USER MOD reduce.3.24.130724 H: found=0, std=0, add=403, rem=0, adj=7 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 GLN : amide:sc= -0.207 X(o=-0.21,f=0) USER MOD Single : A 171 ASN : amide:sc= -0.0253 X(o=-0.025,f=-0.15) USER MOD Single : A 175 SER OG : rot 180:sc= 0 USER MOD Single : A 178 LYS NZ :NH3+ -154:sc= -0.0319 (180deg=-0.275) USER MOD Single : A 181 MET CE :methyl 154:sc= -1.24 (180deg=-1.76) USER MOD Single : A 186 TYR OH : rot 180:sc= 0 USER MOD Single : A 189 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0312) USER MOD Single : A 190 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 19 N TYR A 136 -2.097 -2.025 -1.982 1.00 0.00 N ATOM 20 CA TYR A 136 -3.260 -2.707 -1.443 1.00 0.00 C ATOM 21 C TYR A 136 -4.384 -1.715 -1.136 1.00 0.00 C ATOM 22 O TYR A 136 -4.140 -0.517 -1.004 1.00 0.00 O ATOM 23 CB TYR A 136 -2.800 -3.359 -0.137 1.00 0.00 C ATOM 24 CG TYR A 136 -1.466 -4.098 -0.248 1.00 0.00 C ATOM 25 CD1 TYR A 136 -1.290 -5.064 -1.218 1.00 0.00 C ATOM 26 CD2 TYR A 136 -0.437 -3.799 0.623 1.00 0.00 C ATOM 27 CE1 TYR A 136 -0.034 -5.760 -1.322 1.00 0.00 C ATOM 28 CE2 TYR A 136 0.819 -4.495 0.519 1.00 0.00 C ATOM 29 CZ TYR A 136 0.959 -5.441 -0.447 1.00 0.00 C ATOM 30 OH TYR A 136 2.146 -6.098 -0.545 1.00 0.00 O ATOM 0 HA TYR A 136 -3.645 -3.433 -2.159 1.00 0.00 H new ATOM 0 HB2 TYR A 136 -2.715 -2.590 0.631 1.00 0.00 H new ATOM 0 HB3 TYR A 136 -3.565 -4.060 0.197 1.00 0.00 H new ATOM 0 HD1 TYR A 136 -2.095 -5.298 -1.899 1.00 0.00 H new ATOM 0 HD2 TYR A 136 -0.574 -3.043 1.382 1.00 0.00 H new ATOM 0 HE1 TYR A 136 0.117 -6.518 -2.077 1.00 0.00 H new ATOM 0 HE2 TYR A 136 1.632 -4.270 1.194 1.00 0.00 H new ATOM 0 HH TYR A 136 2.761 -5.767 0.142 1.00 0.00 H new ATOM 40 N VAL A 137 -5.591 -2.252 -1.031 1.00 0.00 N ATOM 41 CA VAL A 137 -6.753 -1.429 -0.742 1.00 0.00 C ATOM 42 C VAL A 137 -7.654 -2.159 0.257 1.00 0.00 C ATOM 43 O VAL A 137 -7.431 -3.330 0.559 1.00 0.00 O ATOM 44 CB VAL A 137 -7.474 -1.065 -2.041 1.00 0.00 C ATOM 45 CG1 VAL A 137 -6.514 -0.405 -3.033 1.00 0.00 C ATOM 46 CG2 VAL A 137 -8.143 -2.295 -2.660 1.00 0.00 C ATOM 0 H VAL A 137 -5.789 -3.247 -1.141 1.00 0.00 H new ATOM 0 HA VAL A 137 -6.449 -0.489 -0.281 1.00 0.00 H new ATOM 0 HB VAL A 137 -8.256 -0.344 -1.801 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -7.051 -0.156 -3.948 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -6.105 0.505 -2.593 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -5.701 -1.093 -3.265 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -8.649 -2.009 -3.582 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -7.387 -3.049 -2.880 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -8.871 -2.705 -1.959 1.00 0.00 H new ATOM 56 N ARG A 138 -8.653 -1.437 0.742 1.00 0.00 N ATOM 57 CA ARG A 138 -9.588 -2.000 1.701 1.00 0.00 C ATOM 58 C ARG A 138 -11.017 -1.568 1.365 1.00 0.00 C ATOM 59 O ARG A 138 -11.274 -0.388 1.131 1.00 0.00 O ATOM 60 CB ARG A 138 -9.250 -1.559 3.126 1.00 0.00 C ATOM 61 CG ARG A 138 -8.520 -2.669 3.885 1.00 0.00 C ATOM 62 CD ARG A 138 -7.441 -2.088 4.801 1.00 0.00 C ATOM 63 NE ARG A 138 -6.233 -2.942 4.765 1.00 0.00 N ATOM 64 CZ ARG A 138 -5.397 -3.019 3.721 1.00 0.00 C ATOM 65 NH1 ARG A 138 -5.633 -2.294 2.619 1.00 0.00 N ATOM 66 NH2 ARG A 138 -4.326 -3.822 3.778 1.00 0.00 N ATOM 0 H ARG A 138 -8.836 -0.466 0.489 1.00 0.00 H new ATOM 0 HA ARG A 138 -9.509 -3.086 1.642 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -8.628 -0.664 3.096 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -10.165 -1.293 3.655 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -9.235 -3.241 4.476 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -8.066 -3.362 3.176 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -7.190 -1.076 4.485 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -7.817 -2.019 5.822 1.00 0.00 H new ATOM 0 HE ARG A 138 -6.024 -3.508 5.587 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -6.449 -1.684 2.575 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -4.997 -2.353 1.824 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -4.147 -4.375 4.616 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -3.690 -3.881 2.983 1.00 0.00 H new ATOM 80 N ALA A 139 -11.909 -2.547 1.352 1.00 0.00 N ATOM 81 CA ALA A 139 -13.306 -2.283 1.049 1.00 0.00 C ATOM 82 C ALA A 139 -14.038 -1.893 2.336 1.00 0.00 C ATOM 83 O ALA A 139 -13.966 -2.607 3.335 1.00 0.00 O ATOM 84 CB ALA A 139 -13.924 -3.510 0.376 1.00 0.00 C ATOM 0 H ALA A 139 -11.692 -3.525 1.546 1.00 0.00 H new ATOM 0 HA ALA A 139 -13.396 -1.449 0.352 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -14.971 -3.312 0.149 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -13.387 -3.727 -0.548 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -13.854 -4.367 1.046 1.00 0.00 H new ATOM 90 N LEU A 140 -14.725 -0.762 2.269 1.00 0.00 N ATOM 91 CA LEU A 140 -15.469 -0.270 3.416 1.00 0.00 C ATOM 92 C LEU A 140 -16.951 -0.167 3.051 1.00 0.00 C ATOM 93 O LEU A 140 -17.577 0.870 3.271 1.00 0.00 O ATOM 94 CB LEU A 140 -14.867 1.042 3.922 1.00 0.00 C ATOM 95 CG LEU A 140 -14.111 1.876 2.886 1.00 0.00 C ATOM 96 CD1 LEU A 140 -14.610 3.323 2.878 1.00 0.00 C ATOM 97 CD2 LEU A 140 -12.601 1.792 3.110 1.00 0.00 C ATOM 0 H LEU A 140 -14.782 -0.172 1.439 1.00 0.00 H new ATOM 0 HA LEU A 140 -15.394 -0.970 4.248 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -15.670 1.652 4.334 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -14.187 0.814 4.742 1.00 0.00 H new ATOM 0 HG LEU A 140 -14.313 1.460 1.899 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -14.056 3.895 2.133 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -15.672 3.340 2.633 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -14.457 3.766 3.862 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -12.088 2.394 2.360 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -12.359 2.168 4.104 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -12.278 0.754 3.026 1.00 0.00 H new ATOM 109 N PHE A 141 -17.470 -1.254 2.499 1.00 0.00 N ATOM 110 CA PHE A 141 -18.866 -1.299 2.101 1.00 0.00 C ATOM 111 C PHE A 141 -19.231 -2.671 1.532 1.00 0.00 C ATOM 112 O PHE A 141 -18.505 -3.215 0.701 1.00 0.00 O ATOM 113 CB PHE A 141 -19.054 -0.241 1.011 1.00 0.00 C ATOM 114 CG PHE A 141 -20.171 0.762 1.304 1.00 0.00 C ATOM 115 CD1 PHE A 141 -20.388 1.187 2.578 1.00 0.00 C ATOM 116 CD2 PHE A 141 -20.949 1.230 0.290 1.00 0.00 C ATOM 117 CE1 PHE A 141 -21.425 2.118 2.850 1.00 0.00 C ATOM 118 CE2 PHE A 141 -21.986 2.161 0.563 1.00 0.00 C ATOM 119 CZ PHE A 141 -22.202 2.586 1.836 1.00 0.00 C ATOM 0 H PHE A 141 -16.948 -2.111 2.318 1.00 0.00 H new ATOM 0 HA PHE A 141 -19.505 -1.113 2.964 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -18.118 0.301 0.880 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -19.267 -0.741 0.066 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -19.771 0.816 3.383 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -20.778 0.893 -0.722 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -21.597 2.455 3.862 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -22.604 2.532 -0.242 1.00 0.00 H new ATOM 0 HZ PHE A 141 -22.990 3.295 2.042 1.00 0.00 H new ATOM 129 N ASP A 142 -20.356 -3.191 2.003 1.00 0.00 N ATOM 130 CA ASP A 142 -20.825 -4.490 1.551 1.00 0.00 C ATOM 131 C ASP A 142 -21.286 -4.383 0.097 1.00 0.00 C ATOM 132 O ASP A 142 -22.012 -3.458 -0.262 1.00 0.00 O ATOM 133 CB ASP A 142 -22.013 -4.968 2.389 1.00 0.00 C ATOM 134 CG ASP A 142 -22.824 -6.107 1.769 1.00 0.00 C ATOM 135 OD1 ASP A 142 -23.730 -5.789 0.970 1.00 0.00 O ATOM 136 OD2 ASP A 142 -22.521 -7.271 2.111 1.00 0.00 O ATOM 0 H ASP A 142 -20.955 -2.737 2.692 1.00 0.00 H new ATOM 0 HA ASP A 142 -20.003 -5.199 1.651 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -21.645 -5.292 3.362 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -22.678 -4.122 2.565 1.00 0.00 H new ATOM 141 N PHE A 143 -20.844 -5.344 -0.703 1.00 0.00 N ATOM 142 CA PHE A 143 -21.201 -5.369 -2.110 1.00 0.00 C ATOM 143 C PHE A 143 -22.686 -5.687 -2.294 1.00 0.00 C ATOM 144 O PHE A 143 -23.340 -6.166 -1.369 1.00 0.00 O ATOM 145 CB PHE A 143 -20.370 -6.476 -2.763 1.00 0.00 C ATOM 146 CG PHE A 143 -21.068 -7.836 -2.803 1.00 0.00 C ATOM 147 CD1 PHE A 143 -21.854 -8.166 -3.863 1.00 0.00 C ATOM 148 CD2 PHE A 143 -20.903 -8.716 -1.778 1.00 0.00 C ATOM 149 CE1 PHE A 143 -22.502 -9.430 -3.900 1.00 0.00 C ATOM 150 CE2 PHE A 143 -21.551 -9.979 -1.816 1.00 0.00 C ATOM 151 CZ PHE A 143 -22.337 -10.309 -2.876 1.00 0.00 C ATOM 0 H PHE A 143 -20.242 -6.110 -0.402 1.00 0.00 H new ATOM 0 HA PHE A 143 -21.007 -4.395 -2.560 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -20.121 -6.177 -3.781 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -19.429 -6.578 -2.222 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -21.985 -7.468 -4.676 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -20.279 -8.454 -0.936 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -23.126 -9.693 -4.742 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -21.420 -10.678 -1.003 1.00 0.00 H new ATOM 0 HZ PHE A 143 -22.830 -11.269 -2.904 1.00 0.00 H new ATOM 250 N LEU A 151 -15.299 -9.907 -8.373 1.00 0.00 N ATOM 251 CA LEU A 151 -15.144 -10.507 -7.059 1.00 0.00 C ATOM 252 C LEU A 151 -15.609 -9.515 -5.991 1.00 0.00 C ATOM 253 O LEU A 151 -14.959 -8.497 -5.760 1.00 0.00 O ATOM 254 CB LEU A 151 -13.708 -10.997 -6.859 1.00 0.00 C ATOM 255 CG LEU A 151 -13.163 -10.910 -5.433 1.00 0.00 C ATOM 256 CD1 LEU A 151 -13.684 -12.064 -4.575 1.00 0.00 C ATOM 257 CD2 LEU A 151 -11.634 -10.842 -5.435 1.00 0.00 C ATOM 0 HA LEU A 151 -15.774 -11.392 -6.969 1.00 0.00 H new ATOM 0 HB2 LEU A 151 -13.650 -12.035 -7.186 1.00 0.00 H new ATOM 0 HB3 LEU A 151 -13.054 -10.420 -7.513 1.00 0.00 H new ATOM 0 HG LEU A 151 -13.527 -9.986 -4.984 1.00 0.00 H new ATOM 0 HD11 LEU A 151 -13.281 -11.978 -3.566 1.00 0.00 H new ATOM 0 HD12 LEU A 151 -14.773 -12.025 -4.536 1.00 0.00 H new ATOM 0 HD13 LEU A 151 -13.370 -13.012 -5.011 1.00 0.00 H new ATOM 0 HD21 LEU A 151 -11.271 -10.781 -4.409 1.00 0.00 H new ATOM 0 HD22 LEU A 151 -11.231 -11.736 -5.910 1.00 0.00 H new ATOM 0 HD23 LEU A 151 -11.310 -9.960 -5.988 1.00 0.00 H new ATOM 269 N PRO A 152 -16.760 -9.855 -5.352 1.00 0.00 N ATOM 270 CA PRO A 152 -17.319 -9.006 -4.315 1.00 0.00 C ATOM 271 C PRO A 152 -16.521 -9.129 -3.015 1.00 0.00 C ATOM 272 O PRO A 152 -15.450 -9.734 -2.996 1.00 0.00 O ATOM 273 CB PRO A 152 -18.763 -9.460 -4.169 1.00 0.00 C ATOM 274 CG PRO A 152 -18.829 -10.845 -4.794 1.00 0.00 C ATOM 275 CD PRO A 152 -17.557 -11.054 -5.599 1.00 0.00 C ATOM 0 HA PRO A 152 -17.272 -7.947 -4.569 1.00 0.00 H new ATOM 0 HB2 PRO A 152 -19.059 -9.490 -3.120 1.00 0.00 H new ATOM 0 HB3 PRO A 152 -19.442 -8.771 -4.672 1.00 0.00 H new ATOM 0 HG2 PRO A 152 -18.922 -11.608 -4.021 1.00 0.00 H new ATOM 0 HG3 PRO A 152 -19.706 -10.933 -5.436 1.00 0.00 H new ATOM 0 HD2 PRO A 152 -17.029 -11.953 -5.280 1.00 0.00 H new ATOM 0 HD3 PRO A 152 -17.775 -11.173 -6.660 1.00 0.00 H new ATOM 283 N PHE A 153 -17.072 -8.545 -1.961 1.00 0.00 N ATOM 284 CA PHE A 153 -16.425 -8.583 -0.661 1.00 0.00 C ATOM 285 C PHE A 153 -17.367 -8.080 0.435 1.00 0.00 C ATOM 286 O PHE A 153 -18.525 -7.763 0.167 1.00 0.00 O ATOM 287 CB PHE A 153 -15.212 -7.654 -0.739 1.00 0.00 C ATOM 288 CG PHE A 153 -15.436 -6.408 -1.598 1.00 0.00 C ATOM 289 CD1 PHE A 153 -15.955 -5.282 -1.040 1.00 0.00 C ATOM 290 CD2 PHE A 153 -15.117 -6.427 -2.920 1.00 0.00 C ATOM 291 CE1 PHE A 153 -16.164 -4.125 -1.836 1.00 0.00 C ATOM 292 CE2 PHE A 153 -15.325 -5.269 -3.717 1.00 0.00 C ATOM 293 CZ PHE A 153 -15.844 -4.144 -3.158 1.00 0.00 C ATOM 0 H PHE A 153 -17.960 -8.043 -1.981 1.00 0.00 H new ATOM 0 HA PHE A 153 -16.140 -9.606 -0.417 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -14.940 -7.343 0.270 1.00 0.00 H new ATOM 0 HB3 PHE A 153 -14.366 -8.212 -1.140 1.00 0.00 H new ATOM 0 HD1 PHE A 153 -16.209 -5.268 0.010 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -14.706 -7.322 -3.364 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -16.577 -3.231 -1.392 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -15.071 -5.283 -4.767 1.00 0.00 H new ATOM 0 HZ PHE A 153 -16.002 -3.264 -3.764 1.00 0.00 H new ATOM 303 N LYS A 154 -16.836 -8.024 1.648 1.00 0.00 N ATOM 304 CA LYS A 154 -17.615 -7.565 2.785 1.00 0.00 C ATOM 305 C LYS A 154 -17.011 -6.265 3.320 1.00 0.00 C ATOM 306 O LYS A 154 -15.863 -5.940 3.021 1.00 0.00 O ATOM 307 CB LYS A 154 -17.726 -8.670 3.838 1.00 0.00 C ATOM 308 CG LYS A 154 -16.359 -8.990 4.445 1.00 0.00 C ATOM 309 CD LYS A 154 -16.319 -10.421 4.985 1.00 0.00 C ATOM 310 CE LYS A 154 -16.337 -11.438 3.843 1.00 0.00 C ATOM 311 NZ LYS A 154 -15.111 -12.267 3.868 1.00 0.00 N ATOM 0 H LYS A 154 -15.876 -8.289 1.868 1.00 0.00 H new ATOM 0 HA LYS A 154 -18.638 -7.341 2.481 1.00 0.00 H new ATOM 0 HB2 LYS A 154 -18.413 -8.359 4.625 1.00 0.00 H new ATOM 0 HB3 LYS A 154 -18.146 -9.568 3.385 1.00 0.00 H new ATOM 0 HG2 LYS A 154 -15.583 -8.861 3.690 1.00 0.00 H new ATOM 0 HG3 LYS A 154 -16.141 -8.288 5.250 1.00 0.00 H new ATOM 0 HD2 LYS A 154 -15.422 -10.561 5.588 1.00 0.00 H new ATOM 0 HD3 LYS A 154 -17.173 -10.590 5.641 1.00 0.00 H new ATOM 0 HE2 LYS A 154 -17.216 -12.076 3.930 1.00 0.00 H new ATOM 0 HE3 LYS A 154 -16.413 -10.919 2.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 -15.139 -12.952 3.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 -14.276 -11.656 3.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 -15.055 -12.776 4.773 1.00 0.00 H new ATOM 325 N LYS A 155 -17.812 -5.556 4.102 1.00 0.00 N ATOM 326 CA LYS A 155 -17.372 -4.299 4.682 1.00 0.00 C ATOM 327 C LYS A 155 -16.089 -4.533 5.483 1.00 0.00 C ATOM 328 O LYS A 155 -15.998 -5.490 6.249 1.00 0.00 O ATOM 329 CB LYS A 155 -18.498 -3.661 5.498 1.00 0.00 C ATOM 330 CG LYS A 155 -18.303 -2.148 5.612 1.00 0.00 C ATOM 331 CD LYS A 155 -17.112 -1.815 6.512 1.00 0.00 C ATOM 332 CE LYS A 155 -17.535 -0.910 7.671 1.00 0.00 C ATOM 333 NZ LYS A 155 -16.730 -1.201 8.878 1.00 0.00 N ATOM 0 H LYS A 155 -18.764 -5.829 4.347 1.00 0.00 H new ATOM 0 HA LYS A 155 -17.133 -3.581 3.897 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -19.458 -3.873 5.027 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -18.526 -4.104 6.494 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -18.145 -1.722 4.621 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -19.207 -1.691 6.015 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -16.680 -2.736 6.904 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -16.336 -1.323 5.926 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -17.411 0.135 7.388 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -18.593 -1.058 7.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -17.031 -0.578 9.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -16.869 -2.193 9.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -15.724 -1.037 8.672 1.00 0.00 H new ATOM 347 N GLY A 156 -15.131 -3.641 5.278 1.00 0.00 N ATOM 348 CA GLY A 156 -13.857 -3.739 5.971 1.00 0.00 C ATOM 349 C GLY A 156 -13.054 -4.943 5.476 1.00 0.00 C ATOM 350 O GLY A 156 -12.360 -5.594 6.256 1.00 0.00 O ATOM 0 H GLY A 156 -15.211 -2.847 4.642 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -13.283 -2.826 5.815 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -14.029 -3.828 7.044 1.00 0.00 H new ATOM 354 N ASP A 157 -13.175 -5.204 4.184 1.00 0.00 N ATOM 355 CA ASP A 157 -12.470 -6.320 3.575 1.00 0.00 C ATOM 356 C ASP A 157 -11.101 -5.844 3.083 1.00 0.00 C ATOM 357 O ASP A 157 -10.868 -4.643 2.953 1.00 0.00 O ATOM 358 CB ASP A 157 -13.239 -6.868 2.372 1.00 0.00 C ATOM 359 CG ASP A 157 -12.505 -7.946 1.572 1.00 0.00 C ATOM 360 OD1 ASP A 157 -12.651 -9.129 1.945 1.00 0.00 O ATOM 361 OD2 ASP A 157 -11.814 -7.561 0.603 1.00 0.00 O ATOM 0 H ASP A 157 -13.751 -4.662 3.540 1.00 0.00 H new ATOM 0 HA ASP A 157 -12.368 -7.104 4.325 1.00 0.00 H new ATOM 0 HB2 ASP A 157 -14.186 -7.278 2.722 1.00 0.00 H new ATOM 0 HB3 ASP A 157 -13.477 -6.040 1.704 1.00 0.00 H new ATOM 366 N ILE A 158 -10.232 -6.809 2.824 1.00 0.00 N ATOM 367 CA ILE A 158 -8.894 -6.505 2.351 1.00 0.00 C ATOM 368 C ILE A 158 -8.749 -6.979 0.903 1.00 0.00 C ATOM 369 O ILE A 158 -9.243 -8.047 0.544 1.00 0.00 O ATOM 370 CB ILE A 158 -7.844 -7.091 3.297 1.00 0.00 C ATOM 371 CG1 ILE A 158 -7.566 -6.140 4.464 1.00 0.00 C ATOM 372 CG2 ILE A 158 -6.565 -7.455 2.539 1.00 0.00 C ATOM 373 CD1 ILE A 158 -6.711 -6.821 5.534 1.00 0.00 C ATOM 0 H ILE A 158 -10.429 -7.804 2.933 1.00 0.00 H new ATOM 0 HA ILE A 158 -8.726 -5.428 2.353 1.00 0.00 H new ATOM 0 HB ILE A 158 -8.242 -8.013 3.720 1.00 0.00 H new ATOM 0 HG12 ILE A 158 -7.056 -5.249 4.098 1.00 0.00 H new ATOM 0 HG13 ILE A 158 -8.508 -5.810 4.902 1.00 0.00 H new ATOM 0 HG21 ILE A 158 -5.835 -7.869 3.235 1.00 0.00 H new ATOM 0 HG22 ILE A 158 -6.795 -8.194 1.771 1.00 0.00 H new ATOM 0 HG23 ILE A 158 -6.153 -6.561 2.070 1.00 0.00 H new ATOM 0 HD11 ILE A 158 -6.528 -6.124 6.352 1.00 0.00 H new ATOM 0 HD12 ILE A 158 -7.235 -7.698 5.915 1.00 0.00 H new ATOM 0 HD13 ILE A 158 -5.760 -7.128 5.099 1.00 0.00 H new ATOM 385 N LEU A 159 -8.071 -6.162 0.110 1.00 0.00 N ATOM 386 CA LEU A 159 -7.855 -6.485 -1.289 1.00 0.00 C ATOM 387 C LEU A 159 -6.509 -5.913 -1.739 1.00 0.00 C ATOM 388 O LEU A 159 -6.270 -4.712 -1.622 1.00 0.00 O ATOM 389 CB LEU A 159 -9.038 -6.011 -2.136 1.00 0.00 C ATOM 390 CG LEU A 159 -10.299 -6.875 -2.070 1.00 0.00 C ATOM 391 CD1 LEU A 159 -11.545 -6.052 -2.405 1.00 0.00 C ATOM 392 CD2 LEU A 159 -10.167 -8.107 -2.969 1.00 0.00 C ATOM 0 H LEU A 159 -7.664 -5.276 0.411 1.00 0.00 H new ATOM 0 HA LEU A 159 -7.805 -7.565 -1.427 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -9.298 -4.999 -1.826 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -8.715 -5.953 -3.175 1.00 0.00 H new ATOM 0 HG LEU A 159 -10.415 -7.233 -1.047 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -12.427 -6.690 -2.351 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -11.644 -5.234 -1.691 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -11.452 -5.645 -3.412 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -11.077 -8.704 -2.904 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -10.014 -7.790 -4.001 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -9.316 -8.705 -2.644 1.00 0.00 H new ATOM 404 N ARG A 160 -5.664 -6.800 -2.243 1.00 0.00 N ATOM 405 CA ARG A 160 -4.348 -6.399 -2.710 1.00 0.00 C ATOM 406 C ARG A 160 -4.410 -5.993 -4.185 1.00 0.00 C ATOM 407 O ARG A 160 -5.220 -6.520 -4.944 1.00 0.00 O ATOM 408 CB ARG A 160 -3.334 -7.533 -2.543 1.00 0.00 C ATOM 409 CG ARG A 160 -2.311 -7.527 -3.681 1.00 0.00 C ATOM 410 CD ARG A 160 -1.430 -8.776 -3.632 1.00 0.00 C ATOM 411 NE ARG A 160 -0.511 -8.793 -4.792 1.00 0.00 N ATOM 412 CZ ARG A 160 0.804 -8.546 -4.713 1.00 0.00 C ATOM 413 NH1 ARG A 160 1.362 -8.262 -3.529 1.00 0.00 N ATOM 414 NH2 ARG A 160 1.560 -8.583 -5.819 1.00 0.00 N ATOM 0 H ARG A 160 -5.865 -7.795 -2.338 1.00 0.00 H new ATOM 0 HA ARG A 160 -4.027 -5.549 -2.108 1.00 0.00 H new ATOM 0 HB2 ARG A 160 -2.820 -7.428 -1.587 1.00 0.00 H new ATOM 0 HB3 ARG A 160 -3.854 -8.491 -2.522 1.00 0.00 H new ATOM 0 HG2 ARG A 160 -2.828 -7.480 -4.639 1.00 0.00 H new ATOM 0 HG3 ARG A 160 -1.688 -6.635 -3.610 1.00 0.00 H new ATOM 0 HD2 ARG A 160 -0.858 -8.791 -2.704 1.00 0.00 H new ATOM 0 HD3 ARG A 160 -2.053 -9.671 -3.638 1.00 0.00 H new ATOM 0 HE ARG A 160 -0.903 -9.006 -5.709 1.00 0.00 H new ATOM 0 HH11 ARG A 160 0.786 -8.234 -2.688 1.00 0.00 H new ATOM 0 HH12 ARG A 160 2.363 -8.074 -3.469 1.00 0.00 H new ATOM 0 HH21 ARG A 160 1.135 -8.799 -6.721 1.00 0.00 H new ATOM 0 HH22 ARG A 160 2.561 -8.395 -5.759 1.00 0.00 H new ATOM 428 N ILE A 161 -3.542 -5.058 -4.544 1.00 0.00 N ATOM 429 CA ILE A 161 -3.487 -4.575 -5.913 1.00 0.00 C ATOM 430 C ILE A 161 -2.593 -5.501 -6.741 1.00 0.00 C ATOM 431 O ILE A 161 -1.476 -5.817 -6.335 1.00 0.00 O ATOM 432 CB ILE A 161 -3.052 -3.109 -5.948 1.00 0.00 C ATOM 433 CG1 ILE A 161 -4.001 -2.236 -5.123 1.00 0.00 C ATOM 434 CG2 ILE A 161 -2.921 -2.609 -7.387 1.00 0.00 C ATOM 435 CD1 ILE A 161 -5.339 -2.049 -5.842 1.00 0.00 C ATOM 0 H ILE A 161 -2.872 -4.622 -3.911 1.00 0.00 H new ATOM 0 HA ILE A 161 -4.479 -4.600 -6.365 1.00 0.00 H new ATOM 0 HB ILE A 161 -2.065 -3.035 -5.491 1.00 0.00 H new ATOM 0 HG12 ILE A 161 -4.169 -2.695 -4.149 1.00 0.00 H new ATOM 0 HG13 ILE A 161 -3.542 -1.264 -4.942 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -2.611 -1.564 -7.382 1.00 0.00 H new ATOM 0 HG22 ILE A 161 -2.177 -3.206 -7.913 1.00 0.00 H new ATOM 0 HG23 ILE A 161 -3.882 -2.700 -7.893 1.00 0.00 H new ATOM 0 HD11 ILE A 161 -5.994 -1.425 -5.234 1.00 0.00 H new ATOM 0 HD12 ILE A 161 -5.170 -1.568 -6.805 1.00 0.00 H new ATOM 0 HD13 ILE A 161 -5.807 -3.021 -5.999 1.00 0.00 H new ATOM 447 N ARG A 162 -3.118 -5.908 -7.887 1.00 0.00 N ATOM 448 CA ARG A 162 -2.381 -6.791 -8.776 1.00 0.00 C ATOM 449 C ARG A 162 -2.184 -6.128 -10.140 1.00 0.00 C ATOM 450 O ARG A 162 -1.053 -5.931 -10.582 1.00 0.00 O ATOM 451 CB ARG A 162 -3.114 -8.121 -8.963 1.00 0.00 C ATOM 452 CG ARG A 162 -2.136 -9.241 -9.321 1.00 0.00 C ATOM 453 CD ARG A 162 -2.863 -10.416 -9.976 1.00 0.00 C ATOM 454 NE ARG A 162 -1.906 -11.506 -10.268 1.00 0.00 N ATOM 455 CZ ARG A 162 -2.095 -12.443 -11.207 1.00 0.00 C ATOM 456 NH1 ARG A 162 -3.209 -12.427 -11.952 1.00 0.00 N ATOM 457 NH2 ARG A 162 -1.171 -13.393 -11.402 1.00 0.00 N ATOM 0 H ARG A 162 -4.045 -5.643 -8.221 1.00 0.00 H new ATOM 0 HA ARG A 162 -1.410 -6.985 -8.320 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -3.647 -8.378 -8.048 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -3.861 -8.021 -9.750 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -1.372 -8.859 -9.998 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -1.623 -9.582 -8.422 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -3.651 -10.780 -9.316 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -3.345 -10.088 -10.897 1.00 0.00 H new ATOM 0 HE ARG A 162 -1.047 -11.547 -9.719 1.00 0.00 H new ATOM 0 HH11 ARG A 162 -3.911 -11.702 -11.804 1.00 0.00 H new ATOM 0 HH12 ARG A 162 -3.354 -13.139 -12.667 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -0.323 -13.403 -10.835 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -1.316 -14.106 -12.117 1.00 0.00 H new ATOM 471 N ASP A 163 -3.302 -5.801 -10.770 1.00 0.00 N ATOM 472 CA ASP A 163 -3.267 -5.163 -12.076 1.00 0.00 C ATOM 473 C ASP A 163 -4.411 -4.151 -12.174 1.00 0.00 C ATOM 474 O ASP A 163 -5.459 -4.332 -11.560 1.00 0.00 O ATOM 475 CB ASP A 163 -3.447 -6.191 -13.195 1.00 0.00 C ATOM 476 CG ASP A 163 -2.400 -7.305 -13.224 1.00 0.00 C ATOM 477 OD1 ASP A 163 -1.314 -7.050 -13.789 1.00 0.00 O ATOM 478 OD2 ASP A 163 -2.708 -8.388 -12.680 1.00 0.00 O ATOM 0 H ASP A 163 -4.239 -5.966 -10.401 1.00 0.00 H new ATOM 0 HA ASP A 163 -2.299 -4.674 -12.188 1.00 0.00 H new ATOM 0 HB2 ASP A 163 -4.434 -6.643 -13.097 1.00 0.00 H new ATOM 0 HB3 ASP A 163 -3.428 -5.670 -14.152 1.00 0.00 H new ATOM 483 N LYS A 164 -4.167 -3.106 -12.954 1.00 0.00 N ATOM 484 CA LYS A 164 -5.162 -2.065 -13.142 1.00 0.00 C ATOM 485 C LYS A 164 -5.260 -1.722 -14.629 1.00 0.00 C ATOM 486 O LYS A 164 -5.043 -0.577 -15.022 1.00 0.00 O ATOM 487 CB LYS A 164 -4.851 -0.860 -12.251 1.00 0.00 C ATOM 488 CG LYS A 164 -4.534 -1.302 -10.821 1.00 0.00 C ATOM 489 CD LYS A 164 -3.177 -0.758 -10.368 1.00 0.00 C ATOM 490 CE LYS A 164 -3.343 0.230 -9.211 1.00 0.00 C ATOM 491 NZ LYS A 164 -2.969 1.597 -9.640 1.00 0.00 N ATOM 0 H LYS A 164 -3.295 -2.959 -13.462 1.00 0.00 H new ATOM 0 HA LYS A 164 -6.146 -2.417 -12.831 1.00 0.00 H new ATOM 0 HB2 LYS A 164 -4.005 -0.309 -12.661 1.00 0.00 H new ATOM 0 HB3 LYS A 164 -5.702 -0.179 -12.245 1.00 0.00 H new ATOM 0 HG2 LYS A 164 -5.315 -0.951 -10.146 1.00 0.00 H new ATOM 0 HG3 LYS A 164 -4.531 -2.391 -10.765 1.00 0.00 H new ATOM 0 HD2 LYS A 164 -2.535 -1.583 -10.058 1.00 0.00 H new ATOM 0 HD3 LYS A 164 -2.681 -0.265 -11.204 1.00 0.00 H new ATOM 0 HE2 LYS A 164 -4.376 0.221 -8.863 1.00 0.00 H new ATOM 0 HE3 LYS A 164 -2.721 -0.077 -8.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 -3.087 2.255 -8.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 -1.977 1.604 -9.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 -3.580 1.893 -10.428 1.00 0.00 H new ATOM 505 N PRO A 165 -5.597 -2.762 -15.438 1.00 0.00 N ATOM 506 CA PRO A 165 -5.728 -2.582 -16.874 1.00 0.00 C ATOM 507 C PRO A 165 -7.025 -1.848 -17.219 1.00 0.00 C ATOM 508 O PRO A 165 -7.363 -1.697 -18.392 1.00 0.00 O ATOM 509 CB PRO A 165 -5.666 -3.985 -17.454 1.00 0.00 C ATOM 510 CG PRO A 165 -5.972 -4.927 -16.299 1.00 0.00 C ATOM 511 CD PRO A 165 -5.863 -4.132 -15.009 1.00 0.00 C ATOM 0 HA PRO A 165 -4.939 -1.958 -17.293 1.00 0.00 H new ATOM 0 HB2 PRO A 165 -6.390 -4.107 -18.260 1.00 0.00 H new ATOM 0 HB3 PRO A 165 -4.682 -4.190 -17.876 1.00 0.00 H new ATOM 0 HG2 PRO A 165 -6.972 -5.348 -16.405 1.00 0.00 H new ATOM 0 HG3 PRO A 165 -5.273 -5.763 -16.293 1.00 0.00 H new ATOM 0 HD2 PRO A 165 -6.783 -4.193 -14.428 1.00 0.00 H new ATOM 0 HD3 PRO A 165 -5.060 -4.512 -14.377 1.00 0.00 H new ATOM 519 N GLU A 166 -7.716 -1.411 -16.177 1.00 0.00 N ATOM 520 CA GLU A 166 -8.968 -0.697 -16.355 1.00 0.00 C ATOM 521 C GLU A 166 -9.005 0.543 -15.459 1.00 0.00 C ATOM 522 O GLU A 166 -8.033 0.841 -14.768 1.00 0.00 O ATOM 523 CB GLU A 166 -10.165 -1.610 -16.077 1.00 0.00 C ATOM 524 CG GLU A 166 -10.032 -2.934 -16.833 1.00 0.00 C ATOM 525 CD GLU A 166 -11.293 -3.227 -17.648 1.00 0.00 C ATOM 526 OE1 GLU A 166 -11.946 -2.243 -18.058 1.00 0.00 O ATOM 527 OE2 GLU A 166 -11.576 -4.429 -17.843 1.00 0.00 O ATOM 0 H GLU A 166 -7.432 -1.538 -15.206 1.00 0.00 H new ATOM 0 HA GLU A 166 -9.033 -0.373 -17.394 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -10.238 -1.804 -15.007 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -11.086 -1.109 -16.374 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -9.167 -2.894 -17.495 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -9.855 -3.745 -16.126 1.00 0.00 H new ATOM 534 N GLU A 167 -10.136 1.231 -15.501 1.00 0.00 N ATOM 535 CA GLU A 167 -10.312 2.432 -14.703 1.00 0.00 C ATOM 536 C GLU A 167 -11.410 2.219 -13.659 1.00 0.00 C ATOM 537 O GLU A 167 -12.472 1.683 -13.971 1.00 0.00 O ATOM 538 CB GLU A 167 -10.624 3.639 -15.589 1.00 0.00 C ATOM 539 CG GLU A 167 -9.400 4.546 -15.733 1.00 0.00 C ATOM 540 CD GLU A 167 -9.381 5.232 -17.100 1.00 0.00 C ATOM 541 OE1 GLU A 167 -8.814 4.622 -18.033 1.00 0.00 O ATOM 542 OE2 GLU A 167 -9.936 6.349 -17.182 1.00 0.00 O ATOM 0 H GLU A 167 -10.940 0.979 -16.076 1.00 0.00 H new ATOM 0 HA GLU A 167 -9.377 2.638 -14.182 1.00 0.00 H new ATOM 0 HB2 GLU A 167 -10.946 3.298 -16.573 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -11.452 4.205 -15.161 1.00 0.00 H new ATOM 0 HG2 GLU A 167 -9.407 5.299 -14.945 1.00 0.00 H new ATOM 0 HG3 GLU A 167 -8.491 3.958 -15.605 1.00 0.00 H new ATOM 549 N GLN A 168 -11.116 2.651 -12.442 1.00 0.00 N ATOM 550 CA GLN A 168 -12.065 2.514 -11.350 1.00 0.00 C ATOM 551 C GLN A 168 -12.003 1.101 -10.766 1.00 0.00 C ATOM 552 O GLN A 168 -11.810 0.931 -9.564 1.00 0.00 O ATOM 553 CB GLN A 168 -13.484 2.856 -11.811 1.00 0.00 C ATOM 554 CG GLN A 168 -14.139 3.866 -10.868 1.00 0.00 C ATOM 555 CD GLN A 168 -15.664 3.821 -10.989 1.00 0.00 C ATOM 556 OE1 GLN A 168 -16.294 4.701 -11.553 1.00 0.00 O ATOM 557 NE2 GLN A 168 -16.219 2.750 -10.430 1.00 0.00 N ATOM 0 H GLN A 168 -10.234 3.096 -12.188 1.00 0.00 H new ATOM 0 HA GLN A 168 -11.792 3.221 -10.567 1.00 0.00 H new ATOM 0 HB2 GLN A 168 -13.453 3.264 -12.821 1.00 0.00 H new ATOM 0 HB3 GLN A 168 -14.086 1.948 -11.852 1.00 0.00 H new ATOM 0 HG2 GLN A 168 -13.846 3.652 -9.840 1.00 0.00 H new ATOM 0 HG3 GLN A 168 -13.782 4.869 -11.099 1.00 0.00 H new ATOM 0 HE21 GLN A 168 -15.633 2.051 -9.974 1.00 0.00 H new ATOM 0 HE22 GLN A 168 -17.231 2.627 -10.457 1.00 0.00 H new ATOM 566 N TRP A 169 -12.171 0.124 -11.645 1.00 0.00 N ATOM 567 CA TRP A 169 -12.137 -1.268 -11.232 1.00 0.00 C ATOM 568 C TRP A 169 -10.799 -1.861 -11.680 1.00 0.00 C ATOM 569 O TRP A 169 -10.424 -1.747 -12.845 1.00 0.00 O ATOM 570 CB TRP A 169 -13.343 -2.033 -11.781 1.00 0.00 C ATOM 571 CG TRP A 169 -14.693 -1.417 -11.407 1.00 0.00 C ATOM 572 CD1 TRP A 169 -15.269 -0.320 -11.917 1.00 0.00 C ATOM 573 CD2 TRP A 169 -15.618 -1.912 -10.416 1.00 0.00 C ATOM 574 NE1 TRP A 169 -16.492 -0.072 -11.329 1.00 0.00 N ATOM 575 CE2 TRP A 169 -16.711 -1.070 -10.388 1.00 0.00 C ATOM 576 CE3 TRP A 169 -15.534 -3.032 -9.571 1.00 0.00 C ATOM 577 CZ2 TRP A 169 -17.804 -1.261 -9.532 1.00 0.00 C ATOM 578 CZ3 TRP A 169 -16.633 -3.209 -8.723 1.00 0.00 C ATOM 579 CH2 TRP A 169 -17.742 -2.371 -8.682 1.00 0.00 C ATOM 0 H TRP A 169 -12.331 0.269 -12.642 1.00 0.00 H new ATOM 0 HA TRP A 169 -12.210 -1.350 -10.148 1.00 0.00 H new ATOM 0 HB2 TRP A 169 -13.266 -2.082 -12.867 1.00 0.00 H new ATOM 0 HB3 TRP A 169 -13.308 -3.058 -11.413 1.00 0.00 H new ATOM 0 HD1 TRP A 169 -14.831 0.293 -12.691 1.00 0.00 H new ATOM 0 HE1 TRP A 169 -17.120 0.702 -11.545 1.00 0.00 H new ATOM 0 HE3 TRP A 169 -14.688 -3.703 -9.576 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 -18.649 -0.588 -9.528 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 -16.619 -4.056 -8.053 1.00 0.00 H new ATOM 0 HH2 TRP A 169 -18.552 -2.576 -7.997 1.00 0.00 H new ATOM 590 N TRP A 170 -10.116 -2.482 -10.729 1.00 0.00 N ATOM 591 CA TRP A 170 -8.829 -3.093 -11.010 1.00 0.00 C ATOM 592 C TRP A 170 -8.845 -4.513 -10.442 1.00 0.00 C ATOM 593 O TRP A 170 -9.726 -4.862 -9.658 1.00 0.00 O ATOM 594 CB TRP A 170 -7.684 -2.241 -10.457 1.00 0.00 C ATOM 595 CG TRP A 170 -7.665 -0.806 -10.985 1.00 0.00 C ATOM 596 CD1 TRP A 170 -8.024 -0.369 -12.200 1.00 0.00 C ATOM 597 CD2 TRP A 170 -7.249 0.371 -10.262 1.00 0.00 C ATOM 598 NE1 TRP A 170 -7.870 0.997 -12.313 1.00 0.00 N ATOM 599 CE2 TRP A 170 -7.383 1.462 -11.096 1.00 0.00 C ATOM 600 CE3 TRP A 170 -6.773 0.510 -8.946 1.00 0.00 C ATOM 601 CZ2 TRP A 170 -7.065 2.769 -10.707 1.00 0.00 C ATOM 602 CZ3 TRP A 170 -6.458 1.822 -8.573 1.00 0.00 C ATOM 603 CH2 TRP A 170 -6.589 2.931 -9.400 1.00 0.00 C ATOM 0 H TRP A 170 -10.430 -2.575 -9.763 1.00 0.00 H new ATOM 0 HA TRP A 170 -8.656 -3.150 -12.085 1.00 0.00 H new ATOM 0 HB2 TRP A 170 -7.756 -2.216 -9.370 1.00 0.00 H new ATOM 0 HB3 TRP A 170 -6.736 -2.720 -10.703 1.00 0.00 H new ATOM 0 HD1 TRP A 170 -8.388 -1.007 -12.992 1.00 0.00 H new ATOM 0 HE1 TRP A 170 -8.075 1.562 -13.137 1.00 0.00 H new ATOM 0 HE3 TRP A 170 -6.659 -0.329 -8.276 1.00 0.00 H new ATOM 0 HZ2 TRP A 170 -7.181 3.607 -11.379 1.00 0.00 H new ATOM 0 HZ3 TRP A 170 -6.087 1.984 -7.572 1.00 0.00 H new ATOM 0 HH2 TRP A 170 -6.325 3.913 -9.037 1.00 0.00 H new ATOM 614 N ASN A 171 -7.861 -5.296 -10.862 1.00 0.00 N ATOM 615 CA ASN A 171 -7.752 -6.670 -10.405 1.00 0.00 C ATOM 616 C ASN A 171 -6.944 -6.710 -9.107 1.00 0.00 C ATOM 617 O ASN A 171 -5.741 -6.451 -9.111 1.00 0.00 O ATOM 618 CB ASN A 171 -7.029 -7.539 -11.438 1.00 0.00 C ATOM 619 CG ASN A 171 -7.925 -8.684 -11.916 1.00 0.00 C ATOM 620 OD1 ASN A 171 -9.028 -8.483 -12.395 1.00 0.00 O ATOM 621 ND2 ASN A 171 -7.389 -9.891 -11.759 1.00 0.00 N ATOM 0 H ASN A 171 -7.133 -5.004 -11.514 1.00 0.00 H new ATOM 0 HA ASN A 171 -8.760 -7.054 -10.252 1.00 0.00 H new ATOM 0 HB2 ASN A 171 -6.731 -6.926 -12.289 1.00 0.00 H new ATOM 0 HB3 ASN A 171 -6.116 -7.945 -11.002 1.00 0.00 H new ATOM 0 HD21 ASN A 171 -7.908 -10.721 -12.047 1.00 0.00 H new ATOM 0 HD22 ASN A 171 -6.459 -9.987 -11.350 1.00 0.00 H new ATOM 628 N ALA A 172 -7.638 -7.034 -8.025 1.00 0.00 N ATOM 629 CA ALA A 172 -7.000 -7.110 -6.722 1.00 0.00 C ATOM 630 C ALA A 172 -7.091 -8.544 -6.196 1.00 0.00 C ATOM 631 O ALA A 172 -8.041 -9.262 -6.505 1.00 0.00 O ATOM 632 CB ALA A 172 -7.650 -6.099 -5.775 1.00 0.00 C ATOM 0 H ALA A 172 -8.636 -7.247 -8.025 1.00 0.00 H new ATOM 0 HA ALA A 172 -5.943 -6.853 -6.797 1.00 0.00 H new ATOM 0 HB1 ALA A 172 -7.171 -6.156 -4.797 1.00 0.00 H new ATOM 0 HB2 ALA A 172 -7.531 -5.094 -6.179 1.00 0.00 H new ATOM 0 HB3 ALA A 172 -8.711 -6.326 -5.673 1.00 0.00 H new ATOM 638 N GLU A 173 -6.093 -8.917 -5.411 1.00 0.00 N ATOM 639 CA GLU A 173 -6.049 -10.253 -4.839 1.00 0.00 C ATOM 640 C GLU A 173 -6.628 -10.243 -3.423 1.00 0.00 C ATOM 641 O GLU A 173 -6.009 -9.718 -2.499 1.00 0.00 O ATOM 642 CB GLU A 173 -4.622 -10.805 -4.844 1.00 0.00 C ATOM 643 CG GLU A 173 -4.607 -12.286 -4.462 1.00 0.00 C ATOM 644 CD GLU A 173 -3.650 -12.542 -3.296 1.00 0.00 C ATOM 645 OE1 GLU A 173 -2.428 -12.556 -3.557 1.00 0.00 O ATOM 646 OE2 GLU A 173 -4.163 -12.717 -2.169 1.00 0.00 O ATOM 0 H GLU A 173 -5.307 -8.318 -5.157 1.00 0.00 H new ATOM 0 HA GLU A 173 -6.660 -10.912 -5.456 1.00 0.00 H new ATOM 0 HB2 GLU A 173 -4.182 -10.676 -5.833 1.00 0.00 H new ATOM 0 HB3 GLU A 173 -4.007 -10.239 -4.145 1.00 0.00 H new ATOM 0 HG2 GLU A 173 -5.613 -12.605 -4.188 1.00 0.00 H new ATOM 0 HG3 GLU A 173 -4.306 -12.884 -5.322 1.00 0.00 H new ATOM 653 N ASP A 174 -7.810 -10.830 -3.297 1.00 0.00 N ATOM 654 CA ASP A 174 -8.480 -10.895 -2.009 1.00 0.00 C ATOM 655 C ASP A 174 -7.555 -11.568 -0.993 1.00 0.00 C ATOM 656 O ASP A 174 -6.507 -12.099 -1.357 1.00 0.00 O ATOM 657 CB ASP A 174 -9.765 -11.719 -2.098 1.00 0.00 C ATOM 658 CG ASP A 174 -10.791 -11.438 -0.998 1.00 0.00 C ATOM 659 OD1 ASP A 174 -11.456 -10.385 -1.097 1.00 0.00 O ATOM 660 OD2 ASP A 174 -10.886 -12.285 -0.082 1.00 0.00 O ATOM 0 H ASP A 174 -8.320 -11.265 -4.066 1.00 0.00 H new ATOM 0 HA ASP A 174 -8.725 -9.878 -1.704 1.00 0.00 H new ATOM 0 HB2 ASP A 174 -10.232 -11.533 -3.065 1.00 0.00 H new ATOM 0 HB3 ASP A 174 -9.503 -12.777 -2.068 1.00 0.00 H new ATOM 665 N SER A 175 -7.979 -11.527 0.263 1.00 0.00 N ATOM 666 CA SER A 175 -7.203 -12.126 1.334 1.00 0.00 C ATOM 667 C SER A 175 -7.465 -13.632 1.390 1.00 0.00 C ATOM 668 O SER A 175 -7.345 -14.247 2.449 1.00 0.00 O ATOM 669 CB SER A 175 -7.533 -11.480 2.681 1.00 0.00 C ATOM 670 OG SER A 175 -8.909 -11.625 3.020 1.00 0.00 O ATOM 0 H SER A 175 -8.850 -11.088 0.561 1.00 0.00 H new ATOM 0 HA SER A 175 -6.146 -11.954 1.128 1.00 0.00 H new ATOM 0 HB2 SER A 175 -6.918 -11.931 3.460 1.00 0.00 H new ATOM 0 HB3 SER A 175 -7.278 -10.421 2.647 1.00 0.00 H new ATOM 0 HG SER A 175 -9.079 -11.201 3.887 1.00 0.00 H new ATOM 676 N GLU A 176 -7.817 -14.182 0.238 1.00 0.00 N ATOM 677 CA GLU A 176 -8.097 -15.605 0.142 1.00 0.00 C ATOM 678 C GLU A 176 -7.398 -16.203 -1.081 1.00 0.00 C ATOM 679 O GLU A 176 -7.453 -17.411 -1.302 1.00 0.00 O ATOM 680 CB GLU A 176 -9.604 -15.866 0.095 1.00 0.00 C ATOM 681 CG GLU A 176 -10.275 -15.443 1.403 1.00 0.00 C ATOM 682 CD GLU A 176 -11.098 -16.591 1.992 1.00 0.00 C ATOM 683 OE1 GLU A 176 -10.482 -17.448 2.661 1.00 0.00 O ATOM 684 OE2 GLU A 176 -12.327 -16.585 1.760 1.00 0.00 O ATOM 0 H GLU A 176 -7.915 -13.668 -0.638 1.00 0.00 H new ATOM 0 HA GLU A 176 -7.705 -16.093 1.034 1.00 0.00 H new ATOM 0 HB2 GLU A 176 -10.046 -15.319 -0.738 1.00 0.00 H new ATOM 0 HB3 GLU A 176 -9.788 -16.925 -0.086 1.00 0.00 H new ATOM 0 HG2 GLU A 176 -9.517 -15.129 2.120 1.00 0.00 H new ATOM 0 HG3 GLU A 176 -10.920 -14.583 1.224 1.00 0.00 H new ATOM 691 N GLY A 177 -6.757 -15.328 -1.842 1.00 0.00 N ATOM 692 CA GLY A 177 -6.048 -15.754 -3.036 1.00 0.00 C ATOM 693 C GLY A 177 -6.913 -15.563 -4.284 1.00 0.00 C ATOM 694 O GLY A 177 -6.462 -15.816 -5.401 1.00 0.00 O ATOM 0 H GLY A 177 -6.714 -14.326 -1.655 1.00 0.00 H new ATOM 0 HA2 GLY A 177 -5.125 -15.184 -3.138 1.00 0.00 H new ATOM 0 HA3 GLY A 177 -5.766 -16.803 -2.941 1.00 0.00 H new ATOM 698 N LYS A 178 -8.140 -15.119 -4.053 1.00 0.00 N ATOM 699 CA LYS A 178 -9.072 -14.892 -5.144 1.00 0.00 C ATOM 700 C LYS A 178 -8.772 -13.537 -5.790 1.00 0.00 C ATOM 701 O LYS A 178 -8.976 -12.493 -5.173 1.00 0.00 O ATOM 702 CB LYS A 178 -10.514 -15.035 -4.656 1.00 0.00 C ATOM 703 CG LYS A 178 -11.504 -14.866 -5.811 1.00 0.00 C ATOM 704 CD LYS A 178 -12.840 -15.536 -5.490 1.00 0.00 C ATOM 705 CE LYS A 178 -13.025 -16.812 -6.313 1.00 0.00 C ATOM 706 NZ LYS A 178 -13.182 -16.486 -7.748 1.00 0.00 N ATOM 0 H LYS A 178 -8.510 -14.910 -3.126 1.00 0.00 H new ATOM 0 HA LYS A 178 -8.946 -15.650 -5.917 1.00 0.00 H new ATOM 0 HB2 LYS A 178 -10.650 -16.014 -4.196 1.00 0.00 H new ATOM 0 HB3 LYS A 178 -10.717 -14.290 -3.887 1.00 0.00 H new ATOM 0 HG2 LYS A 178 -11.663 -13.805 -6.006 1.00 0.00 H new ATOM 0 HG3 LYS A 178 -11.085 -15.298 -6.720 1.00 0.00 H new ATOM 0 HD2 LYS A 178 -12.885 -15.775 -4.427 1.00 0.00 H new ATOM 0 HD3 LYS A 178 -13.657 -14.844 -5.696 1.00 0.00 H new ATOM 0 HE2 LYS A 178 -12.166 -17.468 -6.175 1.00 0.00 H new ATOM 0 HE3 LYS A 178 -13.901 -17.356 -5.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 -13.723 -17.239 -8.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 -13.689 -15.583 -7.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 -12.244 -16.406 -8.190 1.00 0.00 H new ATOM 720 N ARG A 179 -8.294 -13.598 -7.024 1.00 0.00 N ATOM 721 CA ARG A 179 -7.965 -12.389 -7.759 1.00 0.00 C ATOM 722 C ARG A 179 -9.107 -12.017 -8.708 1.00 0.00 C ATOM 723 O ARG A 179 -9.453 -12.790 -9.601 1.00 0.00 O ATOM 724 CB ARG A 179 -6.678 -12.569 -8.567 1.00 0.00 C ATOM 725 CG ARG A 179 -5.500 -12.908 -7.653 1.00 0.00 C ATOM 726 CD ARG A 179 -4.993 -14.328 -7.916 1.00 0.00 C ATOM 727 NE ARG A 179 -3.531 -14.392 -7.700 1.00 0.00 N ATOM 728 CZ ARG A 179 -2.717 -15.257 -8.319 1.00 0.00 C ATOM 729 NH1 ARG A 179 -3.218 -16.138 -9.196 1.00 0.00 N ATOM 730 NH2 ARG A 179 -1.402 -15.243 -8.062 1.00 0.00 N ATOM 0 H ARG A 179 -8.127 -14.466 -7.533 1.00 0.00 H new ATOM 0 HA ARG A 179 -7.816 -11.590 -7.033 1.00 0.00 H new ATOM 0 HB2 ARG A 179 -6.813 -13.363 -9.301 1.00 0.00 H new ATOM 0 HB3 ARG A 179 -6.462 -11.656 -9.121 1.00 0.00 H new ATOM 0 HG2 ARG A 179 -4.692 -12.194 -7.815 1.00 0.00 H new ATOM 0 HG3 ARG A 179 -5.805 -12.814 -6.611 1.00 0.00 H new ATOM 0 HD2 ARG A 179 -5.498 -15.032 -7.254 1.00 0.00 H new ATOM 0 HD3 ARG A 179 -5.231 -14.625 -8.937 1.00 0.00 H new ATOM 0 HE ARG A 179 -3.117 -13.736 -7.038 1.00 0.00 H new ATOM 0 HH11 ARG A 179 -4.219 -16.150 -9.392 1.00 0.00 H new ATOM 0 HH12 ARG A 179 -2.598 -16.797 -9.668 1.00 0.00 H new ATOM 0 HH21 ARG A 179 -1.020 -14.573 -7.394 1.00 0.00 H new ATOM 0 HH22 ARG A 179 -0.783 -15.902 -8.534 1.00 0.00 H new ATOM 744 N GLY A 180 -9.661 -10.835 -8.482 1.00 0.00 N ATOM 745 CA GLY A 180 -10.756 -10.352 -9.304 1.00 0.00 C ATOM 746 C GLY A 180 -10.771 -8.823 -9.355 1.00 0.00 C ATOM 747 O GLY A 180 -9.844 -8.173 -8.874 1.00 0.00 O ATOM 0 H GLY A 180 -9.371 -10.197 -7.740 1.00 0.00 H new ATOM 0 HA2 GLY A 180 -10.661 -10.752 -10.314 1.00 0.00 H new ATOM 0 HA3 GLY A 180 -11.703 -10.715 -8.905 1.00 0.00 H new ATOM 751 N MET A 181 -11.833 -8.293 -9.944 1.00 0.00 N ATOM 752 CA MET A 181 -11.980 -6.852 -10.063 1.00 0.00 C ATOM 753 C MET A 181 -12.624 -6.261 -8.808 1.00 0.00 C ATOM 754 O MET A 181 -13.549 -6.845 -8.245 1.00 0.00 O ATOM 755 CB MET A 181 -12.847 -6.527 -11.282 1.00 0.00 C ATOM 756 CG MET A 181 -12.001 -5.937 -12.413 1.00 0.00 C ATOM 757 SD MET A 181 -13.032 -5.591 -13.829 1.00 0.00 S ATOM 758 CE MET A 181 -11.825 -5.745 -15.136 1.00 0.00 C ATOM 0 H MET A 181 -12.599 -8.835 -10.344 1.00 0.00 H new ATOM 0 HA MET A 181 -10.989 -6.413 -10.182 1.00 0.00 H new ATOM 0 HB2 MET A 181 -13.346 -7.431 -11.630 1.00 0.00 H new ATOM 0 HB3 MET A 181 -13.628 -5.821 -11.000 1.00 0.00 H new ATOM 0 HG2 MET A 181 -11.514 -5.022 -12.075 1.00 0.00 H new ATOM 0 HG3 MET A 181 -11.211 -6.635 -12.690 1.00 0.00 H new ATOM 0 HE1 MET A 181 -12.327 -6.019 -16.064 1.00 0.00 H new ATOM 0 HE2 MET A 181 -11.310 -4.794 -15.269 1.00 0.00 H new ATOM 0 HE3 MET A 181 -11.101 -6.516 -14.874 1.00 0.00 H new ATOM 768 N ILE A 182 -12.108 -5.108 -8.405 1.00 0.00 N ATOM 769 CA ILE A 182 -12.622 -4.431 -7.226 1.00 0.00 C ATOM 770 C ILE A 182 -12.697 -2.927 -7.499 1.00 0.00 C ATOM 771 O ILE A 182 -11.908 -2.394 -8.277 1.00 0.00 O ATOM 772 CB ILE A 182 -11.786 -4.790 -5.996 1.00 0.00 C ATOM 773 CG1 ILE A 182 -10.693 -3.748 -5.752 1.00 0.00 C ATOM 774 CG2 ILE A 182 -11.215 -6.205 -6.115 1.00 0.00 C ATOM 775 CD1 ILE A 182 -9.736 -3.669 -6.943 1.00 0.00 C ATOM 0 H ILE A 182 -11.340 -4.626 -8.873 1.00 0.00 H new ATOM 0 HA ILE A 182 -13.635 -4.767 -7.005 1.00 0.00 H new ATOM 0 HB ILE A 182 -12.440 -4.779 -5.124 1.00 0.00 H new ATOM 0 HG12 ILE A 182 -11.147 -2.772 -5.581 1.00 0.00 H new ATOM 0 HG13 ILE A 182 -10.137 -4.003 -4.850 1.00 0.00 H new ATOM 0 HG21 ILE A 182 -10.625 -6.435 -5.228 1.00 0.00 H new ATOM 0 HG22 ILE A 182 -12.032 -6.921 -6.203 1.00 0.00 H new ATOM 0 HG23 ILE A 182 -10.581 -6.268 -6.999 1.00 0.00 H new ATOM 0 HD11 ILE A 182 -8.969 -2.921 -6.744 1.00 0.00 H new ATOM 0 HD12 ILE A 182 -9.265 -4.640 -7.096 1.00 0.00 H new ATOM 0 HD13 ILE A 182 -10.292 -3.390 -7.838 1.00 0.00 H new ATOM 787 N PRO A 183 -13.681 -2.270 -6.828 1.00 0.00 N ATOM 788 CA PRO A 183 -13.870 -0.839 -6.990 1.00 0.00 C ATOM 789 C PRO A 183 -12.789 -0.055 -6.245 1.00 0.00 C ATOM 790 O PRO A 183 -12.408 -0.416 -5.133 1.00 0.00 O ATOM 791 CB PRO A 183 -15.270 -0.565 -6.465 1.00 0.00 C ATOM 792 CG PRO A 183 -15.634 -1.763 -5.604 1.00 0.00 C ATOM 793 CD PRO A 183 -14.634 -2.869 -5.898 1.00 0.00 C ATOM 0 HA PRO A 183 -13.778 -0.518 -8.028 1.00 0.00 H new ATOM 0 HB2 PRO A 183 -15.296 0.356 -5.883 1.00 0.00 H new ATOM 0 HB3 PRO A 183 -15.978 -0.444 -7.285 1.00 0.00 H new ATOM 0 HG2 PRO A 183 -15.608 -1.496 -4.548 1.00 0.00 H new ATOM 0 HG3 PRO A 183 -16.648 -2.097 -5.824 1.00 0.00 H new ATOM 0 HD2 PRO A 183 -14.139 -3.208 -4.988 1.00 0.00 H new ATOM 0 HD3 PRO A 183 -15.123 -3.738 -6.337 1.00 0.00 H new ATOM 801 N VAL A 184 -12.322 1.007 -6.888 1.00 0.00 N ATOM 802 CA VAL A 184 -11.292 1.846 -6.301 1.00 0.00 C ATOM 803 C VAL A 184 -11.941 2.850 -5.346 1.00 0.00 C ATOM 804 O VAL A 184 -11.330 3.259 -4.361 1.00 0.00 O ATOM 805 CB VAL A 184 -10.470 2.514 -7.404 1.00 0.00 C ATOM 806 CG1 VAL A 184 -9.579 3.619 -6.830 1.00 0.00 C ATOM 807 CG2 VAL A 184 -9.640 1.484 -8.172 1.00 0.00 C ATOM 0 H VAL A 184 -12.639 1.305 -7.811 1.00 0.00 H new ATOM 0 HA VAL A 184 -10.596 1.244 -5.716 1.00 0.00 H new ATOM 0 HB VAL A 184 -11.165 2.974 -8.107 1.00 0.00 H new ATOM 0 HG11 VAL A 184 -9.005 4.078 -7.635 1.00 0.00 H new ATOM 0 HG12 VAL A 184 -10.201 4.375 -6.350 1.00 0.00 H new ATOM 0 HG13 VAL A 184 -8.896 3.191 -6.096 1.00 0.00 H new ATOM 0 HG21 VAL A 184 -9.066 1.987 -8.950 1.00 0.00 H new ATOM 0 HG22 VAL A 184 -8.959 0.981 -7.486 1.00 0.00 H new ATOM 0 HG23 VAL A 184 -10.303 0.749 -8.628 1.00 0.00 H new ATOM 817 N PRO A 185 -13.203 3.228 -5.681 1.00 0.00 N ATOM 818 CA PRO A 185 -13.942 4.177 -4.865 1.00 0.00 C ATOM 819 C PRO A 185 -14.444 3.519 -3.578 1.00 0.00 C ATOM 820 O PRO A 185 -14.267 4.063 -2.489 1.00 0.00 O ATOM 821 CB PRO A 185 -15.069 4.670 -5.758 1.00 0.00 C ATOM 822 CG PRO A 185 -15.198 3.643 -6.872 1.00 0.00 C ATOM 823 CD PRO A 185 -13.959 2.764 -6.842 1.00 0.00 C ATOM 0 HA PRO A 185 -13.326 5.010 -4.527 1.00 0.00 H new ATOM 0 HB2 PRO A 185 -16.000 4.758 -5.199 1.00 0.00 H new ATOM 0 HB3 PRO A 185 -14.844 5.657 -6.161 1.00 0.00 H new ATOM 0 HG2 PRO A 185 -16.096 3.041 -6.734 1.00 0.00 H new ATOM 0 HG3 PRO A 185 -15.291 4.138 -7.839 1.00 0.00 H new ATOM 0 HD2 PRO A 185 -14.223 1.711 -6.747 1.00 0.00 H new ATOM 0 HD3 PRO A 185 -13.379 2.866 -7.759 1.00 0.00 H new ATOM 831 N TYR A 186 -15.059 2.357 -3.746 1.00 0.00 N ATOM 832 CA TYR A 186 -15.587 1.619 -2.611 1.00 0.00 C ATOM 833 C TYR A 186 -14.471 1.245 -1.633 1.00 0.00 C ATOM 834 O TYR A 186 -14.677 1.247 -0.421 1.00 0.00 O ATOM 835 CB TYR A 186 -16.197 0.340 -3.187 1.00 0.00 C ATOM 836 CG TYR A 186 -17.725 0.295 -3.122 1.00 0.00 C ATOM 837 CD1 TYR A 186 -18.474 1.144 -3.910 1.00 0.00 C ATOM 838 CD2 TYR A 186 -18.354 -0.595 -2.275 1.00 0.00 C ATOM 839 CE1 TYR A 186 -19.912 1.102 -3.851 1.00 0.00 C ATOM 840 CE2 TYR A 186 -19.792 -0.638 -2.215 1.00 0.00 C ATOM 841 CZ TYR A 186 -20.500 0.213 -3.006 1.00 0.00 C ATOM 842 OH TYR A 186 -21.859 0.173 -2.948 1.00 0.00 O ATOM 0 H TYR A 186 -15.203 1.909 -4.651 1.00 0.00 H new ATOM 0 HA TYR A 186 -16.315 2.220 -2.067 1.00 0.00 H new ATOM 0 HB2 TYR A 186 -15.885 0.237 -4.226 1.00 0.00 H new ATOM 0 HB3 TYR A 186 -15.795 -0.517 -2.647 1.00 0.00 H new ATOM 0 HD1 TYR A 186 -17.981 1.841 -4.572 1.00 0.00 H new ATOM 0 HD2 TYR A 186 -17.768 -1.259 -1.657 1.00 0.00 H new ATOM 0 HE1 TYR A 186 -20.510 1.761 -4.463 1.00 0.00 H new ATOM 0 HE2 TYR A 186 -20.297 -1.330 -1.557 1.00 0.00 H new ATOM 0 HH TYR A 186 -22.139 -0.510 -2.303 1.00 0.00 H new ATOM 852 N VAL A 187 -13.314 0.931 -2.199 1.00 0.00 N ATOM 853 CA VAL A 187 -12.166 0.554 -1.392 1.00 0.00 C ATOM 854 C VAL A 187 -11.350 1.805 -1.059 1.00 0.00 C ATOM 855 O VAL A 187 -11.702 2.909 -1.472 1.00 0.00 O ATOM 856 CB VAL A 187 -11.348 -0.519 -2.115 1.00 0.00 C ATOM 857 CG1 VAL A 187 -12.233 -1.698 -2.524 1.00 0.00 C ATOM 858 CG2 VAL A 187 -10.622 0.069 -3.326 1.00 0.00 C ATOM 0 H VAL A 187 -13.148 0.930 -3.205 1.00 0.00 H new ATOM 0 HA VAL A 187 -12.489 0.116 -0.448 1.00 0.00 H new ATOM 0 HB VAL A 187 -10.594 -0.891 -1.422 1.00 0.00 H new ATOM 0 HG11 VAL A 187 -11.628 -2.447 -3.036 1.00 0.00 H new ATOM 0 HG12 VAL A 187 -12.683 -2.141 -1.635 1.00 0.00 H new ATOM 0 HG13 VAL A 187 -13.019 -1.348 -3.193 1.00 0.00 H new ATOM 0 HG21 VAL A 187 -10.048 -0.714 -3.822 1.00 0.00 H new ATOM 0 HG22 VAL A 187 -11.352 0.481 -4.023 1.00 0.00 H new ATOM 0 HG23 VAL A 187 -9.948 0.860 -2.997 1.00 0.00 H new ATOM 868 N GLU A 188 -10.274 1.590 -0.315 1.00 0.00 N ATOM 869 CA GLU A 188 -9.405 2.686 0.077 1.00 0.00 C ATOM 870 C GLU A 188 -7.939 2.298 -0.124 1.00 0.00 C ATOM 871 O GLU A 188 -7.624 1.126 -0.321 1.00 0.00 O ATOM 872 CB GLU A 188 -9.668 3.102 1.526 1.00 0.00 C ATOM 873 CG GLU A 188 -9.476 1.921 2.479 1.00 0.00 C ATOM 874 CD GLU A 188 -9.666 2.353 3.934 1.00 0.00 C ATOM 875 OE1 GLU A 188 -9.225 3.479 4.253 1.00 0.00 O ATOM 876 OE2 GLU A 188 -10.248 1.550 4.694 1.00 0.00 O ATOM 0 H GLU A 188 -9.985 0.673 0.026 1.00 0.00 H new ATOM 0 HA GLU A 188 -9.624 3.544 -0.559 1.00 0.00 H new ATOM 0 HB2 GLU A 188 -8.993 3.912 1.804 1.00 0.00 H new ATOM 0 HB3 GLU A 188 -10.683 3.487 1.619 1.00 0.00 H new ATOM 0 HG2 GLU A 188 -10.188 1.132 2.234 1.00 0.00 H new ATOM 0 HG3 GLU A 188 -8.478 1.502 2.348 1.00 0.00 H new ATOM 883 N LYS A 189 -7.081 3.307 -0.068 1.00 0.00 N ATOM 884 CA LYS A 189 -5.655 3.087 -0.242 1.00 0.00 C ATOM 885 C LYS A 189 -5.027 2.747 1.112 1.00 0.00 C ATOM 886 O LYS A 189 -5.046 3.564 2.030 1.00 0.00 O ATOM 887 CB LYS A 189 -5.008 4.287 -0.937 1.00 0.00 C ATOM 888 CG LYS A 189 -5.021 5.518 -0.028 1.00 0.00 C ATOM 889 CD LYS A 189 -5.482 6.759 -0.794 1.00 0.00 C ATOM 890 CE LYS A 189 -6.993 6.955 -0.659 1.00 0.00 C ATOM 891 NZ LYS A 189 -7.702 6.311 -1.788 1.00 0.00 N ATOM 0 H LYS A 189 -7.346 4.278 0.095 1.00 0.00 H new ATOM 0 HA LYS A 189 -5.478 2.235 -0.899 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -3.982 4.043 -1.211 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -5.541 4.507 -1.862 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -5.684 5.342 0.819 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -4.023 5.686 0.377 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -4.962 7.639 -0.415 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -5.217 6.661 -1.847 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -7.338 6.531 0.284 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -7.227 8.019 -0.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -8.718 6.525 -1.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -7.325 6.674 -2.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -7.562 5.281 -1.744 1.00 0.00 H new ATOM 905 N TYR A 190 -4.485 1.541 1.190 1.00 0.00 N ATOM 906 CA TYR A 190 -3.851 1.083 2.415 1.00 0.00 C ATOM 907 C TYR A 190 -2.857 -0.045 2.131 1.00 0.00 C ATOM 908 O TYR A 190 -3.188 -1.220 2.281 1.00 0.00 O ATOM 909 CB TYR A 190 -4.979 0.543 3.296 1.00 0.00 C ATOM 910 CG TYR A 190 -5.317 1.435 4.492 1.00 0.00 C ATOM 911 CD1 TYR A 190 -4.317 1.845 5.351 1.00 0.00 C ATOM 912 CD2 TYR A 190 -6.621 1.829 4.714 1.00 0.00 C ATOM 913 CE1 TYR A 190 -4.635 2.684 6.477 1.00 0.00 C ATOM 914 CE2 TYR A 190 -6.939 2.668 5.839 1.00 0.00 C ATOM 915 CZ TYR A 190 -5.930 3.054 6.665 1.00 0.00 C ATOM 916 OH TYR A 190 -6.230 3.848 7.728 1.00 0.00 O ATOM 0 H TYR A 190 -4.472 0.867 0.425 1.00 0.00 H new ATOM 0 HA TYR A 190 -3.301 1.896 2.890 1.00 0.00 H new ATOM 0 HB2 TYR A 190 -5.873 0.417 2.686 1.00 0.00 H new ATOM 0 HB3 TYR A 190 -4.700 -0.445 3.661 1.00 0.00 H new ATOM 0 HD1 TYR A 190 -3.296 1.536 5.178 1.00 0.00 H new ATOM 0 HD2 TYR A 190 -7.403 1.507 4.043 1.00 0.00 H new ATOM 0 HE1 TYR A 190 -3.863 3.012 7.157 1.00 0.00 H new ATOM 0 HE2 TYR A 190 -7.955 2.984 6.023 1.00 0.00 H new ATOM 0 HH TYR A 190 -7.192 4.033 7.737 1.00 0.00 H new