USER MOD reduce.3.24.130724 H: found=0, std=0, add=398, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 400 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 X(o=0,f=0) USER MOD Single : A 171 ASN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 175 SER OG : rot 180:sc= 0 USER MOD Single : A 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 181 MET CE :methyl -112:sc= -1.62 (180deg=-2.66!) USER MOD Single : A 186 TYR OH : rot -85:sc= 0.261 USER MOD Single : A 189 LYS NZ :NH3+ 169:sc= 0.355 (180deg=-0.0479!) USER MOD ----------------------------------------------------------------- ATOM 26 N TYR A 136 4.817 3.625 -0.203 1.00 0.00 N ATOM 27 CA TYR A 136 5.921 4.085 0.622 1.00 0.00 C ATOM 28 C TYR A 136 6.438 2.962 1.522 1.00 0.00 C ATOM 29 O TYR A 136 5.667 2.343 2.254 1.00 0.00 O ATOM 30 CB TYR A 136 5.355 5.205 1.497 1.00 0.00 C ATOM 31 CG TYR A 136 5.756 6.611 1.045 1.00 0.00 C ATOM 32 CD1 TYR A 136 5.261 7.122 -0.138 1.00 0.00 C ATOM 33 CD2 TYR A 136 6.612 7.367 1.819 1.00 0.00 C ATOM 34 CE1 TYR A 136 5.638 8.446 -0.563 1.00 0.00 C ATOM 35 CE2 TYR A 136 6.988 8.690 1.394 1.00 0.00 C ATOM 36 CZ TYR A 136 6.483 9.164 0.224 1.00 0.00 C ATOM 37 OH TYR A 136 6.840 10.413 -0.178 1.00 0.00 O ATOM 0 HA TYR A 136 6.751 4.419 0.000 1.00 0.00 H new ATOM 0 HB2 TYR A 136 4.267 5.133 1.503 1.00 0.00 H new ATOM 0 HB3 TYR A 136 5.690 5.055 2.523 1.00 0.00 H new ATOM 0 HD1 TYR A 136 4.592 6.530 -0.744 1.00 0.00 H new ATOM 0 HD2 TYR A 136 7.000 6.966 2.744 1.00 0.00 H new ATOM 0 HE1 TYR A 136 5.258 8.859 -1.486 1.00 0.00 H new ATOM 0 HE2 TYR A 136 7.656 9.293 1.991 1.00 0.00 H new ATOM 0 HH TYR A 136 7.447 10.808 0.482 1.00 0.00 H new ATOM 47 N VAL A 137 7.741 2.732 1.440 1.00 0.00 N ATOM 48 CA VAL A 137 8.370 1.695 2.239 1.00 0.00 C ATOM 49 C VAL A 137 9.776 2.148 2.639 1.00 0.00 C ATOM 50 O VAL A 137 10.440 2.860 1.888 1.00 0.00 O ATOM 51 CB VAL A 137 8.364 0.370 1.474 1.00 0.00 C ATOM 52 CG1 VAL A 137 6.942 -0.177 1.337 1.00 0.00 C ATOM 53 CG2 VAL A 137 9.027 0.525 0.103 1.00 0.00 C ATOM 0 H VAL A 137 8.378 3.247 0.832 1.00 0.00 H new ATOM 0 HA VAL A 137 7.809 1.527 3.158 1.00 0.00 H new ATOM 0 HB VAL A 137 8.946 -0.351 2.048 1.00 0.00 H new ATOM 0 HG11 VAL A 137 6.966 -1.119 0.789 1.00 0.00 H new ATOM 0 HG12 VAL A 137 6.519 -0.344 2.328 1.00 0.00 H new ATOM 0 HG13 VAL A 137 6.326 0.542 0.796 1.00 0.00 H new ATOM 0 HG21 VAL A 137 9.009 -0.431 -0.420 1.00 0.00 H new ATOM 0 HG22 VAL A 137 8.485 1.268 -0.481 1.00 0.00 H new ATOM 0 HG23 VAL A 137 10.060 0.849 0.233 1.00 0.00 H new ATOM 63 N ARG A 138 10.188 1.716 3.823 1.00 0.00 N ATOM 64 CA ARG A 138 11.502 2.068 4.332 1.00 0.00 C ATOM 65 C ARG A 138 12.266 0.808 4.745 1.00 0.00 C ATOM 66 O ARG A 138 11.703 -0.084 5.378 1.00 0.00 O ATOM 67 CB ARG A 138 11.393 3.008 5.534 1.00 0.00 C ATOM 68 CG ARG A 138 10.768 2.293 6.733 1.00 0.00 C ATOM 69 CD ARG A 138 9.701 3.167 7.397 1.00 0.00 C ATOM 70 NE ARG A 138 8.380 2.502 7.315 1.00 0.00 N ATOM 71 CZ ARG A 138 7.618 2.212 8.379 1.00 0.00 C ATOM 72 NH1 ARG A 138 8.041 2.527 9.611 1.00 0.00 N ATOM 73 NH2 ARG A 138 6.434 1.608 8.210 1.00 0.00 N ATOM 0 H ARG A 138 9.634 1.126 4.444 1.00 0.00 H new ATOM 0 HA ARG A 138 12.041 2.579 3.534 1.00 0.00 H new ATOM 0 HB2 ARG A 138 12.383 3.378 5.802 1.00 0.00 H new ATOM 0 HB3 ARG A 138 10.789 3.876 5.268 1.00 0.00 H new ATOM 0 HG2 ARG A 138 10.323 1.352 6.409 1.00 0.00 H new ATOM 0 HG3 ARG A 138 11.543 2.045 7.458 1.00 0.00 H new ATOM 0 HD2 ARG A 138 9.963 3.346 8.440 1.00 0.00 H new ATOM 0 HD3 ARG A 138 9.659 4.140 6.907 1.00 0.00 H new ATOM 0 HE ARG A 138 8.028 2.249 6.392 1.00 0.00 H new ATOM 0 HH11 ARG A 138 8.942 2.987 9.739 1.00 0.00 H new ATOM 0 HH12 ARG A 138 7.462 2.307 10.421 1.00 0.00 H new ATOM 0 HH21 ARG A 138 6.113 1.369 7.272 1.00 0.00 H new ATOM 0 HH22 ARG A 138 5.854 1.387 9.019 1.00 0.00 H new ATOM 87 N ALA A 139 13.536 0.775 4.371 1.00 0.00 N ATOM 88 CA ALA A 139 14.383 -0.361 4.694 1.00 0.00 C ATOM 89 C ALA A 139 15.081 -0.105 6.032 1.00 0.00 C ATOM 90 O ALA A 139 15.544 1.004 6.292 1.00 0.00 O ATOM 91 CB ALA A 139 15.375 -0.599 3.555 1.00 0.00 C ATOM 0 H ALA A 139 14.000 1.517 3.847 1.00 0.00 H new ATOM 0 HA ALA A 139 13.787 -1.267 4.800 1.00 0.00 H new ATOM 0 HB1 ALA A 139 16.010 -1.451 3.798 1.00 0.00 H new ATOM 0 HB2 ALA A 139 14.829 -0.804 2.634 1.00 0.00 H new ATOM 0 HB3 ALA A 139 15.994 0.288 3.420 1.00 0.00 H new ATOM 97 N LEU A 140 15.135 -1.151 6.844 1.00 0.00 N ATOM 98 CA LEU A 140 15.769 -1.054 8.147 1.00 0.00 C ATOM 99 C LEU A 140 16.846 -2.134 8.268 1.00 0.00 C ATOM 100 O LEU A 140 17.260 -2.483 9.372 1.00 0.00 O ATOM 101 CB LEU A 140 14.718 -1.107 9.259 1.00 0.00 C ATOM 102 CG LEU A 140 13.290 -0.742 8.850 1.00 0.00 C ATOM 103 CD1 LEU A 140 12.543 -1.966 8.316 1.00 0.00 C ATOM 104 CD2 LEU A 140 12.542 -0.073 10.006 1.00 0.00 C ATOM 0 H LEU A 140 14.750 -2.070 6.624 1.00 0.00 H new ATOM 0 HA LEU A 140 16.269 -0.091 8.256 1.00 0.00 H new ATOM 0 HB2 LEU A 140 14.709 -2.114 9.676 1.00 0.00 H new ATOM 0 HB3 LEU A 140 15.029 -0.434 10.058 1.00 0.00 H new ATOM 0 HG LEU A 140 13.342 -0.017 8.038 1.00 0.00 H new ATOM 0 HD11 LEU A 140 11.530 -1.679 8.032 1.00 0.00 H new ATOM 0 HD12 LEU A 140 13.066 -2.360 7.445 1.00 0.00 H new ATOM 0 HD13 LEU A 140 12.500 -2.732 9.090 1.00 0.00 H new ATOM 0 HD21 LEU A 140 11.530 0.176 9.688 1.00 0.00 H new ATOM 0 HD22 LEU A 140 12.498 -0.756 10.855 1.00 0.00 H new ATOM 0 HD23 LEU A 140 13.065 0.837 10.299 1.00 0.00 H new ATOM 116 N PHE A 141 17.268 -2.634 7.116 1.00 0.00 N ATOM 117 CA PHE A 141 18.289 -3.668 7.078 1.00 0.00 C ATOM 118 C PHE A 141 19.340 -3.362 6.008 1.00 0.00 C ATOM 119 O PHE A 141 20.331 -4.079 5.883 1.00 0.00 O ATOM 120 CB PHE A 141 17.585 -4.979 6.725 1.00 0.00 C ATOM 121 CG PHE A 141 17.982 -6.157 7.617 1.00 0.00 C ATOM 122 CD1 PHE A 141 19.248 -6.650 7.570 1.00 0.00 C ATOM 123 CD2 PHE A 141 17.067 -6.711 8.458 1.00 0.00 C ATOM 124 CE1 PHE A 141 19.615 -7.745 8.398 1.00 0.00 C ATOM 125 CE2 PHE A 141 17.434 -7.804 9.286 1.00 0.00 C ATOM 126 CZ PHE A 141 18.700 -8.298 9.239 1.00 0.00 C ATOM 0 H PHE A 141 16.922 -2.343 6.202 1.00 0.00 H new ATOM 0 HA PHE A 141 18.796 -3.726 8.041 1.00 0.00 H new ATOM 0 HB2 PHE A 141 16.507 -4.831 6.794 1.00 0.00 H new ATOM 0 HB3 PHE A 141 17.806 -5.231 5.688 1.00 0.00 H new ATOM 0 HD1 PHE A 141 19.975 -6.210 6.903 1.00 0.00 H new ATOM 0 HD2 PHE A 141 16.061 -6.319 8.496 1.00 0.00 H new ATOM 0 HE1 PHE A 141 20.620 -8.138 8.360 1.00 0.00 H new ATOM 0 HE2 PHE A 141 16.708 -8.243 9.954 1.00 0.00 H new ATOM 0 HZ PHE A 141 18.979 -9.129 9.869 1.00 0.00 H new ATOM 136 N ASP A 142 19.086 -2.296 5.263 1.00 0.00 N ATOM 137 CA ASP A 142 19.996 -1.886 4.207 1.00 0.00 C ATOM 138 C ASP A 142 20.233 -3.063 3.258 1.00 0.00 C ATOM 139 O ASP A 142 19.941 -4.209 3.600 1.00 0.00 O ATOM 140 CB ASP A 142 21.351 -1.464 4.782 1.00 0.00 C ATOM 141 CG ASP A 142 22.537 -1.631 3.830 1.00 0.00 C ATOM 142 OD1 ASP A 142 22.750 -0.703 3.019 1.00 0.00 O ATOM 143 OD2 ASP A 142 23.204 -2.683 3.935 1.00 0.00 O ATOM 0 H ASP A 142 18.263 -1.704 5.370 1.00 0.00 H new ATOM 0 HA ASP A 142 19.546 -1.043 3.683 1.00 0.00 H new ATOM 0 HB2 ASP A 142 21.291 -0.418 5.084 1.00 0.00 H new ATOM 0 HB3 ASP A 142 21.543 -2.046 5.684 1.00 0.00 H new ATOM 148 N PHE A 143 20.758 -2.741 2.086 1.00 0.00 N ATOM 149 CA PHE A 143 21.036 -3.757 1.085 1.00 0.00 C ATOM 150 C PHE A 143 22.030 -3.243 0.042 1.00 0.00 C ATOM 151 O PHE A 143 22.882 -3.993 -0.431 1.00 0.00 O ATOM 152 CB PHE A 143 19.710 -4.077 0.393 1.00 0.00 C ATOM 153 CG PHE A 143 19.867 -4.732 -0.982 1.00 0.00 C ATOM 154 CD1 PHE A 143 20.178 -3.969 -2.065 1.00 0.00 C ATOM 155 CD2 PHE A 143 19.697 -6.074 -1.120 1.00 0.00 C ATOM 156 CE1 PHE A 143 20.324 -4.576 -3.341 1.00 0.00 C ATOM 157 CE2 PHE A 143 19.844 -6.680 -2.396 1.00 0.00 C ATOM 158 CZ PHE A 143 20.154 -5.918 -3.479 1.00 0.00 C ATOM 0 H PHE A 143 20.999 -1.790 1.806 1.00 0.00 H new ATOM 0 HA PHE A 143 21.471 -4.637 1.559 1.00 0.00 H new ATOM 0 HB2 PHE A 143 19.128 -4.738 1.035 1.00 0.00 H new ATOM 0 HB3 PHE A 143 19.138 -3.156 0.282 1.00 0.00 H new ATOM 0 HD1 PHE A 143 20.314 -2.903 -1.955 1.00 0.00 H new ATOM 0 HD2 PHE A 143 19.450 -6.679 -0.260 1.00 0.00 H new ATOM 0 HE1 PHE A 143 20.570 -3.972 -4.202 1.00 0.00 H new ATOM 0 HE2 PHE A 143 19.710 -7.746 -2.506 1.00 0.00 H new ATOM 0 HZ PHE A 143 20.265 -6.379 -4.449 1.00 0.00 H new ATOM 245 N ASP A 150 18.481 -4.816 -7.994 1.00 0.00 N ATOM 246 CA ASP A 150 17.625 -4.427 -6.886 1.00 0.00 C ATOM 247 C ASP A 150 17.937 -2.983 -6.489 1.00 0.00 C ATOM 248 O ASP A 150 19.026 -2.480 -6.764 1.00 0.00 O ATOM 249 CB ASP A 150 17.869 -5.316 -5.664 1.00 0.00 C ATOM 250 CG ASP A 150 17.612 -6.807 -5.888 1.00 0.00 C ATOM 251 OD1 ASP A 150 16.466 -7.135 -6.262 1.00 0.00 O ATOM 252 OD2 ASP A 150 18.569 -7.585 -5.681 1.00 0.00 O ATOM 0 HA ASP A 150 16.589 -4.531 -7.207 1.00 0.00 H new ATOM 0 HB2 ASP A 150 18.901 -5.185 -5.339 1.00 0.00 H new ATOM 0 HB3 ASP A 150 17.232 -4.971 -4.850 1.00 0.00 H new ATOM 257 N LEU A 151 16.962 -2.355 -5.848 1.00 0.00 N ATOM 258 CA LEU A 151 17.118 -0.978 -5.410 1.00 0.00 C ATOM 259 C LEU A 151 17.983 -0.943 -4.149 1.00 0.00 C ATOM 260 O LEU A 151 17.625 -1.531 -3.129 1.00 0.00 O ATOM 261 CB LEU A 151 15.752 -0.312 -5.238 1.00 0.00 C ATOM 262 CG LEU A 151 15.675 0.800 -4.189 1.00 0.00 C ATOM 263 CD1 LEU A 151 16.814 1.805 -4.371 1.00 0.00 C ATOM 264 CD2 LEU A 151 14.303 1.477 -4.207 1.00 0.00 C ATOM 0 H LEU A 151 16.060 -2.775 -5.621 1.00 0.00 H new ATOM 0 HA LEU A 151 17.638 -0.394 -6.169 1.00 0.00 H new ATOM 0 HB2 LEU A 151 15.448 0.101 -6.200 1.00 0.00 H new ATOM 0 HB3 LEU A 151 15.025 -1.081 -4.977 1.00 0.00 H new ATOM 0 HG LEU A 151 15.798 0.350 -3.204 1.00 0.00 H new ATOM 0 HD11 LEU A 151 16.736 2.585 -3.613 1.00 0.00 H new ATOM 0 HD12 LEU A 151 17.771 1.293 -4.268 1.00 0.00 H new ATOM 0 HD13 LEU A 151 16.748 2.254 -5.362 1.00 0.00 H new ATOM 0 HD21 LEU A 151 14.275 2.263 -3.452 1.00 0.00 H new ATOM 0 HD22 LEU A 151 14.125 1.912 -5.190 1.00 0.00 H new ATOM 0 HD23 LEU A 151 13.530 0.739 -3.991 1.00 0.00 H new ATOM 276 N PRO A 152 19.135 -0.231 -4.262 1.00 0.00 N ATOM 277 CA PRO A 152 20.055 -0.111 -3.143 1.00 0.00 C ATOM 278 C PRO A 152 19.516 0.860 -2.092 1.00 0.00 C ATOM 279 O PRO A 152 19.262 2.026 -2.391 1.00 0.00 O ATOM 280 CB PRO A 152 21.367 0.347 -3.758 1.00 0.00 C ATOM 281 CG PRO A 152 21.011 0.914 -5.123 1.00 0.00 C ATOM 282 CD PRO A 152 19.593 0.479 -5.454 1.00 0.00 C ATOM 0 HA PRO A 152 20.189 -1.051 -2.607 1.00 0.00 H new ATOM 0 HB2 PRO A 152 21.848 1.101 -3.135 1.00 0.00 H new ATOM 0 HB3 PRO A 152 22.066 -0.484 -3.850 1.00 0.00 H new ATOM 0 HG2 PRO A 152 21.085 2.001 -5.115 1.00 0.00 H new ATOM 0 HG3 PRO A 152 21.707 0.553 -5.880 1.00 0.00 H new ATOM 0 HD2 PRO A 152 18.957 1.336 -5.673 1.00 0.00 H new ATOM 0 HD3 PRO A 152 19.572 -0.166 -6.332 1.00 0.00 H new ATOM 290 N PHE A 153 19.356 0.345 -0.881 1.00 0.00 N ATOM 291 CA PHE A 153 18.851 1.153 0.216 1.00 0.00 C ATOM 292 C PHE A 153 19.680 0.933 1.484 1.00 0.00 C ATOM 293 O PHE A 153 20.504 0.023 1.541 1.00 0.00 O ATOM 294 CB PHE A 153 17.412 0.704 0.477 1.00 0.00 C ATOM 295 CG PHE A 153 17.262 -0.800 0.710 1.00 0.00 C ATOM 296 CD1 PHE A 153 17.545 -1.332 1.930 1.00 0.00 C ATOM 297 CD2 PHE A 153 16.847 -1.608 -0.302 1.00 0.00 C ATOM 298 CE1 PHE A 153 17.405 -2.728 2.147 1.00 0.00 C ATOM 299 CE2 PHE A 153 16.707 -3.004 -0.086 1.00 0.00 C ATOM 300 CZ PHE A 153 16.989 -3.535 1.134 1.00 0.00 C ATOM 0 H PHE A 153 19.567 -0.622 -0.636 1.00 0.00 H new ATOM 0 HA PHE A 153 18.906 2.210 -0.044 1.00 0.00 H new ATOM 0 HB2 PHE A 153 17.029 1.236 1.348 1.00 0.00 H new ATOM 0 HB3 PHE A 153 16.792 0.993 -0.372 1.00 0.00 H new ATOM 0 HD1 PHE A 153 17.876 -0.692 2.734 1.00 0.00 H new ATOM 0 HD2 PHE A 153 16.624 -1.187 -1.271 1.00 0.00 H new ATOM 0 HE1 PHE A 153 17.629 -3.149 3.116 1.00 0.00 H new ATOM 0 HE2 PHE A 153 16.377 -3.644 -0.890 1.00 0.00 H new ATOM 0 HZ PHE A 153 16.883 -4.597 1.298 1.00 0.00 H new ATOM 310 N LYS A 154 19.431 1.784 2.468 1.00 0.00 N ATOM 311 CA LYS A 154 20.144 1.696 3.732 1.00 0.00 C ATOM 312 C LYS A 154 19.186 1.200 4.819 1.00 0.00 C ATOM 313 O LYS A 154 17.996 1.020 4.566 1.00 0.00 O ATOM 314 CB LYS A 154 20.814 3.030 4.065 1.00 0.00 C ATOM 315 CG LYS A 154 22.195 2.810 4.683 1.00 0.00 C ATOM 316 CD LYS A 154 22.259 3.382 6.101 1.00 0.00 C ATOM 317 CE LYS A 154 23.243 2.593 6.967 1.00 0.00 C ATOM 318 NZ LYS A 154 23.434 3.260 8.274 1.00 0.00 N ATOM 0 H LYS A 154 18.746 2.538 2.416 1.00 0.00 H new ATOM 0 HA LYS A 154 20.953 0.969 3.663 1.00 0.00 H new ATOM 0 HB2 LYS A 154 20.908 3.630 3.160 1.00 0.00 H new ATOM 0 HB3 LYS A 154 20.188 3.593 4.757 1.00 0.00 H new ATOM 0 HG2 LYS A 154 22.421 1.744 4.707 1.00 0.00 H new ATOM 0 HG3 LYS A 154 22.955 3.283 4.061 1.00 0.00 H new ATOM 0 HD2 LYS A 154 22.562 4.428 6.061 1.00 0.00 H new ATOM 0 HD3 LYS A 154 21.268 3.354 6.553 1.00 0.00 H new ATOM 0 HE2 LYS A 154 22.871 1.580 7.120 1.00 0.00 H new ATOM 0 HE3 LYS A 154 24.200 2.506 6.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 24.105 2.711 8.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 23.810 4.218 8.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 22.522 3.320 8.770 1.00 0.00 H new ATOM 332 N LYS A 155 19.742 0.994 6.003 1.00 0.00 N ATOM 333 CA LYS A 155 18.953 0.523 7.129 1.00 0.00 C ATOM 334 C LYS A 155 18.164 1.694 7.718 1.00 0.00 C ATOM 335 O LYS A 155 18.594 2.309 8.692 1.00 0.00 O ATOM 336 CB LYS A 155 19.844 -0.192 8.146 1.00 0.00 C ATOM 337 CG LYS A 155 20.817 0.787 8.808 1.00 0.00 C ATOM 338 CD LYS A 155 20.700 0.729 10.332 1.00 0.00 C ATOM 339 CE LYS A 155 19.298 1.137 10.791 1.00 0.00 C ATOM 340 NZ LYS A 155 19.064 0.703 12.187 1.00 0.00 N ATOM 0 H LYS A 155 20.730 1.145 6.208 1.00 0.00 H new ATOM 0 HA LYS A 155 18.225 -0.219 6.801 1.00 0.00 H new ATOM 0 HB2 LYS A 155 19.225 -0.666 8.908 1.00 0.00 H new ATOM 0 HB3 LYS A 155 20.403 -0.986 7.650 1.00 0.00 H new ATOM 0 HG2 LYS A 155 21.838 0.549 8.509 1.00 0.00 H new ATOM 0 HG3 LYS A 155 20.611 1.800 8.462 1.00 0.00 H new ATOM 0 HD2 LYS A 155 20.921 -0.280 10.679 1.00 0.00 H new ATOM 0 HD3 LYS A 155 21.441 1.390 10.782 1.00 0.00 H new ATOM 0 HE2 LYS A 155 19.185 2.218 10.716 1.00 0.00 H new ATOM 0 HE3 LYS A 155 18.550 0.692 10.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 18.109 0.987 12.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 19.152 -0.331 12.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 19.767 1.148 12.811 1.00 0.00 H new ATOM 354 N GLY A 156 17.022 1.966 7.102 1.00 0.00 N ATOM 355 CA GLY A 156 16.169 3.052 7.553 1.00 0.00 C ATOM 356 C GLY A 156 15.938 4.069 6.434 1.00 0.00 C ATOM 357 O GLY A 156 15.636 5.232 6.699 1.00 0.00 O ATOM 0 H GLY A 156 16.668 1.453 6.295 1.00 0.00 H new ATOM 0 HA2 GLY A 156 15.212 2.652 7.889 1.00 0.00 H new ATOM 0 HA3 GLY A 156 16.626 3.547 8.410 1.00 0.00 H new ATOM 361 N ASP A 157 16.089 3.594 5.207 1.00 0.00 N ATOM 362 CA ASP A 157 15.900 4.448 4.046 1.00 0.00 C ATOM 363 C ASP A 157 14.414 4.492 3.685 1.00 0.00 C ATOM 364 O ASP A 157 13.656 3.595 4.054 1.00 0.00 O ATOM 365 CB ASP A 157 16.663 3.908 2.835 1.00 0.00 C ATOM 366 CG ASP A 157 16.456 4.691 1.537 1.00 0.00 C ATOM 367 OD1 ASP A 157 16.112 5.888 1.645 1.00 0.00 O ATOM 368 OD2 ASP A 157 16.647 4.075 0.466 1.00 0.00 O ATOM 0 H ASP A 157 16.340 2.629 4.991 1.00 0.00 H new ATOM 0 HA ASP A 157 16.273 5.441 4.295 1.00 0.00 H new ATOM 0 HB2 ASP A 157 17.727 3.899 3.070 1.00 0.00 H new ATOM 0 HB3 ASP A 157 16.364 2.873 2.669 1.00 0.00 H new ATOM 373 N ILE A 158 14.040 5.542 2.971 1.00 0.00 N ATOM 374 CA ILE A 158 12.658 5.714 2.558 1.00 0.00 C ATOM 375 C ILE A 158 12.558 5.538 1.042 1.00 0.00 C ATOM 376 O ILE A 158 13.431 5.990 0.301 1.00 0.00 O ATOM 377 CB ILE A 158 12.113 7.054 3.058 1.00 0.00 C ATOM 378 CG1 ILE A 158 11.984 7.058 4.583 1.00 0.00 C ATOM 379 CG2 ILE A 158 10.789 7.397 2.371 1.00 0.00 C ATOM 380 CD1 ILE A 158 10.730 6.303 5.031 1.00 0.00 C ATOM 0 H ILE A 158 14.671 6.284 2.667 1.00 0.00 H new ATOM 0 HA ILE A 158 12.027 4.949 3.011 1.00 0.00 H new ATOM 0 HB ILE A 158 12.826 7.834 2.792 1.00 0.00 H new ATOM 0 HG12 ILE A 158 12.867 6.599 5.027 1.00 0.00 H new ATOM 0 HG13 ILE A 158 11.943 8.085 4.945 1.00 0.00 H new ATOM 0 HG21 ILE A 158 10.423 8.354 2.744 1.00 0.00 H new ATOM 0 HG22 ILE A 158 10.944 7.463 1.294 1.00 0.00 H new ATOM 0 HG23 ILE A 158 10.056 6.619 2.585 1.00 0.00 H new ATOM 0 HD11 ILE A 158 10.663 6.322 6.119 1.00 0.00 H new ATOM 0 HD12 ILE A 158 9.847 6.779 4.605 1.00 0.00 H new ATOM 0 HD13 ILE A 158 10.786 5.270 4.689 1.00 0.00 H new ATOM 392 N LEU A 159 11.487 4.880 0.624 1.00 0.00 N ATOM 393 CA LEU A 159 11.261 4.638 -0.791 1.00 0.00 C ATOM 394 C LEU A 159 9.756 4.579 -1.060 1.00 0.00 C ATOM 395 O LEU A 159 8.951 4.859 -0.172 1.00 0.00 O ATOM 396 CB LEU A 159 12.017 3.389 -1.248 1.00 0.00 C ATOM 397 CG LEU A 159 12.856 2.684 -0.180 1.00 0.00 C ATOM 398 CD1 LEU A 159 12.823 1.167 -0.370 1.00 0.00 C ATOM 399 CD2 LEU A 159 14.286 3.229 -0.159 1.00 0.00 C ATOM 0 H LEU A 159 10.766 4.507 1.241 1.00 0.00 H new ATOM 0 HA LEU A 159 11.659 5.459 -1.387 1.00 0.00 H new ATOM 0 HB2 LEU A 159 11.294 2.675 -1.643 1.00 0.00 H new ATOM 0 HB3 LEU A 159 12.674 3.667 -2.072 1.00 0.00 H new ATOM 0 HG LEU A 159 12.417 2.895 0.795 1.00 0.00 H new ATOM 0 HD11 LEU A 159 13.427 0.690 0.402 1.00 0.00 H new ATOM 0 HD12 LEU A 159 11.795 0.813 -0.296 1.00 0.00 H new ATOM 0 HD13 LEU A 159 13.224 0.914 -1.352 1.00 0.00 H new ATOM 0 HD21 LEU A 159 14.861 2.711 0.609 1.00 0.00 H new ATOM 0 HD22 LEU A 159 14.751 3.068 -1.132 1.00 0.00 H new ATOM 0 HD23 LEU A 159 14.265 4.296 0.061 1.00 0.00 H new ATOM 411 N ARG A 160 9.421 4.215 -2.289 1.00 0.00 N ATOM 412 CA ARG A 160 8.026 4.116 -2.686 1.00 0.00 C ATOM 413 C ARG A 160 7.802 2.856 -3.524 1.00 0.00 C ATOM 414 O ARG A 160 8.737 2.331 -4.126 1.00 0.00 O ATOM 415 CB ARG A 160 7.597 5.341 -3.495 1.00 0.00 C ATOM 416 CG ARG A 160 7.514 6.584 -2.607 1.00 0.00 C ATOM 417 CD ARG A 160 8.573 7.614 -3.005 1.00 0.00 C ATOM 418 NE ARG A 160 8.119 8.373 -4.191 1.00 0.00 N ATOM 419 CZ ARG A 160 8.911 9.169 -4.922 1.00 0.00 C ATOM 420 NH1 ARG A 160 10.202 9.315 -4.592 1.00 0.00 N ATOM 421 NH2 ARG A 160 8.412 9.820 -5.982 1.00 0.00 N ATOM 0 H ARG A 160 10.091 3.985 -3.023 1.00 0.00 H new ATOM 0 HA ARG A 160 7.425 4.065 -1.778 1.00 0.00 H new ATOM 0 HB2 ARG A 160 8.307 5.514 -4.303 1.00 0.00 H new ATOM 0 HB3 ARG A 160 6.628 5.155 -3.957 1.00 0.00 H new ATOM 0 HG2 ARG A 160 6.522 7.028 -2.688 1.00 0.00 H new ATOM 0 HG3 ARG A 160 7.652 6.300 -1.564 1.00 0.00 H new ATOM 0 HD2 ARG A 160 8.759 8.296 -2.175 1.00 0.00 H new ATOM 0 HD3 ARG A 160 9.516 7.113 -3.223 1.00 0.00 H new ATOM 0 HE ARG A 160 7.142 8.285 -4.470 1.00 0.00 H new ATOM 0 HH11 ARG A 160 10.581 8.820 -3.785 1.00 0.00 H new ATOM 0 HH12 ARG A 160 10.805 9.921 -5.148 1.00 0.00 H new ATOM 0 HH21 ARG A 160 7.429 9.709 -6.232 1.00 0.00 H new ATOM 0 HH22 ARG A 160 9.015 10.426 -6.538 1.00 0.00 H new ATOM 435 N ILE A 161 6.555 2.407 -3.536 1.00 0.00 N ATOM 436 CA ILE A 161 6.195 1.218 -4.289 1.00 0.00 C ATOM 437 C ILE A 161 5.577 1.634 -5.626 1.00 0.00 C ATOM 438 O ILE A 161 4.510 2.244 -5.656 1.00 0.00 O ATOM 439 CB ILE A 161 5.295 0.305 -3.454 1.00 0.00 C ATOM 440 CG1 ILE A 161 6.027 -0.983 -3.070 1.00 0.00 C ATOM 441 CG2 ILE A 161 3.978 0.022 -4.177 1.00 0.00 C ATOM 442 CD1 ILE A 161 7.376 -0.674 -2.418 1.00 0.00 C ATOM 0 H ILE A 161 5.782 2.846 -3.036 1.00 0.00 H new ATOM 0 HA ILE A 161 7.083 0.629 -4.516 1.00 0.00 H new ATOM 0 HB ILE A 161 5.048 0.824 -2.528 1.00 0.00 H new ATOM 0 HG12 ILE A 161 5.412 -1.564 -2.383 1.00 0.00 H new ATOM 0 HG13 ILE A 161 6.180 -1.597 -3.958 1.00 0.00 H new ATOM 0 HG21 ILE A 161 3.358 -0.629 -3.561 1.00 0.00 H new ATOM 0 HG22 ILE A 161 3.453 0.960 -4.357 1.00 0.00 H new ATOM 0 HG23 ILE A 161 4.183 -0.467 -5.129 1.00 0.00 H new ATOM 0 HD11 ILE A 161 7.875 -1.607 -2.155 1.00 0.00 H new ATOM 0 HD12 ILE A 161 7.998 -0.114 -3.116 1.00 0.00 H new ATOM 0 HD13 ILE A 161 7.217 -0.081 -1.517 1.00 0.00 H new ATOM 454 N ARG A 162 6.275 1.287 -6.698 1.00 0.00 N ATOM 455 CA ARG A 162 5.808 1.617 -8.033 1.00 0.00 C ATOM 456 C ARG A 162 5.231 0.375 -8.716 1.00 0.00 C ATOM 457 O ARG A 162 4.176 0.443 -9.345 1.00 0.00 O ATOM 458 CB ARG A 162 6.943 2.181 -8.890 1.00 0.00 C ATOM 459 CG ARG A 162 7.734 1.056 -9.560 1.00 0.00 C ATOM 460 CD ARG A 162 8.873 1.619 -10.413 1.00 0.00 C ATOM 461 NE ARG A 162 9.052 0.792 -11.627 1.00 0.00 N ATOM 462 CZ ARG A 162 8.231 0.824 -12.686 1.00 0.00 C ATOM 463 NH1 ARG A 162 7.169 1.640 -12.685 1.00 0.00 N ATOM 464 NH2 ARG A 162 8.472 0.038 -13.744 1.00 0.00 N ATOM 0 H ARG A 162 7.160 0.781 -6.668 1.00 0.00 H new ATOM 0 HA ARG A 162 5.031 2.375 -7.934 1.00 0.00 H new ATOM 0 HB2 ARG A 162 6.534 2.846 -9.651 1.00 0.00 H new ATOM 0 HB3 ARG A 162 7.610 2.780 -8.269 1.00 0.00 H new ATOM 0 HG2 ARG A 162 8.140 0.389 -8.799 1.00 0.00 H new ATOM 0 HG3 ARG A 162 7.068 0.460 -10.184 1.00 0.00 H new ATOM 0 HD2 ARG A 162 8.653 2.649 -10.694 1.00 0.00 H new ATOM 0 HD3 ARG A 162 9.797 1.636 -9.835 1.00 0.00 H new ATOM 0 HE ARG A 162 9.850 0.158 -11.660 1.00 0.00 H new ATOM 0 HH11 ARG A 162 6.985 2.237 -11.879 1.00 0.00 H new ATOM 0 HH12 ARG A 162 6.544 1.665 -13.491 1.00 0.00 H new ATOM 0 HH21 ARG A 162 9.280 -0.584 -13.743 1.00 0.00 H new ATOM 0 HH22 ARG A 162 7.847 0.062 -14.550 1.00 0.00 H new ATOM 478 N ASP A 163 5.947 -0.729 -8.568 1.00 0.00 N ATOM 479 CA ASP A 163 5.520 -1.983 -9.163 1.00 0.00 C ATOM 480 C ASP A 163 5.718 -3.115 -8.152 1.00 0.00 C ATOM 481 O ASP A 163 6.399 -2.939 -7.143 1.00 0.00 O ATOM 482 CB ASP A 163 6.346 -2.313 -10.408 1.00 0.00 C ATOM 483 CG ASP A 163 5.539 -2.834 -11.599 1.00 0.00 C ATOM 484 OD1 ASP A 163 4.583 -2.130 -11.988 1.00 0.00 O ATOM 485 OD2 ASP A 163 5.899 -3.924 -12.094 1.00 0.00 O ATOM 0 H ASP A 163 6.821 -0.781 -8.044 1.00 0.00 H new ATOM 0 HA ASP A 163 4.471 -1.883 -9.442 1.00 0.00 H new ATOM 0 HB2 ASP A 163 6.884 -1.417 -10.717 1.00 0.00 H new ATOM 0 HB3 ASP A 163 7.095 -3.059 -10.142 1.00 0.00 H new ATOM 490 N LYS A 164 5.107 -4.251 -8.456 1.00 0.00 N ATOM 491 CA LYS A 164 5.208 -5.411 -7.588 1.00 0.00 C ATOM 492 C LYS A 164 4.924 -6.677 -8.398 1.00 0.00 C ATOM 493 O LYS A 164 3.782 -7.130 -8.470 1.00 0.00 O ATOM 494 CB LYS A 164 4.299 -5.247 -6.367 1.00 0.00 C ATOM 495 CG LYS A 164 4.000 -6.599 -5.719 1.00 0.00 C ATOM 496 CD LYS A 164 2.528 -6.978 -5.892 1.00 0.00 C ATOM 497 CE LYS A 164 2.036 -7.819 -4.713 1.00 0.00 C ATOM 498 NZ LYS A 164 1.408 -6.955 -3.687 1.00 0.00 N ATOM 0 H LYS A 164 4.540 -4.392 -9.292 1.00 0.00 H new ATOM 0 HA LYS A 164 6.220 -5.504 -7.195 1.00 0.00 H new ATOM 0 HB2 LYS A 164 4.776 -4.589 -5.640 1.00 0.00 H new ATOM 0 HB3 LYS A 164 3.366 -4.769 -6.666 1.00 0.00 H new ATOM 0 HG2 LYS A 164 4.632 -7.367 -6.165 1.00 0.00 H new ATOM 0 HG3 LYS A 164 4.247 -6.560 -4.658 1.00 0.00 H new ATOM 0 HD2 LYS A 164 1.924 -6.075 -5.976 1.00 0.00 H new ATOM 0 HD3 LYS A 164 2.399 -7.535 -6.820 1.00 0.00 H new ATOM 0 HE2 LYS A 164 1.317 -8.560 -5.062 1.00 0.00 H new ATOM 0 HE3 LYS A 164 2.871 -8.366 -4.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 1.079 -7.541 -2.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 2.104 -6.264 -3.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 0.599 -6.452 -4.104 1.00 0.00 H new ATOM 512 N PRO A 165 6.010 -7.227 -9.004 1.00 0.00 N ATOM 513 CA PRO A 165 5.889 -8.432 -9.807 1.00 0.00 C ATOM 514 C PRO A 165 5.716 -9.667 -8.921 1.00 0.00 C ATOM 515 O PRO A 165 4.880 -10.524 -9.202 1.00 0.00 O ATOM 516 CB PRO A 165 7.156 -8.476 -10.645 1.00 0.00 C ATOM 517 CG PRO A 165 8.147 -7.554 -9.950 1.00 0.00 C ATOM 518 CD PRO A 165 7.377 -6.718 -8.941 1.00 0.00 C ATOM 0 HA PRO A 165 5.005 -8.424 -10.445 1.00 0.00 H new ATOM 0 HB2 PRO A 165 7.546 -9.492 -10.710 1.00 0.00 H new ATOM 0 HB3 PRO A 165 6.962 -8.143 -11.665 1.00 0.00 H new ATOM 0 HG2 PRO A 165 8.923 -8.134 -9.452 1.00 0.00 H new ATOM 0 HG3 PRO A 165 8.645 -6.912 -10.676 1.00 0.00 H new ATOM 0 HD2 PRO A 165 7.793 -6.824 -7.939 1.00 0.00 H new ATOM 0 HD3 PRO A 165 7.417 -5.658 -9.192 1.00 0.00 H new ATOM 526 N GLU A 166 6.518 -9.717 -7.868 1.00 0.00 N ATOM 527 CA GLU A 166 6.463 -10.832 -6.938 1.00 0.00 C ATOM 528 C GLU A 166 5.957 -10.362 -5.573 1.00 0.00 C ATOM 529 O GLU A 166 5.502 -9.227 -5.433 1.00 0.00 O ATOM 530 CB GLU A 166 7.830 -11.509 -6.813 1.00 0.00 C ATOM 531 CG GLU A 166 8.428 -11.797 -8.192 1.00 0.00 C ATOM 532 CD GLU A 166 9.866 -11.283 -8.285 1.00 0.00 C ATOM 533 OE1 GLU A 166 10.734 -11.905 -7.634 1.00 0.00 O ATOM 534 OE2 GLU A 166 10.065 -10.281 -9.005 1.00 0.00 O ATOM 0 H GLU A 166 7.210 -9.003 -7.638 1.00 0.00 H new ATOM 0 HA GLU A 166 5.762 -11.570 -7.328 1.00 0.00 H new ATOM 0 HB2 GLU A 166 8.506 -10.869 -6.246 1.00 0.00 H new ATOM 0 HB3 GLU A 166 7.729 -12.440 -6.255 1.00 0.00 H new ATOM 0 HG2 GLU A 166 8.409 -12.870 -8.384 1.00 0.00 H new ATOM 0 HG3 GLU A 166 7.819 -11.324 -8.962 1.00 0.00 H new ATOM 541 N GLU A 167 6.054 -11.258 -4.601 1.00 0.00 N ATOM 542 CA GLU A 167 5.611 -10.947 -3.252 1.00 0.00 C ATOM 543 C GLU A 167 6.815 -10.796 -2.320 1.00 0.00 C ATOM 544 O GLU A 167 6.778 -10.011 -1.374 1.00 0.00 O ATOM 545 CB GLU A 167 4.646 -12.015 -2.733 1.00 0.00 C ATOM 546 CG GLU A 167 3.938 -11.543 -1.461 1.00 0.00 C ATOM 547 CD GLU A 167 3.864 -12.667 -0.426 1.00 0.00 C ATOM 548 OE1 GLU A 167 4.931 -13.255 -0.148 1.00 0.00 O ATOM 549 OE2 GLU A 167 2.740 -12.913 0.064 1.00 0.00 O ATOM 0 H GLU A 167 6.432 -12.198 -4.721 1.00 0.00 H new ATOM 0 HA GLU A 167 5.074 -9.999 -3.276 1.00 0.00 H new ATOM 0 HB2 GLU A 167 3.907 -12.246 -3.500 1.00 0.00 H new ATOM 0 HB3 GLU A 167 5.193 -12.936 -2.529 1.00 0.00 H new ATOM 0 HG2 GLU A 167 4.470 -10.690 -1.040 1.00 0.00 H new ATOM 0 HG3 GLU A 167 2.932 -11.202 -1.706 1.00 0.00 H new ATOM 556 N GLN A 168 7.855 -11.561 -2.621 1.00 0.00 N ATOM 557 CA GLN A 168 9.068 -11.522 -1.822 1.00 0.00 C ATOM 558 C GLN A 168 9.848 -10.235 -2.104 1.00 0.00 C ATOM 559 O GLN A 168 10.457 -9.664 -1.200 1.00 0.00 O ATOM 560 CB GLN A 168 9.935 -12.755 -2.080 1.00 0.00 C ATOM 561 CG GLN A 168 9.262 -14.020 -1.541 1.00 0.00 C ATOM 562 CD GLN A 168 10.200 -14.783 -0.603 1.00 0.00 C ATOM 563 OE1 GLN A 168 9.974 -14.890 0.591 1.00 0.00 O ATOM 564 NE2 GLN A 168 11.264 -15.304 -1.208 1.00 0.00 N ATOM 0 H GLN A 168 7.882 -12.211 -3.407 1.00 0.00 H new ATOM 0 HA GLN A 168 8.786 -11.531 -0.769 1.00 0.00 H new ATOM 0 HB2 GLN A 168 10.114 -12.861 -3.150 1.00 0.00 H new ATOM 0 HB3 GLN A 168 10.908 -12.626 -1.606 1.00 0.00 H new ATOM 0 HG2 GLN A 168 8.349 -13.752 -1.009 1.00 0.00 H new ATOM 0 HG3 GLN A 168 8.970 -14.663 -2.371 1.00 0.00 H new ATOM 0 HE21 GLN A 168 11.393 -15.177 -2.212 1.00 0.00 H new ATOM 0 HE22 GLN A 168 11.951 -15.830 -0.668 1.00 0.00 H new ATOM 573 N TRP A 169 9.803 -9.817 -3.359 1.00 0.00 N ATOM 574 CA TRP A 169 10.498 -8.609 -3.771 1.00 0.00 C ATOM 575 C TRP A 169 9.465 -7.651 -4.370 1.00 0.00 C ATOM 576 O TRP A 169 8.577 -8.072 -5.109 1.00 0.00 O ATOM 577 CB TRP A 169 11.640 -8.935 -4.736 1.00 0.00 C ATOM 578 CG TRP A 169 12.841 -9.612 -4.071 1.00 0.00 C ATOM 579 CD1 TRP A 169 12.930 -10.866 -3.609 1.00 0.00 C ATOM 580 CD2 TRP A 169 14.129 -9.015 -3.813 1.00 0.00 C ATOM 581 NE1 TRP A 169 14.175 -11.121 -3.073 1.00 0.00 N ATOM 582 CE2 TRP A 169 14.929 -9.960 -3.202 1.00 0.00 C ATOM 583 CE3 TRP A 169 14.604 -7.721 -4.087 1.00 0.00 C ATOM 584 CZ2 TRP A 169 16.250 -9.710 -2.813 1.00 0.00 C ATOM 585 CZ3 TRP A 169 15.927 -7.486 -3.693 1.00 0.00 C ATOM 586 CH2 TRP A 169 16.745 -8.426 -3.076 1.00 0.00 C ATOM 0 H TRP A 169 9.296 -10.293 -4.105 1.00 0.00 H new ATOM 0 HA TRP A 169 10.969 -8.124 -2.916 1.00 0.00 H new ATOM 0 HB2 TRP A 169 11.261 -9.584 -5.526 1.00 0.00 H new ATOM 0 HB3 TRP A 169 11.973 -8.013 -5.213 1.00 0.00 H new ATOM 0 HD1 TRP A 169 12.127 -11.587 -3.651 1.00 0.00 H new ATOM 0 HE1 TRP A 169 14.485 -12.000 -2.658 1.00 0.00 H new ATOM 0 HE3 TRP A 169 13.996 -6.967 -4.564 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 16.855 -10.466 -2.336 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 16.341 -6.506 -3.881 1.00 0.00 H new ATOM 0 HH2 TRP A 169 17.757 -8.168 -2.801 1.00 0.00 H new ATOM 597 N TRP A 170 9.617 -6.379 -4.027 1.00 0.00 N ATOM 598 CA TRP A 170 8.709 -5.358 -4.520 1.00 0.00 C ATOM 599 C TRP A 170 9.532 -4.334 -5.305 1.00 0.00 C ATOM 600 O TRP A 170 10.666 -4.032 -4.938 1.00 0.00 O ATOM 601 CB TRP A 170 7.911 -4.733 -3.374 1.00 0.00 C ATOM 602 CG TRP A 170 6.743 -5.593 -2.889 1.00 0.00 C ATOM 603 CD1 TRP A 170 6.288 -6.739 -3.412 1.00 0.00 C ATOM 604 CD2 TRP A 170 5.892 -5.324 -1.754 1.00 0.00 C ATOM 605 NE1 TRP A 170 5.212 -7.228 -2.701 1.00 0.00 N ATOM 606 CE2 TRP A 170 4.963 -6.340 -1.660 1.00 0.00 C ATOM 607 CE3 TRP A 170 5.908 -4.259 -0.837 1.00 0.00 C ATOM 608 CZ2 TRP A 170 3.981 -6.392 -0.664 1.00 0.00 C ATOM 609 CZ3 TRP A 170 4.919 -4.324 0.152 1.00 0.00 C ATOM 610 CH2 TRP A 170 3.976 -5.340 0.260 1.00 0.00 C ATOM 0 H TRP A 170 10.355 -6.033 -3.414 1.00 0.00 H new ATOM 0 HA TRP A 170 7.965 -5.793 -5.188 1.00 0.00 H new ATOM 0 HB2 TRP A 170 8.583 -4.545 -2.537 1.00 0.00 H new ATOM 0 HB3 TRP A 170 7.527 -3.766 -3.697 1.00 0.00 H new ATOM 0 HD1 TRP A 170 6.711 -7.220 -4.282 1.00 0.00 H new ATOM 0 HE1 TRP A 170 4.694 -8.084 -2.902 1.00 0.00 H new ATOM 0 HE3 TRP A 170 6.626 -3.454 -0.891 1.00 0.00 H new ATOM 0 HZ2 TRP A 170 3.266 -7.200 -0.611 1.00 0.00 H new ATOM 0 HZ3 TRP A 170 4.886 -3.529 0.882 1.00 0.00 H new ATOM 0 HH2 TRP A 170 3.243 -5.318 1.053 1.00 0.00 H new ATOM 621 N ASN A 171 8.928 -3.829 -6.370 1.00 0.00 N ATOM 622 CA ASN A 171 9.591 -2.845 -7.210 1.00 0.00 C ATOM 623 C ASN A 171 9.303 -1.442 -6.668 1.00 0.00 C ATOM 624 O ASN A 171 8.293 -0.834 -7.018 1.00 0.00 O ATOM 625 CB ASN A 171 9.075 -2.911 -8.648 1.00 0.00 C ATOM 626 CG ASN A 171 10.217 -2.726 -9.649 1.00 0.00 C ATOM 627 OD1 ASN A 171 11.117 -1.925 -9.461 1.00 0.00 O ATOM 628 ND2 ASN A 171 10.130 -3.509 -10.720 1.00 0.00 N ATOM 0 H ASN A 171 7.987 -4.082 -6.671 1.00 0.00 H new ATOM 0 HA ASN A 171 10.660 -3.059 -7.201 1.00 0.00 H new ATOM 0 HB2 ASN A 171 8.588 -3.871 -8.820 1.00 0.00 H new ATOM 0 HB3 ASN A 171 8.321 -2.139 -8.804 1.00 0.00 H new ATOM 0 HD21 ASN A 171 10.844 -3.460 -11.447 1.00 0.00 H new ATOM 0 HD22 ASN A 171 9.349 -4.158 -10.815 1.00 0.00 H new ATOM 635 N ALA A 172 10.208 -0.971 -5.824 1.00 0.00 N ATOM 636 CA ALA A 172 10.064 0.348 -5.231 1.00 0.00 C ATOM 637 C ALA A 172 11.057 1.309 -5.888 1.00 0.00 C ATOM 638 O ALA A 172 11.977 0.878 -6.582 1.00 0.00 O ATOM 639 CB ALA A 172 10.260 0.252 -3.718 1.00 0.00 C ATOM 0 H ALA A 172 11.044 -1.479 -5.536 1.00 0.00 H new ATOM 0 HA ALA A 172 9.062 0.740 -5.405 1.00 0.00 H new ATOM 0 HB1 ALA A 172 10.152 1.241 -3.274 1.00 0.00 H new ATOM 0 HB2 ALA A 172 9.512 -0.419 -3.296 1.00 0.00 H new ATOM 0 HB3 ALA A 172 11.256 -0.135 -3.504 1.00 0.00 H new ATOM 645 N GLU A 173 10.837 2.593 -5.647 1.00 0.00 N ATOM 646 CA GLU A 173 11.701 3.618 -6.206 1.00 0.00 C ATOM 647 C GLU A 173 12.444 4.355 -5.089 1.00 0.00 C ATOM 648 O GLU A 173 11.861 4.662 -4.050 1.00 0.00 O ATOM 649 CB GLU A 173 10.904 4.596 -7.072 1.00 0.00 C ATOM 650 CG GLU A 173 11.246 4.422 -8.553 1.00 0.00 C ATOM 651 CD GLU A 173 10.394 5.345 -9.425 1.00 0.00 C ATOM 652 OE1 GLU A 173 9.155 5.297 -9.260 1.00 0.00 O ATOM 653 OE2 GLU A 173 11.000 6.078 -10.236 1.00 0.00 O ATOM 0 H GLU A 173 10.073 2.947 -5.072 1.00 0.00 H new ATOM 0 HA GLU A 173 12.437 3.133 -6.847 1.00 0.00 H new ATOM 0 HB2 GLU A 173 9.837 4.435 -6.920 1.00 0.00 H new ATOM 0 HB3 GLU A 173 11.119 5.619 -6.763 1.00 0.00 H new ATOM 0 HG2 GLU A 173 12.302 4.637 -8.714 1.00 0.00 H new ATOM 0 HG3 GLU A 173 11.084 3.385 -8.848 1.00 0.00 H new ATOM 660 N ASP A 174 13.718 4.616 -5.340 1.00 0.00 N ATOM 661 CA ASP A 174 14.545 5.311 -4.368 1.00 0.00 C ATOM 662 C ASP A 174 14.218 6.805 -4.401 1.00 0.00 C ATOM 663 O ASP A 174 13.654 7.299 -5.376 1.00 0.00 O ATOM 664 CB ASP A 174 16.031 5.145 -4.690 1.00 0.00 C ATOM 665 CG ASP A 174 16.950 5.049 -3.471 1.00 0.00 C ATOM 666 OD1 ASP A 174 16.530 4.393 -2.494 1.00 0.00 O ATOM 667 OD2 ASP A 174 18.054 5.634 -3.545 1.00 0.00 O ATOM 0 H ASP A 174 14.198 4.359 -6.202 1.00 0.00 H new ATOM 0 HA ASP A 174 14.339 4.886 -3.386 1.00 0.00 H new ATOM 0 HB2 ASP A 174 16.158 4.246 -5.294 1.00 0.00 H new ATOM 0 HB3 ASP A 174 16.351 5.988 -5.302 1.00 0.00 H new ATOM 672 N SER A 175 14.586 7.484 -3.324 1.00 0.00 N ATOM 673 CA SER A 175 14.339 8.911 -3.219 1.00 0.00 C ATOM 674 C SER A 175 14.860 9.626 -4.466 1.00 0.00 C ATOM 675 O SER A 175 14.429 10.737 -4.775 1.00 0.00 O ATOM 676 CB SER A 175 14.992 9.492 -1.962 1.00 0.00 C ATOM 677 OG SER A 175 14.716 8.706 -0.805 1.00 0.00 O ATOM 0 H SER A 175 15.053 7.072 -2.517 1.00 0.00 H new ATOM 0 HA SER A 175 13.263 9.067 -3.142 1.00 0.00 H new ATOM 0 HB2 SER A 175 16.070 9.554 -2.109 1.00 0.00 H new ATOM 0 HB3 SER A 175 14.633 10.509 -1.804 1.00 0.00 H new ATOM 0 HG SER A 175 15.151 9.109 -0.025 1.00 0.00 H new ATOM 683 N GLU A 176 15.779 8.962 -5.150 1.00 0.00 N ATOM 684 CA GLU A 176 16.364 9.520 -6.358 1.00 0.00 C ATOM 685 C GLU A 176 15.466 9.235 -7.563 1.00 0.00 C ATOM 686 O GLU A 176 15.460 9.993 -8.531 1.00 0.00 O ATOM 687 CB GLU A 176 17.775 8.976 -6.585 1.00 0.00 C ATOM 688 CG GLU A 176 18.637 9.144 -5.332 1.00 0.00 C ATOM 689 CD GLU A 176 20.021 9.692 -5.687 1.00 0.00 C ATOM 690 OE1 GLU A 176 20.517 9.322 -6.771 1.00 0.00 O ATOM 691 OE2 GLU A 176 20.550 10.470 -4.863 1.00 0.00 O ATOM 0 H GLU A 176 16.134 8.041 -4.891 1.00 0.00 H new ATOM 0 HA GLU A 176 16.442 10.600 -6.235 1.00 0.00 H new ATOM 0 HB2 GLU A 176 17.723 7.921 -6.856 1.00 0.00 H new ATOM 0 HB3 GLU A 176 18.239 9.497 -7.422 1.00 0.00 H new ATOM 0 HG2 GLU A 176 18.143 9.820 -4.634 1.00 0.00 H new ATOM 0 HG3 GLU A 176 18.741 8.184 -4.826 1.00 0.00 H new ATOM 698 N GLY A 177 14.726 8.139 -7.464 1.00 0.00 N ATOM 699 CA GLY A 177 13.827 7.745 -8.535 1.00 0.00 C ATOM 700 C GLY A 177 14.340 6.493 -9.250 1.00 0.00 C ATOM 701 O GLY A 177 14.088 6.306 -10.439 1.00 0.00 O ATOM 0 H GLY A 177 14.731 7.513 -6.659 1.00 0.00 H new ATOM 0 HA2 GLY A 177 12.834 7.555 -8.129 1.00 0.00 H new ATOM 0 HA3 GLY A 177 13.728 8.562 -9.250 1.00 0.00 H new ATOM 705 N LYS A 178 15.051 5.669 -8.494 1.00 0.00 N ATOM 706 CA LYS A 178 15.602 4.441 -9.041 1.00 0.00 C ATOM 707 C LYS A 178 14.584 3.311 -8.875 1.00 0.00 C ATOM 708 O LYS A 178 14.260 2.923 -7.754 1.00 0.00 O ATOM 709 CB LYS A 178 16.964 4.137 -8.412 1.00 0.00 C ATOM 710 CG LYS A 178 18.001 5.186 -8.819 1.00 0.00 C ATOM 711 CD LYS A 178 19.136 4.552 -9.624 1.00 0.00 C ATOM 712 CE LYS A 178 18.809 4.542 -11.119 1.00 0.00 C ATOM 713 NZ LYS A 178 18.337 3.203 -11.537 1.00 0.00 N ATOM 0 H LYS A 178 15.258 5.828 -7.508 1.00 0.00 H new ATOM 0 HA LYS A 178 15.787 4.551 -10.110 1.00 0.00 H new ATOM 0 HB2 LYS A 178 16.871 4.115 -7.326 1.00 0.00 H new ATOM 0 HB3 LYS A 178 17.300 3.148 -8.723 1.00 0.00 H new ATOM 0 HG2 LYS A 178 17.522 5.965 -9.411 1.00 0.00 H new ATOM 0 HG3 LYS A 178 18.406 5.666 -7.928 1.00 0.00 H new ATOM 0 HD2 LYS A 178 20.060 5.105 -9.454 1.00 0.00 H new ATOM 0 HD3 LYS A 178 19.306 3.532 -9.278 1.00 0.00 H new ATOM 0 HE2 LYS A 178 18.044 5.288 -11.335 1.00 0.00 H new ATOM 0 HE3 LYS A 178 19.694 4.818 -11.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 18.119 3.213 -12.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 19.079 2.499 -11.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 17.480 2.954 -11.002 1.00 0.00 H new ATOM 727 N ARG A 179 14.107 2.816 -10.008 1.00 0.00 N ATOM 728 CA ARG A 179 13.131 1.740 -10.002 1.00 0.00 C ATOM 729 C ARG A 179 13.837 0.385 -9.935 1.00 0.00 C ATOM 730 O ARG A 179 14.455 -0.047 -10.907 1.00 0.00 O ATOM 731 CB ARG A 179 12.250 1.788 -11.252 1.00 0.00 C ATOM 732 CG ARG A 179 11.973 3.232 -11.674 1.00 0.00 C ATOM 733 CD ARG A 179 10.945 3.286 -12.805 1.00 0.00 C ATOM 734 NE ARG A 179 9.690 3.899 -12.319 1.00 0.00 N ATOM 735 CZ ARG A 179 8.554 3.950 -13.029 1.00 0.00 C ATOM 736 NH1 ARG A 179 8.511 3.426 -14.261 1.00 0.00 N ATOM 737 NH2 ARG A 179 7.463 4.528 -12.507 1.00 0.00 N ATOM 0 H ARG A 179 14.378 3.140 -10.936 1.00 0.00 H new ATOM 0 HA ARG A 179 12.500 1.869 -9.123 1.00 0.00 H new ATOM 0 HB2 ARG A 179 12.740 1.255 -12.067 1.00 0.00 H new ATOM 0 HB3 ARG A 179 11.308 1.276 -11.057 1.00 0.00 H new ATOM 0 HG2 ARG A 179 11.608 3.801 -10.819 1.00 0.00 H new ATOM 0 HG3 ARG A 179 12.900 3.704 -11.998 1.00 0.00 H new ATOM 0 HD2 ARG A 179 11.341 3.863 -13.641 1.00 0.00 H new ATOM 0 HD3 ARG A 179 10.748 2.280 -13.177 1.00 0.00 H new ATOM 0 HE ARG A 179 9.689 4.309 -11.385 1.00 0.00 H new ATOM 0 HH11 ARG A 179 9.342 2.988 -14.658 1.00 0.00 H new ATOM 0 HH12 ARG A 179 7.647 3.464 -14.802 1.00 0.00 H new ATOM 0 HH21 ARG A 179 7.497 4.929 -11.570 1.00 0.00 H new ATOM 0 HH22 ARG A 179 6.599 4.567 -13.047 1.00 0.00 H new ATOM 751 N GLY A 180 13.722 -0.251 -8.778 1.00 0.00 N ATOM 752 CA GLY A 180 14.342 -1.549 -8.571 1.00 0.00 C ATOM 753 C GLY A 180 13.565 -2.369 -7.540 1.00 0.00 C ATOM 754 O GLY A 180 12.768 -1.823 -6.780 1.00 0.00 O ATOM 0 H GLY A 180 13.208 0.109 -7.974 1.00 0.00 H new ATOM 0 HA2 GLY A 180 14.383 -2.091 -9.516 1.00 0.00 H new ATOM 0 HA3 GLY A 180 15.370 -1.415 -8.235 1.00 0.00 H new ATOM 758 N MET A 181 13.824 -3.669 -7.548 1.00 0.00 N ATOM 759 CA MET A 181 13.159 -4.570 -6.624 1.00 0.00 C ATOM 760 C MET A 181 13.938 -4.682 -5.311 1.00 0.00 C ATOM 761 O MET A 181 15.165 -4.599 -5.303 1.00 0.00 O ATOM 762 CB MET A 181 13.034 -5.956 -7.262 1.00 0.00 C ATOM 763 CG MET A 181 11.811 -6.028 -8.178 1.00 0.00 C ATOM 764 SD MET A 181 11.006 -7.611 -7.998 1.00 0.00 S ATOM 765 CE MET A 181 12.328 -8.691 -8.517 1.00 0.00 C ATOM 0 H MET A 181 14.486 -4.119 -8.180 1.00 0.00 H new ATOM 0 HA MET A 181 12.169 -4.170 -6.405 1.00 0.00 H new ATOM 0 HB2 MET A 181 13.935 -6.180 -7.833 1.00 0.00 H new ATOM 0 HB3 MET A 181 12.954 -6.714 -6.482 1.00 0.00 H new ATOM 0 HG2 MET A 181 11.114 -5.226 -7.932 1.00 0.00 H new ATOM 0 HG3 MET A 181 12.114 -5.880 -9.215 1.00 0.00 H new ATOM 0 HE1 MET A 181 12.063 -9.162 -9.463 1.00 0.00 H new ATOM 0 HE2 MET A 181 13.243 -8.112 -8.644 1.00 0.00 H new ATOM 0 HE3 MET A 181 12.488 -9.460 -7.761 1.00 0.00 H new ATOM 775 N ILE A 182 13.191 -4.868 -4.232 1.00 0.00 N ATOM 776 CA ILE A 182 13.796 -4.991 -2.917 1.00 0.00 C ATOM 777 C ILE A 182 12.937 -5.914 -2.050 1.00 0.00 C ATOM 778 O ILE A 182 11.780 -6.176 -2.372 1.00 0.00 O ATOM 779 CB ILE A 182 14.026 -3.609 -2.301 1.00 0.00 C ATOM 780 CG1 ILE A 182 12.738 -2.785 -2.306 1.00 0.00 C ATOM 781 CG2 ILE A 182 15.175 -2.882 -3.002 1.00 0.00 C ATOM 782 CD1 ILE A 182 12.957 -1.421 -1.648 1.00 0.00 C ATOM 0 H ILE A 182 12.173 -4.936 -4.242 1.00 0.00 H new ATOM 0 HA ILE A 182 14.782 -5.449 -2.993 1.00 0.00 H new ATOM 0 HB ILE A 182 14.317 -3.743 -1.259 1.00 0.00 H new ATOM 0 HG12 ILE A 182 12.394 -2.647 -3.331 1.00 0.00 H new ATOM 0 HG13 ILE A 182 11.954 -3.326 -1.777 1.00 0.00 H new ATOM 0 HG21 ILE A 182 15.318 -1.903 -2.546 1.00 0.00 H new ATOM 0 HG22 ILE A 182 16.090 -3.466 -2.902 1.00 0.00 H new ATOM 0 HG23 ILE A 182 14.937 -2.759 -4.058 1.00 0.00 H new ATOM 0 HD11 ILE A 182 12.026 -0.855 -1.665 1.00 0.00 H new ATOM 0 HD12 ILE A 182 13.277 -1.562 -0.616 1.00 0.00 H new ATOM 0 HD13 ILE A 182 13.725 -0.873 -2.194 1.00 0.00 H new ATOM 794 N PRO A 183 13.554 -6.396 -0.937 1.00 0.00 N ATOM 795 CA PRO A 183 12.859 -7.285 -0.022 1.00 0.00 C ATOM 796 C PRO A 183 11.848 -6.514 0.830 1.00 0.00 C ATOM 797 O PRO A 183 12.138 -5.414 1.299 1.00 0.00 O ATOM 798 CB PRO A 183 13.956 -7.937 0.804 1.00 0.00 C ATOM 799 CG PRO A 183 15.181 -7.051 0.641 1.00 0.00 C ATOM 800 CD PRO A 183 14.923 -6.108 -0.523 1.00 0.00 C ATOM 0 HA PRO A 183 12.266 -8.040 -0.539 1.00 0.00 H new ATOM 0 HB2 PRO A 183 13.664 -8.012 1.852 1.00 0.00 H new ATOM 0 HB3 PRO A 183 14.157 -8.950 0.456 1.00 0.00 H new ATOM 0 HG2 PRO A 183 15.368 -6.487 1.555 1.00 0.00 H new ATOM 0 HG3 PRO A 183 16.068 -7.656 0.452 1.00 0.00 H new ATOM 0 HD2 PRO A 183 15.035 -5.067 -0.221 1.00 0.00 H new ATOM 0 HD3 PRO A 183 15.627 -6.281 -1.337 1.00 0.00 H new ATOM 808 N VAL A 184 10.684 -7.122 1.005 1.00 0.00 N ATOM 809 CA VAL A 184 9.630 -6.506 1.792 1.00 0.00 C ATOM 810 C VAL A 184 9.917 -6.719 3.279 1.00 0.00 C ATOM 811 O VAL A 184 9.574 -5.879 4.108 1.00 0.00 O ATOM 812 CB VAL A 184 8.267 -7.055 1.362 1.00 0.00 C ATOM 813 CG1 VAL A 184 7.356 -7.270 2.573 1.00 0.00 C ATOM 814 CG2 VAL A 184 7.605 -6.136 0.334 1.00 0.00 C ATOM 0 H VAL A 184 10.448 -8.035 0.615 1.00 0.00 H new ATOM 0 HA VAL A 184 9.603 -5.430 1.617 1.00 0.00 H new ATOM 0 HB VAL A 184 8.430 -8.023 0.889 1.00 0.00 H new ATOM 0 HG11 VAL A 184 6.394 -7.660 2.240 1.00 0.00 H new ATOM 0 HG12 VAL A 184 7.820 -7.982 3.256 1.00 0.00 H new ATOM 0 HG13 VAL A 184 7.204 -6.321 3.087 1.00 0.00 H new ATOM 0 HG21 VAL A 184 6.638 -6.549 0.046 1.00 0.00 H new ATOM 0 HG22 VAL A 184 7.462 -5.147 0.769 1.00 0.00 H new ATOM 0 HG23 VAL A 184 8.243 -6.056 -0.546 1.00 0.00 H new ATOM 824 N PRO A 185 10.563 -7.878 3.578 1.00 0.00 N ATOM 825 CA PRO A 185 10.902 -8.212 4.951 1.00 0.00 C ATOM 826 C PRO A 185 12.091 -7.383 5.440 1.00 0.00 C ATOM 827 O PRO A 185 12.401 -7.378 6.631 1.00 0.00 O ATOM 828 CB PRO A 185 11.186 -9.706 4.934 1.00 0.00 C ATOM 829 CG PRO A 185 11.450 -10.063 3.480 1.00 0.00 C ATOM 830 CD PRO A 185 10.986 -8.897 2.622 1.00 0.00 C ATOM 0 HA PRO A 185 10.099 -7.981 5.651 1.00 0.00 H new ATOM 0 HB2 PRO A 185 12.047 -9.947 5.558 1.00 0.00 H new ATOM 0 HB3 PRO A 185 10.340 -10.269 5.327 1.00 0.00 H new ATOM 0 HG2 PRO A 185 12.511 -10.256 3.321 1.00 0.00 H new ATOM 0 HG3 PRO A 185 10.916 -10.974 3.208 1.00 0.00 H new ATOM 0 HD2 PRO A 185 11.790 -8.531 1.983 1.00 0.00 H new ATOM 0 HD3 PRO A 185 10.166 -9.190 1.966 1.00 0.00 H new ATOM 838 N TYR A 186 12.724 -6.703 4.497 1.00 0.00 N ATOM 839 CA TYR A 186 13.873 -5.872 4.816 1.00 0.00 C ATOM 840 C TYR A 186 13.472 -4.399 4.924 1.00 0.00 C ATOM 841 O TYR A 186 14.294 -3.551 5.268 1.00 0.00 O ATOM 842 CB TYR A 186 14.851 -6.037 3.651 1.00 0.00 C ATOM 843 CG TYR A 186 16.145 -6.763 4.024 1.00 0.00 C ATOM 844 CD1 TYR A 186 16.095 -7.938 4.745 1.00 0.00 C ATOM 845 CD2 TYR A 186 17.364 -6.241 3.639 1.00 0.00 C ATOM 846 CE1 TYR A 186 17.313 -8.621 5.097 1.00 0.00 C ATOM 847 CE2 TYR A 186 18.582 -6.924 3.990 1.00 0.00 C ATOM 848 CZ TYR A 186 18.496 -8.080 4.702 1.00 0.00 C ATOM 849 OH TYR A 186 19.647 -8.725 5.033 1.00 0.00 O ATOM 0 H TYR A 186 12.463 -6.710 3.511 1.00 0.00 H new ATOM 0 HA TYR A 186 14.307 -6.169 5.771 1.00 0.00 H new ATOM 0 HB2 TYR A 186 14.356 -6.586 2.850 1.00 0.00 H new ATOM 0 HB3 TYR A 186 15.100 -5.052 3.256 1.00 0.00 H new ATOM 0 HD1 TYR A 186 15.141 -8.346 5.046 1.00 0.00 H new ATOM 0 HD2 TYR A 186 17.404 -5.321 3.075 1.00 0.00 H new ATOM 0 HE1 TYR A 186 17.287 -9.541 5.662 1.00 0.00 H new ATOM 0 HE2 TYR A 186 19.542 -6.528 3.695 1.00 0.00 H new ATOM 0 HH TYR A 186 19.921 -8.463 5.937 1.00 0.00 H new ATOM 859 N VAL A 187 12.208 -4.140 4.622 1.00 0.00 N ATOM 860 CA VAL A 187 11.687 -2.784 4.680 1.00 0.00 C ATOM 861 C VAL A 187 10.249 -2.817 5.202 1.00 0.00 C ATOM 862 O VAL A 187 9.656 -3.887 5.331 1.00 0.00 O ATOM 863 CB VAL A 187 11.811 -2.117 3.309 1.00 0.00 C ATOM 864 CG1 VAL A 187 13.018 -2.660 2.542 1.00 0.00 C ATOM 865 CG2 VAL A 187 10.524 -2.288 2.498 1.00 0.00 C ATOM 0 H VAL A 187 11.529 -4.846 4.336 1.00 0.00 H new ATOM 0 HA VAL A 187 12.271 -2.179 5.374 1.00 0.00 H new ATOM 0 HB VAL A 187 11.968 -1.050 3.468 1.00 0.00 H new ATOM 0 HG11 VAL A 187 13.083 -2.169 1.571 1.00 0.00 H new ATOM 0 HG12 VAL A 187 13.928 -2.464 3.109 1.00 0.00 H new ATOM 0 HG13 VAL A 187 12.905 -3.735 2.398 1.00 0.00 H new ATOM 0 HG21 VAL A 187 10.638 -1.805 1.528 1.00 0.00 H new ATOM 0 HG22 VAL A 187 10.323 -3.350 2.353 1.00 0.00 H new ATOM 0 HG23 VAL A 187 9.692 -1.832 3.035 1.00 0.00 H new ATOM 875 N GLU A 188 9.730 -1.632 5.488 1.00 0.00 N ATOM 876 CA GLU A 188 8.373 -1.511 5.992 1.00 0.00 C ATOM 877 C GLU A 188 7.525 -0.669 5.038 1.00 0.00 C ATOM 878 O GLU A 188 7.968 -0.333 3.940 1.00 0.00 O ATOM 879 CB GLU A 188 8.364 -0.919 7.403 1.00 0.00 C ATOM 880 CG GLU A 188 9.780 -0.844 7.977 1.00 0.00 C ATOM 881 CD GLU A 188 9.814 0.013 9.243 1.00 0.00 C ATOM 882 OE1 GLU A 188 9.575 -0.565 10.326 1.00 0.00 O ATOM 883 OE2 GLU A 188 10.079 1.227 9.101 1.00 0.00 O ATOM 0 H GLU A 188 10.225 -0.747 5.380 1.00 0.00 H new ATOM 0 HA GLU A 188 7.937 -2.508 6.049 1.00 0.00 H new ATOM 0 HB2 GLU A 188 7.924 0.078 7.380 1.00 0.00 H new ATOM 0 HB3 GLU A 188 7.737 -1.529 8.053 1.00 0.00 H new ATOM 0 HG2 GLU A 188 10.138 -1.848 8.204 1.00 0.00 H new ATOM 0 HG3 GLU A 188 10.456 -0.425 7.232 1.00 0.00 H new ATOM 890 N LYS A 189 6.320 -0.352 5.490 1.00 0.00 N ATOM 891 CA LYS A 189 5.406 0.444 4.690 1.00 0.00 C ATOM 892 C LYS A 189 5.001 1.693 5.477 1.00 0.00 C ATOM 893 O LYS A 189 4.370 1.591 6.528 1.00 0.00 O ATOM 894 CB LYS A 189 4.218 -0.404 4.229 1.00 0.00 C ATOM 895 CG LYS A 189 3.974 -0.234 2.729 1.00 0.00 C ATOM 896 CD LYS A 189 4.263 -1.533 1.975 1.00 0.00 C ATOM 897 CE LYS A 189 4.046 -1.355 0.471 1.00 0.00 C ATOM 898 NZ LYS A 189 3.083 -2.358 -0.037 1.00 0.00 N ATOM 0 H LYS A 189 5.956 -0.633 6.401 1.00 0.00 H new ATOM 0 HA LYS A 189 5.897 0.786 3.779 1.00 0.00 H new ATOM 0 HB2 LYS A 189 4.407 -1.454 4.454 1.00 0.00 H new ATOM 0 HB3 LYS A 189 3.324 -0.115 4.782 1.00 0.00 H new ATOM 0 HG2 LYS A 189 2.941 0.068 2.557 1.00 0.00 H new ATOM 0 HG3 LYS A 189 4.608 0.564 2.342 1.00 0.00 H new ATOM 0 HD2 LYS A 189 5.290 -1.846 2.163 1.00 0.00 H new ATOM 0 HD3 LYS A 189 3.615 -2.326 2.348 1.00 0.00 H new ATOM 0 HE2 LYS A 189 3.675 -0.351 0.268 1.00 0.00 H new ATOM 0 HE3 LYS A 189 4.996 -1.456 -0.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 2.805 -2.111 -1.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 3.527 -3.299 -0.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 2.240 -2.370 0.572 1.00 0.00 H new