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 Set 1.1: A 171 ASN : amide:sc= -0.323 K(o=-3.8,f=-5.4) USER MOD Set 1.2: A 181 MET CE :methyl -144:sc= -3.5 (180deg=-7.78!) USER MOD Single : A 136 TYR OH : rot 130: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= -1.3 K(o=-1.3,f=-3.9!) USER MOD Single : A 175 SER OG : rot -47:sc= 1.1 USER MOD Single : A 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 TYR OH : rot 180:sc= 0 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 -1.972 -1.881 -1.564 1.00 0.00 N ATOM 20 CA TYR A 136 -3.162 -2.642 -1.220 1.00 0.00 C ATOM 21 C TYR A 136 -4.356 -1.715 -0.986 1.00 0.00 C ATOM 22 O TYR A 136 -4.184 -0.556 -0.610 1.00 0.00 O ATOM 23 CB TYR A 136 -2.834 -3.370 0.085 1.00 0.00 C ATOM 24 CG TYR A 136 -1.709 -4.400 -0.043 1.00 0.00 C ATOM 25 CD1 TYR A 136 -0.395 -3.983 -0.098 1.00 0.00 C ATOM 26 CD2 TYR A 136 -2.010 -5.745 -0.105 1.00 0.00 C ATOM 27 CE1 TYR A 136 0.664 -4.951 -0.218 1.00 0.00 C ATOM 28 CE2 TYR A 136 -0.951 -6.715 -0.225 1.00 0.00 C ATOM 29 CZ TYR A 136 0.333 -6.270 -0.276 1.00 0.00 C ATOM 30 OH TYR A 136 1.332 -7.185 -0.390 1.00 0.00 O ATOM 0 HA TYR A 136 -3.426 -3.327 -2.026 1.00 0.00 H new ATOM 0 HB2 TYR A 136 -2.555 -2.634 0.839 1.00 0.00 H new ATOM 0 HB3 TYR A 136 -3.732 -3.871 0.445 1.00 0.00 H new ATOM 0 HD1 TYR A 136 -0.161 -2.930 -0.051 1.00 0.00 H new ATOM 0 HD2 TYR A 136 -3.039 -6.071 -0.064 1.00 0.00 H new ATOM 0 HE1 TYR A 136 1.697 -4.638 -0.261 1.00 0.00 H new ATOM 0 HE2 TYR A 136 -1.172 -7.771 -0.273 1.00 0.00 H new ATOM 0 HH TYR A 136 1.214 -7.884 0.287 1.00 0.00 H new ATOM 40 N VAL A 137 -5.541 -2.260 -1.218 1.00 0.00 N ATOM 41 CA VAL A 137 -6.765 -1.497 -1.037 1.00 0.00 C ATOM 42 C VAL A 137 -7.652 -2.199 -0.007 1.00 0.00 C ATOM 43 O VAL A 137 -7.488 -3.390 0.249 1.00 0.00 O ATOM 44 CB VAL A 137 -7.459 -1.293 -2.385 1.00 0.00 C ATOM 45 CG1 VAL A 137 -6.481 -0.755 -3.431 1.00 0.00 C ATOM 46 CG2 VAL A 137 -8.115 -2.591 -2.865 1.00 0.00 C ATOM 0 H VAL A 137 -5.680 -3.221 -1.530 1.00 0.00 H new ATOM 0 HA VAL A 137 -6.541 -0.503 -0.649 1.00 0.00 H new ATOM 0 HB VAL A 137 -8.244 -0.550 -2.248 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -7.001 -0.619 -4.379 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -6.081 0.202 -3.097 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -5.664 -1.464 -3.563 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -8.602 -2.419 -3.825 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -7.354 -3.364 -2.977 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -8.857 -2.915 -2.135 1.00 0.00 H new ATOM 56 N ARG A 138 -8.572 -1.430 0.557 1.00 0.00 N ATOM 57 CA ARG A 138 -9.484 -1.964 1.554 1.00 0.00 C ATOM 58 C ARG A 138 -10.909 -1.473 1.286 1.00 0.00 C ATOM 59 O ARG A 138 -11.135 -0.277 1.112 1.00 0.00 O ATOM 60 CB ARG A 138 -9.066 -1.544 2.965 1.00 0.00 C ATOM 61 CG ARG A 138 -8.211 -2.627 3.627 1.00 0.00 C ATOM 62 CD ARG A 138 -6.790 -2.124 3.884 1.00 0.00 C ATOM 63 NE ARG A 138 -5.976 -3.196 4.499 1.00 0.00 N ATOM 64 CZ ARG A 138 -5.899 -3.418 5.818 1.00 0.00 C ATOM 65 NH1 ARG A 138 -6.585 -2.643 6.669 1.00 0.00 N ATOM 66 NH2 ARG A 138 -5.135 -4.414 6.286 1.00 0.00 N ATOM 0 H ARG A 138 -8.705 -0.442 0.343 1.00 0.00 H new ATOM 0 HA ARG A 138 -9.450 -3.051 1.485 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -8.506 -0.610 2.920 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -9.953 -1.355 3.570 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -8.668 -2.931 4.568 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -8.178 -3.510 2.989 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -6.335 -1.802 2.947 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -6.817 -1.254 4.541 1.00 0.00 H new ATOM 0 HE ARG A 138 -5.440 -3.804 3.880 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -7.166 -1.884 6.313 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -6.526 -2.812 7.673 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -4.612 -5.003 5.638 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -5.076 -4.583 7.290 1.00 0.00 H new ATOM 80 N ALA A 139 -11.832 -2.423 1.259 1.00 0.00 N ATOM 81 CA ALA A 139 -13.229 -2.103 1.015 1.00 0.00 C ATOM 82 C ALA A 139 -13.899 -1.724 2.337 1.00 0.00 C ATOM 83 O ALA A 139 -13.951 -2.530 3.264 1.00 0.00 O ATOM 84 CB ALA A 139 -13.912 -3.290 0.334 1.00 0.00 C ATOM 0 H ALA A 139 -11.640 -3.415 1.402 1.00 0.00 H new ATOM 0 HA ALA A 139 -13.316 -1.248 0.345 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -14.960 -3.051 0.151 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -13.417 -3.500 -0.614 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -13.847 -4.166 0.979 1.00 0.00 H new ATOM 90 N LEU A 140 -14.394 -0.496 2.382 1.00 0.00 N ATOM 91 CA LEU A 140 -15.060 0.001 3.574 1.00 0.00 C ATOM 92 C LEU A 140 -16.574 -0.042 3.363 1.00 0.00 C ATOM 93 O LEU A 140 -17.295 0.839 3.830 1.00 0.00 O ATOM 94 CB LEU A 140 -14.529 1.387 3.946 1.00 0.00 C ATOM 95 CG LEU A 140 -13.083 1.682 3.543 1.00 0.00 C ATOM 96 CD1 LEU A 140 -12.854 3.187 3.385 1.00 0.00 C ATOM 97 CD2 LEU A 140 -12.098 1.053 4.530 1.00 0.00 C ATOM 0 H LEU A 140 -14.347 0.170 1.611 1.00 0.00 H new ATOM 0 HA LEU A 140 -14.839 -0.639 4.428 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -15.173 2.136 3.486 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -14.617 1.510 5.025 1.00 0.00 H new ATOM 0 HG LEU A 140 -12.900 1.224 2.571 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -11.818 3.369 3.098 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -13.518 3.577 2.614 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -13.062 3.688 4.330 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -11.078 1.278 4.219 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -12.272 1.459 5.526 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -12.241 -0.027 4.548 1.00 0.00 H new ATOM 109 N PHE A 141 -17.013 -1.075 2.659 1.00 0.00 N ATOM 110 CA PHE A 141 -18.429 -1.244 2.381 1.00 0.00 C ATOM 111 C PHE A 141 -18.713 -2.634 1.809 1.00 0.00 C ATOM 112 O PHE A 141 -18.119 -3.030 0.806 1.00 0.00 O ATOM 113 CB PHE A 141 -18.809 -0.189 1.341 1.00 0.00 C ATOM 114 CG PHE A 141 -19.025 1.210 1.923 1.00 0.00 C ATOM 115 CD1 PHE A 141 -19.880 1.388 2.964 1.00 0.00 C ATOM 116 CD2 PHE A 141 -18.361 2.274 1.397 1.00 0.00 C ATOM 117 CE1 PHE A 141 -20.080 2.686 3.505 1.00 0.00 C ATOM 118 CE2 PHE A 141 -18.561 3.573 1.937 1.00 0.00 C ATOM 119 CZ PHE A 141 -19.416 3.751 2.979 1.00 0.00 C ATOM 0 H PHE A 141 -16.413 -1.804 2.273 1.00 0.00 H new ATOM 0 HA PHE A 141 -19.005 -1.135 3.300 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -18.025 -0.140 0.585 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -19.721 -0.505 0.834 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -20.408 0.542 3.380 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -17.682 2.132 0.569 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -20.759 2.828 4.333 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -18.034 4.418 1.520 1.00 0.00 H new ATOM 0 HZ PHE A 141 -19.568 4.738 3.390 1.00 0.00 H new ATOM 129 N ASP A 142 -19.622 -3.337 2.468 1.00 0.00 N ATOM 130 CA ASP A 142 -19.992 -4.674 2.037 1.00 0.00 C ATOM 131 C ASP A 142 -20.880 -4.577 0.795 1.00 0.00 C ATOM 132 O ASP A 142 -21.777 -3.738 0.733 1.00 0.00 O ATOM 133 CB ASP A 142 -20.780 -5.405 3.126 1.00 0.00 C ATOM 134 CG ASP A 142 -21.194 -6.836 2.774 1.00 0.00 C ATOM 135 OD1 ASP A 142 -20.552 -7.405 1.867 1.00 0.00 O ATOM 136 OD2 ASP A 142 -22.144 -7.327 3.422 1.00 0.00 O ATOM 0 H ASP A 142 -20.114 -3.005 3.298 1.00 0.00 H new ATOM 0 HA ASP A 142 -19.076 -5.225 1.823 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -20.178 -5.430 4.034 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -21.677 -4.829 3.353 1.00 0.00 H new ATOM 141 N PHE A 143 -20.600 -5.448 -0.163 1.00 0.00 N ATOM 142 CA PHE A 143 -21.361 -5.471 -1.400 1.00 0.00 C ATOM 143 C PHE A 143 -22.081 -6.810 -1.575 1.00 0.00 C ATOM 144 O PHE A 143 -21.745 -7.790 -0.913 1.00 0.00 O ATOM 145 CB PHE A 143 -20.363 -5.288 -2.544 1.00 0.00 C ATOM 146 CG PHE A 143 -20.995 -4.801 -3.849 1.00 0.00 C ATOM 147 CD1 PHE A 143 -21.664 -5.676 -4.648 1.00 0.00 C ATOM 148 CD2 PHE A 143 -20.887 -3.494 -4.211 1.00 0.00 C ATOM 149 CE1 PHE A 143 -22.250 -5.224 -5.860 1.00 0.00 C ATOM 150 CE2 PHE A 143 -21.474 -3.043 -5.424 1.00 0.00 C ATOM 151 CZ PHE A 143 -22.143 -3.917 -6.222 1.00 0.00 C ATOM 0 H PHE A 143 -19.856 -6.144 -0.107 1.00 0.00 H new ATOM 0 HA PHE A 143 -22.114 -4.683 -1.388 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -19.598 -4.576 -2.235 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -19.859 -6.237 -2.728 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -21.749 -6.714 -4.361 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -20.356 -2.800 -3.577 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -22.781 -5.918 -6.495 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -21.389 -2.006 -5.712 1.00 0.00 H new ATOM 0 HZ PHE A 143 -22.590 -3.574 -7.143 1.00 0.00 H new ATOM 250 N LEU A 151 -15.700 -9.709 -8.156 1.00 0.00 N ATOM 251 CA LEU A 151 -15.795 -10.472 -6.923 1.00 0.00 C ATOM 252 C LEU A 151 -16.454 -9.610 -5.845 1.00 0.00 C ATOM 253 O LEU A 151 -16.174 -8.416 -5.741 1.00 0.00 O ATOM 254 CB LEU A 151 -14.422 -11.015 -6.523 1.00 0.00 C ATOM 255 CG LEU A 151 -14.270 -11.442 -5.062 1.00 0.00 C ATOM 256 CD1 LEU A 151 -14.098 -12.958 -4.949 1.00 0.00 C ATOM 257 CD2 LEU A 151 -13.127 -10.684 -4.384 1.00 0.00 C ATOM 0 HA LEU A 151 -16.430 -11.347 -7.063 1.00 0.00 H new ATOM 0 HB2 LEU A 151 -14.193 -11.872 -7.157 1.00 0.00 H new ATOM 0 HB3 LEU A 151 -13.675 -10.251 -6.737 1.00 0.00 H new ATOM 0 HG LEU A 151 -15.187 -11.181 -4.534 1.00 0.00 H new ATOM 0 HD11 LEU A 151 -13.992 -13.235 -3.900 1.00 0.00 H new ATOM 0 HD12 LEU A 151 -14.972 -13.456 -5.369 1.00 0.00 H new ATOM 0 HD13 LEU A 151 -13.207 -13.265 -5.497 1.00 0.00 H new ATOM 0 HD21 LEU A 151 -13.041 -11.007 -3.346 1.00 0.00 H new ATOM 0 HD22 LEU A 151 -12.193 -10.890 -4.907 1.00 0.00 H new ATOM 0 HD23 LEU A 151 -13.331 -9.614 -4.415 1.00 0.00 H new ATOM 269 N PRO A 152 -17.340 -10.264 -5.047 1.00 0.00 N ATOM 270 CA PRO A 152 -18.041 -9.572 -3.980 1.00 0.00 C ATOM 271 C PRO A 152 -17.111 -9.311 -2.792 1.00 0.00 C ATOM 272 O PRO A 152 -16.341 -10.185 -2.400 1.00 0.00 O ATOM 273 CB PRO A 152 -19.214 -10.472 -3.631 1.00 0.00 C ATOM 274 CG PRO A 152 -18.866 -11.844 -4.184 1.00 0.00 C ATOM 275 CD PRO A 152 -17.696 -11.678 -5.141 1.00 0.00 C ATOM 0 HA PRO A 152 -18.391 -8.584 -4.278 1.00 0.00 H new ATOM 0 HB2 PRO A 152 -19.367 -10.513 -2.553 1.00 0.00 H new ATOM 0 HB3 PRO A 152 -20.138 -10.097 -4.070 1.00 0.00 H new ATOM 0 HG2 PRO A 152 -18.604 -12.526 -3.375 1.00 0.00 H new ATOM 0 HG3 PRO A 152 -19.723 -12.276 -4.700 1.00 0.00 H new ATOM 0 HD2 PRO A 152 -16.859 -12.317 -4.859 1.00 0.00 H new ATOM 0 HD3 PRO A 152 -17.975 -11.950 -6.159 1.00 0.00 H new ATOM 283 N PHE A 153 -17.216 -8.104 -2.255 1.00 0.00 N ATOM 284 CA PHE A 153 -16.395 -7.717 -1.121 1.00 0.00 C ATOM 285 C PHE A 153 -17.262 -7.375 0.092 1.00 0.00 C ATOM 286 O PHE A 153 -18.424 -6.998 -0.056 1.00 0.00 O ATOM 287 CB PHE A 153 -15.610 -6.472 -1.540 1.00 0.00 C ATOM 288 CG PHE A 153 -16.281 -5.658 -2.647 1.00 0.00 C ATOM 289 CD1 PHE A 153 -16.081 -5.990 -3.951 1.00 0.00 C ATOM 290 CD2 PHE A 153 -17.077 -4.602 -2.328 1.00 0.00 C ATOM 291 CE1 PHE A 153 -16.704 -5.234 -4.979 1.00 0.00 C ATOM 292 CE2 PHE A 153 -17.700 -3.846 -3.357 1.00 0.00 C ATOM 293 CZ PHE A 153 -17.500 -4.178 -4.661 1.00 0.00 C ATOM 0 H PHE A 153 -17.857 -7.382 -2.584 1.00 0.00 H new ATOM 0 HA PHE A 153 -15.735 -8.539 -0.842 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -15.469 -5.833 -0.668 1.00 0.00 H new ATOM 0 HB3 PHE A 153 -14.619 -6.776 -1.876 1.00 0.00 H new ATOM 0 HD1 PHE A 153 -15.449 -6.828 -4.204 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -17.235 -4.338 -1.293 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -16.546 -5.498 -6.014 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -18.332 -3.008 -3.104 1.00 0.00 H new ATOM 0 HZ PHE A 153 -17.973 -3.603 -5.443 1.00 0.00 H new ATOM 303 N LYS A 154 -16.664 -7.517 1.267 1.00 0.00 N ATOM 304 CA LYS A 154 -17.368 -7.227 2.504 1.00 0.00 C ATOM 305 C LYS A 154 -16.865 -5.899 3.073 1.00 0.00 C ATOM 306 O LYS A 154 -15.885 -5.340 2.581 1.00 0.00 O ATOM 307 CB LYS A 154 -17.242 -8.400 3.479 1.00 0.00 C ATOM 308 CG LYS A 154 -17.962 -9.639 2.941 1.00 0.00 C ATOM 309 CD LYS A 154 -17.861 -10.804 3.929 1.00 0.00 C ATOM 310 CE LYS A 154 -18.971 -11.827 3.683 1.00 0.00 C ATOM 311 NZ LYS A 154 -20.137 -11.545 4.550 1.00 0.00 N ATOM 0 H LYS A 154 -15.700 -7.829 1.387 1.00 0.00 H new ATOM 0 HA LYS A 154 -18.435 -7.110 2.316 1.00 0.00 H new ATOM 0 HB2 LYS A 154 -16.189 -8.629 3.644 1.00 0.00 H new ATOM 0 HB3 LYS A 154 -17.662 -8.121 4.445 1.00 0.00 H new ATOM 0 HG2 LYS A 154 -19.010 -9.404 2.757 1.00 0.00 H new ATOM 0 HG3 LYS A 154 -17.528 -9.930 1.985 1.00 0.00 H new ATOM 0 HD2 LYS A 154 -16.888 -11.286 3.830 1.00 0.00 H new ATOM 0 HD3 LYS A 154 -17.928 -10.427 4.950 1.00 0.00 H new ATOM 0 HE2 LYS A 154 -19.274 -11.799 2.636 1.00 0.00 H new ATOM 0 HE3 LYS A 154 -18.598 -12.832 3.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 -20.881 -12.249 4.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 -19.848 -11.594 5.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 -20.502 -10.594 4.342 1.00 0.00 H new ATOM 325 N LYS A 155 -17.556 -5.432 4.102 1.00 0.00 N ATOM 326 CA LYS A 155 -17.192 -4.180 4.743 1.00 0.00 C ATOM 327 C LYS A 155 -15.883 -4.368 5.512 1.00 0.00 C ATOM 328 O LYS A 155 -15.749 -5.304 6.298 1.00 0.00 O ATOM 329 CB LYS A 155 -18.344 -3.665 5.607 1.00 0.00 C ATOM 330 CG LYS A 155 -18.619 -4.613 6.776 1.00 0.00 C ATOM 331 CD LYS A 155 -18.569 -3.868 8.110 1.00 0.00 C ATOM 332 CE LYS A 155 -17.137 -3.454 8.455 1.00 0.00 C ATOM 333 NZ LYS A 155 -17.137 -2.222 9.273 1.00 0.00 N ATOM 0 H LYS A 155 -18.367 -5.899 4.508 1.00 0.00 H new ATOM 0 HA LYS A 155 -17.015 -3.407 3.995 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -18.102 -2.673 5.988 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -19.242 -3.563 4.998 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -19.598 -5.076 6.651 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -17.884 -5.417 6.777 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -19.205 -2.984 8.061 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -18.968 -4.504 8.901 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -16.640 -4.258 8.998 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -16.569 -3.290 7.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -16.157 -1.955 9.498 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -17.592 -1.453 8.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -17.661 -2.391 10.155 1.00 0.00 H new ATOM 347 N GLY A 156 -14.948 -3.463 5.258 1.00 0.00 N ATOM 348 CA GLY A 156 -13.655 -3.517 5.917 1.00 0.00 C ATOM 349 C GLY A 156 -12.866 -4.752 5.474 1.00 0.00 C ATOM 350 O GLY A 156 -12.201 -5.391 6.288 1.00 0.00 O ATOM 0 H GLY A 156 -15.061 -2.688 4.604 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -13.087 -2.616 5.686 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -13.794 -3.538 6.998 1.00 0.00 H new ATOM 354 N ASP A 157 -12.966 -5.049 4.187 1.00 0.00 N ATOM 355 CA ASP A 157 -12.271 -6.196 3.628 1.00 0.00 C ATOM 356 C ASP A 157 -10.923 -5.743 3.062 1.00 0.00 C ATOM 357 O ASP A 157 -10.698 -4.550 2.865 1.00 0.00 O ATOM 358 CB ASP A 157 -13.075 -6.824 2.487 1.00 0.00 C ATOM 359 CG ASP A 157 -12.868 -8.330 2.304 1.00 0.00 C ATOM 360 OD1 ASP A 157 -11.811 -8.694 1.745 1.00 0.00 O ATOM 361 OD2 ASP A 157 -13.773 -9.082 2.728 1.00 0.00 O ATOM 0 H ASP A 157 -13.518 -4.515 3.515 1.00 0.00 H new ATOM 0 HA ASP A 157 -12.137 -6.930 4.422 1.00 0.00 H new ATOM 0 HB2 ASP A 157 -14.134 -6.636 2.663 1.00 0.00 H new ATOM 0 HB3 ASP A 157 -12.812 -6.320 1.557 1.00 0.00 H new ATOM 366 N ILE A 158 -10.062 -6.720 2.820 1.00 0.00 N ATOM 367 CA ILE A 158 -8.741 -6.437 2.281 1.00 0.00 C ATOM 368 C ILE A 158 -8.677 -6.908 0.828 1.00 0.00 C ATOM 369 O ILE A 158 -9.238 -7.947 0.482 1.00 0.00 O ATOM 370 CB ILE A 158 -7.657 -7.044 3.175 1.00 0.00 C ATOM 371 CG1 ILE A 158 -7.159 -6.026 4.202 1.00 0.00 C ATOM 372 CG2 ILE A 158 -6.515 -7.619 2.335 1.00 0.00 C ATOM 373 CD1 ILE A 158 -8.004 -6.074 5.476 1.00 0.00 C ATOM 0 H ILE A 158 -10.252 -7.708 2.987 1.00 0.00 H new ATOM 0 HA ILE A 158 -8.552 -5.363 2.276 1.00 0.00 H new ATOM 0 HB ILE A 158 -8.096 -7.872 3.732 1.00 0.00 H new ATOM 0 HG12 ILE A 158 -6.116 -6.230 4.445 1.00 0.00 H new ATOM 0 HG13 ILE A 158 -7.197 -5.024 3.774 1.00 0.00 H new ATOM 0 HG21 ILE A 158 -5.758 -8.044 2.993 1.00 0.00 H new ATOM 0 HG22 ILE A 158 -6.903 -8.397 1.678 1.00 0.00 H new ATOM 0 HG23 ILE A 158 -6.070 -6.826 1.735 1.00 0.00 H new ATOM 0 HD11 ILE A 158 -7.629 -5.340 6.189 1.00 0.00 H new ATOM 0 HD12 ILE A 158 -9.042 -5.846 5.233 1.00 0.00 H new ATOM 0 HD13 ILE A 158 -7.945 -7.070 5.915 1.00 0.00 H new ATOM 385 N LEU A 159 -7.986 -6.122 0.014 1.00 0.00 N ATOM 386 CA LEU A 159 -7.841 -6.446 -1.395 1.00 0.00 C ATOM 387 C LEU A 159 -6.491 -5.928 -1.895 1.00 0.00 C ATOM 388 O LEU A 159 -6.234 -4.726 -1.863 1.00 0.00 O ATOM 389 CB LEU A 159 -9.036 -5.921 -2.192 1.00 0.00 C ATOM 390 CG LEU A 159 -10.307 -6.770 -2.133 1.00 0.00 C ATOM 391 CD1 LEU A 159 -11.553 -5.908 -2.348 1.00 0.00 C ATOM 392 CD2 LEU A 159 -10.236 -7.932 -3.125 1.00 0.00 C ATOM 0 H LEU A 159 -7.521 -5.262 0.304 1.00 0.00 H new ATOM 0 HA LEU A 159 -7.842 -7.526 -1.540 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -9.275 -4.920 -1.833 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -8.737 -5.823 -3.235 1.00 0.00 H new ATOM 0 HG LEU A 159 -10.383 -7.202 -1.135 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -12.443 -6.536 -2.301 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -11.606 -5.145 -1.571 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -11.499 -5.428 -3.325 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -11.152 -8.520 -3.063 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -10.124 -7.541 -4.136 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -9.382 -8.565 -2.884 1.00 0.00 H new ATOM 404 N ARG A 160 -5.666 -6.860 -2.348 1.00 0.00 N ATOM 405 CA ARG A 160 -4.349 -6.512 -2.854 1.00 0.00 C ATOM 406 C ARG A 160 -4.429 -6.163 -4.342 1.00 0.00 C ATOM 407 O ARG A 160 -4.897 -6.965 -5.148 1.00 0.00 O ATOM 408 CB ARG A 160 -3.362 -7.665 -2.661 1.00 0.00 C ATOM 409 CG ARG A 160 -2.263 -7.630 -3.725 1.00 0.00 C ATOM 410 CD ARG A 160 -1.557 -8.984 -3.828 1.00 0.00 C ATOM 411 NE ARG A 160 -0.725 -9.213 -2.627 1.00 0.00 N ATOM 412 CZ ARG A 160 -0.435 -10.426 -2.134 1.00 0.00 C ATOM 413 NH1 ARG A 160 -0.908 -11.525 -2.737 1.00 0.00 N ATOM 414 NH2 ARG A 160 0.329 -10.539 -1.040 1.00 0.00 N ATOM 0 H ARG A 160 -5.884 -7.856 -2.375 1.00 0.00 H new ATOM 0 HA ARG A 160 -3.995 -5.648 -2.292 1.00 0.00 H new ATOM 0 HB2 ARG A 160 -2.915 -7.603 -1.669 1.00 0.00 H new ATOM 0 HB3 ARG A 160 -3.893 -8.615 -2.713 1.00 0.00 H new ATOM 0 HG2 ARG A 160 -2.695 -7.366 -4.691 1.00 0.00 H new ATOM 0 HG3 ARG A 160 -1.537 -6.855 -3.478 1.00 0.00 H new ATOM 0 HD2 ARG A 160 -2.294 -9.781 -3.927 1.00 0.00 H new ATOM 0 HD3 ARG A 160 -0.935 -9.012 -4.722 1.00 0.00 H new ATOM 0 HE ARG A 160 -0.348 -8.398 -2.144 1.00 0.00 H new ATOM 0 HH11 ARG A 160 -1.489 -11.439 -3.571 1.00 0.00 H new ATOM 0 HH12 ARG A 160 -0.687 -12.448 -2.362 1.00 0.00 H new ATOM 0 HH21 ARG A 160 0.690 -9.702 -0.582 1.00 0.00 H new ATOM 0 HH22 ARG A 160 0.550 -11.462 -0.665 1.00 0.00 H new ATOM 428 N ILE A 161 -3.965 -4.963 -4.661 1.00 0.00 N ATOM 429 CA ILE A 161 -3.978 -4.497 -6.037 1.00 0.00 C ATOM 430 C ILE A 161 -2.748 -5.041 -6.767 1.00 0.00 C ATOM 431 O ILE A 161 -1.617 -4.811 -6.341 1.00 0.00 O ATOM 432 CB ILE A 161 -4.098 -2.972 -6.086 1.00 0.00 C ATOM 433 CG1 ILE A 161 -5.368 -2.546 -6.824 1.00 0.00 C ATOM 434 CG2 ILE A 161 -2.843 -2.343 -6.695 1.00 0.00 C ATOM 435 CD1 ILE A 161 -5.296 -2.922 -8.304 1.00 0.00 C ATOM 0 H ILE A 161 -3.578 -4.300 -3.990 1.00 0.00 H new ATOM 0 HA ILE A 161 -4.855 -4.879 -6.560 1.00 0.00 H new ATOM 0 HB ILE A 161 -4.180 -2.602 -5.064 1.00 0.00 H new ATOM 0 HG12 ILE A 161 -6.235 -3.022 -6.366 1.00 0.00 H new ATOM 0 HG13 ILE A 161 -5.506 -1.469 -6.725 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -2.954 -1.259 -6.718 1.00 0.00 H new ATOM 0 HG22 ILE A 161 -1.975 -2.606 -6.091 1.00 0.00 H new ATOM 0 HG23 ILE A 161 -2.705 -2.715 -7.710 1.00 0.00 H new ATOM 0 HD11 ILE A 161 -6.212 -2.607 -8.804 1.00 0.00 H new ATOM 0 HD12 ILE A 161 -4.442 -2.425 -8.764 1.00 0.00 H new ATOM 0 HD13 ILE A 161 -5.183 -4.002 -8.400 1.00 0.00 H new ATOM 447 N ARG A 162 -3.011 -5.753 -7.854 1.00 0.00 N ATOM 448 CA ARG A 162 -1.939 -6.331 -8.646 1.00 0.00 C ATOM 449 C ARG A 162 -2.001 -5.810 -10.083 1.00 0.00 C ATOM 450 O ARG A 162 -0.973 -5.683 -10.746 1.00 0.00 O ATOM 451 CB ARG A 162 -2.028 -7.858 -8.660 1.00 0.00 C ATOM 452 CG ARG A 162 -3.322 -8.326 -9.328 1.00 0.00 C ATOM 453 CD ARG A 162 -3.026 -9.127 -10.598 1.00 0.00 C ATOM 454 NE ARG A 162 -2.802 -10.550 -10.259 1.00 0.00 N ATOM 455 CZ ARG A 162 -2.904 -11.556 -11.138 1.00 0.00 C ATOM 456 NH1 ARG A 162 -3.226 -11.302 -12.414 1.00 0.00 N ATOM 457 NH2 ARG A 162 -2.683 -12.817 -10.741 1.00 0.00 N ATOM 0 H ARG A 162 -3.950 -5.942 -8.204 1.00 0.00 H new ATOM 0 HA ARG A 162 -0.993 -6.037 -8.190 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -1.170 -8.271 -9.191 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -1.984 -8.238 -7.639 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -3.893 -8.940 -8.632 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -3.941 -7.463 -9.574 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -3.858 -9.038 -11.296 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -2.146 -8.721 -11.097 1.00 0.00 H new ATOM 0 HE ARG A 162 -2.555 -10.779 -9.296 1.00 0.00 H new ATOM 0 HH11 ARG A 162 -3.394 -10.342 -12.716 1.00 0.00 H new ATOM 0 HH12 ARG A 162 -3.303 -12.068 -13.083 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -2.437 -13.010 -9.770 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -2.761 -13.583 -11.410 1.00 0.00 H new ATOM 471 N ASP A 163 -3.218 -5.522 -10.522 1.00 0.00 N ATOM 472 CA ASP A 163 -3.426 -5.017 -11.869 1.00 0.00 C ATOM 473 C ASP A 163 -4.505 -3.932 -11.840 1.00 0.00 C ATOM 474 O ASP A 163 -5.578 -4.132 -11.272 1.00 0.00 O ATOM 475 CB ASP A 163 -3.899 -6.129 -12.807 1.00 0.00 C ATOM 476 CG ASP A 163 -2.792 -6.808 -13.615 1.00 0.00 C ATOM 477 OD1 ASP A 163 -2.052 -7.608 -13.003 1.00 0.00 O ATOM 478 OD2 ASP A 163 -2.710 -6.511 -14.827 1.00 0.00 O ATOM 0 H ASP A 163 -4.069 -5.629 -9.970 1.00 0.00 H new ATOM 0 HA ASP A 163 -2.478 -4.619 -12.231 1.00 0.00 H new ATOM 0 HB2 ASP A 163 -4.414 -6.887 -12.217 1.00 0.00 H new ATOM 0 HB3 ASP A 163 -4.630 -5.713 -13.500 1.00 0.00 H new ATOM 483 N LYS A 164 -4.184 -2.805 -12.460 1.00 0.00 N ATOM 484 CA LYS A 164 -5.112 -1.689 -12.512 1.00 0.00 C ATOM 485 C LYS A 164 -5.041 -1.038 -13.895 1.00 0.00 C ATOM 486 O LYS A 164 -4.609 0.106 -14.025 1.00 0.00 O ATOM 487 CB LYS A 164 -4.847 -0.717 -11.360 1.00 0.00 C ATOM 488 CG LYS A 164 -3.427 -0.153 -11.436 1.00 0.00 C ATOM 489 CD LYS A 164 -3.432 1.369 -11.269 1.00 0.00 C ATOM 490 CE LYS A 164 -2.021 1.941 -11.414 1.00 0.00 C ATOM 491 NZ LYS A 164 -1.780 2.375 -12.809 1.00 0.00 N ATOM 0 H LYS A 164 -3.294 -2.642 -12.930 1.00 0.00 H new ATOM 0 HA LYS A 164 -6.136 -2.037 -12.375 1.00 0.00 H new ATOM 0 HB2 LYS A 164 -5.569 0.099 -11.394 1.00 0.00 H new ATOM 0 HB3 LYS A 164 -4.989 -1.228 -10.408 1.00 0.00 H new ATOM 0 HG2 LYS A 164 -2.810 -0.606 -10.660 1.00 0.00 H new ATOM 0 HG3 LYS A 164 -2.978 -0.416 -12.394 1.00 0.00 H new ATOM 0 HD2 LYS A 164 -4.089 1.818 -12.014 1.00 0.00 H new ATOM 0 HD3 LYS A 164 -3.835 1.630 -10.290 1.00 0.00 H new ATOM 0 HE2 LYS A 164 -1.893 2.785 -10.737 1.00 0.00 H new ATOM 0 HE3 LYS A 164 -1.286 1.189 -11.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 -0.818 2.761 -12.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 -1.882 1.561 -13.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 -2.470 3.108 -13.069 1.00 0.00 H new ATOM 505 N PRO A 165 -5.486 -1.815 -14.919 1.00 0.00 N ATOM 506 CA PRO A 165 -5.477 -1.326 -16.287 1.00 0.00 C ATOM 507 C PRO A 165 -6.606 -0.318 -16.516 1.00 0.00 C ATOM 508 O PRO A 165 -6.369 0.784 -17.008 1.00 0.00 O ATOM 509 CB PRO A 165 -5.608 -2.569 -17.151 1.00 0.00 C ATOM 510 CG PRO A 165 -6.150 -3.657 -16.237 1.00 0.00 C ATOM 511 CD PRO A 165 -6.006 -3.174 -14.802 1.00 0.00 C ATOM 0 HA PRO A 165 -4.565 -0.781 -16.532 1.00 0.00 H new ATOM 0 HB2 PRO A 165 -6.281 -2.392 -17.990 1.00 0.00 H new ATOM 0 HB3 PRO A 165 -4.644 -2.856 -17.571 1.00 0.00 H new ATOM 0 HG2 PRO A 165 -7.195 -3.864 -16.467 1.00 0.00 H new ATOM 0 HG3 PRO A 165 -5.601 -4.587 -16.384 1.00 0.00 H new ATOM 0 HD2 PRO A 165 -6.964 -3.188 -14.281 1.00 0.00 H new ATOM 0 HD3 PRO A 165 -5.326 -3.811 -14.236 1.00 0.00 H new ATOM 519 N GLU A 166 -7.809 -0.732 -16.148 1.00 0.00 N ATOM 520 CA GLU A 166 -8.975 0.121 -16.307 1.00 0.00 C ATOM 521 C GLU A 166 -8.846 1.366 -15.427 1.00 0.00 C ATOM 522 O GLU A 166 -7.858 1.525 -14.713 1.00 0.00 O ATOM 523 CB GLU A 166 -10.262 -0.645 -15.990 1.00 0.00 C ATOM 524 CG GLU A 166 -10.470 -1.797 -16.973 1.00 0.00 C ATOM 525 CD GLU A 166 -10.537 -3.138 -16.239 1.00 0.00 C ATOM 526 OE1 GLU A 166 -9.451 -3.714 -16.008 1.00 0.00 O ATOM 527 OE2 GLU A 166 -11.672 -3.558 -15.925 1.00 0.00 O ATOM 0 H GLU A 166 -8.002 -1.647 -15.740 1.00 0.00 H new ATOM 0 HA GLU A 166 -9.029 0.440 -17.348 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -10.217 -1.034 -14.973 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -11.114 0.034 -16.034 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -11.391 -1.639 -17.534 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -9.655 -1.814 -17.696 1.00 0.00 H new ATOM 534 N GLU A 167 -9.859 2.217 -15.508 1.00 0.00 N ATOM 535 CA GLU A 167 -9.871 3.442 -14.728 1.00 0.00 C ATOM 536 C GLU A 167 -11.077 3.460 -13.786 1.00 0.00 C ATOM 537 O GLU A 167 -11.783 4.463 -13.695 1.00 0.00 O ATOM 538 CB GLU A 167 -9.868 4.672 -15.638 1.00 0.00 C ATOM 539 CG GLU A 167 -11.156 4.748 -16.461 1.00 0.00 C ATOM 540 CD GLU A 167 -10.923 5.496 -17.776 1.00 0.00 C ATOM 541 OE1 GLU A 167 -10.140 6.470 -17.743 1.00 0.00 O ATOM 542 OE2 GLU A 167 -11.534 5.077 -18.782 1.00 0.00 O ATOM 0 H GLU A 167 -10.677 2.082 -16.102 1.00 0.00 H new ATOM 0 HA GLU A 167 -8.963 3.474 -14.125 1.00 0.00 H new ATOM 0 HB2 GLU A 167 -9.763 5.574 -15.036 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -9.007 4.633 -16.306 1.00 0.00 H new ATOM 0 HG2 GLU A 167 -11.518 3.741 -16.670 1.00 0.00 H new ATOM 0 HG3 GLU A 167 -11.931 5.252 -15.884 1.00 0.00 H new ATOM 549 N GLN A 168 -11.277 2.338 -13.111 1.00 0.00 N ATOM 550 CA GLN A 168 -12.385 2.212 -12.180 1.00 0.00 C ATOM 551 C GLN A 168 -12.269 0.907 -11.388 1.00 0.00 C ATOM 552 O GLN A 168 -12.158 0.928 -10.163 1.00 0.00 O ATOM 553 CB GLN A 168 -13.728 2.292 -12.911 1.00 0.00 C ATOM 554 CG GLN A 168 -14.314 3.702 -12.828 1.00 0.00 C ATOM 555 CD GLN A 168 -14.526 4.292 -14.223 1.00 0.00 C ATOM 556 OE1 GLN A 168 -13.907 3.891 -15.194 1.00 0.00 O ATOM 557 NE2 GLN A 168 -15.433 5.263 -14.268 1.00 0.00 N ATOM 0 H GLN A 168 -10.690 1.508 -13.190 1.00 0.00 H new ATOM 0 HA GLN A 168 -12.340 3.045 -11.478 1.00 0.00 H new ATOM 0 HB2 GLN A 168 -13.595 2.011 -13.956 1.00 0.00 H new ATOM 0 HB3 GLN A 168 -14.427 1.578 -12.475 1.00 0.00 H new ATOM 0 HG2 GLN A 168 -15.263 3.674 -12.293 1.00 0.00 H new ATOM 0 HG3 GLN A 168 -13.645 4.344 -12.256 1.00 0.00 H new ATOM 0 HE21 GLN A 168 -15.915 5.550 -13.416 1.00 0.00 H new ATOM 0 HE22 GLN A 168 -15.647 5.721 -15.154 1.00 0.00 H new ATOM 566 N TRP A 169 -12.296 -0.196 -12.121 1.00 0.00 N ATOM 567 CA TRP A 169 -12.194 -1.507 -11.503 1.00 0.00 C ATOM 568 C TRP A 169 -10.813 -2.077 -11.828 1.00 0.00 C ATOM 569 O TRP A 169 -10.385 -2.059 -12.980 1.00 0.00 O ATOM 570 CB TRP A 169 -13.338 -2.417 -11.956 1.00 0.00 C ATOM 571 CG TRP A 169 -14.708 -1.736 -11.968 1.00 0.00 C ATOM 572 CD1 TRP A 169 -15.126 -0.737 -12.756 1.00 0.00 C ATOM 573 CD2 TRP A 169 -15.830 -2.047 -11.116 1.00 0.00 C ATOM 574 NE1 TRP A 169 -16.429 -0.382 -12.476 1.00 0.00 N ATOM 575 CE2 TRP A 169 -16.872 -1.204 -11.447 1.00 0.00 C ATOM 576 CE3 TRP A 169 -15.961 -3.009 -10.099 1.00 0.00 C ATOM 577 CZ2 TRP A 169 -18.118 -1.239 -10.809 1.00 0.00 C ATOM 578 CZ3 TRP A 169 -17.212 -3.031 -9.471 1.00 0.00 C ATOM 579 CH2 TRP A 169 -18.271 -2.190 -9.793 1.00 0.00 C ATOM 0 H TRP A 169 -12.387 -0.209 -13.137 1.00 0.00 H new ATOM 0 HA TRP A 169 -12.293 -1.431 -10.420 1.00 0.00 H new ATOM 0 HB2 TRP A 169 -13.119 -2.787 -12.958 1.00 0.00 H new ATOM 0 HB3 TRP A 169 -13.381 -3.285 -11.298 1.00 0.00 H new ATOM 0 HD1 TRP A 169 -14.519 -0.268 -13.516 1.00 0.00 H new ATOM 0 HE1 TRP A 169 -16.968 0.349 -12.939 1.00 0.00 H new ATOM 0 HE3 TRP A 169 -15.159 -3.678 -9.824 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 -18.918 -0.568 -11.086 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 -17.365 -3.752 -8.681 1.00 0.00 H new ATOM 0 HH2 TRP A 169 -19.208 -2.270 -9.262 1.00 0.00 H new ATOM 590 N TRP A 170 -10.152 -2.570 -10.790 1.00 0.00 N ATOM 591 CA TRP A 170 -8.827 -3.144 -10.951 1.00 0.00 C ATOM 592 C TRP A 170 -8.853 -4.560 -10.373 1.00 0.00 C ATOM 593 O TRP A 170 -9.719 -4.889 -9.564 1.00 0.00 O ATOM 594 CB TRP A 170 -7.762 -2.255 -10.307 1.00 0.00 C ATOM 595 CG TRP A 170 -7.799 -0.800 -10.777 1.00 0.00 C ATOM 596 CD1 TRP A 170 -8.160 -0.330 -11.979 1.00 0.00 C ATOM 597 CD2 TRP A 170 -7.444 0.364 -10.001 1.00 0.00 C ATOM 598 NE1 TRP A 170 -8.066 1.046 -12.034 1.00 0.00 N ATOM 599 CE2 TRP A 170 -7.616 1.482 -10.792 1.00 0.00 C ATOM 600 CE3 TRP A 170 -6.994 0.470 -8.673 1.00 0.00 C ATOM 601 CZ2 TRP A 170 -7.361 2.784 -10.347 1.00 0.00 C ATOM 602 CZ3 TRP A 170 -6.743 1.778 -8.243 1.00 0.00 C ATOM 603 CH2 TRP A 170 -6.911 2.913 -9.028 1.00 0.00 C ATOM 0 H TRP A 170 -10.510 -2.584 -9.835 1.00 0.00 H new ATOM 0 HA TRP A 170 -8.557 -3.203 -12.005 1.00 0.00 H new ATOM 0 HB2 TRP A 170 -7.889 -2.280 -9.225 1.00 0.00 H new ATOM 0 HB3 TRP A 170 -6.778 -2.671 -10.522 1.00 0.00 H new ATOM 0 HD1 TRP A 170 -8.484 -0.950 -12.802 1.00 0.00 H new ATOM 0 HE1 TRP A 170 -8.286 1.635 -12.837 1.00 0.00 H new ATOM 0 HE3 TRP A 170 -6.853 -0.390 -8.035 1.00 0.00 H new ATOM 0 HZ2 TRP A 170 -7.504 3.643 -10.987 1.00 0.00 H new ATOM 0 HZ3 TRP A 170 -6.394 1.915 -7.230 1.00 0.00 H new ATOM 0 HH2 TRP A 170 -6.695 3.890 -8.622 1.00 0.00 H new ATOM 614 N ASN A 171 -7.892 -5.362 -10.810 1.00 0.00 N ATOM 615 CA ASN A 171 -7.793 -6.735 -10.346 1.00 0.00 C ATOM 616 C ASN A 171 -6.967 -6.776 -9.059 1.00 0.00 C ATOM 617 O ASN A 171 -5.788 -6.427 -9.063 1.00 0.00 O ATOM 618 CB ASN A 171 -7.096 -7.618 -11.384 1.00 0.00 C ATOM 619 CG ASN A 171 -7.950 -8.840 -11.726 1.00 0.00 C ATOM 620 OD1 ASN A 171 -8.904 -8.771 -12.484 1.00 0.00 O ATOM 621 ND2 ASN A 171 -7.557 -9.960 -11.125 1.00 0.00 N ATOM 0 H ASN A 171 -7.175 -5.086 -11.481 1.00 0.00 H new ATOM 0 HA ASN A 171 -8.803 -7.107 -10.176 1.00 0.00 H new ATOM 0 HB2 ASN A 171 -6.903 -7.040 -12.288 1.00 0.00 H new ATOM 0 HB3 ASN A 171 -6.128 -7.942 -11.000 1.00 0.00 H new ATOM 0 HD21 ASN A 171 -8.063 -10.831 -11.287 1.00 0.00 H new ATOM 0 HD22 ASN A 171 -6.749 -9.948 -10.502 1.00 0.00 H new ATOM 628 N ALA A 172 -7.619 -7.205 -7.989 1.00 0.00 N ATOM 629 CA ALA A 172 -6.960 -7.296 -6.697 1.00 0.00 C ATOM 630 C ALA A 172 -7.203 -8.685 -6.102 1.00 0.00 C ATOM 631 O ALA A 172 -8.229 -9.308 -6.371 1.00 0.00 O ATOM 632 CB ALA A 172 -7.464 -6.175 -5.787 1.00 0.00 C ATOM 0 H ALA A 172 -8.597 -7.494 -7.990 1.00 0.00 H new ATOM 0 HA ALA A 172 -5.883 -7.168 -6.805 1.00 0.00 H new ATOM 0 HB1 ALA A 172 -6.970 -6.243 -4.818 1.00 0.00 H new ATOM 0 HB2 ALA A 172 -7.241 -5.210 -6.241 1.00 0.00 H new ATOM 0 HB3 ALA A 172 -8.541 -6.272 -5.653 1.00 0.00 H new ATOM 638 N GLU A 173 -6.243 -9.128 -5.304 1.00 0.00 N ATOM 639 CA GLU A 173 -6.340 -10.431 -4.669 1.00 0.00 C ATOM 640 C GLU A 173 -6.948 -10.296 -3.270 1.00 0.00 C ATOM 641 O GLU A 173 -6.289 -9.822 -2.347 1.00 0.00 O ATOM 642 CB GLU A 173 -4.973 -11.115 -4.609 1.00 0.00 C ATOM 643 CG GLU A 173 -5.099 -12.547 -4.083 1.00 0.00 C ATOM 644 CD GLU A 173 -3.933 -12.895 -3.154 1.00 0.00 C ATOM 645 OE1 GLU A 173 -4.007 -12.486 -1.974 1.00 0.00 O ATOM 646 OE2 GLU A 173 -2.996 -13.560 -3.645 1.00 0.00 O ATOM 0 H GLU A 173 -5.394 -8.608 -5.083 1.00 0.00 H new ATOM 0 HA GLU A 173 -6.997 -11.059 -5.271 1.00 0.00 H new ATOM 0 HB2 GLU A 173 -4.524 -11.127 -5.602 1.00 0.00 H new ATOM 0 HB3 GLU A 173 -4.305 -10.544 -3.964 1.00 0.00 H new ATOM 0 HG2 GLU A 173 -6.042 -12.660 -3.547 1.00 0.00 H new ATOM 0 HG3 GLU A 173 -5.123 -13.245 -4.920 1.00 0.00 H new ATOM 653 N ASP A 174 -8.197 -10.722 -3.161 1.00 0.00 N ATOM 654 CA ASP A 174 -8.901 -10.654 -1.891 1.00 0.00 C ATOM 655 C ASP A 174 -8.083 -11.378 -0.820 1.00 0.00 C ATOM 656 O ASP A 174 -7.092 -12.038 -1.131 1.00 0.00 O ATOM 657 CB ASP A 174 -10.268 -11.336 -1.982 1.00 0.00 C ATOM 658 CG ASP A 174 -11.240 -10.991 -0.852 1.00 0.00 C ATOM 659 OD1 ASP A 174 -11.469 -9.779 -0.650 1.00 0.00 O ATOM 660 OD2 ASP A 174 -11.732 -11.947 -0.215 1.00 0.00 O ATOM 0 H ASP A 174 -8.740 -11.115 -3.930 1.00 0.00 H new ATOM 0 HA ASP A 174 -9.038 -9.603 -1.637 1.00 0.00 H new ATOM 0 HB2 ASP A 174 -10.729 -11.067 -2.932 1.00 0.00 H new ATOM 0 HB3 ASP A 174 -10.118 -12.416 -1.995 1.00 0.00 H new ATOM 665 N SER A 175 -8.527 -11.228 0.420 1.00 0.00 N ATOM 666 CA SER A 175 -7.847 -11.858 1.538 1.00 0.00 C ATOM 667 C SER A 175 -8.209 -13.344 1.600 1.00 0.00 C ATOM 668 O SER A 175 -8.229 -13.938 2.677 1.00 0.00 O ATOM 669 CB SER A 175 -8.205 -11.171 2.858 1.00 0.00 C ATOM 670 OG SER A 175 -7.554 -11.779 3.971 1.00 0.00 O ATOM 0 H SER A 175 -9.349 -10.680 0.674 1.00 0.00 H new ATOM 0 HA SER A 175 -6.772 -11.757 1.386 1.00 0.00 H new ATOM 0 HB2 SER A 175 -7.927 -10.118 2.806 1.00 0.00 H new ATOM 0 HB3 SER A 175 -9.284 -11.208 3.005 1.00 0.00 H new ATOM 0 HG SER A 175 -7.652 -12.753 3.915 1.00 0.00 H new ATOM 676 N GLU A 176 -8.484 -13.902 0.430 1.00 0.00 N ATOM 677 CA GLU A 176 -8.842 -15.307 0.338 1.00 0.00 C ATOM 678 C GLU A 176 -8.105 -15.968 -0.829 1.00 0.00 C ATOM 679 O GLU A 176 -8.203 -17.177 -1.025 1.00 0.00 O ATOM 680 CB GLU A 176 -10.357 -15.478 0.196 1.00 0.00 C ATOM 681 CG GLU A 176 -11.055 -15.318 1.548 1.00 0.00 C ATOM 682 CD GLU A 176 -12.392 -16.061 1.566 1.00 0.00 C ATOM 683 OE1 GLU A 176 -12.380 -17.261 1.214 1.00 0.00 O ATOM 684 OE2 GLU A 176 -13.397 -15.412 1.931 1.00 0.00 O ATOM 0 H GLU A 176 -8.466 -13.407 -0.462 1.00 0.00 H new ATOM 0 HA GLU A 176 -8.537 -15.801 1.261 1.00 0.00 H new ATOM 0 HB2 GLU A 176 -10.745 -14.742 -0.507 1.00 0.00 H new ATOM 0 HB3 GLU A 176 -10.579 -16.462 -0.218 1.00 0.00 H new ATOM 0 HG2 GLU A 176 -10.412 -15.700 2.341 1.00 0.00 H new ATOM 0 HG3 GLU A 176 -11.220 -14.260 1.753 1.00 0.00 H new ATOM 691 N GLY A 177 -7.383 -15.143 -1.574 1.00 0.00 N ATOM 692 CA GLY A 177 -6.629 -15.632 -2.715 1.00 0.00 C ATOM 693 C GLY A 177 -7.427 -15.464 -4.011 1.00 0.00 C ATOM 694 O GLY A 177 -6.919 -15.745 -5.096 1.00 0.00 O ATOM 0 H GLY A 177 -7.305 -14.139 -1.409 1.00 0.00 H new ATOM 0 HA2 GLY A 177 -5.686 -15.091 -2.791 1.00 0.00 H new ATOM 0 HA3 GLY A 177 -6.382 -16.684 -2.569 1.00 0.00 H new ATOM 698 N LYS A 178 -8.660 -15.008 -3.854 1.00 0.00 N ATOM 699 CA LYS A 178 -9.532 -14.800 -4.997 1.00 0.00 C ATOM 700 C LYS A 178 -9.158 -13.487 -5.687 1.00 0.00 C ATOM 701 O LYS A 178 -9.439 -12.407 -5.168 1.00 0.00 O ATOM 702 CB LYS A 178 -11.000 -14.876 -4.573 1.00 0.00 C ATOM 703 CG LYS A 178 -11.393 -16.308 -4.208 1.00 0.00 C ATOM 704 CD LYS A 178 -12.177 -16.968 -5.344 1.00 0.00 C ATOM 705 CE LYS A 178 -12.459 -18.439 -5.033 1.00 0.00 C ATOM 706 NZ LYS A 178 -13.878 -18.626 -4.655 1.00 0.00 N ATOM 0 H LYS A 178 -9.076 -14.776 -2.952 1.00 0.00 H new ATOM 0 HA LYS A 178 -9.395 -15.595 -5.730 1.00 0.00 H new ATOM 0 HB2 LYS A 178 -11.170 -14.220 -3.719 1.00 0.00 H new ATOM 0 HB3 LYS A 178 -11.635 -14.516 -5.383 1.00 0.00 H new ATOM 0 HG2 LYS A 178 -10.498 -16.891 -3.993 1.00 0.00 H new ATOM 0 HG3 LYS A 178 -11.996 -16.303 -3.300 1.00 0.00 H new ATOM 0 HD2 LYS A 178 -13.117 -16.438 -5.497 1.00 0.00 H new ATOM 0 HD3 LYS A 178 -11.612 -16.891 -6.273 1.00 0.00 H new ATOM 0 HE2 LYS A 178 -12.224 -19.052 -5.903 1.00 0.00 H new ATOM 0 HE3 LYS A 178 -11.813 -18.776 -4.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 -14.052 -19.630 -4.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 -14.091 -18.056 -3.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 -14.489 -18.324 -5.440 1.00 0.00 H new ATOM 720 N ARG A 179 -8.529 -13.621 -6.845 1.00 0.00 N ATOM 721 CA ARG A 179 -8.114 -12.458 -7.611 1.00 0.00 C ATOM 722 C ARG A 179 -9.184 -12.089 -8.639 1.00 0.00 C ATOM 723 O ARG A 179 -9.470 -12.866 -9.549 1.00 0.00 O ATOM 724 CB ARG A 179 -6.790 -12.718 -8.333 1.00 0.00 C ATOM 725 CG ARG A 179 -5.733 -13.254 -7.366 1.00 0.00 C ATOM 726 CD ARG A 179 -4.829 -14.279 -8.054 1.00 0.00 C ATOM 727 NE ARG A 179 -4.153 -15.119 -7.040 1.00 0.00 N ATOM 728 CZ ARG A 179 -3.725 -16.368 -7.264 1.00 0.00 C ATOM 729 NH1 ARG A 179 -3.899 -16.930 -8.468 1.00 0.00 N ATOM 730 NH2 ARG A 179 -3.121 -17.056 -6.284 1.00 0.00 N ATOM 0 H ARG A 179 -8.296 -14.518 -7.272 1.00 0.00 H new ATOM 0 HA ARG A 179 -7.978 -11.633 -6.912 1.00 0.00 H new ATOM 0 HB2 ARG A 179 -6.946 -13.434 -9.140 1.00 0.00 H new ATOM 0 HB3 ARG A 179 -6.434 -11.795 -8.791 1.00 0.00 H new ATOM 0 HG2 ARG A 179 -5.130 -12.429 -6.987 1.00 0.00 H new ATOM 0 HG3 ARG A 179 -6.221 -13.713 -6.506 1.00 0.00 H new ATOM 0 HD2 ARG A 179 -5.419 -14.906 -8.723 1.00 0.00 H new ATOM 0 HD3 ARG A 179 -4.087 -13.768 -8.668 1.00 0.00 H new ATOM 0 HE ARG A 179 -4.004 -14.722 -6.113 1.00 0.00 H new ATOM 0 HH11 ARG A 179 -4.357 -16.406 -9.214 1.00 0.00 H new ATOM 0 HH12 ARG A 179 -3.573 -17.881 -8.639 1.00 0.00 H new ATOM 0 HH21 ARG A 179 -2.988 -16.628 -5.368 1.00 0.00 H new ATOM 0 HH22 ARG A 179 -2.795 -18.007 -6.455 1.00 0.00 H new ATOM 744 N GLY A 180 -9.747 -10.903 -8.460 1.00 0.00 N ATOM 745 CA GLY A 180 -10.781 -10.421 -9.361 1.00 0.00 C ATOM 746 C GLY A 180 -10.793 -8.893 -9.414 1.00 0.00 C ATOM 747 O GLY A 180 -9.931 -8.241 -8.827 1.00 0.00 O ATOM 0 H GLY A 180 -9.507 -10.261 -7.704 1.00 0.00 H new ATOM 0 HA2 GLY A 180 -10.613 -10.822 -10.361 1.00 0.00 H new ATOM 0 HA3 GLY A 180 -11.754 -10.785 -9.031 1.00 0.00 H new ATOM 751 N MET A 181 -11.780 -8.365 -10.123 1.00 0.00 N ATOM 752 CA MET A 181 -11.917 -6.924 -10.260 1.00 0.00 C ATOM 753 C MET A 181 -12.719 -6.337 -9.097 1.00 0.00 C ATOM 754 O MET A 181 -13.757 -6.876 -8.719 1.00 0.00 O ATOM 755 CB MET A 181 -12.619 -6.601 -11.579 1.00 0.00 C ATOM 756 CG MET A 181 -11.734 -6.964 -12.774 1.00 0.00 C ATOM 757 SD MET A 181 -11.599 -5.567 -13.878 1.00 0.00 S ATOM 758 CE MET A 181 -9.877 -5.155 -13.646 1.00 0.00 C ATOM 0 H MET A 181 -12.493 -8.909 -10.609 1.00 0.00 H new ATOM 0 HA MET A 181 -10.921 -6.481 -10.251 1.00 0.00 H new ATOM 0 HB2 MET A 181 -13.559 -7.149 -11.638 1.00 0.00 H new ATOM 0 HB3 MET A 181 -12.866 -5.540 -11.614 1.00 0.00 H new ATOM 0 HG2 MET A 181 -10.744 -7.261 -12.427 1.00 0.00 H new ATOM 0 HG3 MET A 181 -12.156 -7.818 -13.304 1.00 0.00 H new ATOM 0 HE1 MET A 181 -9.753 -4.073 -13.688 1.00 0.00 H new ATOM 0 HE2 MET A 181 -9.543 -5.522 -12.675 1.00 0.00 H new ATOM 0 HE3 MET A 181 -9.283 -5.619 -14.433 1.00 0.00 H new ATOM 768 N ILE A 182 -12.206 -5.238 -8.561 1.00 0.00 N ATOM 769 CA ILE A 182 -12.862 -4.571 -7.450 1.00 0.00 C ATOM 770 C ILE A 182 -12.881 -3.063 -7.706 1.00 0.00 C ATOM 771 O ILE A 182 -12.045 -2.544 -8.443 1.00 0.00 O ATOM 772 CB ILE A 182 -12.201 -4.961 -6.127 1.00 0.00 C ATOM 773 CG1 ILE A 182 -10.713 -4.608 -6.130 1.00 0.00 C ATOM 774 CG2 ILE A 182 -12.438 -6.440 -5.811 1.00 0.00 C ATOM 775 CD1 ILE A 182 -10.487 -3.180 -5.628 1.00 0.00 C ATOM 0 H ILE A 182 -11.344 -4.794 -8.876 1.00 0.00 H new ATOM 0 HA ILE A 182 -13.900 -4.894 -7.370 1.00 0.00 H new ATOM 0 HB ILE A 182 -12.667 -4.381 -5.330 1.00 0.00 H new ATOM 0 HG12 ILE A 182 -10.168 -5.310 -5.499 1.00 0.00 H new ATOM 0 HG13 ILE A 182 -10.313 -4.710 -7.139 1.00 0.00 H new ATOM 0 HG21 ILE A 182 -11.958 -6.692 -4.865 1.00 0.00 H new ATOM 0 HG22 ILE A 182 -13.509 -6.629 -5.736 1.00 0.00 H new ATOM 0 HG23 ILE A 182 -12.016 -7.054 -6.607 1.00 0.00 H new ATOM 0 HD11 ILE A 182 -9.421 -2.955 -5.640 1.00 0.00 H new ATOM 0 HD12 ILE A 182 -11.014 -2.479 -6.276 1.00 0.00 H new ATOM 0 HD13 ILE A 182 -10.866 -3.088 -4.610 1.00 0.00 H new ATOM 787 N PRO A 183 -13.871 -2.384 -7.066 1.00 0.00 N ATOM 788 CA PRO A 183 -14.011 -0.946 -7.217 1.00 0.00 C ATOM 789 C PRO A 183 -12.938 -0.204 -6.418 1.00 0.00 C ATOM 790 O PRO A 183 -12.614 -0.593 -5.297 1.00 0.00 O ATOM 791 CB PRO A 183 -15.423 -0.636 -6.746 1.00 0.00 C ATOM 792 CG PRO A 183 -15.858 -1.834 -5.918 1.00 0.00 C ATOM 793 CD PRO A 183 -14.880 -2.966 -6.186 1.00 0.00 C ATOM 0 HA PRO A 183 -13.867 -0.615 -8.246 1.00 0.00 H new ATOM 0 HB2 PRO A 183 -15.445 0.278 -6.152 1.00 0.00 H new ATOM 0 HB3 PRO A 183 -16.092 -0.482 -7.592 1.00 0.00 H new ATOM 0 HG2 PRO A 183 -15.868 -1.582 -4.858 1.00 0.00 H new ATOM 0 HG3 PRO A 183 -16.871 -2.134 -6.184 1.00 0.00 H new ATOM 0 HD2 PRO A 183 -14.435 -3.332 -5.261 1.00 0.00 H new ATOM 0 HD3 PRO A 183 -15.376 -3.814 -6.658 1.00 0.00 H new ATOM 801 N VAL A 184 -12.417 0.852 -7.026 1.00 0.00 N ATOM 802 CA VAL A 184 -11.387 1.652 -6.384 1.00 0.00 C ATOM 803 C VAL A 184 -12.045 2.646 -5.424 1.00 0.00 C ATOM 804 O VAL A 184 -11.452 3.024 -4.415 1.00 0.00 O ATOM 805 CB VAL A 184 -10.517 2.331 -7.443 1.00 0.00 C ATOM 806 CG1 VAL A 184 -9.530 3.306 -6.799 1.00 0.00 C ATOM 807 CG2 VAL A 184 -9.783 1.292 -8.297 1.00 0.00 C ATOM 0 H VAL A 184 -12.689 1.172 -7.956 1.00 0.00 H new ATOM 0 HA VAL A 184 -10.724 1.020 -5.794 1.00 0.00 H new ATOM 0 HB VAL A 184 -11.173 2.903 -8.099 1.00 0.00 H new ATOM 0 HG11 VAL A 184 -8.924 3.775 -7.574 1.00 0.00 H new ATOM 0 HG12 VAL A 184 -10.080 4.074 -6.254 1.00 0.00 H new ATOM 0 HG13 VAL A 184 -8.882 2.765 -6.109 1.00 0.00 H new ATOM 0 HG21 VAL A 184 -9.171 1.800 -9.042 1.00 0.00 H new ATOM 0 HG22 VAL A 184 -9.144 0.682 -7.658 1.00 0.00 H new ATOM 0 HG23 VAL A 184 -10.510 0.654 -8.799 1.00 0.00 H new ATOM 817 N PRO A 185 -13.291 3.052 -5.782 1.00 0.00 N ATOM 818 CA PRO A 185 -14.036 3.994 -4.964 1.00 0.00 C ATOM 819 C PRO A 185 -14.579 3.317 -3.704 1.00 0.00 C ATOM 820 O PRO A 185 -14.663 3.942 -2.647 1.00 0.00 O ATOM 821 CB PRO A 185 -15.131 4.526 -5.873 1.00 0.00 C ATOM 822 CG PRO A 185 -15.249 3.525 -7.012 1.00 0.00 C ATOM 823 CD PRO A 185 -14.025 2.626 -6.971 1.00 0.00 C ATOM 0 HA PRO A 185 -13.416 4.810 -4.592 1.00 0.00 H new ATOM 0 HB2 PRO A 185 -16.074 4.619 -5.335 1.00 0.00 H new ATOM 0 HB3 PRO A 185 -14.879 5.518 -6.249 1.00 0.00 H new ATOM 0 HG2 PRO A 185 -16.160 2.935 -6.909 1.00 0.00 H new ATOM 0 HG3 PRO A 185 -15.311 4.042 -7.970 1.00 0.00 H new ATOM 0 HD2 PRO A 185 -14.308 1.575 -6.906 1.00 0.00 H new ATOM 0 HD3 PRO A 185 -13.421 2.739 -7.871 1.00 0.00 H new ATOM 831 N TYR A 186 -14.935 2.050 -3.858 1.00 0.00 N ATOM 832 CA TYR A 186 -15.468 1.283 -2.747 1.00 0.00 C ATOM 833 C TYR A 186 -14.342 0.729 -1.872 1.00 0.00 C ATOM 834 O TYR A 186 -14.583 -0.093 -0.989 1.00 0.00 O ATOM 835 CB TYR A 186 -16.234 0.114 -3.371 1.00 0.00 C ATOM 836 CG TYR A 186 -17.667 -0.036 -2.857 1.00 0.00 C ATOM 837 CD1 TYR A 186 -18.672 0.758 -3.373 1.00 0.00 C ATOM 838 CD2 TYR A 186 -17.956 -0.963 -1.877 1.00 0.00 C ATOM 839 CE1 TYR A 186 -20.021 0.617 -2.889 1.00 0.00 C ATOM 840 CE2 TYR A 186 -19.304 -1.105 -1.393 1.00 0.00 C ATOM 841 CZ TYR A 186 -20.270 -0.307 -1.923 1.00 0.00 C ATOM 842 OH TYR A 186 -21.545 -0.440 -1.466 1.00 0.00 O ATOM 0 H TYR A 186 -14.864 1.536 -4.736 1.00 0.00 H new ATOM 0 HA TYR A 186 -16.100 1.909 -2.117 1.00 0.00 H new ATOM 0 HB2 TYR A 186 -16.259 0.245 -4.453 1.00 0.00 H new ATOM 0 HB3 TYR A 186 -15.690 -0.810 -3.175 1.00 0.00 H new ATOM 0 HD1 TYR A 186 -18.446 1.485 -4.139 1.00 0.00 H new ATOM 0 HD2 TYR A 186 -17.170 -1.583 -1.472 1.00 0.00 H new ATOM 0 HE1 TYR A 186 -20.817 1.231 -3.284 1.00 0.00 H new ATOM 0 HE2 TYR A 186 -19.543 -1.828 -0.627 1.00 0.00 H new ATOM 0 HH TYR A 186 -21.575 -1.138 -0.779 1.00 0.00 H new ATOM 852 N VAL A 187 -13.135 1.202 -2.148 1.00 0.00 N ATOM 853 CA VAL A 187 -11.970 0.764 -1.397 1.00 0.00 C ATOM 854 C VAL A 187 -11.093 1.975 -1.073 1.00 0.00 C ATOM 855 O VAL A 187 -11.334 3.072 -1.574 1.00 0.00 O ATOM 856 CB VAL A 187 -11.225 -0.323 -2.174 1.00 0.00 C ATOM 857 CG1 VAL A 187 -12.113 -1.551 -2.388 1.00 0.00 C ATOM 858 CG2 VAL A 187 -10.704 0.215 -3.507 1.00 0.00 C ATOM 0 H VAL A 187 -12.939 1.884 -2.881 1.00 0.00 H new ATOM 0 HA VAL A 187 -12.272 0.318 -0.449 1.00 0.00 H new ATOM 0 HB VAL A 187 -10.366 -0.631 -1.578 1.00 0.00 H new ATOM 0 HG11 VAL A 187 -11.559 -2.308 -2.943 1.00 0.00 H new ATOM 0 HG12 VAL A 187 -12.413 -1.956 -1.422 1.00 0.00 H new ATOM 0 HG13 VAL A 187 -13.000 -1.264 -2.952 1.00 0.00 H new ATOM 0 HG21 VAL A 187 -10.178 -0.578 -4.039 1.00 0.00 H new ATOM 0 HG22 VAL A 187 -11.542 0.564 -4.111 1.00 0.00 H new ATOM 0 HG23 VAL A 187 -10.020 1.043 -3.323 1.00 0.00 H new ATOM 868 N GLU A 188 -10.093 1.735 -0.238 1.00 0.00 N ATOM 869 CA GLU A 188 -9.178 2.792 0.158 1.00 0.00 C ATOM 870 C GLU A 188 -7.731 2.302 0.073 1.00 0.00 C ATOM 871 O GLU A 188 -7.483 1.101 -0.023 1.00 0.00 O ATOM 872 CB GLU A 188 -9.503 3.300 1.565 1.00 0.00 C ATOM 873 CG GLU A 188 -9.033 2.306 2.628 1.00 0.00 C ATOM 874 CD GLU A 188 -8.974 2.965 4.007 1.00 0.00 C ATOM 875 OE1 GLU A 188 -8.774 4.198 4.038 1.00 0.00 O ATOM 876 OE2 GLU A 188 -9.130 2.221 5.000 1.00 0.00 O ATOM 0 H GLU A 188 -9.896 0.824 0.175 1.00 0.00 H new ATOM 0 HA GLU A 188 -9.299 3.627 -0.532 1.00 0.00 H new ATOM 0 HB2 GLU A 188 -9.023 4.265 1.727 1.00 0.00 H new ATOM 0 HB3 GLU A 188 -10.577 3.458 1.659 1.00 0.00 H new ATOM 0 HG2 GLU A 188 -9.710 1.452 2.658 1.00 0.00 H new ATOM 0 HG3 GLU A 188 -8.048 1.922 2.362 1.00 0.00 H new ATOM 883 N LYS A 189 -6.814 3.257 0.111 1.00 0.00 N ATOM 884 CA LYS A 189 -5.399 2.939 0.038 1.00 0.00 C ATOM 885 C LYS A 189 -4.870 2.663 1.448 1.00 0.00 C ATOM 886 O LYS A 189 -4.790 3.570 2.274 1.00 0.00 O ATOM 887 CB LYS A 189 -4.637 4.042 -0.699 1.00 0.00 C ATOM 888 CG LYS A 189 -4.861 5.401 -0.034 1.00 0.00 C ATOM 889 CD LYS A 189 -5.738 6.302 -0.907 1.00 0.00 C ATOM 890 CE LYS A 189 -5.152 7.713 -0.999 1.00 0.00 C ATOM 891 NZ LYS A 189 -5.131 8.173 -2.405 1.00 0.00 N ATOM 0 H LYS A 189 -7.024 4.252 0.191 1.00 0.00 H new ATOM 0 HA LYS A 189 -5.243 2.032 -0.546 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -3.572 3.809 -0.709 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -4.964 4.083 -1.738 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -5.333 5.260 0.938 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -3.901 5.885 0.145 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -5.825 5.874 -1.906 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -6.745 6.349 -0.492 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -5.744 8.400 -0.394 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -4.141 7.721 -0.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -4.731 9.132 -2.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -4.547 7.527 -2.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -6.101 8.184 -2.781 1.00 0.00 H new ATOM 905 N TYR A 190 -4.521 1.406 1.679 1.00 0.00 N ATOM 906 CA TYR A 190 -4.003 0.999 2.974 1.00 0.00 C ATOM 907 C TYR A 190 -2.748 1.795 3.337 1.00 0.00 C ATOM 908 O TYR A 190 -2.438 1.971 4.515 1.00 0.00 O ATOM 909 CB TYR A 190 -3.631 -0.479 2.834 1.00 0.00 C ATOM 910 CG TYR A 190 -2.154 -0.722 2.521 1.00 0.00 C ATOM 911 CD1 TYR A 190 -1.661 -0.452 1.260 1.00 0.00 C ATOM 912 CD2 TYR A 190 -1.313 -1.212 3.500 1.00 0.00 C ATOM 913 CE1 TYR A 190 -0.271 -0.681 0.966 1.00 0.00 C ATOM 914 CE2 TYR A 190 0.078 -1.441 3.205 1.00 0.00 C ATOM 915 CZ TYR A 190 0.531 -1.164 1.954 1.00 0.00 C ATOM 916 OH TYR A 190 1.844 -1.380 1.675 1.00 0.00 O ATOM 0 H TYR A 190 -4.587 0.656 0.991 1.00 0.00 H new ATOM 0 HA TYR A 190 -4.743 1.172 3.755 1.00 0.00 H new ATOM 0 HB2 TYR A 190 -3.886 -0.996 3.759 1.00 0.00 H new ATOM 0 HB3 TYR A 190 -4.237 -0.922 2.044 1.00 0.00 H new ATOM 0 HD1 TYR A 190 -2.319 -0.069 0.494 1.00 0.00 H new ATOM 0 HD2 TYR A 190 -1.698 -1.424 4.487 1.00 0.00 H new ATOM 0 HE1 TYR A 190 0.127 -0.474 -0.017 1.00 0.00 H new ATOM 0 HE2 TYR A 190 0.747 -1.825 3.962 1.00 0.00 H new ATOM 0 HH TYR A 190 2.296 -1.724 2.474 1.00 0.00 H new