A 188 -8.950 3.926 4.124 1.00 0.00 O ATOM 876 OE2 GLU A 188 -9.385 1.878 4.882 1.00 0.00 O ATOM 0 H GLU A 188 -9.753 0.705 0.128 1.00 0.00 H new ATOM 0 HA GLU A 188 -9.211 3.522 -0.581 1.00 0.00 H new ATOM 0 HB2 GLU A 188 -8.836 4.113 1.701 1.00 0.00 H new ATOM 0 HB3 GLU A 188 -10.432 3.396 1.608 1.00 0.00 H new ATOM 0 HG2 GLU A 188 -9.577 1.247 2.448 1.00 0.00 H new ATOM 0 HG3 GLU A 188 -7.927 1.836 2.393 1.00 0.00 H new ATOM 883 N LYS A 189 -6.707 3.187 0.022 1.00 0.00 N ATOM 884 CA LYS A 189 -5.289 2.891 -0.078 1.00 0.00 C ATOM 885 C LYS A 189 -4.731 2.609 1.318 1.00 0.00 C ATOM 886 O LYS A 189 -4.631 3.513 2.146 1.00 0.00 O ATOM 887 CB LYS A 189 -4.558 4.015 -0.816 1.00 0.00 C ATOM 888 CG LYS A 189 -4.024 3.529 -2.165 1.00 0.00 C ATOM 889 CD LYS A 189 -4.674 4.294 -3.320 1.00 0.00 C ATOM 890 CE LYS A 189 -3.678 5.257 -3.970 1.00 0.00 C ATOM 891 NZ LYS A 189 -3.895 5.318 -5.432 1.00 0.00 N ATOM 0 H LYS A 189 -6.930 4.177 0.122 1.00 0.00 H new ATOM 0 HA LYS A 189 -5.129 1.992 -0.673 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -5.236 4.854 -0.970 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -3.733 4.380 -0.204 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -2.942 3.660 -2.200 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -4.220 2.462 -2.275 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -5.043 3.589 -4.065 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -5.536 4.850 -2.953 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -3.790 6.251 -3.538 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -2.659 4.931 -3.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -3.211 5.976 -5.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -3.766 4.371 -5.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -4.861 5.650 -5.626 1.00 0.00 H new ATOM 905 N TYR A 190 -4.381 1.349 1.536 1.00 0.00 N ATOM 906 CA TYR A 190 -3.836 0.936 2.818 1.00 0.00 C ATOM 907 C TYR A 190 -2.314 1.093 2.844 1.00 0.00 C ATOM 908 O TYR A 190 -1.753 1.587 3.821 1.00 0.00 O ATOM 909 CB TYR A 190 -4.185 -0.546 2.967 1.00 0.00 C ATOM 910 CG TYR A 190 -3.395 -1.265 4.062 1.00 0.00 C ATOM 911 CD1 TYR A 190 -2.078 -1.617 3.845 1.00 0.00 C ATOM 912 CD2 TYR A 190 -3.999 -1.561 5.268 1.00 0.00 C ATOM 913 CE1 TYR A 190 -1.335 -2.294 4.876 1.00 0.00 C ATOM 914 CE2 TYR A 190 -3.256 -2.239 6.298 1.00 0.00 C ATOM 915 CZ TYR A 190 -1.960 -2.571 6.051 1.00 0.00 C ATOM 916 OH TYR A 190 -1.257 -3.210 7.025 1.00 0.00 O ATOM 0 H TYR A 190 -4.464 0.602 0.847 1.00 0.00 H new ATOM 0 HA TYR A 190 -4.246 1.546 3.623 1.00 0.00 H new ATOM 0 HB2 TYR A 190 -5.250 -0.638 3.182 1.00 0.00 H new ATOM 0 HB3 TYR A 190 -4.007 -1.048 2.016 1.00 0.00 H new ATOM 0 HD1 TYR A 190 -1.605 -1.385 2.902 1.00 0.00 H new ATOM 0 HD2 TYR A 190 -5.029 -1.284 5.439 1.00 0.00 H new ATOM 0 HE1 TYR A 190 -0.304 -2.575 4.719 1.00 0.00 H new ATOM 0 HE2 TYR A 190 -3.717 -2.479 7.245 1.00 0.00 H new ATOM 0 HH TYR A 190 -1.830 -3.341 7.809 1.00 0.00 H new