USER MOD reduce.3.24.130724 H: found=0, std=0, add=329, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 330 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 421 SER OG : rot 180:sc= 0 USER MOD Single : A 423 MET CE :methyl -104:sc= 0 (180deg=-0.933) USER MOD Single : A 433 MET CE :methyl -120:sc= -0.104 (180deg=-1.03) USER MOD Single : A 434 THR OG1 : rot 92:sc= 1.32 USER MOD Single : A 436 GLN : amide:sc= 0.336 X(o=0.34,f=0) USER MOD Single : A 464 GLN : amide:sc= -0.207 X(o=-0.21,f=-0.31) USER MOD Single : A 467 GLN : amide:sc= -0.0355 K(o=-0.035,f=-0.82) USER MOD Single : A 473 GLN : amide:sc= 0 K(o=0,f=-0.84) USER MOD Single : A 477 HIS : no HD1:sc= -0.0357 X(o=-0.036,f=0) USER MOD Single : A 482 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 483 THR OG1 : rot 180:sc= 0 USER MOD Single : A 484 GLN : amide:sc= 0.274 X(o=0.27,f=0) USER MOD ----------------------------------------------------------------- ATOM 113 N GLU A 419 -24.718 -29.544 -72.072 1.00 25.00 N ATOM 114 CA GLU A 419 -25.284 -29.940 -70.780 1.00 25.00 C ATOM 115 C GLU A 419 -25.123 -31.442 -70.594 1.00 25.00 C ATOM 116 O GLU A 419 -24.828 -31.912 -69.515 1.00 25.00 O ATOM 117 CB GLU A 419 -26.780 -29.599 -70.721 1.00 25.00 C ATOM 118 CG GLU A 419 -27.119 -28.126 -70.942 1.00 25.00 C ATOM 119 CD GLU A 419 -26.638 -27.212 -69.829 1.00 25.00 C ATOM 120 OE1 GLU A 419 -25.987 -26.195 -70.153 1.00 25.00 O ATOM 121 OE2 GLU A 419 -26.920 -27.493 -68.648 1.00 25.00 O ATOM 0 HA GLU A 419 -24.758 -29.400 -69.993 1.00 25.00 H new ATOM 0 HB2 GLU A 419 -27.302 -30.192 -71.472 1.00 25.00 H new ATOM 0 HB3 GLU A 419 -27.168 -29.903 -69.749 1.00 25.00 H new ATOM 0 HG2 GLU A 419 -26.678 -27.799 -71.884 1.00 25.00 H new ATOM 0 HG3 GLU A 419 -28.199 -28.023 -71.043 1.00 25.00 H new ATOM 128 N VAL A 420 -25.313 -32.195 -71.668 1.00 25.00 N ATOM 129 CA VAL A 420 -25.202 -33.653 -71.612 1.00 25.00 C ATOM 130 C VAL A 420 -23.753 -34.081 -71.377 1.00 25.00 C ATOM 131 O VAL A 420 -23.495 -35.072 -70.704 1.00 25.00 O ATOM 132 CB VAL A 420 -25.760 -34.299 -72.917 1.00 25.00 C ATOM 133 CG1 VAL A 420 -25.627 -35.832 -72.895 1.00 25.00 C ATOM 134 CG2 VAL A 420 -27.238 -33.926 -73.083 1.00 25.00 C ATOM 0 H VAL A 420 -25.545 -31.825 -72.590 1.00 25.00 H new ATOM 0 HA VAL A 420 -25.801 -34.005 -70.772 1.00 25.00 H new ATOM 0 HB VAL A 420 -25.175 -33.918 -73.754 1.00 25.00 H new ATOM 0 HG11 VAL A 420 -26.027 -36.245 -73.821 1.00 25.00 H new ATOM 0 HG12 VAL A 420 -24.576 -36.105 -72.800 1.00 25.00 H new ATOM 0 HG13 VAL A 420 -26.184 -36.233 -72.048 1.00 25.00 H new ATOM 0 HG21 VAL A 420 -27.627 -34.378 -73.995 1.00 25.00 H new ATOM 0 HG22 VAL A 420 -27.804 -34.292 -72.227 1.00 25.00 H new ATOM 0 HG23 VAL A 420 -27.335 -32.842 -73.145 1.00 25.00 H new ATOM 144 N SER A 421 -22.805 -33.336 -71.919 1.00 25.00 N ATOM 145 CA SER A 421 -21.396 -33.672 -71.742 1.00 25.00 C ATOM 146 C SER A 421 -20.981 -33.474 -70.287 1.00 25.00 C ATOM 147 O SER A 421 -20.261 -34.295 -69.721 1.00 25.00 O ATOM 148 CB SER A 421 -20.525 -32.803 -72.644 1.00 25.00 C ATOM 149 OG SER A 421 -20.892 -32.974 -74.007 1.00 25.00 O ATOM 0 H SER A 421 -22.979 -32.502 -72.480 1.00 25.00 H new ATOM 0 HA SER A 421 -21.258 -34.719 -72.013 1.00 25.00 H new ATOM 0 HB2 SER A 421 -20.631 -31.756 -72.362 1.00 25.00 H new ATOM 0 HB3 SER A 421 -19.476 -33.065 -72.508 1.00 25.00 H new ATOM 0 HG SER A 421 -20.325 -32.408 -74.572 1.00 25.00 H new ATOM 155 N ASP A 422 -21.445 -32.392 -69.683 1.00 25.00 N ATOM 156 CA ASP A 422 -21.128 -32.106 -68.283 1.00 25.00 C ATOM 157 C ASP A 422 -21.911 -33.039 -67.370 1.00 25.00 C ATOM 158 O ASP A 422 -21.441 -33.419 -66.297 1.00 25.00 O ATOM 159 CB ASP A 422 -21.443 -30.643 -67.960 1.00 25.00 C ATOM 160 CG ASP A 422 -20.498 -29.678 -68.666 1.00 25.00 C ATOM 161 OD1 ASP A 422 -19.266 -29.886 -68.588 1.00 25.00 O ATOM 162 OD2 ASP A 422 -20.981 -28.717 -69.303 1.00 25.00 O ATOM 0 H ASP A 422 -22.040 -31.697 -70.133 1.00 25.00 H new ATOM 0 HA ASP A 422 -20.064 -32.273 -68.117 1.00 25.00 H new ATOM 0 HB2 ASP A 422 -22.470 -30.422 -68.252 1.00 25.00 H new ATOM 0 HB3 ASP A 422 -21.378 -30.489 -66.883 1.00 25.00 H new ATOM 167 N MET A 423 -23.097 -33.430 -67.808 1.00 25.00 N ATOM 168 CA MET A 423 -23.919 -34.375 -67.057 1.00 25.00 C ATOM 169 C MET A 423 -23.196 -35.721 -67.008 1.00 25.00 C ATOM 170 O MET A 423 -23.135 -36.359 -65.971 1.00 25.00 O ATOM 171 CB MET A 423 -25.303 -34.503 -67.707 1.00 25.00 C ATOM 172 CG MET A 423 -26.288 -35.383 -66.957 1.00 25.00 C ATOM 173 SD MET A 423 -27.987 -35.179 -67.603 1.00 25.00 S ATOM 174 CE MET A 423 -27.846 -35.812 -69.306 1.00 25.00 C ATOM 0 H MET A 423 -23.516 -33.109 -68.681 1.00 25.00 H new ATOM 0 HA MET A 423 -24.070 -34.019 -66.038 1.00 25.00 H new ATOM 0 HB2 MET A 423 -25.733 -33.507 -67.808 1.00 25.00 H new ATOM 0 HB3 MET A 423 -25.179 -34.900 -68.714 1.00 25.00 H new ATOM 0 HG2 MET A 423 -25.986 -36.427 -67.045 1.00 25.00 H new ATOM 0 HG3 MET A 423 -26.268 -35.133 -65.896 1.00 25.00 H new ATOM 0 HE1 MET A 423 -27.827 -34.976 -70.005 1.00 25.00 H new ATOM 0 HE2 MET A 423 -26.926 -36.389 -69.405 1.00 25.00 H new ATOM 0 HE3 MET A 423 -28.700 -36.451 -69.529 1.00 25.00 H new ATOM 184 N ALA A 424 -22.618 -36.137 -68.124 1.00 25.00 N ATOM 185 CA ALA A 424 -21.886 -37.400 -68.172 1.00 25.00 C ATOM 186 C ALA A 424 -20.642 -37.338 -67.272 1.00 25.00 C ATOM 187 O ALA A 424 -20.232 -38.340 -66.681 1.00 25.00 O ATOM 188 CB ALA A 424 -21.486 -37.713 -69.618 1.00 25.00 C ATOM 0 H ALA A 424 -22.639 -35.624 -69.006 1.00 25.00 H new ATOM 0 HA ALA A 424 -22.533 -38.196 -67.803 1.00 25.00 H new ATOM 0 HB1 ALA A 424 -20.940 -38.656 -69.649 1.00 25.00 H new ATOM 0 HB2 ALA A 424 -22.382 -37.792 -70.234 1.00 25.00 H new ATOM 0 HB3 ALA A 424 -20.851 -36.914 -70.001 1.00 25.00 H new ATOM 194 N ALA A 425 -20.035 -36.163 -67.180 1.00 25.00 N ATOM 195 CA ALA A 425 -18.847 -35.987 -66.354 1.00 25.00 C ATOM 196 C ALA A 425 -19.181 -36.133 -64.863 1.00 25.00 C ATOM 197 O ALA A 425 -18.461 -36.802 -64.121 1.00 25.00 O ATOM 198 CB ALA A 425 -18.218 -34.613 -66.629 1.00 25.00 C ATOM 0 H ALA A 425 -20.343 -35.320 -67.665 1.00 25.00 H new ATOM 0 HA ALA A 425 -18.131 -36.767 -66.613 1.00 25.00 H new ATOM 0 HB1 ALA A 425 -17.331 -34.488 -66.008 1.00 25.00 H new ATOM 0 HB2 ALA A 425 -17.938 -34.545 -67.680 1.00 25.00 H new ATOM 0 HB3 ALA A 425 -18.938 -33.829 -66.394 1.00 25.00 H new ATOM 204 N VAL A 426 -20.262 -35.504 -64.421 1.00 25.00 N ATOM 205 CA VAL A 426 -20.646 -35.570 -63.011 1.00 25.00 C ATOM 206 C VAL A 426 -21.174 -36.958 -62.663 1.00 25.00 C ATOM 207 O VAL A 426 -20.956 -37.450 -61.559 1.00 25.00 O ATOM 208 CB VAL A 426 -21.647 -34.437 -62.644 1.00 25.00 C ATOM 209 CG1 VAL A 426 -22.990 -34.585 -63.329 1.00 25.00 C ATOM 210 CG2 VAL A 426 -21.821 -34.339 -61.136 1.00 25.00 C ATOM 0 H VAL A 426 -20.884 -34.948 -65.008 1.00 25.00 H new ATOM 0 HA VAL A 426 -19.758 -35.403 -62.401 1.00 25.00 H new ATOM 0 HB VAL A 426 -21.211 -33.509 -63.014 1.00 25.00 H new ATOM 0 HG11 VAL A 426 -23.643 -33.764 -63.032 1.00 25.00 H new ATOM 0 HG12 VAL A 426 -22.851 -34.565 -64.410 1.00 25.00 H new ATOM 0 HG13 VAL A 426 -23.444 -35.533 -63.039 1.00 25.00 H new ATOM 0 HG21 VAL A 426 -22.525 -33.540 -60.902 1.00 25.00 H new ATOM 0 HG22 VAL A 426 -22.204 -35.284 -60.752 1.00 25.00 H new ATOM 0 HG23 VAL A 426 -20.859 -34.122 -60.672 1.00 25.00 H new ATOM 220 N GLU A 427 -21.831 -37.597 -63.618 1.00 25.00 N ATOM 221 CA GLU A 427 -22.303 -38.976 -63.444 1.00 25.00 C ATOM 222 C GLU A 427 -21.112 -39.876 -63.118 1.00 25.00 C ATOM 223 O GLU A 427 -21.154 -40.672 -62.183 1.00 25.00 O ATOM 224 CB GLU A 427 -22.967 -39.501 -64.725 1.00 25.00 C ATOM 225 CG GLU A 427 -24.444 -39.157 -64.889 1.00 25.00 C ATOM 226 CD GLU A 427 -24.999 -39.666 -66.224 1.00 25.00 C ATOM 227 OE1 GLU A 427 -24.970 -40.898 -66.450 1.00 25.00 O ATOM 228 OE2 GLU A 427 -25.454 -38.839 -67.049 1.00 25.00 O ATOM 0 H GLU A 427 -22.053 -37.188 -64.526 1.00 25.00 H new ATOM 0 HA GLU A 427 -23.034 -38.985 -62.635 1.00 25.00 H new ATOM 0 HB2 GLU A 427 -22.423 -39.106 -65.583 1.00 25.00 H new ATOM 0 HB3 GLU A 427 -22.860 -40.585 -64.751 1.00 25.00 H new ATOM 0 HG2 GLU A 427 -25.013 -39.594 -64.068 1.00 25.00 H new ATOM 0 HG3 GLU A 427 -24.575 -38.077 -64.828 1.00 25.00 H new ATOM 235 N ALA A 428 -20.037 -39.742 -63.882 1.00 25.00 N ATOM 236 CA ALA A 428 -18.846 -40.554 -63.656 1.00 25.00 C ATOM 237 C ALA A 428 -18.231 -40.251 -62.284 1.00 25.00 C ATOM 238 O ALA A 428 -17.777 -41.158 -61.578 1.00 25.00 O ATOM 239 CB ALA A 428 -17.824 -40.301 -64.771 1.00 25.00 C ATOM 0 H ALA A 428 -19.963 -39.085 -64.658 1.00 25.00 H new ATOM 0 HA ALA A 428 -19.133 -41.605 -63.670 1.00 25.00 H new ATOM 0 HB1 ALA A 428 -16.937 -40.910 -64.597 1.00 25.00 H new ATOM 0 HB2 ALA A 428 -18.262 -40.565 -65.733 1.00 25.00 H new ATOM 0 HB3 ALA A 428 -17.545 -39.247 -64.777 1.00 25.00 H new ATOM 245 N ALA A 429 -18.229 -38.978 -61.913 1.00 25.00 N ATOM 246 CA ALA A 429 -17.657 -38.548 -60.642 1.00 25.00 C ATOM 247 C ALA A 429 -18.421 -39.134 -59.448 1.00 25.00 C ATOM 248 O ALA A 429 -17.815 -39.600 -58.477 1.00 25.00 O ATOM 249 CB ALA A 429 -17.654 -37.017 -60.568 1.00 25.00 C ATOM 0 H ALA A 429 -18.618 -38.222 -62.476 1.00 25.00 H new ATOM 0 HA ALA A 429 -16.633 -38.919 -60.591 1.00 25.00 H new ATOM 0 HB1 ALA A 429 -17.226 -36.700 -59.617 1.00 25.00 H new ATOM 0 HB2 ALA A 429 -17.058 -36.614 -61.387 1.00 25.00 H new ATOM 0 HB3 ALA A 429 -18.676 -36.647 -60.647 1.00 25.00 H new ATOM 255 N GLU A 430 -19.745 -39.109 -59.491 1.00 25.00 N ATOM 256 CA GLU A 430 -20.505 -39.635 -58.365 1.00 25.00 C ATOM 257 C GLU A 430 -20.425 -41.159 -58.332 1.00 25.00 C ATOM 258 O GLU A 430 -20.435 -41.762 -57.256 1.00 25.00 O ATOM 259 CB GLU A 430 -21.952 -39.122 -58.328 1.00 25.00 C ATOM 260 CG GLU A 430 -22.876 -39.605 -59.435 1.00 25.00 C ATOM 261 CD GLU A 430 -24.317 -39.160 -59.196 1.00 25.00 C ATOM 262 OE1 GLU A 430 -25.245 -39.907 -59.575 1.00 25.00 O ATOM 263 OE2 GLU A 430 -24.523 -38.067 -58.614 1.00 25.00 O ATOM 0 H GLU A 430 -20.301 -38.744 -60.264 1.00 25.00 H new ATOM 0 HA GLU A 430 -20.044 -39.255 -57.454 1.00 25.00 H new ATOM 0 HB2 GLU A 430 -22.390 -39.407 -57.371 1.00 25.00 H new ATOM 0 HB3 GLU A 430 -21.928 -38.033 -58.356 1.00 25.00 H new ATOM 0 HG2 GLU A 430 -22.529 -39.219 -60.394 1.00 25.00 H new ATOM 0 HG3 GLU A 430 -22.835 -40.693 -59.496 1.00 25.00 H new ATOM 270 N LEU A 431 -20.311 -41.793 -59.491 1.00 25.00 N ATOM 271 CA LEU A 431 -20.178 -43.243 -59.528 1.00 25.00 C ATOM 272 C LEU A 431 -18.887 -43.667 -58.838 1.00 25.00 C ATOM 273 O LEU A 431 -18.895 -44.576 -58.003 1.00 25.00 O ATOM 274 CB LEU A 431 -20.180 -43.756 -60.974 1.00 25.00 C ATOM 275 CG LEU A 431 -21.560 -43.886 -61.642 1.00 25.00 C ATOM 276 CD1 LEU A 431 -21.384 -44.090 -63.147 1.00 25.00 C ATOM 277 CD2 LEU A 431 -22.356 -45.058 -61.052 1.00 25.00 C ATOM 0 H LEU A 431 -20.308 -41.336 -60.403 1.00 25.00 H new ATOM 0 HA LEU A 431 -21.030 -43.675 -59.004 1.00 25.00 H new ATOM 0 HB2 LEU A 431 -19.568 -43.085 -61.577 1.00 25.00 H new ATOM 0 HB3 LEU A 431 -19.696 -44.732 -60.993 1.00 25.00 H new ATOM 0 HG LEU A 431 -22.117 -42.968 -61.455 1.00 25.00 H new ATOM 0 HD11 LEU A 431 -22.362 -44.182 -63.619 1.00 25.00 H new ATOM 0 HD12 LEU A 431 -20.856 -43.236 -63.571 1.00 25.00 H new ATOM 0 HD13 LEU A 431 -20.808 -44.998 -63.326 1.00 25.00 H new ATOM 0 HD21 LEU A 431 -23.326 -45.124 -61.545 1.00 25.00 H new ATOM 0 HD22 LEU A 431 -21.806 -45.986 -61.208 1.00 25.00 H new ATOM 0 HD23 LEU A 431 -22.502 -44.898 -59.984 1.00 25.00 H new ATOM 289 N GLU A 432 -17.771 -43.028 -59.165 1.00 25.00 N ATOM 290 CA GLU A 432 -16.499 -43.430 -58.567 1.00 25.00 C ATOM 291 C GLU A 432 -16.393 -43.056 -57.087 1.00 25.00 C ATOM 292 O GLU A 432 -15.784 -43.807 -56.305 1.00 25.00 O ATOM 293 CB GLU A 432 -15.295 -42.901 -59.363 1.00 25.00 C ATOM 294 CG GLU A 432 -15.047 -41.398 -59.278 1.00 25.00 C ATOM 295 CD GLU A 432 -13.813 -40.974 -60.065 1.00 25.00 C ATOM 296 OE1 GLU A 432 -13.106 -41.859 -60.600 1.00 25.00 O ATOM 297 OE2 GLU A 432 -13.544 -39.757 -60.138 1.00 25.00 O ATOM 0 H GLU A 432 -17.716 -42.250 -59.822 1.00 25.00 H new ATOM 0 HA GLU A 432 -16.477 -44.519 -58.618 1.00 25.00 H new ATOM 0 HB2 GLU A 432 -14.400 -43.417 -59.016 1.00 25.00 H new ATOM 0 HB3 GLU A 432 -15.431 -43.168 -60.411 1.00 25.00 H new ATOM 0 HG2 GLU A 432 -15.919 -40.865 -59.658 1.00 25.00 H new ATOM 0 HG3 GLU A 432 -14.927 -41.110 -58.234 1.00 25.00 H new ATOM 304 N MET A 433 -16.978 -41.939 -56.664 1.00 25.00 N ATOM 305 CA MET A 433 -16.905 -41.579 -55.246 1.00 25.00 C ATOM 306 C MET A 433 -17.710 -42.560 -54.425 1.00 25.00 C ATOM 307 O MET A 433 -17.352 -42.870 -53.291 1.00 25.00 O ATOM 308 CB MET A 433 -17.373 -40.146 -54.953 1.00 25.00 C ATOM 309 CG MET A 433 -18.863 -39.887 -55.005 1.00 25.00 C ATOM 310 SD MET A 433 -19.265 -38.168 -54.562 1.00 25.00 S ATOM 311 CE MET A 433 -18.642 -37.219 -56.005 1.00 25.00 C ATOM 0 H MET A 433 -17.491 -41.286 -57.256 1.00 25.00 H new ATOM 0 HA MET A 433 -15.852 -41.624 -54.968 1.00 25.00 H new ATOM 0 HB2 MET A 433 -17.015 -39.869 -53.962 1.00 25.00 H new ATOM 0 HB3 MET A 433 -16.888 -39.479 -55.665 1.00 25.00 H new ATOM 0 HG2 MET A 433 -19.234 -40.101 -56.007 1.00 25.00 H new ATOM 0 HG3 MET A 433 -19.374 -40.567 -54.324 1.00 25.00 H new ATOM 0 HE1 MET A 433 -17.882 -36.511 -55.674 1.00 25.00 H new ATOM 0 HE2 MET A 433 -18.207 -37.905 -56.731 1.00 25.00 H new ATOM 0 HE3 MET A 433 -19.467 -36.677 -56.467 1.00 25.00 H new ATOM 321 N THR A 434 -18.793 -43.064 -54.994 1.00 25.00 N ATOM 322 CA THR A 434 -19.637 -43.998 -54.274 1.00 25.00 C ATOM 323 C THR A 434 -18.868 -45.291 -54.015 1.00 25.00 C ATOM 324 O THR A 434 -18.975 -45.891 -52.952 1.00 25.00 O ATOM 325 CB THR A 434 -20.949 -44.283 -55.030 1.00 25.00 C ATOM 326 OG1 THR A 434 -21.633 -43.051 -55.257 1.00 25.00 O ATOM 327 CG2 THR A 434 -21.865 -45.149 -54.210 1.00 25.00 C ATOM 0 H THR A 434 -19.104 -42.845 -55.940 1.00 25.00 H new ATOM 0 HA THR A 434 -19.910 -43.546 -53.321 1.00 25.00 H new ATOM 0 HB THR A 434 -20.697 -44.786 -55.964 1.00 25.00 H new ATOM 0 HG1 THR A 434 -21.376 -42.690 -56.131 1.00 25.00 H new ATOM 0 HG21 THR A 434 -22.784 -45.335 -54.766 1.00 25.00 H new ATOM 0 HG22 THR A 434 -21.373 -46.097 -53.994 1.00 25.00 H new ATOM 0 HG23 THR A 434 -22.103 -44.643 -53.275 1.00 25.00 H new ATOM 335 N ARG A 435 -18.056 -45.720 -54.969 1.00 25.00 N ATOM 336 CA ARG A 435 -17.271 -46.943 -54.770 1.00 25.00 C ATOM 337 C ARG A 435 -16.276 -46.725 -53.649 1.00 25.00 C ATOM 338 O ARG A 435 -16.009 -47.617 -52.848 1.00 25.00 O ATOM 339 CB ARG A 435 -16.515 -47.331 -56.039 1.00 25.00 C ATOM 340 CG ARG A 435 -17.417 -47.576 -57.229 1.00 25.00 C ATOM 341 CD ARG A 435 -16.679 -48.312 -58.329 1.00 25.00 C ATOM 342 NE ARG A 435 -16.450 -49.720 -57.960 1.00 25.00 N ATOM 343 CZ ARG A 435 -15.547 -50.523 -58.510 1.00 25.00 C ATOM 344 NH1 ARG A 435 -14.731 -50.117 -59.453 1.00 25.00 N ATOM 345 NH2 ARG A 435 -15.460 -51.756 -58.093 1.00 25.00 N ATOM 0 H ARG A 435 -17.920 -45.259 -55.868 1.00 25.00 H new ATOM 0 HA ARG A 435 -17.959 -47.750 -54.517 1.00 25.00 H new ATOM 0 HB2 ARG A 435 -15.807 -46.540 -56.287 1.00 25.00 H new ATOM 0 HB3 ARG A 435 -15.932 -48.231 -55.844 1.00 25.00 H new ATOM 0 HG2 ARG A 435 -18.286 -48.156 -56.918 1.00 25.00 H new ATOM 0 HG3 ARG A 435 -17.789 -46.625 -57.610 1.00 25.00 H new ATOM 0 HD2 ARG A 435 -17.254 -48.263 -59.253 1.00 25.00 H new ATOM 0 HD3 ARG A 435 -15.724 -47.823 -58.522 1.00 25.00 H new ATOM 0 HE ARG A 435 -17.034 -50.110 -57.220 1.00 25.00 H new ATOM 0 HH11 ARG A 435 -14.777 -49.155 -59.788 1.00 25.00 H new ATOM 0 HH12 ARG A 435 -14.050 -50.764 -59.851 1.00 25.00 H new ATOM 0 HH21 ARG A 435 -16.080 -52.090 -57.355 1.00 25.00 H new ATOM 0 HH22 ARG A 435 -14.772 -52.386 -58.505 1.00 25.00 H new ATOM 359 N GLN A 436 -15.725 -45.527 -53.602 1.00 25.00 N ATOM 360 CA GLN A 436 -14.733 -45.193 -52.593 1.00 25.00 C ATOM 361 C GLN A 436 -15.292 -45.163 -51.171 1.00 25.00 C ATOM 362 O GLN A 436 -14.627 -45.621 -50.256 1.00 25.00 O ATOM 363 CB GLN A 436 -14.056 -43.894 -52.936 1.00 25.00 C ATOM 364 CG GLN A 436 -12.995 -44.144 -53.969 1.00 25.00 C ATOM 365 CD GLN A 436 -12.474 -42.891 -54.528 1.00 25.00 C ATOM 366 OE1 GLN A 436 -11.474 -42.362 -54.081 1.00 25.00 O ATOM 367 NE2 GLN A 436 -13.146 -42.393 -55.505 1.00 25.00 N ATOM 0 H GLN A 436 -15.946 -44.769 -54.248 1.00 25.00 H new ATOM 0 HA GLN A 436 -13.997 -45.997 -52.603 1.00 25.00 H new ATOM 0 HB2 GLN A 436 -14.787 -43.179 -53.314 1.00 25.00 H new ATOM 0 HB3 GLN A 436 -13.613 -43.455 -52.042 1.00 25.00 H new ATOM 0 HG2 GLN A 436 -12.178 -44.710 -53.522 1.00 25.00 H new ATOM 0 HG3 GLN A 436 -13.406 -44.757 -54.771 1.00 25.00 H new ATOM 0 HE21 GLN A 436 -13.979 -42.872 -55.847 1.00 25.00 H new ATOM 0 HE22 GLN A 436 -12.846 -41.519 -55.938 1.00 25.00 H new ATOM 376 N VAL A 437 -16.499 -44.645 -50.978 1.00 25.00 N ATOM 377 CA VAL A 437 -17.109 -44.573 -49.644 1.00 25.00 C ATOM 378 C VAL A 437 -17.667 -45.895 -49.144 1.00 25.00 C ATOM 379 O VAL A 437 -17.786 -46.116 -47.951 1.00 25.00 O ATOM 380 CB VAL A 437 -18.259 -43.547 -49.584 1.00 25.00 C ATOM 381 CG1 VAL A 437 -17.713 -42.128 -49.792 1.00 25.00 C ATOM 382 CG2 VAL A 437 -19.348 -43.821 -50.598 1.00 25.00 C ATOM 0 H VAL A 437 -17.080 -44.266 -51.726 1.00 25.00 H new ATOM 0 HA VAL A 437 -16.281 -44.272 -49.002 1.00 25.00 H new ATOM 0 HB VAL A 437 -18.706 -43.639 -48.594 1.00 25.00 H new ATOM 0 HG11 VAL A 437 -18.534 -41.412 -49.748 1.00 25.00 H new ATOM 0 HG12 VAL A 437 -16.989 -41.899 -49.010 1.00 25.00 H new ATOM 0 HG13 VAL A 437 -17.228 -42.064 -50.766 1.00 25.00 H new ATOM 0 HG21 VAL A 437 -20.129 -43.066 -50.507 1.00 25.00 H new ATOM 0 HG22 VAL A 437 -18.926 -43.788 -51.603 1.00 25.00 H new ATOM 0 HG23 VAL A 437 -19.775 -44.807 -50.416 1.00 25.00 H new ATOM 392 N LEU A 438 -18.003 -46.775 -50.062 1.00 25.00 N ATOM 393 CA LEU A 438 -18.455 -48.116 -49.692 1.00 25.00 C ATOM 394 C LEU A 438 -17.294 -48.909 -49.091 1.00 25.00 C ATOM 395 O LEU A 438 -17.481 -49.672 -48.152 1.00 25.00 O ATOM 396 CB LEU A 438 -19.034 -48.851 -50.904 1.00 25.00 C ATOM 397 CG LEU A 438 -20.419 -48.355 -51.363 1.00 25.00 C ATOM 398 CD1 LEU A 438 -20.789 -49.026 -52.682 1.00 25.00 C ATOM 399 CD2 LEU A 438 -21.501 -48.631 -50.314 1.00 25.00 C ATOM 0 H LEU A 438 -17.975 -46.597 -51.066 1.00 25.00 H new ATOM 0 HA LEU A 438 -19.245 -48.022 -48.947 1.00 25.00 H new ATOM 0 HB2 LEU A 438 -18.336 -48.756 -51.736 1.00 25.00 H new ATOM 0 HB3 LEU A 438 -19.105 -49.913 -50.667 1.00 25.00 H new ATOM 0 HG LEU A 438 -20.362 -47.275 -51.498 1.00 25.00 H new ATOM 0 HD11 LEU A 438 -21.769 -48.675 -53.006 1.00 25.00 H new ATOM 0 HD12 LEU A 438 -20.045 -48.776 -53.439 1.00 25.00 H new ATOM 0 HD13 LEU A 438 -20.818 -50.107 -52.545 1.00 25.00 H new ATOM 0 HD21 LEU A 438 -22.462 -48.266 -50.677 1.00 25.00 H new ATOM 0 HD22 LEU A 438 -21.566 -49.704 -50.132 1.00 25.00 H new ATOM 0 HD23 LEU A 438 -21.246 -48.120 -49.385 1.00 25.00 H new ATOM 720 N ALA A 462 -18.065 -32.792 -45.066 1.00 25.00 N ATOM 721 CA ALA A 462 -16.995 -32.924 -44.084 1.00 25.00 C ATOM 722 C ALA A 462 -17.556 -33.408 -42.744 1.00 25.00 C ATOM 723 O ALA A 462 -16.973 -34.273 -42.103 1.00 25.00 O ATOM 724 CB ALA A 462 -16.266 -31.586 -43.913 1.00 25.00 C ATOM 0 HA ALA A 462 -16.280 -33.665 -44.443 1.00 25.00 H new ATOM 0 HB1 ALA A 462 -15.469 -31.697 -43.177 1.00 25.00 H new ATOM 0 HB2 ALA A 462 -15.838 -31.280 -44.868 1.00 25.00 H new ATOM 0 HB3 ALA A 462 -16.971 -30.828 -43.572 1.00 25.00 H new ATOM 730 N LEU A 463 -18.692 -32.864 -42.319 1.00 25.00 N ATOM 731 CA LEU A 463 -19.295 -33.286 -41.059 1.00 25.00 C ATOM 732 C LEU A 463 -19.737 -34.742 -41.160 1.00 25.00 C ATOM 733 O LEU A 463 -19.591 -35.483 -40.210 1.00 25.00 O ATOM 734 CB LEU A 463 -20.441 -32.341 -40.644 1.00 25.00 C ATOM 735 CG LEU A 463 -21.921 -32.692 -40.906 1.00 25.00 C ATOM 736 CD1 LEU A 463 -22.503 -33.661 -39.876 1.00 25.00 C ATOM 737 CD2 LEU A 463 -22.726 -31.412 -40.875 1.00 25.00 C ATOM 0 H LEU A 463 -19.208 -32.140 -42.820 1.00 25.00 H new ATOM 0 HA LEU A 463 -18.551 -33.223 -40.265 1.00 25.00 H new ATOM 0 HB2 LEU A 463 -20.341 -32.177 -39.571 1.00 25.00 H new ATOM 0 HB3 LEU A 463 -20.253 -31.384 -41.132 1.00 25.00 H new ATOM 0 HG LEU A 463 -21.973 -33.186 -41.876 1.00 25.00 H new ATOM 0 HD11 LEU A 463 -23.546 -33.866 -40.118 1.00 25.00 H new ATOM 0 HD12 LEU A 463 -21.937 -34.592 -39.892 1.00 25.00 H new ATOM 0 HD13 LEU A 463 -22.442 -33.216 -38.883 1.00 25.00 H new ATOM 0 HD21 LEU A 463 -23.776 -31.638 -41.058 1.00 25.00 H new ATOM 0 HD22 LEU A 463 -22.622 -30.940 -39.898 1.00 25.00 H new ATOM 0 HD23 LEU A 463 -22.361 -30.734 -41.646 1.00 25.00 H new ATOM 749 N GLN A 464 -20.249 -35.168 -42.306 1.00 25.00 N ATOM 750 CA GLN A 464 -20.646 -36.571 -42.469 1.00 25.00 C ATOM 751 C GLN A 464 -19.431 -37.481 -42.406 1.00 25.00 C ATOM 752 O GLN A 464 -19.506 -38.602 -41.909 1.00 25.00 O ATOM 753 CB GLN A 464 -21.380 -36.784 -43.788 1.00 25.00 C ATOM 754 CG GLN A 464 -22.784 -36.218 -43.788 1.00 25.00 C ATOM 755 CD GLN A 464 -23.669 -36.864 -42.739 1.00 25.00 C ATOM 756 OE1 GLN A 464 -24.000 -36.256 -41.736 1.00 25.00 O ATOM 757 NE2 GLN A 464 -24.044 -38.097 -42.960 1.00 25.00 N ATOM 0 H GLN A 464 -20.400 -34.580 -43.126 1.00 25.00 H new ATOM 0 HA GLN A 464 -21.322 -36.821 -41.651 1.00 25.00 H new ATOM 0 HB2 GLN A 464 -20.809 -36.321 -44.593 1.00 25.00 H new ATOM 0 HB3 GLN A 464 -21.426 -37.852 -44.002 1.00 25.00 H new ATOM 0 HG2 GLN A 464 -22.739 -35.144 -43.610 1.00 25.00 H new ATOM 0 HG3 GLN A 464 -23.230 -36.360 -44.773 1.00 25.00 H new ATOM 0 HE21 GLN A 464 -23.748 -38.575 -43.811 1.00 25.00 H new ATOM 0 HE22 GLN A 464 -24.633 -38.580 -42.282 1.00 25.00 H new ATOM 766 N GLY A 465 -18.305 -36.984 -42.887 1.00 25.00 N ATOM 767 CA GLY A 465 -17.064 -37.722 -42.784 1.00 25.00 C ATOM 768 C GLY A 465 -16.730 -37.845 -41.317 1.00 25.00 C ATOM 769 O GLY A 465 -16.455 -38.931 -40.831 1.00 25.00 O ATOM 0 H GLY A 465 -18.227 -36.078 -43.349 1.00 25.00 H new ATOM 0 HA2 GLY A 465 -17.165 -38.708 -43.238 1.00 25.00 H new ATOM 0 HA3 GLY A 465 -16.266 -37.206 -43.317 1.00 25.00 H new ATOM 773 N ALA A 466 -16.789 -36.729 -40.601 1.00 25.00 N ATOM 774 CA ALA A 466 -16.513 -36.703 -39.168 1.00 25.00 C ATOM 775 C ALA A 466 -17.408 -37.694 -38.397 1.00 25.00 C ATOM 776 O ALA A 466 -16.957 -38.332 -37.459 1.00 25.00 O ATOM 777 CB ALA A 466 -16.691 -35.280 -38.630 1.00 25.00 C ATOM 0 H ALA A 466 -17.029 -35.819 -40.994 1.00 25.00 H new ATOM 0 HA ALA A 466 -15.480 -37.016 -39.016 1.00 25.00 H new ATOM 0 HB1 ALA A 466 -16.484 -35.267 -37.560 1.00 25.00 H new ATOM 0 HB2 ALA A 466 -16.001 -34.609 -39.141 1.00 25.00 H new ATOM 0 HB3 ALA A 466 -17.715 -34.950 -38.805 1.00 25.00 H new ATOM 783 N GLN A 467 -18.664 -37.827 -38.803 1.00 25.00 N ATOM 784 CA GLN A 467 -19.588 -38.775 -38.164 1.00 25.00 C ATOM 785 C GLN A 467 -19.111 -40.213 -38.370 1.00 25.00 C ATOM 786 O GLN A 467 -19.095 -41.018 -37.440 1.00 25.00 O ATOM 787 CB GLN A 467 -20.976 -38.670 -38.800 1.00 25.00 C ATOM 788 CG GLN A 467 -21.692 -37.322 -38.647 1.00 25.00 C ATOM 789 CD GLN A 467 -22.522 -37.189 -37.392 1.00 25.00 C ATOM 790 OE1 GLN A 467 -23.121 -38.135 -36.911 1.00 25.00 O ATOM 791 NE2 GLN A 467 -22.565 -35.993 -36.862 1.00 25.00 N ATOM 0 H GLN A 467 -19.073 -37.294 -39.571 1.00 25.00 H new ATOM 0 HA GLN A 467 -19.624 -38.530 -37.102 1.00 25.00 H new ATOM 0 HB2 GLN A 467 -20.883 -38.889 -39.864 1.00 25.00 H new ATOM 0 HB3 GLN A 467 -21.610 -39.445 -38.369 1.00 25.00 H new ATOM 0 HG2 GLN A 467 -20.947 -36.526 -38.660 1.00 25.00 H new ATOM 0 HG3 GLN A 467 -22.338 -37.168 -39.512 1.00 25.00 H new ATOM 0 HE21 GLN A 467 -22.050 -35.225 -37.293 1.00 25.00 H new ATOM 0 HE22 GLN A 467 -23.113 -35.829 -36.018 1.00 25.00 H new ATOM 800 N ALA A 468 -18.737 -40.536 -39.601 1.00 25.00 N ATOM 801 CA ALA A 468 -18.318 -41.891 -39.942 1.00 25.00 C ATOM 802 C ALA A 468 -16.995 -42.253 -39.268 1.00 25.00 C ATOM 803 O ALA A 468 -16.850 -43.335 -38.695 1.00 25.00 O ATOM 804 CB ALA A 468 -18.195 -42.025 -41.468 1.00 25.00 C ATOM 0 H ALA A 468 -18.715 -39.879 -40.381 1.00 25.00 H new ATOM 0 HA ALA A 468 -19.074 -42.586 -39.577 1.00 25.00 H new ATOM 0 HB1 ALA A 468 -17.882 -43.038 -41.720 1.00 25.00 H new ATOM 0 HB2 ALA A 468 -19.160 -41.818 -41.930 1.00 25.00 H new ATOM 0 HB3 ALA A 468 -17.456 -41.314 -41.837 1.00 25.00 H new ATOM 810 N VAL A 469 -16.028 -41.349 -39.326 1.00 25.00 N ATOM 811 CA VAL A 469 -14.721 -41.616 -38.733 1.00 25.00 C ATOM 812 C VAL A 469 -14.828 -41.659 -37.219 1.00 25.00 C ATOM 813 O VAL A 469 -14.038 -42.321 -36.579 1.00 25.00 O ATOM 814 CB VAL A 469 -13.621 -40.601 -39.172 1.00 25.00 C ATOM 815 CG1 VAL A 469 -13.530 -40.548 -40.702 1.00 25.00 C ATOM 816 CG2 VAL A 469 -13.887 -39.217 -38.611 1.00 25.00 C ATOM 0 H VAL A 469 -16.118 -40.435 -39.771 1.00 25.00 H new ATOM 0 HA VAL A 469 -14.406 -42.590 -39.107 1.00 25.00 H new ATOM 0 HB VAL A 469 -12.668 -40.945 -38.770 1.00 25.00 H new ATOM 0 HG11 VAL A 469 -12.759 -39.836 -40.996 1.00 25.00 H new ATOM 0 HG12 VAL A 469 -13.277 -41.536 -41.086 1.00 25.00 H new ATOM 0 HG13 VAL A 469 -14.489 -40.234 -41.113 1.00 25.00 H new ATOM 0 HG21 VAL A 469 -13.101 -38.535 -38.937 1.00 25.00 H new ATOM 0 HG22 VAL A 469 -14.851 -38.858 -38.971 1.00 25.00 H new ATOM 0 HG23 VAL A 469 -13.900 -39.262 -37.522 1.00 25.00 H new ATOM 826 N ALA A 470 -15.805 -40.972 -36.638 1.00 25.00 N ATOM 827 CA ALA A 470 -15.978 -40.976 -35.181 1.00 25.00 C ATOM 828 C ALA A 470 -16.162 -42.399 -34.648 1.00 25.00 C ATOM 829 O ALA A 470 -15.746 -42.700 -33.529 1.00 25.00 O ATOM 830 CB ALA A 470 -17.167 -40.101 -34.770 1.00 25.00 C ATOM 0 H ALA A 470 -16.487 -40.408 -37.145 1.00 25.00 H new ATOM 0 HA ALA A 470 -15.071 -40.561 -34.742 1.00 25.00 H new ATOM 0 HB1 ALA A 470 -17.275 -40.120 -33.686 1.00 25.00 H new ATOM 0 HB2 ALA A 470 -16.996 -39.076 -35.100 1.00 25.00 H new ATOM 0 HB3 ALA A 470 -18.077 -40.484 -35.232 1.00 25.00 H new ATOM 836 N ALA A 471 -16.764 -43.277 -35.442 1.00 25.00 N ATOM 837 CA ALA A 471 -16.934 -44.668 -35.034 1.00 25.00 C ATOM 838 C ALA A 471 -15.558 -45.345 -34.929 1.00 25.00 C ATOM 839 O ALA A 471 -15.318 -46.140 -34.027 1.00 25.00 O ATOM 840 CB ALA A 471 -17.827 -45.407 -36.036 1.00 25.00 C ATOM 0 H ALA A 471 -17.140 -43.054 -36.364 1.00 25.00 H new ATOM 0 HA ALA A 471 -17.418 -44.702 -34.058 1.00 25.00 H new ATOM 0 HB1 ALA A 471 -17.947 -46.444 -35.721 1.00 25.00 H new ATOM 0 HB2 ALA A 471 -18.804 -44.925 -36.077 1.00 25.00 H new ATOM 0 HB3 ALA A 471 -17.367 -45.379 -37.024 1.00 25.00 H new ATOM 846 N ALA A 472 -14.659 -45.012 -35.843 1.00 25.00 N ATOM 847 CA ALA A 472 -13.297 -45.538 -35.809 1.00 25.00 C ATOM 848 C ALA A 472 -12.506 -44.884 -34.668 1.00 25.00 C ATOM 849 O ALA A 472 -11.702 -45.531 -34.016 1.00 25.00 O ATOM 850 CB ALA A 472 -12.599 -45.299 -37.157 1.00 25.00 C ATOM 0 H ALA A 472 -14.846 -44.379 -36.620 1.00 25.00 H new ATOM 0 HA ALA A 472 -13.339 -46.612 -35.630 1.00 25.00 H new ATOM 0 HB1 ALA A 472 -11.585 -45.696 -37.117 1.00 25.00 H new ATOM 0 HB2 ALA A 472 -13.155 -45.802 -37.949 1.00 25.00 H new ATOM 0 HB3 ALA A 472 -12.562 -44.229 -37.363 1.00 25.00 H new ATOM 856 N GLN A 473 -12.733 -43.600 -34.431 1.00 25.00 N ATOM 857 CA GLN A 473 -12.023 -42.882 -33.374 1.00 25.00 C ATOM 858 C GLN A 473 -12.370 -43.394 -31.985 1.00 25.00 C ATOM 859 O GLN A 473 -11.491 -43.645 -31.166 1.00 25.00 O ATOM 860 CB GLN A 473 -12.347 -41.384 -33.412 1.00 25.00 C ATOM 861 CG GLN A 473 -11.923 -40.655 -34.682 1.00 25.00 C ATOM 862 CD GLN A 473 -10.426 -40.497 -34.822 1.00 25.00 C ATOM 863 OE1 GLN A 473 -9.681 -40.621 -33.863 1.00 25.00 O ATOM 864 NE2 GLN A 473 -9.984 -40.220 -36.018 1.00 25.00 N ATOM 0 H GLN A 473 -13.401 -43.032 -34.953 1.00 25.00 H new ATOM 0 HA GLN A 473 -10.963 -43.053 -33.564 1.00 25.00 H new ATOM 0 HB2 GLN A 473 -13.422 -41.259 -33.283 1.00 25.00 H new ATOM 0 HB3 GLN A 473 -11.866 -40.904 -32.560 1.00 25.00 H new ATOM 0 HG2 GLN A 473 -12.304 -41.198 -35.547 1.00 25.00 H new ATOM 0 HG3 GLN A 473 -12.386 -39.668 -34.696 1.00 25.00 H new ATOM 0 HE21 GLN A 473 -10.639 -40.124 -36.794 1.00 25.00 H new ATOM 0 HE22 GLN A 473 -8.984 -40.099 -36.177 1.00 25.00 H new ATOM 873 N ARG A 474 -13.655 -43.569 -31.708 1.00 25.00 N ATOM 874 CA ARG A 474 -14.069 -44.085 -30.395 1.00 25.00 C ATOM 875 C ARG A 474 -13.522 -45.496 -30.208 1.00 25.00 C ATOM 876 O ARG A 474 -13.268 -45.932 -29.091 1.00 25.00 O ATOM 877 CB ARG A 474 -15.597 -44.041 -30.228 1.00 25.00 C ATOM 878 CG ARG A 474 -16.382 -44.965 -31.145 1.00 25.00 C ATOM 879 CD ARG A 474 -17.877 -44.677 -31.085 1.00 25.00 C ATOM 880 NE ARG A 474 -18.444 -44.938 -29.751 1.00 25.00 N ATOM 881 CZ ARG A 474 -19.707 -44.717 -29.399 1.00 25.00 C ATOM 882 NH1 ARG A 474 -20.591 -44.222 -30.232 1.00 25.00 N ATOM 883 NH2 ARG A 474 -20.086 -44.992 -28.181 1.00 25.00 N ATOM 0 H ARG A 474 -14.419 -43.369 -32.353 1.00 25.00 H new ATOM 0 HA ARG A 474 -13.654 -43.444 -29.617 1.00 25.00 H new ATOM 0 HB2 ARG A 474 -15.840 -44.291 -29.195 1.00 25.00 H new ATOM 0 HB3 ARG A 474 -15.934 -43.018 -30.396 1.00 25.00 H new ATOM 0 HG2 ARG A 474 -16.029 -44.848 -32.170 1.00 25.00 H new ATOM 0 HG3 ARG A 474 -16.199 -46.001 -30.862 1.00 25.00 H new ATOM 0 HD2 ARG A 474 -18.055 -43.636 -31.356 1.00 25.00 H new ATOM 0 HD3 ARG A 474 -18.393 -45.291 -31.823 1.00 25.00 H new ATOM 0 HE ARG A 474 -17.818 -45.318 -29.041 1.00 25.00 H new ATOM 0 HH11 ARG A 474 -20.319 -43.992 -31.188 1.00 25.00 H new ATOM 0 HH12 ARG A 474 -21.551 -44.067 -29.924 1.00 25.00 H new ATOM 0 HH21 ARG A 474 -19.416 -45.372 -27.512 1.00 25.00 H new ATOM 0 HH22 ARG A 474 -21.052 -44.827 -27.898 1.00 25.00 H new ATOM 897 N LEU A 475 -13.331 -46.190 -31.317 1.00 25.00 N ATOM 898 CA LEU A 475 -12.759 -47.527 -31.312 1.00 25.00 C ATOM 899 C LEU A 475 -11.249 -47.483 -31.026 1.00 25.00 C ATOM 900 O LEU A 475 -10.780 -48.195 -30.147 1.00 25.00 O ATOM 901 CB LEU A 475 -13.050 -48.200 -32.668 1.00 25.00 C ATOM 902 CG LEU A 475 -11.986 -49.118 -33.284 1.00 25.00 C ATOM 903 CD1 LEU A 475 -11.825 -50.404 -32.462 1.00 25.00 C ATOM 904 CD2 LEU A 475 -12.363 -49.474 -34.709 1.00 25.00 C ATOM 0 H LEU A 475 -13.568 -45.843 -32.247 1.00 25.00 H new ATOM 0 HA LEU A 475 -13.217 -48.112 -30.514 1.00 25.00 H new ATOM 0 HB2 LEU A 475 -13.964 -48.783 -32.557 1.00 25.00 H new ATOM 0 HB3 LEU A 475 -13.261 -47.410 -33.389 1.00 25.00 H new ATOM 0 HG LEU A 475 -11.038 -48.581 -33.281 1.00 25.00 H new ATOM 0 HD11 LEU A 475 -11.065 -51.036 -32.921 1.00 25.00 H new ATOM 0 HD12 LEU A 475 -11.522 -50.151 -31.446 1.00 25.00 H new ATOM 0 HD13 LEU A 475 -12.774 -50.939 -32.434 1.00 25.00 H new ATOM 0 HD21 LEU A 475 -11.600 -50.126 -35.135 1.00 25.00 H new ATOM 0 HD22 LEU A 475 -13.324 -49.989 -34.713 1.00 25.00 H new ATOM 0 HD23 LEU A 475 -12.436 -48.564 -35.304 1.00 25.00 H new ATOM 916 N VAL A 476 -10.484 -46.674 -31.751 1.00 25.00 N ATOM 917 CA VAL A 476 -9.027 -46.660 -31.566 1.00 25.00 C ATOM 918 C VAL A 476 -8.698 -46.190 -30.158 1.00 25.00 C ATOM 919 O VAL A 476 -7.772 -46.693 -29.515 1.00 25.00 O ATOM 920 CB VAL A 476 -8.278 -45.822 -32.663 1.00 25.00 C ATOM 921 CG1 VAL A 476 -8.637 -44.356 -32.617 1.00 25.00 C ATOM 922 CG2 VAL A 476 -6.763 -45.994 -32.531 1.00 25.00 C ATOM 0 H VAL A 476 -10.834 -46.029 -32.460 1.00 25.00 H new ATOM 0 HA VAL A 476 -8.662 -47.679 -31.690 1.00 25.00 H new ATOM 0 HB VAL A 476 -8.604 -46.207 -33.629 1.00 25.00 H new ATOM 0 HG11 VAL A 476 -8.092 -43.823 -33.396 1.00 25.00 H new ATOM 0 HG12 VAL A 476 -9.708 -44.239 -32.779 1.00 25.00 H new ATOM 0 HG13 VAL A 476 -8.370 -43.947 -31.643 1.00 25.00 H new ATOM 0 HG21 VAL A 476 -6.262 -45.406 -33.300 1.00 25.00 H new ATOM 0 HG22 VAL A 476 -6.443 -45.653 -31.547 1.00 25.00 H new ATOM 0 HG23 VAL A 476 -6.504 -47.046 -32.653 1.00 25.00 H new ATOM 932 N HIS A 477 -9.480 -45.246 -29.662 1.00 25.00 N ATOM 933 CA HIS A 477 -9.301 -44.740 -28.326 1.00 25.00 C ATOM 934 C HIS A 477 -9.527 -45.849 -27.307 1.00 25.00 C ATOM 935 O HIS A 477 -8.846 -45.902 -26.297 1.00 25.00 O ATOM 936 CB HIS A 477 -10.265 -43.583 -28.081 1.00 25.00 C ATOM 937 CG HIS A 477 -9.947 -42.797 -26.850 1.00 25.00 C ATOM 938 ND1 HIS A 477 -10.811 -41.931 -26.230 1.00 25.00 N ATOM 939 CD2 HIS A 477 -8.809 -42.751 -26.108 1.00 25.00 C ATOM 940 CE1 HIS A 477 -10.191 -41.414 -25.171 1.00 25.00 C ATOM 941 NE2 HIS A 477 -8.968 -41.885 -25.046 1.00 25.00 N ATOM 0 H HIS A 477 -10.249 -44.816 -30.176 1.00 25.00 H new ATOM 0 HA HIS A 477 -8.279 -44.377 -28.215 1.00 25.00 H new ATOM 0 HB2 HIS A 477 -10.248 -42.917 -28.943 1.00 25.00 H new ATOM 0 HB3 HIS A 477 -11.279 -43.975 -28.001 1.00 25.00 H new ATOM 0 HD2 HIS A 477 -7.910 -43.311 -26.319 1.00 25.00 H new ATOM 0 HE1 HIS A 477 -10.637 -40.697 -24.498 1.00 25.00 H new ATOM 0 HE2 HIS A 477 -8.286 -41.659 -24.322 1.00 25.00 H new ATOM 949 N ALA A 478 -10.466 -46.750 -27.571 1.00 25.00 N ATOM 950 CA ALA A 478 -10.738 -47.833 -26.636 1.00 25.00 C ATOM 951 C ALA A 478 -9.482 -48.688 -26.435 1.00 25.00 C ATOM 952 O ALA A 478 -9.145 -49.046 -25.314 1.00 25.00 O ATOM 953 CB ALA A 478 -11.903 -48.693 -27.136 1.00 25.00 C ATOM 0 H ALA A 478 -11.044 -46.753 -28.412 1.00 25.00 H new ATOM 0 HA ALA A 478 -11.020 -47.402 -25.675 1.00 25.00 H new ATOM 0 HB1 ALA A 478 -12.093 -49.497 -26.425 1.00 25.00 H new ATOM 0 HB2 ALA A 478 -12.796 -48.076 -27.232 1.00 25.00 H new ATOM 0 HB3 ALA A 478 -11.650 -49.119 -28.107 1.00 25.00 H new ATOM 959 N ILE A 479 -8.780 -49.004 -27.515 1.00 25.00 N ATOM 960 CA ILE A 479 -7.572 -49.824 -27.409 1.00 25.00 C ATOM 961 C ILE A 479 -6.458 -49.022 -26.768 1.00 25.00 C ATOM 962 O ILE A 479 -5.659 -49.561 -26.021 1.00 25.00 O ATOM 963 CB ILE A 479 -7.077 -50.328 -28.780 1.00 25.00 C ATOM 964 CG1 ILE A 479 -8.204 -51.050 -29.522 1.00 25.00 C ATOM 965 CG2 ILE A 479 -5.883 -51.298 -28.623 1.00 25.00 C ATOM 966 CD1 ILE A 479 -8.434 -50.455 -30.848 1.00 25.00 C ATOM 0 H ILE A 479 -9.018 -48.712 -28.463 1.00 25.00 H new ATOM 0 HA ILE A 479 -7.834 -50.689 -26.799 1.00 25.00 H new ATOM 0 HB ILE A 479 -6.755 -49.457 -29.350 1.00 25.00 H new ATOM 0 HG12 ILE A 479 -7.953 -52.105 -29.632 1.00 25.00 H new ATOM 0 HG13 ILE A 479 -9.121 -51.000 -28.934 1.00 25.00 H new ATOM 0 HG21 ILE A 479 -5.557 -51.636 -29.607 1.00 25.00 H new ATOM 0 HG22 ILE A 479 -5.061 -50.785 -28.124 1.00 25.00 H new ATOM 0 HG23 ILE A 479 -6.189 -52.158 -28.027 1.00 25.00 H new ATOM 0 HD11 ILE A 479 -9.240 -50.989 -31.351 1.00 25.00 H new ATOM 0 HD12 ILE A 479 -8.709 -49.406 -30.734 1.00 25.00 H new ATOM 0 HD13 ILE A 479 -7.523 -50.528 -31.443 1.00 25.00 H new ATOM 978 N ALA A 480 -6.414 -47.725 -27.038 1.00 25.00 N ATOM 979 CA ALA A 480 -5.392 -46.860 -26.463 1.00 25.00 C ATOM 980 C ALA A 480 -5.491 -46.901 -24.931 1.00 25.00 C ATOM 981 O ALA A 480 -4.509 -46.696 -24.216 1.00 25.00 O ATOM 982 CB ALA A 480 -5.560 -45.425 -26.989 1.00 25.00 C ATOM 0 H ALA A 480 -7.074 -47.248 -27.652 1.00 25.00 H new ATOM 0 HA ALA A 480 -4.404 -47.213 -26.758 1.00 25.00 H new ATOM 0 HB1 ALA A 480 -4.792 -44.786 -26.554 1.00 25.00 H new ATOM 0 HB2 ALA A 480 -5.463 -45.422 -28.075 1.00 25.00 H new ATOM 0 HB3 ALA A 480 -6.545 -45.049 -26.712 1.00 25.00 H new ATOM 988 N LEU A 481 -6.684 -47.179 -24.428 1.00 25.00 N ATOM 989 CA LEU A 481 -6.878 -47.301 -22.985 1.00 25.00 C ATOM 990 C LEU A 481 -6.423 -48.662 -22.538 1.00 25.00 C ATOM 991 O LEU A 481 -5.769 -48.802 -21.533 1.00 25.00 O ATOM 992 CB LEU A 481 -8.332 -47.088 -22.598 1.00 25.00 C ATOM 993 CG LEU A 481 -8.769 -45.692 -23.015 1.00 25.00 C ATOM 994 CD1 LEU A 481 -10.271 -45.676 -23.206 1.00 25.00 C ATOM 995 CD2 LEU A 481 -8.343 -44.626 -22.018 1.00 25.00 C ATOM 0 H LEU A 481 -7.525 -47.323 -24.987 1.00 25.00 H new ATOM 0 HA LEU A 481 -6.288 -46.529 -22.492 1.00 25.00 H new ATOM 0 HB2 LEU A 481 -8.961 -47.837 -23.080 1.00 25.00 H new ATOM 0 HB3 LEU A 481 -8.455 -47.213 -21.522 1.00 25.00 H new ATOM 0 HG LEU A 481 -8.273 -45.451 -23.955 1.00 25.00 H new ATOM 0 HD11 LEU A 481 -10.589 -44.677 -23.505 1.00 25.00 H new ATOM 0 HD12 LEU A 481 -10.547 -46.392 -23.980 1.00 25.00 H new ATOM 0 HD13 LEU A 481 -10.760 -45.947 -22.270 1.00 25.00 H new ATOM 0 HD21 LEU A 481 -8.680 -43.649 -22.364 1.00 25.00 H new ATOM 0 HD22 LEU A 481 -8.786 -44.839 -21.045 1.00 25.00 H new ATOM 0 HD23 LEU A 481 -7.257 -44.624 -21.929 1.00 25.00 H new ATOM 1007 N MET A 482 -6.758 -49.683 -23.303 1.00 25.00 N ATOM 1008 CA MET A 482 -6.357 -51.041 -22.947 1.00 25.00 C ATOM 1009 C MET A 482 -4.863 -51.196 -22.901 1.00 25.00 C ATOM 1010 O MET A 482 -4.346 -52.044 -22.170 1.00 25.00 O ATOM 1011 CB MET A 482 -6.912 -52.046 -23.944 1.00 25.00 C ATOM 1012 CG MET A 482 -8.378 -51.986 -23.970 1.00 25.00 C ATOM 1013 SD MET A 482 -9.150 -53.505 -24.560 1.00 25.00 S ATOM 1014 CE MET A 482 -9.027 -53.275 -26.342 1.00 25.00 C ATOM 0 H MET A 482 -7.299 -49.607 -24.164 1.00 25.00 H new ATOM 0 HA MET A 482 -6.763 -51.231 -21.953 1.00 25.00 H new ATOM 0 HB2 MET A 482 -6.516 -51.838 -24.938 1.00 25.00 H new ATOM 0 HB3 MET A 482 -6.588 -53.051 -23.675 1.00 25.00 H new ATOM 0 HG2 MET A 482 -8.743 -51.769 -22.966 1.00 25.00 H new ATOM 0 HG3 MET A 482 -8.689 -51.159 -24.608 1.00 25.00 H new ATOM 0 HE1 MET A 482 -9.463 -54.135 -26.851 1.00 25.00 H new ATOM 0 HE2 MET A 482 -9.564 -52.372 -26.630 1.00 25.00 H new ATOM 0 HE3 MET A 482 -7.979 -53.179 -26.625 1.00 25.00 H new ATOM 1024 N THR A 483 -4.162 -50.392 -23.679 1.00 25.00 N ATOM 1025 CA THR A 483 -2.714 -50.525 -23.746 1.00 25.00 C ATOM 1026 C THR A 483 -2.068 -49.836 -22.560 1.00 25.00 C ATOM 1027 O THR A 483 -1.076 -50.323 -22.037 1.00 25.00 O ATOM 1028 CB THR A 483 -2.166 -49.979 -25.068 1.00 25.00 C ATOM 1029 OG1 THR A 483 -2.651 -48.654 -25.273 1.00 25.00 O ATOM 1030 CG2 THR A 483 -2.633 -50.850 -26.231 1.00 25.00 C ATOM 0 H THR A 483 -4.558 -49.655 -24.262 1.00 25.00 H new ATOM 0 HA THR A 483 -2.466 -51.586 -23.705 1.00 25.00 H new ATOM 0 HB THR A 483 -1.077 -49.981 -25.022 1.00 25.00 H new ATOM 0 HG1 THR A 483 -2.299 -48.304 -26.118 1.00 25.00 H new ATOM 0 HG21 THR A 483 -2.237 -50.452 -27.165 1.00 25.00 H new ATOM 0 HG22 THR A 483 -2.273 -51.869 -26.090 1.00 25.00 H new ATOM 0 HG23 THR A 483 -3.722 -50.852 -26.270 1.00 25.00 H new ATOM 1038 N GLN A 484 -2.636 -48.724 -22.109 1.00 25.00 N ATOM 1039 CA GLN A 484 -2.096 -48.044 -20.929 1.00 25.00 C ATOM 1040 C GLN A 484 -2.581 -48.732 -19.648 1.00 25.00 C ATOM 1041 O GLN A 484 -1.927 -48.654 -18.618 1.00 25.00 O ATOM 1042 CB GLN A 484 -2.437 -46.544 -20.932 1.00 25.00 C ATOM 1043 CG GLN A 484 -3.902 -46.216 -20.728 1.00 25.00 C ATOM 1044 CD GLN A 484 -4.199 -44.751 -20.931 1.00 25.00 C ATOM 1045 OE1 GLN A 484 -4.268 -43.984 -19.987 1.00 25.00 O ATOM 1046 NE2 GLN A 484 -4.386 -44.359 -22.163 1.00 25.00 N ATOM 0 H GLN A 484 -3.452 -48.279 -22.528 1.00 25.00 H new ATOM 0 HA GLN A 484 -1.009 -48.118 -20.963 1.00 25.00 H new ATOM 0 HB2 GLN A 484 -1.859 -46.055 -20.148 1.00 25.00 H new ATOM 0 HB3 GLN A 484 -2.114 -46.116 -21.881 1.00 25.00 H new ATOM 0 HG2 GLN A 484 -4.503 -46.805 -21.421 1.00 25.00 H new ATOM 0 HG3 GLN A 484 -4.200 -46.508 -19.721 1.00 25.00 H new ATOM 0 HE21 GLN A 484 -4.320 -45.031 -22.928 1.00 25.00 H new ATOM 0 HE22 GLN A 484 -4.598 -43.381 -22.360 1.00 25.00 H new ATOM 1055 N PHE A 485 -3.717 -49.423 -19.711 1.00 25.00 N ATOM 1056 CA PHE A 485 -4.212 -50.171 -18.570 1.00 25.00 C ATOM 1057 C PHE A 485 -3.445 -51.472 -18.425 1.00 25.00 C ATOM 1058 O PHE A 485 -3.433 -52.078 -17.361 1.00 25.00 O ATOM 1059 CB PHE A 485 -5.689 -50.518 -18.767 1.00 25.00 C ATOM 1060 CG PHE A 485 -6.636 -49.543 -18.123 1.00 25.00 C ATOM 1061 CD1 PHE A 485 -6.754 -48.218 -18.592 1.00 25.00 C ATOM 1062 CD2 PHE A 485 -7.428 -49.953 -17.038 1.00 25.00 C ATOM 1063 CE1 PHE A 485 -7.657 -47.313 -17.985 1.00 25.00 C ATOM 1064 CE2 PHE A 485 -8.337 -49.058 -16.421 1.00 25.00 C ATOM 1065 CZ PHE A 485 -8.450 -47.735 -16.897 1.00 25.00 C ATOM 0 H PHE A 485 -4.307 -49.477 -20.541 1.00 25.00 H new ATOM 0 HA PHE A 485 -4.083 -49.554 -17.681 1.00 25.00 H new ATOM 0 HB2 PHE A 485 -5.902 -50.564 -19.835 1.00 25.00 H new ATOM 0 HB3 PHE A 485 -5.876 -51.512 -18.361 1.00 25.00 H new ATOM 0 HD1 PHE A 485 -6.148 -47.890 -19.424 1.00 25.00 H new ATOM 0 HD2 PHE A 485 -7.343 -50.964 -16.669 1.00 25.00 H new ATOM 0 HE1 PHE A 485 -7.739 -46.301 -18.354 1.00 25.00 H new ATOM 0 HE2 PHE A 485 -8.941 -49.388 -15.589 1.00 25.00 H new ATOM 0 HZ PHE A 485 -9.141 -47.048 -16.431 1.00 25.00 H new