USER MOD reduce.3.24.130724 H: found=0, std=0, add=423, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 425 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 250 ASN : amide:sc= -0.016 X(o=-0.016,f=0) USER MOD Single : A 255 TYR OH : rot 180:sc= 0 USER MOD Single : A 257 SER OG : rot 180:sc= 0 USER MOD Single : A 269 TYR OH : rot 180:sc= 0 USER MOD Single : A 273 LYS NZ :NH3+ -162:sc= -0.0205 (180deg=-0.175) USER MOD Single : A 276 ASN : amide:sc= -0.106 X(o=-0.11,f=0) USER MOD Single : A 277 SER OG : rot 180:sc= 0 USER MOD Single : B 255 TYR OH : rot 180:sc= 0 USER MOD Single : B 257 SER OG : rot 180:sc= 0 USER MOD Single : B 269 TYR OH : rot 180:sc= 0 USER MOD Single : B 273 LYS NZ :NH3+ -162:sc= -0.0165 (180deg=-0.187) USER MOD Single : B 276 ASN : amide:sc= -0.0279 X(o=-0.028,f=0.06) USER MOD Single : B 277 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 85 N ASN A 250 50.894 9.427 50.364 1.00 0.00 N ATOM 86 CA ASN A 250 50.117 10.632 50.680 1.00 0.00 C ATOM 87 C ASN A 250 49.586 11.342 49.423 1.00 0.00 C ATOM 88 O ASN A 250 48.936 12.380 49.536 1.00 0.00 O ATOM 89 CB ASN A 250 50.961 11.576 51.558 1.00 0.00 C ATOM 90 CG ASN A 250 50.249 11.993 52.836 1.00 0.00 C ATOM 91 OD1 ASN A 250 50.794 11.911 53.930 1.00 0.00 O ATOM 92 ND2 ASN A 250 49.013 12.440 52.756 1.00 0.00 N ATOM 0 HA ASN A 250 49.233 10.326 51.239 1.00 0.00 H new ATOM 0 HB2 ASN A 250 51.899 11.083 51.815 1.00 0.00 H new ATOM 0 HB3 ASN A 250 51.216 12.466 50.984 1.00 0.00 H new ATOM 0 HD21 ASN A 250 48.515 12.716 53.602 1.00 0.00 H new ATOM 0 HD22 ASN A 250 48.554 12.511 51.848 1.00 0.00 H new ATOM 99 N LEU A 251 49.837 10.783 48.233 1.00 0.00 N ATOM 100 CA LEU A 251 49.386 11.311 46.945 1.00 0.00 C ATOM 101 C LEU A 251 47.898 11.034 46.663 1.00 0.00 C ATOM 102 O LEU A 251 47.432 11.320 45.572 1.00 0.00 O ATOM 103 CB LEU A 251 50.331 10.800 45.827 1.00 0.00 C ATOM 104 CG LEU A 251 51.506 11.764 45.558 1.00 0.00 C ATOM 105 CD1 LEU A 251 52.532 11.772 46.692 1.00 0.00 C ATOM 106 CD2 LEU A 251 52.235 11.402 44.263 1.00 0.00 C ATOM 0 H LEU A 251 50.377 9.923 48.140 1.00 0.00 H new ATOM 0 HA LEU A 251 49.447 12.399 46.975 1.00 0.00 H new ATOM 0 HB2 LEU A 251 50.724 9.823 46.107 1.00 0.00 H new ATOM 0 HB3 LEU A 251 49.761 10.663 44.908 1.00 0.00 H new ATOM 0 HG LEU A 251 51.059 12.755 45.478 1.00 0.00 H new ATOM 0 HD11 LEU A 251 53.336 12.467 46.450 1.00 0.00 H new ATOM 0 HD12 LEU A 251 52.049 12.084 47.618 1.00 0.00 H new ATOM 0 HD13 LEU A 251 52.943 10.770 46.817 1.00 0.00 H new ATOM 0 HD21 LEU A 251 53.057 12.099 44.101 1.00 0.00 H new ATOM 0 HD22 LEU A 251 52.628 10.388 44.338 1.00 0.00 H new ATOM 0 HD23 LEU A 251 51.540 11.460 43.426 1.00 0.00 H new ATOM 118 N ILE A 252 47.126 10.510 47.621 1.00 0.00 N ATOM 119 CA ILE A 252 45.683 10.208 47.489 1.00 0.00 C ATOM 120 C ILE A 252 44.844 11.366 46.891 1.00 0.00 C ATOM 121 O ILE A 252 44.083 11.106 45.954 1.00 0.00 O ATOM 122 CB ILE A 252 45.070 9.741 48.837 1.00 0.00 C ATOM 123 CG1 ILE A 252 46.003 8.884 49.722 1.00 0.00 C ATOM 124 CG2 ILE A 252 43.751 8.984 48.587 1.00 0.00 C ATOM 125 CD1 ILE A 252 46.615 7.646 49.064 1.00 0.00 C ATOM 0 H ILE A 252 47.493 10.274 48.543 1.00 0.00 H new ATOM 0 HA ILE A 252 45.634 9.390 46.770 1.00 0.00 H new ATOM 0 HB ILE A 252 44.894 10.658 49.400 1.00 0.00 H new ATOM 0 HG12 ILE A 252 46.815 9.519 50.078 1.00 0.00 H new ATOM 0 HG13 ILE A 252 45.442 8.563 50.599 1.00 0.00 H new ATOM 0 HG21 ILE A 252 43.330 8.661 49.539 1.00 0.00 H new ATOM 0 HG22 ILE A 252 43.044 9.642 48.082 1.00 0.00 H new ATOM 0 HG23 ILE A 252 43.945 8.112 47.962 1.00 0.00 H new ATOM 0 HD11 ILE A 252 47.249 7.128 49.783 1.00 0.00 H new ATOM 0 HD12 ILE A 252 45.819 6.978 48.734 1.00 0.00 H new ATOM 0 HD13 ILE A 252 47.213 7.949 48.205 1.00 0.00 H new ATOM 137 N PRO A 253 44.966 12.640 47.337 1.00 0.00 N ATOM 138 CA PRO A 253 44.226 13.746 46.720 1.00 0.00 C ATOM 139 C PRO A 253 44.727 14.047 45.298 1.00 0.00 C ATOM 140 O PRO A 253 43.927 14.345 44.412 1.00 0.00 O ATOM 141 CB PRO A 253 44.403 14.940 47.666 1.00 0.00 C ATOM 142 CG PRO A 253 45.723 14.656 48.369 1.00 0.00 C ATOM 143 CD PRO A 253 45.754 13.130 48.463 1.00 0.00 C ATOM 0 HA PRO A 253 43.171 13.500 46.594 1.00 0.00 H new ATOM 0 HB2 PRO A 253 44.436 15.882 47.119 1.00 0.00 H new ATOM 0 HB3 PRO A 253 43.579 15.013 48.376 1.00 0.00 H new ATOM 0 HG2 PRO A 253 46.571 15.041 47.802 1.00 0.00 H new ATOM 0 HG3 PRO A 253 45.761 15.120 49.355 1.00 0.00 H new ATOM 0 HD2 PRO A 253 46.777 12.757 48.414 1.00 0.00 H new ATOM 0 HD3 PRO A 253 45.335 12.789 49.410 1.00 0.00 H new ATOM 151 N VAL A 254 46.035 13.916 45.046 1.00 0.00 N ATOM 152 CA VAL A 254 46.643 14.169 43.724 1.00 0.00 C ATOM 153 C VAL A 254 46.282 13.069 42.723 1.00 0.00 C ATOM 154 O VAL A 254 46.055 13.365 41.551 1.00 0.00 O ATOM 155 CB VAL A 254 48.173 14.430 43.788 1.00 0.00 C ATOM 156 CG1 VAL A 254 48.677 14.814 45.187 1.00 0.00 C ATOM 157 CG2 VAL A 254 49.061 13.302 43.248 1.00 0.00 C ATOM 0 H VAL A 254 46.710 13.630 45.755 1.00 0.00 H new ATOM 0 HA VAL A 254 46.208 15.100 43.360 1.00 0.00 H new ATOM 0 HB VAL A 254 48.274 15.281 43.114 1.00 0.00 H new ATOM 0 HG11 VAL A 254 49.754 14.981 45.153 1.00 0.00 H new ATOM 0 HG12 VAL A 254 48.179 15.726 45.515 1.00 0.00 H new ATOM 0 HG13 VAL A 254 48.457 14.008 45.887 1.00 0.00 H new ATOM 0 HG21 VAL A 254 50.109 13.588 43.340 1.00 0.00 H new ATOM 0 HG22 VAL A 254 48.882 12.392 43.820 1.00 0.00 H new ATOM 0 HG23 VAL A 254 48.825 13.123 42.199 1.00 0.00 H new ATOM 167 N TYR A 255 46.167 11.817 43.186 1.00 0.00 N ATOM 168 CA TYR A 255 45.799 10.655 42.380 1.00 0.00 C ATOM 169 C TYR A 255 44.470 10.887 41.688 1.00 0.00 C ATOM 170 O TYR A 255 44.426 10.795 40.474 1.00 0.00 O ATOM 171 CB TYR A 255 45.776 9.352 43.199 1.00 0.00 C ATOM 172 CG TYR A 255 47.008 8.482 43.013 1.00 0.00 C ATOM 173 CD1 TYR A 255 47.883 8.236 44.089 1.00 0.00 C ATOM 174 CD2 TYR A 255 47.265 7.899 41.754 1.00 0.00 C ATOM 175 CE1 TYR A 255 49.020 7.425 43.904 1.00 0.00 C ATOM 176 CE2 TYR A 255 48.399 7.086 41.566 1.00 0.00 C ATOM 177 CZ TYR A 255 49.284 6.850 42.642 1.00 0.00 C ATOM 178 OH TYR A 255 50.382 6.066 42.474 1.00 0.00 O ATOM 0 H TYR A 255 46.334 11.582 44.164 1.00 0.00 H new ATOM 0 HA TYR A 255 46.572 10.532 41.622 1.00 0.00 H new ATOM 0 HB2 TYR A 255 45.676 9.601 44.255 1.00 0.00 H new ATOM 0 HB3 TYR A 255 44.893 8.777 42.922 1.00 0.00 H new ATOM 0 HD1 TYR A 255 47.682 8.670 45.057 1.00 0.00 H new ATOM 0 HD2 TYR A 255 46.589 8.077 40.931 1.00 0.00 H new ATOM 0 HE1 TYR A 255 49.692 7.243 44.730 1.00 0.00 H new ATOM 0 HE2 TYR A 255 48.592 6.643 40.600 1.00 0.00 H new ATOM 0 HH TYR A 255 50.418 5.748 41.548 1.00 0.00 H new ATOM 188 N CYS A 256 43.416 11.283 42.407 1.00 0.00 N ATOM 189 CA CYS A 256 42.129 11.596 41.779 1.00 0.00 C ATOM 190 C CYS A 256 42.247 12.570 40.583 1.00 0.00 C ATOM 191 O CYS A 256 41.547 12.405 39.586 1.00 0.00 O ATOM 192 CB CYS A 256 41.154 12.117 42.834 1.00 0.00 C ATOM 193 SG CYS A 256 39.526 12.457 42.124 1.00 0.00 S ATOM 0 H CYS A 256 43.428 11.394 43.421 1.00 0.00 H new ATOM 0 HA CYS A 256 41.742 10.669 41.356 1.00 0.00 H new ATOM 0 HB2 CYS A 256 41.057 11.384 43.634 1.00 0.00 H new ATOM 0 HB3 CYS A 256 41.554 13.027 43.282 1.00 0.00 H new ATOM 198 N SER A 257 43.170 13.538 40.638 1.00 0.00 N ATOM 199 CA SER A 257 43.425 14.482 39.540 1.00 0.00 C ATOM 200 C SER A 257 44.137 13.833 38.340 1.00 0.00 C ATOM 201 O SER A 257 43.585 13.795 37.235 1.00 0.00 O ATOM 202 CB SER A 257 44.243 15.670 40.063 1.00 0.00 C ATOM 203 OG SER A 257 44.228 16.735 39.128 1.00 0.00 O ATOM 0 H SER A 257 43.766 13.690 41.452 1.00 0.00 H new ATOM 0 HA SER A 257 42.456 14.823 39.177 1.00 0.00 H new ATOM 0 HB2 SER A 257 43.835 16.009 41.015 1.00 0.00 H new ATOM 0 HB3 SER A 257 45.270 15.357 40.250 1.00 0.00 H new ATOM 0 HG SER A 257 44.753 17.485 39.478 1.00 0.00 H new ATOM 209 N ILE A 258 45.344 13.280 38.538 1.00 0.00 N ATOM 210 CA ILE A 258 46.129 12.639 37.458 1.00 0.00 C ATOM 211 C ILE A 258 45.433 11.398 36.901 1.00 0.00 C ATOM 212 O ILE A 258 45.422 11.190 35.692 1.00 0.00 O ATOM 213 CB ILE A 258 47.575 12.295 37.894 1.00 0.00 C ATOM 214 CG1 ILE A 258 47.618 11.355 39.119 1.00 0.00 C ATOM 215 CG2 ILE A 258 48.361 13.597 38.102 1.00 0.00 C ATOM 216 CD1 ILE A 258 48.995 11.104 39.744 1.00 0.00 C ATOM 0 H ILE A 258 45.807 13.262 39.447 1.00 0.00 H new ATOM 0 HA ILE A 258 46.193 13.380 36.662 1.00 0.00 H new ATOM 0 HB ILE A 258 48.059 11.728 37.099 1.00 0.00 H new ATOM 0 HG12 ILE A 258 46.965 11.768 39.888 1.00 0.00 H new ATOM 0 HG13 ILE A 258 47.197 10.393 38.825 1.00 0.00 H new ATOM 0 HG21 ILE A 258 49.380 13.362 38.409 1.00 0.00 H new ATOM 0 HG22 ILE A 258 48.384 14.161 37.170 1.00 0.00 H new ATOM 0 HG23 ILE A 258 47.878 14.194 38.875 1.00 0.00 H new ATOM 0 HD11 ILE A 258 48.891 10.429 40.594 1.00 0.00 H new ATOM 0 HD12 ILE A 258 49.655 10.654 39.002 1.00 0.00 H new ATOM 0 HD13 ILE A 258 49.419 12.050 40.081 1.00 0.00 H new ATOM 228 N LEU A 259 44.807 10.593 37.758 1.00 0.00 N ATOM 229 CA LEU A 259 44.071 9.388 37.389 1.00 0.00 C ATOM 230 C LEU A 259 42.825 9.751 36.582 1.00 0.00 C ATOM 231 O LEU A 259 42.584 9.112 35.571 1.00 0.00 O ATOM 232 CB LEU A 259 43.749 8.580 38.659 1.00 0.00 C ATOM 233 CG LEU A 259 43.558 7.066 38.460 1.00 0.00 C ATOM 234 CD1 LEU A 259 44.619 6.288 39.247 1.00 0.00 C ATOM 235 CD2 LEU A 259 42.183 6.604 38.942 1.00 0.00 C ATOM 0 H LEU A 259 44.799 10.769 38.763 1.00 0.00 H new ATOM 0 HA LEU A 259 44.681 8.756 36.744 1.00 0.00 H new ATOM 0 HB2 LEU A 259 44.553 8.734 39.378 1.00 0.00 H new ATOM 0 HB3 LEU A 259 42.841 8.986 39.105 1.00 0.00 H new ATOM 0 HG LEU A 259 43.651 6.872 37.391 1.00 0.00 H new ATOM 0 HD11 LEU A 259 44.472 5.218 39.097 1.00 0.00 H new ATOM 0 HD12 LEU A 259 45.612 6.570 38.896 1.00 0.00 H new ATOM 0 HD13 LEU A 259 44.529 6.521 40.308 1.00 0.00 H new ATOM 0 HD21 LEU A 259 42.085 5.530 38.785 1.00 0.00 H new ATOM 0 HD22 LEU A 259 42.076 6.827 40.003 1.00 0.00 H new ATOM 0 HD23 LEU A 259 41.407 7.125 38.381 1.00 0.00 H new ATOM 247 N ALA A 260 42.087 10.813 36.933 1.00 0.00 N ATOM 248 CA ALA A 260 40.989 11.295 36.090 1.00 0.00 C ATOM 249 C ALA A 260 41.463 11.712 34.684 1.00 0.00 C ATOM 250 O ALA A 260 40.830 11.340 33.700 1.00 0.00 O ATOM 251 CB ALA A 260 40.224 12.425 36.795 1.00 0.00 C ATOM 0 H ALA A 260 42.230 11.350 37.788 1.00 0.00 H new ATOM 0 HA ALA A 260 40.302 10.462 35.940 1.00 0.00 H new ATOM 0 HB1 ALA A 260 39.413 12.770 36.154 1.00 0.00 H new ATOM 0 HB2 ALA A 260 39.812 12.055 37.734 1.00 0.00 H new ATOM 0 HB3 ALA A 260 40.903 13.253 36.998 1.00 0.00 H new ATOM 257 N ALA A 261 42.593 12.415 34.564 1.00 0.00 N ATOM 258 CA ALA A 261 43.135 12.813 33.259 1.00 0.00 C ATOM 259 C ALA A 261 43.675 11.617 32.440 1.00 0.00 C ATOM 260 O ALA A 261 43.402 11.509 31.243 1.00 0.00 O ATOM 261 CB ALA A 261 44.206 13.893 33.474 1.00 0.00 C ATOM 0 H ALA A 261 43.154 12.722 35.359 1.00 0.00 H new ATOM 0 HA ALA A 261 42.322 13.223 32.659 1.00 0.00 H new ATOM 0 HB1 ALA A 261 44.616 14.196 32.510 1.00 0.00 H new ATOM 0 HB2 ALA A 261 43.758 14.757 33.966 1.00 0.00 H new ATOM 0 HB3 ALA A 261 45.005 13.494 34.099 1.00 0.00 H new ATOM 267 N VAL A 262 44.403 10.700 33.087 1.00 0.00 N ATOM 268 CA VAL A 262 44.972 9.489 32.470 1.00 0.00 C ATOM 269 C VAL A 262 43.881 8.503 32.065 1.00 0.00 C ATOM 270 O VAL A 262 43.841 8.107 30.905 1.00 0.00 O ATOM 271 CB VAL A 262 46.018 8.839 33.404 1.00 0.00 C ATOM 272 CG1 VAL A 262 46.427 7.419 33.000 1.00 0.00 C ATOM 273 CG2 VAL A 262 47.295 9.690 33.418 1.00 0.00 C ATOM 0 H VAL A 262 44.620 10.779 34.080 1.00 0.00 H new ATOM 0 HA VAL A 262 45.485 9.785 31.555 1.00 0.00 H new ATOM 0 HB VAL A 262 45.538 8.784 34.381 1.00 0.00 H new ATOM 0 HG11 VAL A 262 47.163 7.037 33.707 1.00 0.00 H new ATOM 0 HG12 VAL A 262 45.550 6.772 33.005 1.00 0.00 H new ATOM 0 HG13 VAL A 262 46.860 7.436 32.000 1.00 0.00 H new ATOM 0 HG21 VAL A 262 48.031 9.230 34.077 1.00 0.00 H new ATOM 0 HG22 VAL A 262 47.701 9.753 32.408 1.00 0.00 H new ATOM 0 HG23 VAL A 262 47.061 10.692 33.778 1.00 0.00 H new ATOM 283 N VAL A 263 42.964 8.146 32.969 1.00 0.00 N ATOM 284 CA VAL A 263 41.862 7.199 32.716 1.00 0.00 C ATOM 285 C VAL A 263 40.916 7.700 31.619 1.00 0.00 C ATOM 286 O VAL A 263 40.554 6.918 30.743 1.00 0.00 O ATOM 287 CB VAL A 263 41.090 6.880 34.015 1.00 0.00 C ATOM 288 CG1 VAL A 263 39.853 6.010 33.781 1.00 0.00 C ATOM 289 CG2 VAL A 263 41.969 6.116 35.015 1.00 0.00 C ATOM 0 H VAL A 263 42.963 8.513 33.921 1.00 0.00 H new ATOM 0 HA VAL A 263 42.311 6.273 32.356 1.00 0.00 H new ATOM 0 HB VAL A 263 40.791 7.854 34.403 1.00 0.00 H new ATOM 0 HG11 VAL A 263 39.355 5.822 34.732 1.00 0.00 H new ATOM 0 HG12 VAL A 263 39.167 6.526 33.108 1.00 0.00 H new ATOM 0 HG13 VAL A 263 40.154 5.062 33.335 1.00 0.00 H new ATOM 0 HG21 VAL A 263 41.395 5.907 35.918 1.00 0.00 H new ATOM 0 HG22 VAL A 263 42.297 5.177 34.568 1.00 0.00 H new ATOM 0 HG23 VAL A 263 42.840 6.720 35.270 1.00 0.00 H new ATOM 299 N VAL A 264 40.569 8.993 31.595 1.00 0.00 N ATOM 300 CA VAL A 264 39.758 9.595 30.513 1.00 0.00 C ATOM 301 C VAL A 264 40.455 9.489 29.156 1.00 0.00 C ATOM 302 O VAL A 264 39.848 9.025 28.188 1.00 0.00 O ATOM 303 CB VAL A 264 39.401 11.062 30.831 1.00 0.00 C ATOM 304 CG1 VAL A 264 38.895 11.864 29.627 1.00 0.00 C ATOM 305 CG2 VAL A 264 38.304 11.109 31.901 1.00 0.00 C ATOM 0 H VAL A 264 40.839 9.656 32.321 1.00 0.00 H new ATOM 0 HA VAL A 264 38.831 9.025 30.453 1.00 0.00 H new ATOM 0 HB VAL A 264 40.333 11.516 31.167 1.00 0.00 H new ATOM 0 HG11 VAL A 264 38.667 12.883 29.939 1.00 0.00 H new ATOM 0 HG12 VAL A 264 39.663 11.884 28.854 1.00 0.00 H new ATOM 0 HG13 VAL A 264 37.994 11.396 29.231 1.00 0.00 H new ATOM 0 HG21 VAL A 264 38.056 12.147 32.122 1.00 0.00 H new ATOM 0 HG22 VAL A 264 37.416 10.593 31.535 1.00 0.00 H new ATOM 0 HG23 VAL A 264 38.659 10.620 32.808 1.00 0.00 H new ATOM 315 N GLY A 265 41.736 9.861 29.082 1.00 0.00 N ATOM 316 CA GLY A 265 42.531 9.711 27.861 1.00 0.00 C ATOM 317 C GLY A 265 42.655 8.247 27.428 1.00 0.00 C ATOM 318 O GLY A 265 42.558 7.946 26.237 1.00 0.00 O ATOM 0 H GLY A 265 42.248 10.272 29.862 1.00 0.00 H new ATOM 0 HA2 GLY A 265 42.073 10.288 27.058 1.00 0.00 H new ATOM 0 HA3 GLY A 265 43.526 10.126 28.024 1.00 0.00 H new ATOM 322 N LEU A 266 42.789 7.331 28.393 1.00 0.00 N ATOM 323 CA LEU A 266 42.823 5.892 28.143 1.00 0.00 C ATOM 324 C LEU A 266 41.503 5.362 27.577 1.00 0.00 C ATOM 325 O LEU A 266 41.549 4.600 26.621 1.00 0.00 O ATOM 326 CB LEU A 266 43.207 5.101 29.411 1.00 0.00 C ATOM 327 CG LEU A 266 44.362 4.120 29.153 1.00 0.00 C ATOM 328 CD1 LEU A 266 45.721 4.799 29.327 1.00 0.00 C ATOM 329 CD2 LEU A 266 44.278 2.908 30.076 1.00 0.00 C ATOM 0 H LEU A 266 42.878 7.574 29.380 1.00 0.00 H new ATOM 0 HA LEU A 266 43.594 5.739 27.388 1.00 0.00 H new ATOM 0 HB2 LEU A 266 43.493 5.797 30.199 1.00 0.00 H new ATOM 0 HB3 LEU A 266 42.338 4.550 29.771 1.00 0.00 H new ATOM 0 HG LEU A 266 44.266 3.785 28.120 1.00 0.00 H new ATOM 0 HD11 LEU A 266 46.515 4.077 29.137 1.00 0.00 H new ATOM 0 HD12 LEU A 266 45.807 5.627 28.623 1.00 0.00 H new ATOM 0 HD13 LEU A 266 45.811 5.178 30.345 1.00 0.00 H new ATOM 0 HD21 LEU A 266 45.109 2.234 29.868 1.00 0.00 H new ATOM 0 HD22 LEU A 266 44.329 3.237 31.114 1.00 0.00 H new ATOM 0 HD23 LEU A 266 43.336 2.386 29.906 1.00 0.00 H new ATOM 341 N VAL A 267 40.342 5.762 28.112 1.00 0.00 N ATOM 342 CA VAL A 267 39.025 5.307 27.618 1.00 0.00 C ATOM 343 C VAL A 267 38.879 5.559 26.118 1.00 0.00 C ATOM 344 O VAL A 267 38.506 4.643 25.391 1.00 0.00 O ATOM 345 CB VAL A 267 37.856 5.931 28.413 1.00 0.00 C ATOM 346 CG1 VAL A 267 36.496 5.822 27.711 1.00 0.00 C ATOM 347 CG2 VAL A 267 37.711 5.234 29.769 1.00 0.00 C ATOM 0 H VAL A 267 40.284 6.409 28.898 1.00 0.00 H new ATOM 0 HA VAL A 267 38.977 4.230 27.781 1.00 0.00 H new ATOM 0 HB VAL A 267 38.111 6.986 28.511 1.00 0.00 H new ATOM 0 HG11 VAL A 267 35.728 6.283 28.332 1.00 0.00 H new ATOM 0 HG12 VAL A 267 36.541 6.334 26.750 1.00 0.00 H new ATOM 0 HG13 VAL A 267 36.252 4.772 27.552 1.00 0.00 H new ATOM 0 HG21 VAL A 267 36.885 5.681 30.321 1.00 0.00 H new ATOM 0 HG22 VAL A 267 37.512 4.174 29.614 1.00 0.00 H new ATOM 0 HG23 VAL A 267 38.633 5.350 30.338 1.00 0.00 H new ATOM 357 N ALA A 268 39.223 6.753 25.635 1.00 0.00 N ATOM 358 CA ALA A 268 39.194 7.048 24.204 1.00 0.00 C ATOM 359 C ALA A 268 40.326 6.338 23.428 1.00 0.00 C ATOM 360 O ALA A 268 40.075 5.771 22.362 1.00 0.00 O ATOM 361 CB ALA A 268 39.223 8.568 24.017 1.00 0.00 C ATOM 0 H ALA A 268 39.526 7.534 26.217 1.00 0.00 H new ATOM 0 HA ALA A 268 38.271 6.652 23.779 1.00 0.00 H new ATOM 0 HB1 ALA A 268 39.202 8.804 22.953 1.00 0.00 H new ATOM 0 HB2 ALA A 268 38.355 9.011 24.504 1.00 0.00 H new ATOM 0 HB3 ALA A 268 40.133 8.972 24.460 1.00 0.00 H new ATOM 367 N TYR A 269 41.554 6.326 23.962 1.00 0.00 N ATOM 368 CA TYR A 269 42.722 5.738 23.296 1.00 0.00 C ATOM 369 C TYR A 269 42.639 4.213 23.158 1.00 0.00 C ATOM 370 O TYR A 269 42.693 3.704 22.041 1.00 0.00 O ATOM 371 CB TYR A 269 44.008 6.118 24.039 1.00 0.00 C ATOM 372 CG TYR A 269 45.257 5.483 23.454 1.00 0.00 C ATOM 373 CD1 TYR A 269 45.793 4.312 24.028 1.00 0.00 C ATOM 374 CD2 TYR A 269 45.860 6.041 22.310 1.00 0.00 C ATOM 375 CE1 TYR A 269 46.926 3.702 23.462 1.00 0.00 C ATOM 376 CE2 TYR A 269 47.004 5.444 21.753 1.00 0.00 C ATOM 377 CZ TYR A 269 47.541 4.271 22.329 1.00 0.00 C ATOM 378 OH TYR A 269 48.638 3.674 21.789 1.00 0.00 O ATOM 0 H TYR A 269 41.766 6.727 24.875 1.00 0.00 H new ATOM 0 HA TYR A 269 42.735 6.149 22.287 1.00 0.00 H new ATOM 0 HB2 TYR A 269 44.120 7.202 24.023 1.00 0.00 H new ATOM 0 HB3 TYR A 269 43.915 5.822 25.084 1.00 0.00 H new ATOM 0 HD1 TYR A 269 45.332 3.882 24.905 1.00 0.00 H new ATOM 0 HD2 TYR A 269 45.442 6.929 21.860 1.00 0.00 H new ATOM 0 HE1 TYR A 269 47.325 2.797 23.896 1.00 0.00 H new ATOM 0 HE2 TYR A 269 47.473 5.882 20.884 1.00 0.00 H new ATOM 0 HH TYR A 269 48.942 4.189 21.012 1.00 0.00 H new ATOM 388 N ILE A 270 42.490 3.487 24.269 1.00 0.00 N ATOM 389 CA ILE A 270 42.377 2.022 24.312 1.00 0.00 C ATOM 390 C ILE A 270 41.210 1.550 23.453 1.00 0.00 C ATOM 391 O ILE A 270 41.374 0.608 22.674 1.00 0.00 O ATOM 392 CB ILE A 270 42.223 1.536 25.773 1.00 0.00 C ATOM 393 CG1 ILE A 270 43.564 1.570 26.526 1.00 0.00 C ATOM 394 CG2 ILE A 270 41.582 0.149 25.889 1.00 0.00 C ATOM 395 CD1 ILE A 270 44.600 0.518 26.125 1.00 0.00 C ATOM 0 H ILE A 270 42.443 3.914 25.194 1.00 0.00 H new ATOM 0 HA ILE A 270 43.291 1.590 23.905 1.00 0.00 H new ATOM 0 HB ILE A 270 41.538 2.241 26.243 1.00 0.00 H new ATOM 0 HG12 ILE A 270 44.008 2.556 26.388 1.00 0.00 H new ATOM 0 HG13 ILE A 270 43.360 1.459 27.591 1.00 0.00 H new ATOM 0 HG21 ILE A 270 41.505 -0.129 26.940 1.00 0.00 H new ATOM 0 HG22 ILE A 270 40.587 0.170 25.445 1.00 0.00 H new ATOM 0 HG23 ILE A 270 42.198 -0.582 25.365 1.00 0.00 H new ATOM 0 HD11 ILE A 270 45.500 0.646 26.726 1.00 0.00 H new ATOM 0 HD12 ILE A 270 44.191 -0.478 26.292 1.00 0.00 H new ATOM 0 HD13 ILE A 270 44.849 0.636 25.070 1.00 0.00 H new ATOM 407 N ALA A 271 40.054 2.217 23.553 1.00 0.00 N ATOM 408 CA ALA A 271 38.900 1.883 22.737 1.00 0.00 C ATOM 409 C ALA A 271 39.209 2.031 21.245 1.00 0.00 C ATOM 410 O ALA A 271 39.008 1.088 20.481 1.00 0.00 O ATOM 411 CB ALA A 271 37.711 2.752 23.153 1.00 0.00 C ATOM 0 H ALA A 271 39.901 2.993 24.197 1.00 0.00 H new ATOM 0 HA ALA A 271 38.643 0.837 22.902 1.00 0.00 H new ATOM 0 HB1 ALA A 271 36.845 2.501 22.540 1.00 0.00 H new ATOM 0 HB2 ALA A 271 37.478 2.571 24.202 1.00 0.00 H new ATOM 0 HB3 ALA A 271 37.962 3.803 23.013 1.00 0.00 H new ATOM 417 N PHE A 272 39.771 3.173 20.835 1.00 0.00 N ATOM 418 CA PHE A 272 40.138 3.405 19.439 1.00 0.00 C ATOM 419 C PHE A 272 41.213 2.431 18.943 1.00 0.00 C ATOM 420 O PHE A 272 41.084 1.895 17.845 1.00 0.00 O ATOM 421 CB PHE A 272 40.550 4.868 19.236 1.00 0.00 C ATOM 422 CG PHE A 272 40.500 5.342 17.796 1.00 0.00 C ATOM 423 CD1 PHE A 272 41.624 5.941 17.196 1.00 0.00 C ATOM 424 CD2 PHE A 272 39.301 5.233 17.064 1.00 0.00 C ATOM 425 CE1 PHE A 272 41.551 6.415 15.874 1.00 0.00 C ATOM 426 CE2 PHE A 272 39.229 5.700 15.743 1.00 0.00 C ATOM 427 CZ PHE A 272 40.357 6.289 15.148 1.00 0.00 C ATOM 0 H PHE A 272 39.982 3.954 21.457 1.00 0.00 H new ATOM 0 HA PHE A 272 39.257 3.209 18.828 1.00 0.00 H new ATOM 0 HB2 PHE A 272 39.898 5.502 19.837 1.00 0.00 H new ATOM 0 HB3 PHE A 272 41.563 5.003 19.615 1.00 0.00 H new ATOM 0 HD1 PHE A 272 42.545 6.037 17.752 1.00 0.00 H new ATOM 0 HD2 PHE A 272 38.431 4.787 17.523 1.00 0.00 H new ATOM 0 HE1 PHE A 272 42.414 6.876 15.417 1.00 0.00 H new ATOM 0 HE2 PHE A 272 38.309 5.607 15.185 1.00 0.00 H new ATOM 0 HZ PHE A 272 40.305 6.645 14.130 1.00 0.00 H new ATOM 437 N LYS A 273 42.220 2.117 19.769 1.00 0.00 N ATOM 438 CA LYS A 273 43.235 1.090 19.483 1.00 0.00 C ATOM 439 C LYS A 273 42.607 -0.278 19.239 1.00 0.00 C ATOM 440 O LYS A 273 42.915 -0.893 18.226 1.00 0.00 O ATOM 441 CB LYS A 273 44.301 1.043 20.598 1.00 0.00 C ATOM 442 CG LYS A 273 45.685 1.558 20.168 1.00 0.00 C ATOM 443 CD LYS A 273 45.703 2.954 19.519 1.00 0.00 C ATOM 444 CE LYS A 273 45.827 2.955 17.988 1.00 0.00 C ATOM 445 NZ LYS A 273 47.122 2.385 17.529 1.00 0.00 N ATOM 0 H LYS A 273 42.356 2.576 20.670 1.00 0.00 H new ATOM 0 HA LYS A 273 43.737 1.371 18.557 1.00 0.00 H new ATOM 0 HB2 LYS A 273 43.952 1.635 21.444 1.00 0.00 H new ATOM 0 HB3 LYS A 273 44.400 0.015 20.947 1.00 0.00 H new ATOM 0 HG2 LYS A 273 46.334 1.576 21.043 1.00 0.00 H new ATOM 0 HG3 LYS A 273 46.116 0.845 19.465 1.00 0.00 H new ATOM 0 HD2 LYS A 273 44.788 3.479 19.795 1.00 0.00 H new ATOM 0 HD3 LYS A 273 46.534 3.522 19.936 1.00 0.00 H new ATOM 0 HE2 LYS A 273 45.006 2.380 17.558 1.00 0.00 H new ATOM 0 HE3 LYS A 273 45.730 3.976 17.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 273 47.300 2.674 16.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 273 47.890 2.735 18.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 273 47.083 1.347 17.583 1.00 0.00 H new ATOM 459 N ARG A 274 41.687 -0.738 20.095 1.00 0.00 N ATOM 460 CA ARG A 274 41.015 -2.043 19.923 1.00 0.00 C ATOM 461 C ARG A 274 39.948 -2.040 18.813 1.00 0.00 C ATOM 462 O ARG A 274 39.649 -3.100 18.263 1.00 0.00 O ATOM 463 CB ARG A 274 40.475 -2.556 21.272 1.00 0.00 C ATOM 464 CG ARG A 274 41.533 -3.366 22.048 1.00 0.00 C ATOM 465 CD ARG A 274 42.705 -2.524 22.566 1.00 0.00 C ATOM 466 NE ARG A 274 43.766 -3.358 23.156 1.00 0.00 N ATOM 467 CZ ARG A 274 44.976 -2.953 23.502 1.00 0.00 C ATOM 468 NH1 ARG A 274 45.344 -1.706 23.402 1.00 0.00 N ATOM 469 NH2 ARG A 274 45.856 -3.799 23.957 1.00 0.00 N ATOM 0 H ARG A 274 41.385 -0.224 20.923 1.00 0.00 H new ATOM 0 HA ARG A 274 41.769 -2.750 19.576 1.00 0.00 H new ATOM 0 HB2 ARG A 274 40.150 -1.710 21.878 1.00 0.00 H new ATOM 0 HB3 ARG A 274 39.598 -3.179 21.098 1.00 0.00 H new ATOM 0 HG2 ARG A 274 41.051 -3.859 22.893 1.00 0.00 H new ATOM 0 HG3 ARG A 274 41.922 -4.152 21.400 1.00 0.00 H new ATOM 0 HD2 ARG A 274 43.119 -1.937 21.747 1.00 0.00 H new ATOM 0 HD3 ARG A 274 42.342 -1.818 23.313 1.00 0.00 H new ATOM 0 HE ARG A 274 43.546 -4.342 23.313 1.00 0.00 H new ATOM 0 HH11 ARG A 274 44.690 -1.008 23.048 1.00 0.00 H new ATOM 0 HH12 ARG A 274 46.286 -1.428 23.678 1.00 0.00 H new ATOM 0 HH21 ARG A 274 45.615 -4.786 24.049 1.00 0.00 H new ATOM 0 HH22 ARG A 274 46.786 -3.475 24.221 1.00 0.00 H new ATOM 483 N TRP A 275 39.434 -0.872 18.428 1.00 0.00 N ATOM 484 CA TRP A 275 38.503 -0.700 17.302 1.00 0.00 C ATOM 485 C TRP A 275 39.189 -0.543 15.927 1.00 0.00 C ATOM 486 O TRP A 275 38.601 -0.923 14.914 1.00 0.00 O ATOM 487 CB TRP A 275 37.584 0.497 17.589 1.00 0.00 C ATOM 488 CG TRP A 275 36.494 0.285 18.603 1.00 0.00 C ATOM 489 CD1 TRP A 275 35.840 -0.879 18.831 1.00 0.00 C ATOM 490 CD2 TRP A 275 35.852 1.274 19.480 1.00 0.00 C ATOM 491 NE1 TRP A 275 34.833 -0.679 19.752 1.00 0.00 N ATOM 492 CE2 TRP A 275 34.782 0.628 20.169 1.00 0.00 C ATOM 493 CE3 TRP A 275 36.039 2.648 19.747 1.00 0.00 C ATOM 494 CZ2 TRP A 275 33.928 1.304 21.052 1.00 0.00 C ATOM 495 CZ3 TRP A 275 35.198 3.337 20.648 1.00 0.00 C ATOM 496 CH2 TRP A 275 34.142 2.668 21.295 1.00 0.00 C ATOM 0 H TRP A 275 39.656 0.005 18.899 1.00 0.00 H new ATOM 0 HA TRP A 275 37.926 -1.621 17.227 1.00 0.00 H new ATOM 0 HB2 TRP A 275 38.204 1.329 17.925 1.00 0.00 H new ATOM 0 HB3 TRP A 275 37.121 0.803 16.651 1.00 0.00 H new ATOM 0 HD1 TRP A 275 36.072 -1.823 18.361 1.00 0.00 H new ATOM 0 HE1 TRP A 275 34.204 -1.411 20.082 1.00 0.00 H new ATOM 0 HE3 TRP A 275 36.839 3.181 19.254 1.00 0.00 H new ATOM 0 HZ2 TRP A 275 33.117 0.782 21.538 1.00 0.00 H new ATOM 0 HZ3 TRP A 275 35.366 4.386 20.842 1.00 0.00 H new ATOM 0 HH2 TRP A 275 33.498 3.204 21.977 1.00 0.00 H new ATOM 507 N ASN A 276 40.417 -0.013 15.866 1.00 0.00 N ATOM 508 CA ASN A 276 41.201 0.167 14.627 1.00 0.00 C ATOM 509 C ASN A 276 42.338 -0.874 14.461 1.00 0.00 C ATOM 510 O ASN A 276 42.973 -0.927 13.402 1.00 0.00 O ATOM 511 CB ASN A 276 41.716 1.624 14.548 1.00 0.00 C ATOM 512 CG ASN A 276 40.715 2.613 13.963 1.00 0.00 C ATOM 513 OD1 ASN A 276 41.009 3.354 13.034 1.00 0.00 O ATOM 514 ND2 ASN A 276 39.499 2.655 14.463 1.00 0.00 N ATOM 0 H ASN A 276 40.910 0.313 16.697 1.00 0.00 H new ATOM 0 HA ASN A 276 40.537 -0.017 13.783 1.00 0.00 H new ATOM 0 HB2 ASN A 276 41.992 1.954 15.550 1.00 0.00 H new ATOM 0 HB3 ASN A 276 42.623 1.644 13.945 1.00 0.00 H new ATOM 0 HD21 ASN A 276 38.811 3.301 14.077 1.00 0.00 H new ATOM 0 HD22 ASN A 276 39.244 2.042 15.237 1.00 0.00 H new ATOM 521 N SER A 277 42.583 -1.721 15.472 1.00 0.00 N ATOM 522 CA SER A 277 43.500 -2.880 15.436 1.00 0.00 C ATOM 523 C SER A 277 43.238 -3.844 14.267 1.00 0.00 C ATOM 524 O SER A 277 42.054 -4.120 13.961 1.00 0.00 O ATOM 525 CB SER A 277 43.439 -3.647 16.764 1.00 0.00 C ATOM 526 OG SER A 277 44.650 -3.438 17.475 1.00 0.00 O ATOM 0 H SER A 277 42.129 -1.616 16.379 1.00 0.00 H new ATOM 0 HA SER A 277 44.497 -2.468 15.281 1.00 0.00 H new ATOM 0 HB2 SER A 277 42.591 -3.306 17.357 1.00 0.00 H new ATOM 0 HB3 SER A 277 43.291 -4.711 16.578 1.00 0.00 H new ATOM 0 HG SER A 277 44.618 -3.924 18.326 1.00 0.00 H new ATOM 683 N VAL B 254 33.019 15.081 46.025 1.00 0.00 N ATOM 684 CA VAL B 254 31.832 14.234 45.788 1.00 0.00 C ATOM 685 C VAL B 254 31.830 13.630 44.385 1.00 0.00 C ATOM 686 O VAL B 254 31.549 12.435 44.262 1.00 0.00 O ATOM 687 CB VAL B 254 30.504 14.966 46.108 1.00 0.00 C ATOM 688 CG1 VAL B 254 30.594 16.476 45.900 1.00 0.00 C ATOM 689 CG2 VAL B 254 29.302 14.490 45.284 1.00 0.00 C ATOM 0 HA VAL B 254 31.902 13.404 46.492 1.00 0.00 H new ATOM 0 HB VAL B 254 30.347 14.720 47.158 1.00 0.00 H new ATOM 0 HG11 VAL B 254 29.634 16.934 46.140 1.00 0.00 H new ATOM 0 HG12 VAL B 254 31.365 16.888 46.551 1.00 0.00 H new ATOM 0 HG13 VAL B 254 30.847 16.686 44.861 1.00 0.00 H new ATOM 0 HG21 VAL B 254 28.416 15.055 45.573 1.00 0.00 H new ATOM 0 HG22 VAL B 254 29.503 14.646 44.224 1.00 0.00 H new ATOM 0 HG23 VAL B 254 29.132 13.429 45.468 1.00 0.00 H new ATOM 699 N TYR B 255 32.198 14.394 43.345 1.00 0.00 N ATOM 700 CA TYR B 255 32.364 13.822 42.007 1.00 0.00 C ATOM 701 C TYR B 255 33.369 12.680 42.040 1.00 0.00 C ATOM 702 O TYR B 255 33.025 11.582 41.628 1.00 0.00 O ATOM 703 CB TYR B 255 32.766 14.851 40.938 1.00 0.00 C ATOM 704 CG TYR B 255 31.659 15.138 39.944 1.00 0.00 C ATOM 705 CD1 TYR B 255 31.004 16.386 39.932 1.00 0.00 C ATOM 706 CD2 TYR B 255 31.283 14.138 39.024 1.00 0.00 C ATOM 707 CE1 TYR B 255 29.983 16.635 38.996 1.00 0.00 C ATOM 708 CE2 TYR B 255 30.262 14.381 38.089 1.00 0.00 C ATOM 709 CZ TYR B 255 29.612 15.635 38.071 1.00 0.00 C ATOM 710 OH TYR B 255 28.631 15.888 37.160 1.00 0.00 O ATOM 0 H TYR B 255 32.383 15.395 43.406 1.00 0.00 H new ATOM 0 HA TYR B 255 31.383 13.447 41.716 1.00 0.00 H new ATOM 0 HB2 TYR B 255 33.056 15.780 41.428 1.00 0.00 H new ATOM 0 HB3 TYR B 255 33.642 14.486 40.402 1.00 0.00 H new ATOM 0 HD1 TYR B 255 31.286 17.151 40.641 1.00 0.00 H new ATOM 0 HD2 TYR B 255 31.782 13.180 39.038 1.00 0.00 H new ATOM 0 HE1 TYR B 255 29.483 17.592 38.985 1.00 0.00 H new ATOM 0 HE2 TYR B 255 29.976 13.612 37.387 1.00 0.00 H new ATOM 0 HH TYR B 255 28.496 15.098 36.596 1.00 0.00 H new ATOM 720 N CYS B 256 34.563 12.892 42.602 1.00 0.00 N ATOM 721 CA CYS B 256 35.577 11.840 42.701 1.00 0.00 C ATOM 722 C CYS B 256 35.072 10.554 43.379 1.00 0.00 C ATOM 723 O CYS B 256 35.474 9.465 42.981 1.00 0.00 O ATOM 724 CB CYS B 256 36.820 12.379 43.407 1.00 0.00 C ATOM 725 SG CYS B 256 38.258 11.308 43.199 1.00 0.00 S ATOM 0 H CYS B 256 34.851 13.787 42.997 1.00 0.00 H new ATOM 0 HA CYS B 256 35.830 11.552 41.681 1.00 0.00 H new ATOM 0 HB2 CYS B 256 37.052 13.371 43.019 1.00 0.00 H new ATOM 0 HB3 CYS B 256 36.608 12.494 44.470 1.00 0.00 H new ATOM 730 N SER B 257 34.159 10.650 44.352 1.00 0.00 N ATOM 731 CA SER B 257 33.563 9.482 45.018 1.00 0.00 C ATOM 732 C SER B 257 32.722 8.614 44.068 1.00 0.00 C ATOM 733 O SER B 257 33.056 7.450 43.820 1.00 0.00 O ATOM 734 CB SER B 257 32.711 9.938 46.212 1.00 0.00 C ATOM 735 OG SER B 257 32.373 8.827 47.023 1.00 0.00 O ATOM 0 H SER B 257 33.810 11.542 44.702 1.00 0.00 H new ATOM 0 HA SER B 257 34.387 8.859 45.365 1.00 0.00 H new ATOM 0 HB2 SER B 257 33.260 10.674 46.800 1.00 0.00 H new ATOM 0 HB3 SER B 257 31.804 10.427 45.856 1.00 0.00 H new ATOM 0 HG SER B 257 31.831 9.129 47.782 1.00 0.00 H new ATOM 741 N ILE B 258 31.652 9.178 43.490 1.00 0.00 N ATOM 742 CA ILE B 258 30.771 8.465 42.546 1.00 0.00 C ATOM 743 C ILE B 258 31.495 8.124 41.242 1.00 0.00 C ATOM 744 O ILE B 258 31.311 7.037 40.700 1.00 0.00 O ATOM 745 CB ILE B 258 29.467 9.249 42.268 1.00 0.00 C ATOM 746 CG1 ILE B 258 29.727 10.635 41.633 1.00 0.00 C ATOM 747 CG2 ILE B 258 28.644 9.329 43.562 1.00 0.00 C ATOM 748 CD1 ILE B 258 28.496 11.527 41.453 1.00 0.00 C ATOM 0 H ILE B 258 31.370 10.143 43.662 1.00 0.00 H new ATOM 0 HA ILE B 258 30.493 7.526 43.025 1.00 0.00 H new ATOM 0 HB ILE B 258 28.886 8.709 41.520 1.00 0.00 H new ATOM 0 HG12 ILE B 258 30.450 11.167 42.251 1.00 0.00 H new ATOM 0 HG13 ILE B 258 30.190 10.486 40.658 1.00 0.00 H new ATOM 0 HG21 ILE B 258 27.723 9.881 43.374 1.00 0.00 H new ATOM 0 HG22 ILE B 258 28.401 8.322 43.902 1.00 0.00 H new ATOM 0 HG23 ILE B 258 29.223 9.841 44.330 1.00 0.00 H new ATOM 0 HD11 ILE B 258 28.795 12.472 41.000 1.00 0.00 H new ATOM 0 HD12 ILE B 258 27.775 11.026 40.806 1.00 0.00 H new ATOM 0 HD13 ILE B 258 28.040 11.718 42.424 1.00 0.00 H new ATOM 760 N LEU B 259 32.358 9.021 40.762 1.00 0.00 N ATOM 761 CA LEU B 259 33.158 8.843 39.556 1.00 0.00 C ATOM 762 C LEU B 259 34.157 7.704 39.733 1.00 0.00 C ATOM 763 O LEU B 259 34.205 6.843 38.872 1.00 0.00 O ATOM 764 CB LEU B 259 33.839 10.174 39.188 1.00 0.00 C ATOM 765 CG LEU B 259 34.426 10.228 37.769 1.00 0.00 C ATOM 766 CD1 LEU B 259 33.658 11.223 36.895 1.00 0.00 C ATOM 767 CD2 LEU B 259 35.897 10.642 37.796 1.00 0.00 C ATOM 0 H LEU B 259 32.522 9.918 41.218 1.00 0.00 H new ATOM 0 HA LEU B 259 32.511 8.560 38.726 1.00 0.00 H new ATOM 0 HB2 LEU B 259 33.113 10.979 39.296 1.00 0.00 H new ATOM 0 HB3 LEU B 259 34.638 10.367 39.904 1.00 0.00 H new ATOM 0 HG LEU B 259 34.337 9.226 37.350 1.00 0.00 H new ATOM 0 HD11 LEU B 259 34.094 11.242 35.896 1.00 0.00 H new ATOM 0 HD12 LEU B 259 32.613 10.919 36.829 1.00 0.00 H new ATOM 0 HD13 LEU B 259 33.719 12.218 37.336 1.00 0.00 H new ATOM 0 HD21 LEU B 259 36.285 10.672 36.778 1.00 0.00 H new ATOM 0 HD22 LEU B 259 35.989 11.629 38.248 1.00 0.00 H new ATOM 0 HD23 LEU B 259 36.467 9.921 38.381 1.00 0.00 H new ATOM 779 N ALA B 260 34.879 7.620 40.856 1.00 0.00 N ATOM 780 CA ALA B 260 35.756 6.479 41.132 1.00 0.00 C ATOM 781 C ALA B 260 34.989 5.148 41.147 1.00 0.00 C ATOM 782 O ALA B 260 35.446 4.186 40.534 1.00 0.00 O ATOM 783 CB ALA B 260 36.542 6.698 42.433 1.00 0.00 C ATOM 0 H ALA B 260 34.872 8.330 41.588 1.00 0.00 H new ATOM 0 HA ALA B 260 36.473 6.412 40.314 1.00 0.00 H new ATOM 0 HB1 ALA B 260 37.186 5.839 42.618 1.00 0.00 H new ATOM 0 HB2 ALA B 260 37.153 7.596 42.342 1.00 0.00 H new ATOM 0 HB3 ALA B 260 35.846 6.815 43.263 1.00 0.00 H new ATOM 789 N ALA B 261 33.806 5.086 41.767 1.00 0.00 N ATOM 790 CA ALA B 261 32.999 3.861 41.796 1.00 0.00 C ATOM 791 C ALA B 261 32.440 3.470 40.410 1.00 0.00 C ATOM 792 O ALA B 261 32.481 2.295 40.031 1.00 0.00 O ATOM 793 CB ALA B 261 31.886 4.027 42.839 1.00 0.00 C ATOM 0 H ALA B 261 33.384 5.874 42.258 1.00 0.00 H new ATOM 0 HA ALA B 261 33.645 3.031 42.081 1.00 0.00 H new ATOM 0 HB1 ALA B 261 31.279 3.122 42.870 1.00 0.00 H new ATOM 0 HB2 ALA B 261 32.329 4.200 43.820 1.00 0.00 H new ATOM 0 HB3 ALA B 261 31.258 4.876 42.569 1.00 0.00 H new ATOM 799 N VAL B 262 31.956 4.447 39.633 1.00 0.00 N ATOM 800 CA VAL B 262 31.423 4.247 38.272 1.00 0.00 C ATOM 801 C VAL B 262 32.536 3.895 37.286 1.00 0.00 C ATOM 802 O VAL B 262 32.456 2.856 36.638 1.00 0.00 O ATOM 803 CB VAL B 262 30.611 5.487 37.830 1.00 0.00 C ATOM 804 CG1 VAL B 262 30.325 5.562 36.324 1.00 0.00 C ATOM 805 CG2 VAL B 262 29.258 5.483 38.551 1.00 0.00 C ATOM 0 H VAL B 262 31.922 5.420 39.936 1.00 0.00 H new ATOM 0 HA VAL B 262 30.743 3.395 38.282 1.00 0.00 H new ATOM 0 HB VAL B 262 31.230 6.347 38.086 1.00 0.00 H new ATOM 0 HG11 VAL B 262 29.752 6.463 36.107 1.00 0.00 H new ATOM 0 HG12 VAL B 262 31.267 5.590 35.776 1.00 0.00 H new ATOM 0 HG13 VAL B 262 29.753 4.686 36.018 1.00 0.00 H new ATOM 0 HG21 VAL B 262 28.680 6.355 38.244 1.00 0.00 H new ATOM 0 HG22 VAL B 262 28.711 4.576 38.294 1.00 0.00 H new ATOM 0 HG23 VAL B 262 29.420 5.516 39.628 1.00 0.00 H new ATOM 815 N VAL B 263 33.600 4.699 37.212 1.00 0.00 N ATOM 816 CA VAL B 263 34.753 4.521 36.308 1.00 0.00 C ATOM 817 C VAL B 263 35.497 3.207 36.570 1.00 0.00 C ATOM 818 O VAL B 263 35.858 2.528 35.611 1.00 0.00 O ATOM 819 CB VAL B 263 35.704 5.736 36.405 1.00 0.00 C ATOM 820 CG1 VAL B 263 37.019 5.577 35.647 1.00 0.00 C ATOM 821 CG2 VAL B 263 35.036 6.996 35.831 1.00 0.00 C ATOM 0 H VAL B 263 33.691 5.527 37.801 1.00 0.00 H new ATOM 0 HA VAL B 263 34.369 4.462 35.290 1.00 0.00 H new ATOM 0 HB VAL B 263 35.919 5.817 37.471 1.00 0.00 H new ATOM 0 HG11 VAL B 263 37.622 6.477 35.771 1.00 0.00 H new ATOM 0 HG12 VAL B 263 37.564 4.718 36.039 1.00 0.00 H new ATOM 0 HG13 VAL B 263 36.812 5.422 34.588 1.00 0.00 H new ATOM 0 HG21 VAL B 263 35.722 7.839 35.909 1.00 0.00 H new ATOM 0 HG22 VAL B 263 34.784 6.829 34.784 1.00 0.00 H new ATOM 0 HG23 VAL B 263 34.128 7.214 36.393 1.00 0.00 H new ATOM 831 N VAL B 264 35.675 2.790 37.832 1.00 0.00 N ATOM 832 CA VAL B 264 36.251 1.470 38.177 1.00 0.00 C ATOM 833 C VAL B 264 35.394 0.319 37.653 1.00 0.00 C ATOM 834 O VAL B 264 35.917 -0.579 36.993 1.00 0.00 O ATOM 835 CB VAL B 264 36.482 1.334 39.699 1.00 0.00 C ATOM 836 CG1 VAL B 264 36.672 -0.105 40.191 1.00 0.00 C ATOM 837 CG2 VAL B 264 37.732 2.121 40.107 1.00 0.00 C ATOM 0 H VAL B 264 35.426 3.353 38.645 1.00 0.00 H new ATOM 0 HA VAL B 264 37.220 1.410 37.682 1.00 0.00 H new ATOM 0 HB VAL B 264 35.572 1.722 40.157 1.00 0.00 H new ATOM 0 HG11 VAL B 264 36.828 -0.103 41.270 1.00 0.00 H new ATOM 0 HG12 VAL B 264 35.784 -0.691 39.953 1.00 0.00 H new ATOM 0 HG13 VAL B 264 37.540 -0.546 39.700 1.00 0.00 H new ATOM 0 HG21 VAL B 264 37.890 2.022 41.181 1.00 0.00 H new ATOM 0 HG22 VAL B 264 38.599 1.729 39.575 1.00 0.00 H new ATOM 0 HG23 VAL B 264 37.598 3.173 39.856 1.00 0.00 H new ATOM 847 N GLY B 265 34.079 0.346 37.875 1.00 0.00 N ATOM 848 CA GLY B 265 33.175 -0.674 37.333 1.00 0.00 C ATOM 849 C GLY B 265 33.136 -0.670 35.798 1.00 0.00 C ATOM 850 O GLY B 265 33.053 -1.728 35.166 1.00 0.00 O ATOM 0 H GLY B 265 33.613 1.065 38.428 1.00 0.00 H new ATOM 0 HA2 GLY B 265 33.490 -1.657 37.683 1.00 0.00 H new ATOM 0 HA3 GLY B 265 32.170 -0.506 37.719 1.00 0.00 H new ATOM 854 N LEU B 266 33.263 0.514 35.194 1.00 0.00 N ATOM 855 CA LEU B 266 33.334 0.690 33.746 1.00 0.00 C ATOM 856 C LEU B 266 34.639 0.161 33.133 1.00 0.00 C ATOM 857 O LEU B 266 34.598 -0.347 32.017 1.00 0.00 O ATOM 858 CB LEU B 266 33.139 2.173 33.373 1.00 0.00 C ATOM 859 CG LEU B 266 32.101 2.364 32.257 1.00 0.00 C ATOM 860 CD1 LEU B 266 30.678 2.458 32.811 1.00 0.00 C ATOM 861 CD2 LEU B 266 32.402 3.620 31.446 1.00 0.00 C ATOM 0 H LEU B 266 33.320 1.392 35.710 1.00 0.00 H new ATOM 0 HA LEU B 266 32.524 0.094 33.325 1.00 0.00 H new ATOM 0 HB2 LEU B 266 32.825 2.729 34.257 1.00 0.00 H new ATOM 0 HB3 LEU B 266 34.093 2.593 33.054 1.00 0.00 H new ATOM 0 HG LEU B 266 32.167 1.486 31.614 1.00 0.00 H new ATOM 0 HD11 LEU B 266 29.976 2.593 31.989 1.00 0.00 H new ATOM 0 HD12 LEU B 266 30.436 1.541 33.349 1.00 0.00 H new ATOM 0 HD13 LEU B 266 30.608 3.307 33.491 1.00 0.00 H new ATOM 0 HD21 LEU B 266 31.654 3.735 30.662 1.00 0.00 H new ATOM 0 HD22 LEU B 266 32.377 4.491 32.101 1.00 0.00 H new ATOM 0 HD23 LEU B 266 33.390 3.534 30.995 1.00 0.00 H new ATOM 873 N VAL B 267 35.780 0.250 33.833 1.00 0.00 N ATOM 874 CA VAL B 267 37.087 -0.208 33.315 1.00 0.00 C ATOM 875 C VAL B 267 37.062 -1.686 32.922 1.00 0.00 C ATOM 876 O VAL B 267 37.680 -2.068 31.934 1.00 0.00 O ATOM 877 CB VAL B 267 38.255 0.106 34.284 1.00 0.00 C ATOM 878 CG1 VAL B 267 38.695 -1.055 35.188 1.00 0.00 C ATOM 879 CG2 VAL B 267 39.496 0.547 33.499 1.00 0.00 C ATOM 0 H VAL B 267 35.827 0.641 34.774 1.00 0.00 H new ATOM 0 HA VAL B 267 37.272 0.366 32.407 1.00 0.00 H new ATOM 0 HB VAL B 267 37.855 0.891 34.926 1.00 0.00 H new ATOM 0 HG11 VAL B 267 39.517 -0.729 35.825 1.00 0.00 H new ATOM 0 HG12 VAL B 267 37.857 -1.370 35.810 1.00 0.00 H new ATOM 0 HG13 VAL B 267 39.024 -1.892 34.572 1.00 0.00 H new ATOM 0 HG21 VAL B 267 40.308 0.764 34.193 1.00 0.00 H new ATOM 0 HG22 VAL B 267 39.801 -0.251 32.822 1.00 0.00 H new ATOM 0 HG23 VAL B 267 39.263 1.442 32.922 1.00 0.00 H new ATOM 889 N ALA B 268 36.306 -2.505 33.656 1.00 0.00 N ATOM 890 CA ALA B 268 36.108 -3.916 33.349 1.00 0.00 C ATOM 891 C ALA B 268 35.097 -4.118 32.204 1.00 0.00 C ATOM 892 O ALA B 268 35.344 -4.917 31.298 1.00 0.00 O ATOM 893 CB ALA B 268 35.670 -4.618 34.640 1.00 0.00 C ATOM 0 H ALA B 268 35.808 -2.198 34.492 1.00 0.00 H new ATOM 0 HA ALA B 268 37.040 -4.354 32.991 1.00 0.00 H new ATOM 0 HB1 ALA B 268 35.513 -5.678 34.442 1.00 0.00 H new ATOM 0 HB2 ALA B 268 36.444 -4.501 35.399 1.00 0.00 H new ATOM 0 HB3 ALA B 268 34.741 -4.175 34.998 1.00 0.00 H new ATOM 899 N TYR B 269 33.982 -3.377 32.210 1.00 0.00 N ATOM 900 CA TYR B 269 32.925 -3.500 31.199 1.00 0.00 C ATOM 901 C TYR B 269 33.355 -2.998 29.814 1.00 0.00 C ATOM 902 O TYR B 269 33.304 -3.758 28.848 1.00 0.00 O ATOM 903 CB TYR B 269 31.663 -2.761 31.668 1.00 0.00 C ATOM 904 CG TYR B 269 30.526 -2.832 30.663 1.00 0.00 C ATOM 905 CD1 TYR B 269 30.282 -1.752 29.791 1.00 0.00 C ATOM 906 CD2 TYR B 269 29.743 -3.999 30.570 1.00 0.00 C ATOM 907 CE1 TYR B 269 29.263 -1.841 28.825 1.00 0.00 C ATOM 908 CE2 TYR B 269 28.715 -4.086 29.614 1.00 0.00 C ATOM 909 CZ TYR B 269 28.474 -3.006 28.737 1.00 0.00 C ATOM 910 OH TYR B 269 27.497 -3.087 27.794 1.00 0.00 O ATOM 0 H TYR B 269 33.787 -2.671 32.920 1.00 0.00 H new ATOM 0 HA TYR B 269 32.712 -4.563 31.090 1.00 0.00 H new ATOM 0 HB2 TYR B 269 31.331 -3.186 32.615 1.00 0.00 H new ATOM 0 HB3 TYR B 269 31.909 -1.716 31.856 1.00 0.00 H new ATOM 0 HD1 TYR B 269 30.878 -0.855 29.864 1.00 0.00 H new ATOM 0 HD2 TYR B 269 29.932 -4.829 31.234 1.00 0.00 H new ATOM 0 HE1 TYR B 269 29.085 -1.016 28.151 1.00 0.00 H new ATOM 0 HE2 TYR B 269 28.110 -4.979 29.551 1.00 0.00 H new ATOM 0 HH TYR B 269 27.045 -3.954 27.864 1.00 0.00 H new ATOM 920 N ILE B 270 33.804 -1.741 29.713 1.00 0.00 N ATOM 921 CA ILE B 270 34.259 -1.103 28.466 1.00 0.00 C ATOM 922 C ILE B 270 35.420 -1.876 27.855 1.00 0.00 C ATOM 923 O ILE B 270 35.394 -2.138 26.653 1.00 0.00 O ATOM 924 CB ILE B 270 34.646 0.373 28.721 1.00 0.00 C ATOM 925 CG1 ILE B 270 33.401 1.225 29.022 1.00 0.00 C ATOM 926 CG2 ILE B 270 35.456 1.031 27.597 1.00 0.00 C ATOM 927 CD1 ILE B 270 32.402 1.466 27.883 1.00 0.00 C ATOM 0 H ILE B 270 33.864 -1.119 30.519 1.00 0.00 H new ATOM 0 HA ILE B 270 33.436 -1.118 27.752 1.00 0.00 H new ATOM 0 HB ILE B 270 35.303 0.337 29.590 1.00 0.00 H new ATOM 0 HG12 ILE B 270 32.863 0.752 29.844 1.00 0.00 H new ATOM 0 HG13 ILE B 270 33.740 2.197 29.380 1.00 0.00 H new ATOM 0 HG21 ILE B 270 35.680 2.063 27.866 1.00 0.00 H new ATOM 0 HG22 ILE B 270 36.387 0.484 27.451 1.00 0.00 H new ATOM 0 HG23 ILE B 270 34.877 1.014 26.674 1.00 0.00 H new ATOM 0 HD11 ILE B 270 31.579 2.082 28.245 1.00 0.00 H new ATOM 0 HD12 ILE B 270 32.903 1.977 27.061 1.00 0.00 H new ATOM 0 HD13 ILE B 270 32.013 0.510 27.532 1.00 0.00 H new ATOM 939 N ALA B 271 36.402 -2.294 28.663 1.00 0.00 N ATOM 940 CA ALA B 271 37.485 -3.147 28.184 1.00 0.00 C ATOM 941 C ALA B 271 36.933 -4.454 27.606 1.00 0.00 C ATOM 942 O ALA B 271 37.200 -4.761 26.451 1.00 0.00 O ATOM 943 CB ALA B 271 38.501 -3.400 29.302 1.00 0.00 C ATOM 0 H ALA B 271 36.465 -2.052 29.652 1.00 0.00 H new ATOM 0 HA ALA B 271 38.006 -2.632 27.376 1.00 0.00 H new ATOM 0 HB1 ALA B 271 39.302 -4.038 28.928 1.00 0.00 H new ATOM 0 HB2 ALA B 271 38.919 -2.450 29.636 1.00 0.00 H new ATOM 0 HB3 ALA B 271 38.006 -3.892 30.139 1.00 0.00 H new ATOM 949 N PHE B 272 36.095 -5.192 28.341 1.00 0.00 N ATOM 950 CA PHE B 272 35.556 -6.461 27.842 1.00 0.00 C ATOM 951 C PHE B 272 34.713 -6.293 26.564 1.00 0.00 C ATOM 952 O PHE B 272 34.858 -7.073 25.623 1.00 0.00 O ATOM 953 CB PHE B 272 34.799 -7.193 28.959 1.00 0.00 C ATOM 954 CG PHE B 272 34.675 -8.693 28.770 1.00 0.00 C ATOM 955 CD1 PHE B 272 33.421 -9.324 28.865 1.00 0.00 C ATOM 956 CD2 PHE B 272 35.828 -9.475 28.564 1.00 0.00 C ATOM 957 CE1 PHE B 272 33.320 -10.721 28.742 1.00 0.00 C ATOM 958 CE2 PHE B 272 35.729 -10.869 28.426 1.00 0.00 C ATOM 959 CZ PHE B 272 34.473 -11.490 28.515 1.00 0.00 C ATOM 0 H PHE B 272 35.777 -4.935 29.276 1.00 0.00 H new ATOM 0 HA PHE B 272 36.399 -7.084 27.544 1.00 0.00 H new ATOM 0 HB2 PHE B 272 35.304 -7.001 29.906 1.00 0.00 H new ATOM 0 HB3 PHE B 272 33.799 -6.768 29.039 1.00 0.00 H new ATOM 0 HD1 PHE B 272 32.533 -8.733 29.033 1.00 0.00 H new ATOM 0 HD2 PHE B 272 36.796 -8.999 28.512 1.00 0.00 H new ATOM 0 HE1 PHE B 272 32.356 -11.202 28.822 1.00 0.00 H new ATOM 0 HE2 PHE B 272 36.615 -11.461 28.252 1.00 0.00 H new ATOM 0 HZ PHE B 272 34.393 -12.562 28.409 1.00 0.00 H new ATOM 969 N LYS B 273 33.906 -5.227 26.475 1.00 0.00 N ATOM 970 CA LYS B 273 33.145 -4.851 25.270 1.00 0.00 C ATOM 971 C LYS B 273 34.048 -4.535 24.074 1.00 0.00 C ATOM 972 O LYS B 273 33.825 -5.081 22.995 1.00 0.00 O ATOM 973 CB LYS B 273 32.192 -3.682 25.593 1.00 0.00 C ATOM 974 CG LYS B 273 30.714 -4.091 25.707 1.00 0.00 C ATOM 975 CD LYS B 273 30.413 -5.264 26.659 1.00 0.00 C ATOM 976 CE LYS B 273 30.218 -6.625 25.975 1.00 0.00 C ATOM 977 NZ LYS B 273 29.035 -6.637 25.074 1.00 0.00 N ATOM 0 H LYS B 273 33.759 -4.586 27.255 1.00 0.00 H new ATOM 0 HA LYS B 273 32.551 -5.714 24.970 1.00 0.00 H new ATOM 0 HB2 LYS B 273 32.504 -3.221 26.530 1.00 0.00 H new ATOM 0 HB3 LYS B 273 32.289 -2.923 24.817 1.00 0.00 H new ATOM 0 HG2 LYS B 273 30.141 -3.224 26.037 1.00 0.00 H new ATOM 0 HG3 LYS B 273 30.352 -4.353 24.713 1.00 0.00 H new ATOM 0 HD2 LYS B 273 31.230 -5.349 27.376 1.00 0.00 H new ATOM 0 HD3 LYS B 273 29.513 -5.028 27.228 1.00 0.00 H new ATOM 0 HE2 LYS B 273 31.111 -6.873 25.402 1.00 0.00 H new ATOM 0 HE3 LYS B 273 30.102 -7.398 26.735 1.00 0.00 H new ATOM 0 HZ1 LYS B 273 28.759 -7.620 24.876 1.00 0.00 H new ATOM 0 HZ2 LYS B 273 28.244 -6.141 25.533 1.00 0.00 H new ATOM 0 HZ3 LYS B 273 29.273 -6.158 24.182 1.00 0.00 H new ATOM 991 N ARG B 274 35.087 -3.710 24.247 1.00 0.00 N ATOM 992 CA ARG B 274 36.069 -3.417 23.185 1.00 0.00 C ATOM 993 C ARG B 274 36.978 -4.604 22.834 1.00 0.00 C ATOM 994 O ARG B 274 37.430 -4.694 21.695 1.00 0.00 O ATOM 995 CB ARG B 274 36.882 -2.153 23.535 1.00 0.00 C ATOM 996 CG ARG B 274 36.197 -0.866 23.036 1.00 0.00 C ATOM 997 CD ARG B 274 35.545 0.012 24.111 1.00 0.00 C ATOM 998 NE ARG B 274 34.076 -0.131 24.150 1.00 0.00 N ATOM 999 CZ ARG B 274 33.195 0.837 24.350 1.00 0.00 C ATOM 1000 NH1 ARG B 274 33.548 2.070 24.598 1.00 0.00 N ATOM 1001 NH2 ARG B 274 31.917 0.593 24.300 1.00 0.00 N ATOM 0 H ARG B 274 35.275 -3.225 25.124 1.00 0.00 H new ATOM 0 HA ARG B 274 35.496 -3.225 22.278 1.00 0.00 H new ATOM 0 HB2 ARG B 274 37.016 -2.096 24.615 1.00 0.00 H new ATOM 0 HB3 ARG B 274 37.876 -2.228 23.094 1.00 0.00 H new ATOM 0 HG2 ARG B 274 36.937 -0.267 22.506 1.00 0.00 H new ATOM 0 HG3 ARG B 274 35.433 -1.144 22.310 1.00 0.00 H new ATOM 0 HD2 ARG B 274 35.957 -0.248 25.086 1.00 0.00 H new ATOM 0 HD3 ARG B 274 35.800 1.056 23.926 1.00 0.00 H new ATOM 0 HE ARG B 274 33.702 -1.070 24.009 1.00 0.00 H new ATOM 0 HH11 ARG B 274 34.536 2.318 24.644 1.00 0.00 H new ATOM 0 HH12 ARG B 274 32.835 2.785 24.746 1.00 0.00 H new ATOM 0 HH21 ARG B 274 31.585 -0.352 24.105 1.00 0.00 H new ATOM 0 HH22 ARG B 274 31.247 1.347 24.456 1.00 0.00 H new ATOM 1015 N TRP B 275 37.212 -5.533 23.761 1.00 0.00 N ATOM 1016 CA TRP B 275 38.011 -6.741 23.526 1.00 0.00 C ATOM 1017 C TRP B 275 37.234 -7.825 22.761 1.00 0.00 C ATOM 1018 O TRP B 275 37.795 -8.453 21.861 1.00 0.00 O ATOM 1019 CB TRP B 275 38.529 -7.303 24.859 1.00 0.00 C ATOM 1020 CG TRP B 275 39.911 -6.874 25.258 1.00 0.00 C ATOM 1021 CD1 TRP B 275 40.933 -7.721 25.516 1.00 0.00 C ATOM 1022 CD2 TRP B 275 40.461 -5.528 25.434 1.00 0.00 C ATOM 1023 NE1 TRP B 275 42.069 -7.009 25.843 1.00 0.00 N ATOM 1024 CE2 TRP B 275 41.834 -5.655 25.816 1.00 0.00 C ATOM 1025 CE3 TRP B 275 39.961 -4.218 25.305 1.00 0.00 C ATOM 1026 CZ2 TRP B 275 42.653 -4.548 26.080 1.00 0.00 C ATOM 1027 CZ3 TRP B 275 40.766 -3.101 25.583 1.00 0.00 C ATOM 1028 CH2 TRP B 275 42.108 -3.261 25.979 1.00 0.00 C ATOM 0 H TRP B 275 36.847 -5.469 24.711 1.00 0.00 H new ATOM 0 HA TRP B 275 38.854 -6.448 22.899 1.00 0.00 H new ATOM 0 HB2 TRP B 275 37.836 -7.010 25.648 1.00 0.00 H new ATOM 0 HB3 TRP B 275 38.509 -8.391 24.805 1.00 0.00 H new ATOM 0 HD1 TRP B 275 40.869 -8.798 25.472 1.00 0.00 H new ATOM 0 HE1 TRP B 275 42.967 -7.433 26.075 1.00 0.00 H new ATOM 0 HE3 TRP B 275 38.940 -4.069 24.986 1.00 0.00 H new ATOM 0 HZ2 TRP B 275 43.688 -4.685 26.357 1.00 0.00 H new ATOM 0 HZ3 TRP B 275 40.351 -2.108 25.492 1.00 0.00 H new ATOM 0 HH2 TRP B 275 42.714 -2.396 26.204 1.00 0.00 H new ATOM 1039 N ASN B 276 35.953 -8.050 23.085 1.00 0.00 N ATOM 1040 CA ASN B 276 35.097 -8.999 22.360 1.00 0.00 C ATOM 1041 C ASN B 276 34.613 -8.479 20.987 1.00 0.00 C ATOM 1042 O ASN B 276 34.238 -9.287 20.131 1.00 0.00 O ATOM 1043 CB ASN B 276 33.904 -9.420 23.245 1.00 0.00 C ATOM 1044 CG ASN B 276 34.205 -10.630 24.115 1.00 0.00 C ATOM 1045 OD1 ASN B 276 34.157 -10.581 25.334 1.00 0.00 O ATOM 1046 ND2 ASN B 276 34.503 -11.761 23.511 1.00 0.00 N ATOM 0 H ASN B 276 35.481 -7.579 23.857 1.00 0.00 H new ATOM 0 HA ASN B 276 35.715 -9.870 22.141 1.00 0.00 H new ATOM 0 HB2 ASN B 276 33.619 -8.583 23.883 1.00 0.00 H new ATOM 0 HB3 ASN B 276 33.047 -9.642 22.608 1.00 0.00 H new ATOM 0 HD21 ASN B 276 34.694 -12.598 24.061 1.00 0.00 H new ATOM 0 HD22 ASN B 276 34.543 -11.800 22.493 1.00 0.00 H new ATOM 1053 N SER B 277 34.626 -7.158 20.763 1.00 0.00 N ATOM 1054 CA SER B 277 34.320 -6.515 19.471 1.00 0.00 C ATOM 1055 C SER B 277 35.169 -7.031 18.296 1.00 0.00 C ATOM 1056 O SER B 277 34.612 -7.196 17.188 1.00 0.00 O ATOM 1057 CB SER B 277 34.449 -4.994 19.593 1.00 0.00 C ATOM 1058 OG SER B 277 33.147 -4.433 19.516 1.00 0.00 O ATOM 0 H SER B 277 34.856 -6.485 21.494 1.00 0.00 H new ATOM 0 HA SER B 277 33.291 -6.786 19.237 1.00 0.00 H new ATOM 0 HB2 SER B 277 34.923 -4.727 20.537 1.00 0.00 H new ATOM 0 HB3 SER B 277 35.081 -4.601 18.797 1.00 0.00 H new ATOM 0 HG SER B 277 33.206 -3.458 19.594 1.00 0.00 H new