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 -93:sc= -0.333 (180deg=-0.631) USER MOD Single : A 433 MET CE :methyl -157:sc=-0.00779 (180deg=-0.673) USER MOD Single : A 434 THR OG1 : rot 70:sc= 1.32 USER MOD Single : A 436 GLN : amide:sc= 0.401 X(o=0.4,f=0) USER MOD Single : A 464 GLN : amide:sc= -0.223 X(o=-0.22,f=-0.24) USER MOD Single : A 467 GLN : amide:sc= 0 K(o=0,f=-0.83) USER MOD Single : A 473 GLN : amide:sc= 0 K(o=0,f=-0.8) USER MOD Single : A 477 HIS : no HD1:sc=-0.00993 X(o=-0.0099,f=0) USER MOD Single : A 482 MET CE :methyl 180:sc= -0.0233 (180deg=-0.0233) USER MOD Single : A 483 THR OG1 : rot 180:sc= 0 USER MOD Single : A 484 GLN : amide:sc= 0.307 X(o=0.31,f=-0.045) USER MOD ----------------------------------------------------------------- ATOM 113 N GLU A 419 5.689 -14.901 -23.277 1.00 25.00 N ATOM 114 CA GLU A 419 4.317 -14.953 -22.773 1.00 25.00 C ATOM 115 C GLU A 419 3.555 -13.775 -23.363 1.00 25.00 C ATOM 116 O GLU A 419 2.415 -13.901 -23.777 1.00 25.00 O ATOM 117 CB GLU A 419 4.305 -14.870 -21.240 1.00 25.00 C ATOM 118 CG GLU A 419 5.022 -16.036 -20.557 1.00 25.00 C ATOM 119 CD GLU A 419 5.231 -15.805 -19.062 1.00 25.00 C ATOM 120 OE1 GLU A 419 5.942 -14.835 -18.701 1.00 25.00 O ATOM 121 OE2 GLU A 419 4.710 -16.593 -18.252 1.00 25.00 O ATOM 0 HA GLU A 419 3.849 -15.894 -23.063 1.00 25.00 H new ATOM 0 HB2 GLU A 419 4.774 -13.936 -20.932 1.00 25.00 H new ATOM 0 HB3 GLU A 419 3.272 -14.837 -20.894 1.00 25.00 H new ATOM 0 HG2 GLU A 419 4.443 -16.948 -20.702 1.00 25.00 H new ATOM 0 HG3 GLU A 419 5.989 -16.193 -21.035 1.00 25.00 H new ATOM 128 N VAL A 420 4.216 -12.627 -23.414 1.00 25.00 N ATOM 129 CA VAL A 420 3.616 -11.412 -23.968 1.00 25.00 C ATOM 130 C VAL A 420 3.385 -11.569 -25.467 1.00 25.00 C ATOM 131 O VAL A 420 2.426 -11.043 -26.011 1.00 25.00 O ATOM 132 CB VAL A 420 4.518 -10.173 -23.688 1.00 25.00 C ATOM 133 CG1 VAL A 420 3.923 -8.887 -24.292 1.00 25.00 C ATOM 134 CG2 VAL A 420 4.682 -9.990 -22.180 1.00 25.00 C ATOM 0 H VAL A 420 5.172 -12.507 -23.078 1.00 25.00 H new ATOM 0 HA VAL A 420 2.654 -11.254 -23.480 1.00 25.00 H new ATOM 0 HB VAL A 420 5.486 -10.353 -24.156 1.00 25.00 H new ATOM 0 HG11 VAL A 420 4.581 -8.045 -24.076 1.00 25.00 H new ATOM 0 HG12 VAL A 420 3.826 -9.003 -25.371 1.00 25.00 H new ATOM 0 HG13 VAL A 420 2.941 -8.701 -23.857 1.00 25.00 H new ATOM 0 HG21 VAL A 420 5.313 -9.123 -21.985 1.00 25.00 H new ATOM 0 HG22 VAL A 420 3.704 -9.837 -21.724 1.00 25.00 H new ATOM 0 HG23 VAL A 420 5.146 -10.880 -21.754 1.00 25.00 H new ATOM 144 N SER A 421 4.253 -12.308 -26.137 1.00 25.00 N ATOM 145 CA SER A 421 4.109 -12.512 -27.574 1.00 25.00 C ATOM 146 C SER A 421 2.819 -13.257 -27.899 1.00 25.00 C ATOM 147 O SER A 421 2.122 -12.913 -28.850 1.00 25.00 O ATOM 148 CB SER A 421 5.290 -13.305 -28.118 1.00 25.00 C ATOM 149 OG SER A 421 6.507 -12.597 -27.932 1.00 25.00 O ATOM 0 H SER A 421 5.058 -12.774 -25.717 1.00 25.00 H new ATOM 0 HA SER A 421 4.077 -11.529 -28.043 1.00 25.00 H new ATOM 0 HB2 SER A 421 5.346 -14.271 -27.616 1.00 25.00 H new ATOM 0 HB3 SER A 421 5.140 -13.506 -29.179 1.00 25.00 H new ATOM 0 HG SER A 421 7.251 -13.127 -28.287 1.00 25.00 H new ATOM 155 N ASP A 422 2.498 -14.269 -27.106 1.00 25.00 N ATOM 156 CA ASP A 422 1.266 -15.030 -27.315 1.00 25.00 C ATOM 157 C ASP A 422 0.072 -14.217 -26.825 1.00 25.00 C ATOM 158 O ASP A 422 -1.005 -14.249 -27.402 1.00 25.00 O ATOM 159 CB ASP A 422 1.337 -16.362 -26.568 1.00 25.00 C ATOM 160 CG ASP A 422 0.269 -17.344 -27.025 1.00 25.00 C ATOM 161 OD1 ASP A 422 0.044 -17.454 -28.251 1.00 25.00 O ATOM 162 OD2 ASP A 422 -0.330 -18.018 -26.162 1.00 25.00 O ATOM 0 H ASP A 422 3.065 -14.583 -26.318 1.00 25.00 H new ATOM 0 HA ASP A 422 1.148 -15.233 -28.379 1.00 25.00 H new ATOM 0 HB2 ASP A 422 2.321 -16.806 -26.716 1.00 25.00 H new ATOM 0 HB3 ASP A 422 1.226 -16.182 -25.499 1.00 25.00 H new ATOM 167 N MET A 423 0.282 -13.465 -25.755 1.00 25.00 N ATOM 168 CA MET A 423 -0.775 -12.634 -25.172 1.00 25.00 C ATOM 169 C MET A 423 -1.225 -11.568 -26.169 1.00 25.00 C ATOM 170 O MET A 423 -2.400 -11.243 -26.252 1.00 25.00 O ATOM 171 CB MET A 423 -0.268 -11.984 -23.879 1.00 25.00 C ATOM 172 CG MET A 423 -1.308 -11.172 -23.119 1.00 25.00 C ATOM 173 SD MET A 423 -0.687 -10.653 -21.485 1.00 25.00 S ATOM 174 CE MET A 423 0.606 -9.450 -21.921 1.00 25.00 C ATOM 0 H MET A 423 1.176 -13.409 -25.267 1.00 25.00 H new ATOM 0 HA MET A 423 -1.634 -13.263 -24.937 1.00 25.00 H new ATOM 0 HB2 MET A 423 0.113 -12.766 -23.222 1.00 25.00 H new ATOM 0 HB3 MET A 423 0.573 -11.334 -24.122 1.00 25.00 H new ATOM 0 HG2 MET A 423 -1.581 -10.292 -23.702 1.00 25.00 H new ATOM 0 HG3 MET A 423 -2.214 -11.765 -22.994 1.00 25.00 H new ATOM 0 HE1 MET A 423 1.569 -9.957 -21.980 1.00 25.00 H new ATOM 0 HE2 MET A 423 0.373 -8.999 -22.886 1.00 25.00 H new ATOM 0 HE3 MET A 423 0.651 -8.672 -21.159 1.00 25.00 H new ATOM 184 N ALA A 424 -0.289 -11.044 -26.944 1.00 25.00 N ATOM 185 CA ALA A 424 -0.600 -10.036 -27.951 1.00 25.00 C ATOM 186 C ALA A 424 -1.535 -10.612 -29.023 1.00 25.00 C ATOM 187 O ALA A 424 -2.360 -9.897 -29.593 1.00 25.00 O ATOM 188 CB ALA A 424 0.696 -9.526 -28.590 1.00 25.00 C ATOM 0 H ALA A 424 0.697 -11.300 -26.896 1.00 25.00 H new ATOM 0 HA ALA A 424 -1.111 -9.203 -27.468 1.00 25.00 H new ATOM 0 HB1 ALA A 424 0.459 -8.773 -29.342 1.00 25.00 H new ATOM 0 HB2 ALA A 424 1.331 -9.085 -27.822 1.00 25.00 H new ATOM 0 HB3 ALA A 424 1.221 -10.357 -29.061 1.00 25.00 H new ATOM 194 N ALA A 425 -1.416 -11.906 -29.289 1.00 25.00 N ATOM 195 CA ALA A 425 -2.282 -12.561 -30.262 1.00 25.00 C ATOM 196 C ALA A 425 -3.703 -12.638 -29.692 1.00 25.00 C ATOM 197 O ALA A 425 -4.684 -12.471 -30.421 1.00 25.00 O ATOM 198 CB ALA A 425 -1.748 -13.967 -30.595 1.00 25.00 C ATOM 0 H ALA A 425 -0.732 -12.521 -28.848 1.00 25.00 H new ATOM 0 HA ALA A 425 -2.297 -11.984 -31.187 1.00 25.00 H new ATOM 0 HB1 ALA A 425 -2.405 -14.443 -31.323 1.00 25.00 H new ATOM 0 HB2 ALA A 425 -0.744 -13.886 -31.012 1.00 25.00 H new ATOM 0 HB3 ALA A 425 -1.716 -14.569 -29.687 1.00 25.00 H new ATOM 204 N VAL A 426 -3.805 -12.875 -28.391 1.00 25.00 N ATOM 205 CA VAL A 426 -5.100 -12.933 -27.715 1.00 25.00 C ATOM 206 C VAL A 426 -5.735 -11.546 -27.722 1.00 25.00 C ATOM 207 O VAL A 426 -6.914 -11.406 -28.021 1.00 25.00 O ATOM 208 CB VAL A 426 -4.952 -13.431 -26.244 1.00 25.00 C ATOM 209 CG1 VAL A 426 -6.316 -13.519 -25.560 1.00 25.00 C ATOM 210 CG2 VAL A 426 -4.264 -14.804 -26.208 1.00 25.00 C ATOM 0 H VAL A 426 -3.005 -13.031 -27.778 1.00 25.00 H new ATOM 0 HA VAL A 426 -5.734 -13.640 -28.250 1.00 25.00 H new ATOM 0 HB VAL A 426 -4.337 -12.710 -25.706 1.00 25.00 H new ATOM 0 HG11 VAL A 426 -6.187 -13.868 -24.536 1.00 25.00 H new ATOM 0 HG12 VAL A 426 -6.783 -12.534 -25.552 1.00 25.00 H new ATOM 0 HG13 VAL A 426 -6.952 -14.217 -26.104 1.00 25.00 H new ATOM 0 HG21 VAL A 426 -4.169 -15.136 -25.174 1.00 25.00 H new ATOM 0 HG22 VAL A 426 -4.861 -15.525 -26.767 1.00 25.00 H new ATOM 0 HG23 VAL A 426 -3.274 -14.727 -26.657 1.00 25.00 H new ATOM 220 N GLU A 427 -4.951 -10.522 -27.413 1.00 25.00 N ATOM 221 CA GLU A 427 -5.443 -9.144 -27.407 1.00 25.00 C ATOM 222 C GLU A 427 -5.989 -8.780 -28.785 1.00 25.00 C ATOM 223 O GLU A 427 -7.063 -8.187 -28.909 1.00 25.00 O ATOM 224 CB GLU A 427 -4.308 -8.180 -27.042 1.00 25.00 C ATOM 225 CG GLU A 427 -3.886 -8.224 -25.576 1.00 25.00 C ATOM 226 CD GLU A 427 -2.674 -7.336 -25.300 1.00 25.00 C ATOM 227 OE1 GLU A 427 -1.619 -7.866 -24.877 1.00 25.00 O ATOM 228 OE2 GLU A 427 -2.771 -6.106 -25.515 1.00 25.00 O ATOM 0 H GLU A 427 -3.967 -10.617 -27.162 1.00 25.00 H new ATOM 0 HA GLU A 427 -6.239 -9.061 -26.667 1.00 25.00 H new ATOM 0 HB2 GLU A 427 -3.442 -8.407 -27.663 1.00 25.00 H new ATOM 0 HB3 GLU A 427 -4.618 -7.164 -27.287 1.00 25.00 H new ATOM 0 HG2 GLU A 427 -4.719 -7.905 -24.950 1.00 25.00 H new ATOM 0 HG3 GLU A 427 -3.653 -9.252 -25.297 1.00 25.00 H new ATOM 235 N ALA A 428 -5.256 -9.147 -29.828 1.00 25.00 N ATOM 236 CA ALA A 428 -5.691 -8.876 -31.190 1.00 25.00 C ATOM 237 C ALA A 428 -7.017 -9.590 -31.480 1.00 25.00 C ATOM 238 O ALA A 428 -7.939 -8.984 -32.011 1.00 25.00 O ATOM 239 CB ALA A 428 -4.607 -9.314 -32.186 1.00 25.00 C ATOM 0 H ALA A 428 -4.361 -9.631 -29.757 1.00 25.00 H new ATOM 0 HA ALA A 428 -5.851 -7.804 -31.303 1.00 25.00 H new ATOM 0 HB1 ALA A 428 -4.942 -9.107 -33.202 1.00 25.00 H new ATOM 0 HB2 ALA A 428 -3.687 -8.764 -31.988 1.00 25.00 H new ATOM 0 HB3 ALA A 428 -4.422 -10.382 -32.075 1.00 25.00 H new ATOM 245 N ALA A 429 -7.107 -10.864 -31.121 1.00 25.00 N ATOM 246 CA ALA A 429 -8.313 -11.654 -31.314 1.00 25.00 C ATOM 247 C ALA A 429 -9.511 -11.080 -30.557 1.00 25.00 C ATOM 248 O ALA A 429 -10.612 -11.101 -31.073 1.00 25.00 O ATOM 249 CB ALA A 429 -8.056 -13.103 -30.879 1.00 25.00 C ATOM 0 H ALA A 429 -6.342 -11.379 -30.686 1.00 25.00 H new ATOM 0 HA ALA A 429 -8.561 -11.624 -32.375 1.00 25.00 H new ATOM 0 HB1 ALA A 429 -8.961 -13.693 -31.025 1.00 25.00 H new ATOM 0 HB2 ALA A 429 -7.248 -13.525 -31.477 1.00 25.00 H new ATOM 0 HB3 ALA A 429 -7.776 -13.122 -29.826 1.00 25.00 H new ATOM 255 N GLU A 430 -9.313 -10.563 -29.353 1.00 25.00 N ATOM 256 CA GLU A 430 -10.423 -9.979 -28.589 1.00 25.00 C ATOM 257 C GLU A 430 -10.998 -8.796 -29.346 1.00 25.00 C ATOM 258 O GLU A 430 -12.212 -8.654 -29.490 1.00 25.00 O ATOM 259 CB GLU A 430 -9.960 -9.507 -27.211 1.00 25.00 C ATOM 260 CG GLU A 430 -9.582 -10.634 -26.283 1.00 25.00 C ATOM 261 CD GLU A 430 -10.479 -10.694 -25.053 1.00 25.00 C ATOM 262 OE1 GLU A 430 -11.231 -11.686 -24.912 1.00 25.00 O ATOM 263 OE2 GLU A 430 -10.443 -9.749 -24.233 1.00 25.00 O ATOM 0 H GLU A 430 -8.409 -10.532 -28.882 1.00 25.00 H new ATOM 0 HA GLU A 430 -11.182 -10.750 -28.458 1.00 25.00 H new ATOM 0 HB2 GLU A 430 -9.103 -8.844 -27.332 1.00 25.00 H new ATOM 0 HB3 GLU A 430 -10.755 -8.920 -26.751 1.00 25.00 H new ATOM 0 HG2 GLU A 430 -9.642 -11.580 -26.821 1.00 25.00 H new ATOM 0 HG3 GLU A 430 -8.546 -10.511 -25.969 1.00 25.00 H new ATOM 270 N LEU A 431 -10.116 -7.948 -29.844 1.00 25.00 N ATOM 271 CA LEU A 431 -10.529 -6.772 -30.611 1.00 25.00 C ATOM 272 C LEU A 431 -11.233 -7.198 -31.902 1.00 25.00 C ATOM 273 O LEU A 431 -12.217 -6.586 -32.333 1.00 25.00 O ATOM 274 CB LEU A 431 -9.299 -5.921 -30.951 1.00 25.00 C ATOM 275 CG LEU A 431 -8.578 -5.281 -29.751 1.00 25.00 C ATOM 276 CD1 LEU A 431 -7.183 -4.824 -30.175 1.00 25.00 C ATOM 277 CD2 LEU A 431 -9.375 -4.097 -29.198 1.00 25.00 C ATOM 0 H LEU A 431 -9.107 -8.046 -29.734 1.00 25.00 H new ATOM 0 HA LEU A 431 -11.223 -6.186 -30.009 1.00 25.00 H new ATOM 0 HB2 LEU A 431 -8.586 -6.545 -31.489 1.00 25.00 H new ATOM 0 HB3 LEU A 431 -9.606 -5.128 -31.632 1.00 25.00 H new ATOM 0 HG LEU A 431 -8.492 -6.027 -28.961 1.00 25.00 H new ATOM 0 HD11 LEU A 431 -6.674 -4.371 -29.324 1.00 25.00 H new ATOM 0 HD12 LEU A 431 -6.610 -5.682 -30.526 1.00 25.00 H new ATOM 0 HD13 LEU A 431 -7.268 -4.092 -30.978 1.00 25.00 H new ATOM 0 HD21 LEU A 431 -8.843 -3.664 -28.351 1.00 25.00 H new ATOM 0 HD22 LEU A 431 -9.494 -3.343 -29.976 1.00 25.00 H new ATOM 0 HD23 LEU A 431 -10.357 -4.440 -28.872 1.00 25.00 H new ATOM 289 N GLU A 432 -10.730 -8.255 -32.515 1.00 25.00 N ATOM 290 CA GLU A 432 -11.275 -8.764 -33.762 1.00 25.00 C ATOM 291 C GLU A 432 -12.643 -9.449 -33.527 1.00 25.00 C ATOM 292 O GLU A 432 -13.546 -9.376 -34.363 1.00 25.00 O ATOM 293 CB GLU A 432 -10.198 -9.653 -34.412 1.00 25.00 C ATOM 294 CG GLU A 432 -10.548 -11.065 -34.757 1.00 25.00 C ATOM 295 CD GLU A 432 -11.080 -11.169 -36.187 1.00 25.00 C ATOM 296 OE1 GLU A 432 -11.857 -10.274 -36.604 1.00 25.00 O ATOM 297 OE2 GLU A 432 -10.712 -12.114 -36.905 1.00 25.00 O ATOM 0 H GLU A 432 -9.933 -8.785 -32.163 1.00 25.00 H new ATOM 0 HA GLU A 432 -11.503 -7.963 -34.466 1.00 25.00 H new ATOM 0 HB2 GLU A 432 -9.870 -9.160 -35.327 1.00 25.00 H new ATOM 0 HB3 GLU A 432 -9.341 -9.679 -33.740 1.00 25.00 H new ATOM 0 HG2 GLU A 432 -9.668 -11.698 -34.647 1.00 25.00 H new ATOM 0 HG3 GLU A 432 -11.298 -11.438 -34.059 1.00 25.00 H new ATOM 304 N MET A 433 -12.823 -10.081 -32.379 1.00 25.00 N ATOM 305 CA MET A 433 -14.125 -10.642 -32.030 1.00 25.00 C ATOM 306 C MET A 433 -15.095 -9.515 -31.709 1.00 25.00 C ATOM 307 O MET A 433 -16.260 -9.576 -32.083 1.00 25.00 O ATOM 308 CB MET A 433 -14.018 -11.592 -30.837 1.00 25.00 C ATOM 309 CG MET A 433 -13.408 -12.936 -31.206 1.00 25.00 C ATOM 310 SD MET A 433 -13.401 -14.111 -29.829 1.00 25.00 S ATOM 311 CE MET A 433 -12.110 -13.423 -28.753 1.00 25.00 C ATOM 0 H MET A 433 -12.095 -10.219 -31.678 1.00 25.00 H new ATOM 0 HA MET A 433 -14.492 -11.213 -32.883 1.00 25.00 H new ATOM 0 HB2 MET A 433 -13.413 -11.125 -30.060 1.00 25.00 H new ATOM 0 HB3 MET A 433 -15.010 -11.752 -30.416 1.00 25.00 H new ATOM 0 HG2 MET A 433 -13.964 -13.365 -32.040 1.00 25.00 H new ATOM 0 HG3 MET A 433 -12.385 -12.782 -31.551 1.00 25.00 H new ATOM 0 HE1 MET A 433 -11.714 -14.210 -28.111 1.00 25.00 H new ATOM 0 HE2 MET A 433 -11.306 -13.015 -29.365 1.00 25.00 H new ATOM 0 HE3 MET A 433 -12.534 -12.631 -28.136 1.00 25.00 H new ATOM 321 N THR A 434 -14.621 -8.481 -31.029 1.00 25.00 N ATOM 322 CA THR A 434 -15.475 -7.349 -30.656 1.00 25.00 C ATOM 323 C THR A 434 -16.085 -6.672 -31.884 1.00 25.00 C ATOM 324 O THR A 434 -17.270 -6.348 -31.897 1.00 25.00 O ATOM 325 CB THR A 434 -14.700 -6.297 -29.825 1.00 25.00 C ATOM 326 OG1 THR A 434 -14.135 -6.922 -28.671 1.00 25.00 O ATOM 327 CG2 THR A 434 -15.626 -5.192 -29.332 1.00 25.00 C ATOM 0 H THR A 434 -13.652 -8.397 -30.722 1.00 25.00 H new ATOM 0 HA THR A 434 -16.278 -7.760 -30.044 1.00 25.00 H new ATOM 0 HB THR A 434 -13.929 -5.873 -30.468 1.00 25.00 H new ATOM 0 HG1 THR A 434 -13.406 -7.517 -28.945 1.00 25.00 H new ATOM 0 HG21 THR A 434 -15.053 -4.469 -28.752 1.00 25.00 H new ATOM 0 HG22 THR A 434 -16.083 -4.692 -30.186 1.00 25.00 H new ATOM 0 HG23 THR A 434 -16.406 -5.624 -28.705 1.00 25.00 H new ATOM 335 N ARG A 435 -15.302 -6.467 -32.933 1.00 25.00 N ATOM 336 CA ARG A 435 -15.856 -5.838 -34.142 1.00 25.00 C ATOM 337 C ARG A 435 -16.895 -6.760 -34.788 1.00 25.00 C ATOM 338 O ARG A 435 -17.847 -6.289 -35.383 1.00 25.00 O ATOM 339 CB ARG A 435 -14.754 -5.451 -35.150 1.00 25.00 C ATOM 340 CG ARG A 435 -13.925 -6.617 -35.654 1.00 25.00 C ATOM 341 CD ARG A 435 -12.877 -6.219 -36.669 1.00 25.00 C ATOM 342 NE ARG A 435 -12.142 -7.407 -37.145 1.00 25.00 N ATOM 343 CZ ARG A 435 -11.151 -7.398 -38.029 1.00 25.00 C ATOM 344 NH1 ARG A 435 -10.707 -6.292 -38.575 1.00 25.00 N ATOM 345 NH2 ARG A 435 -10.598 -8.525 -38.367 1.00 25.00 N ATOM 0 H ARG A 435 -14.314 -6.714 -32.982 1.00 25.00 H new ATOM 0 HA ARG A 435 -16.347 -4.912 -33.841 1.00 25.00 H new ATOM 0 HB2 ARG A 435 -15.217 -4.955 -36.003 1.00 25.00 H new ATOM 0 HB3 ARG A 435 -14.090 -4.725 -34.682 1.00 25.00 H new ATOM 0 HG2 ARG A 435 -13.435 -7.097 -34.807 1.00 25.00 H new ATOM 0 HG3 ARG A 435 -14.588 -7.358 -36.100 1.00 25.00 H new ATOM 0 HD2 ARG A 435 -13.351 -5.715 -37.512 1.00 25.00 H new ATOM 0 HD3 ARG A 435 -12.181 -5.508 -36.223 1.00 25.00 H new ATOM 0 HE ARG A 435 -12.419 -8.311 -36.763 1.00 25.00 H new ATOM 0 HH11 ARG A 435 -11.125 -5.396 -38.324 1.00 25.00 H new ATOM 0 HH12 ARG A 435 -9.943 -6.327 -39.250 1.00 25.00 H new ATOM 0 HH21 ARG A 435 -10.927 -9.398 -37.955 1.00 25.00 H new ATOM 0 HH22 ARG A 435 -9.836 -8.536 -39.045 1.00 25.00 H new ATOM 359 N GLN A 436 -16.718 -8.066 -34.658 1.00 25.00 N ATOM 360 CA GLN A 436 -17.665 -9.024 -35.226 1.00 25.00 C ATOM 361 C GLN A 436 -19.002 -9.093 -34.481 1.00 25.00 C ATOM 362 O GLN A 436 -20.062 -9.124 -35.100 1.00 25.00 O ATOM 363 CB GLN A 436 -17.047 -10.395 -35.296 1.00 25.00 C ATOM 364 CG GLN A 436 -16.348 -10.579 -36.610 1.00 25.00 C ATOM 365 CD GLN A 436 -15.564 -11.826 -36.633 1.00 25.00 C ATOM 366 OE1 GLN A 436 -15.978 -12.834 -37.180 1.00 25.00 O ATOM 367 NE2 GLN A 436 -14.429 -11.782 -36.033 1.00 25.00 N ATOM 0 H GLN A 436 -15.931 -8.490 -34.166 1.00 25.00 H new ATOM 0 HA GLN A 436 -17.890 -8.660 -36.229 1.00 25.00 H new ATOM 0 HB2 GLN A 436 -16.339 -10.526 -34.477 1.00 25.00 H new ATOM 0 HB3 GLN A 436 -17.818 -11.156 -35.176 1.00 25.00 H new ATOM 0 HG2 GLN A 436 -17.082 -10.595 -37.415 1.00 25.00 H new ATOM 0 HG3 GLN A 436 -15.690 -9.730 -36.795 1.00 25.00 H new ATOM 0 HE21 GLN A 436 -14.121 -10.918 -35.588 1.00 25.00 H new ATOM 0 HE22 GLN A 436 -13.836 -12.611 -36.002 1.00 25.00 H new ATOM 376 N VAL A 437 -18.954 -9.127 -33.155 1.00 25.00 N ATOM 377 CA VAL A 437 -20.173 -9.271 -32.347 1.00 25.00 C ATOM 378 C VAL A 437 -21.092 -8.064 -32.441 1.00 25.00 C ATOM 379 O VAL A 437 -22.308 -8.186 -32.353 1.00 25.00 O ATOM 380 CB VAL A 437 -19.849 -9.543 -30.849 1.00 25.00 C ATOM 381 CG1 VAL A 437 -19.168 -10.916 -30.694 1.00 25.00 C ATOM 382 CG2 VAL A 437 -18.975 -8.473 -30.231 1.00 25.00 C ATOM 0 H VAL A 437 -18.093 -9.058 -32.613 1.00 25.00 H new ATOM 0 HA VAL A 437 -20.693 -10.132 -32.768 1.00 25.00 H new ATOM 0 HB VAL A 437 -20.800 -9.532 -30.317 1.00 25.00 H new ATOM 0 HG11 VAL A 437 -18.946 -11.095 -29.642 1.00 25.00 H new ATOM 0 HG12 VAL A 437 -19.834 -11.696 -31.062 1.00 25.00 H new ATOM 0 HG13 VAL A 437 -18.241 -10.929 -31.268 1.00 25.00 H new ATOM 0 HG21 VAL A 437 -18.784 -8.718 -29.186 1.00 25.00 H new ATOM 0 HG22 VAL A 437 -18.029 -8.419 -30.770 1.00 25.00 H new ATOM 0 HG23 VAL A 437 -19.482 -7.510 -30.291 1.00 25.00 H new ATOM 392 N LEU A 438 -20.500 -6.902 -32.639 1.00 25.00 N ATOM 393 CA LEU A 438 -21.250 -5.654 -32.793 1.00 25.00 C ATOM 394 C LEU A 438 -22.045 -5.609 -34.101 1.00 25.00 C ATOM 395 O LEU A 438 -22.871 -4.721 -34.298 1.00 25.00 O ATOM 396 CB LEU A 438 -20.289 -4.462 -32.736 1.00 25.00 C ATOM 397 CG LEU A 438 -19.702 -4.153 -31.346 1.00 25.00 C ATOM 398 CD1 LEU A 438 -18.605 -3.099 -31.476 1.00 25.00 C ATOM 399 CD2 LEU A 438 -20.780 -3.658 -30.372 1.00 25.00 C ATOM 0 H LEU A 438 -19.488 -6.788 -32.699 1.00 25.00 H new ATOM 0 HA LEU A 438 -21.965 -5.602 -31.972 1.00 25.00 H new ATOM 0 HB2 LEU A 438 -19.466 -4.647 -33.426 1.00 25.00 H new ATOM 0 HB3 LEU A 438 -20.813 -3.577 -33.095 1.00 25.00 H new ATOM 0 HG LEU A 438 -19.287 -5.077 -30.944 1.00 25.00 H new ATOM 0 HD11 LEU A 438 -18.191 -2.882 -30.491 1.00 25.00 H new ATOM 0 HD12 LEU A 438 -17.815 -3.474 -32.127 1.00 25.00 H new ATOM 0 HD13 LEU A 438 -19.025 -2.188 -31.902 1.00 25.00 H new ATOM 0 HD21 LEU A 438 -20.327 -3.451 -29.403 1.00 25.00 H new ATOM 0 HD22 LEU A 438 -21.233 -2.747 -30.763 1.00 25.00 H new ATOM 0 HD23 LEU A 438 -21.547 -4.424 -30.258 1.00 25.00 H new ATOM 720 N ALA A 462 -18.416 -32.966 -45.417 1.00 25.00 N ATOM 721 CA ALA A 462 -17.372 -33.020 -44.404 1.00 25.00 C ATOM 722 C ALA A 462 -17.912 -33.611 -43.096 1.00 25.00 C ATOM 723 O ALA A 462 -17.279 -34.480 -42.499 1.00 25.00 O ATOM 724 CB ALA A 462 -16.810 -31.618 -44.162 1.00 25.00 C ATOM 0 HA ALA A 462 -16.572 -33.668 -44.763 1.00 25.00 H new ATOM 0 HB1 ALA A 462 -16.029 -31.665 -43.403 1.00 25.00 H new ATOM 0 HB2 ALA A 462 -16.391 -31.229 -45.090 1.00 25.00 H new ATOM 0 HB3 ALA A 462 -17.609 -30.960 -43.820 1.00 25.00 H new ATOM 730 N LEU A 463 -19.079 -33.156 -42.654 1.00 25.00 N ATOM 731 CA LEU A 463 -19.652 -33.658 -41.406 1.00 25.00 C ATOM 732 C LEU A 463 -20.009 -35.133 -41.522 1.00 25.00 C ATOM 733 O LEU A 463 -19.829 -35.873 -40.578 1.00 25.00 O ATOM 734 CB LEU A 463 -20.849 -32.800 -40.952 1.00 25.00 C ATOM 735 CG LEU A 463 -22.298 -33.199 -41.296 1.00 25.00 C ATOM 736 CD1 LEU A 463 -22.886 -34.230 -40.325 1.00 25.00 C ATOM 737 CD2 LEU A 463 -23.155 -31.955 -41.255 1.00 25.00 C ATOM 0 H LEU A 463 -19.641 -32.451 -43.131 1.00 25.00 H new ATOM 0 HA LEU A 463 -18.893 -33.573 -40.628 1.00 25.00 H new ATOM 0 HB2 LEU A 463 -20.790 -32.722 -39.866 1.00 25.00 H new ATOM 0 HB3 LEU A 463 -20.692 -31.798 -41.352 1.00 25.00 H new ATOM 0 HG LEU A 463 -22.286 -33.658 -42.285 1.00 25.00 H new ATOM 0 HD11 LEU A 463 -23.907 -34.468 -40.622 1.00 25.00 H new ATOM 0 HD12 LEU A 463 -22.281 -35.136 -40.346 1.00 25.00 H new ATOM 0 HD13 LEU A 463 -22.888 -33.819 -39.315 1.00 25.00 H new ATOM 0 HD21 LEU A 463 -24.186 -32.215 -41.496 1.00 25.00 H new ATOM 0 HD22 LEU A 463 -23.115 -31.518 -40.257 1.00 25.00 H new ATOM 0 HD23 LEU A 463 -22.784 -31.233 -41.982 1.00 25.00 H new ATOM 749 N GLN A 464 -20.490 -35.580 -42.673 1.00 25.00 N ATOM 750 CA GLN A 464 -20.806 -37.003 -42.842 1.00 25.00 C ATOM 751 C GLN A 464 -19.552 -37.845 -42.682 1.00 25.00 C ATOM 752 O GLN A 464 -19.593 -38.953 -42.150 1.00 25.00 O ATOM 753 CB GLN A 464 -21.436 -37.272 -44.206 1.00 25.00 C ATOM 754 CG GLN A 464 -22.873 -36.793 -44.319 1.00 25.00 C ATOM 755 CD GLN A 464 -23.792 -37.475 -43.326 1.00 25.00 C ATOM 756 OE1 GLN A 464 -24.180 -36.893 -42.330 1.00 25.00 O ATOM 757 NE2 GLN A 464 -24.130 -38.711 -43.588 1.00 25.00 N ATOM 0 H GLN A 464 -20.669 -34.998 -43.491 1.00 25.00 H new ATOM 0 HA GLN A 464 -21.526 -37.277 -42.071 1.00 25.00 H new ATOM 0 HB2 GLN A 464 -20.838 -36.784 -44.975 1.00 25.00 H new ATOM 0 HB3 GLN A 464 -21.402 -38.343 -44.407 1.00 25.00 H new ATOM 0 HG2 GLN A 464 -22.907 -35.715 -44.160 1.00 25.00 H new ATOM 0 HG3 GLN A 464 -23.235 -36.977 -45.330 1.00 25.00 H new ATOM 0 HE21 GLN A 464 -23.785 -39.166 -44.433 1.00 25.00 H new ATOM 0 HE22 GLN A 464 -24.739 -39.220 -42.947 1.00 25.00 H new ATOM 766 N GLY A 465 -18.431 -37.300 -43.123 1.00 25.00 N ATOM 767 CA GLY A 465 -17.162 -37.972 -42.946 1.00 25.00 C ATOM 768 C GLY A 465 -16.853 -38.009 -41.470 1.00 25.00 C ATOM 769 O GLY A 465 -16.526 -39.054 -40.936 1.00 25.00 O ATOM 0 H GLY A 465 -18.377 -36.401 -43.602 1.00 25.00 H new ATOM 0 HA2 GLY A 465 -17.207 -38.983 -43.351 1.00 25.00 H new ATOM 0 HA3 GLY A 465 -16.375 -37.447 -43.487 1.00 25.00 H new ATOM 773 N ALA A 466 -16.988 -36.868 -40.804 1.00 25.00 N ATOM 774 CA ALA A 466 -16.735 -36.761 -39.368 1.00 25.00 C ATOM 775 C ALA A 466 -17.543 -37.790 -38.561 1.00 25.00 C ATOM 776 O ALA A 466 -17.045 -38.358 -37.599 1.00 25.00 O ATOM 777 CB ALA A 466 -17.059 -35.343 -38.893 1.00 25.00 C ATOM 0 H ALA A 466 -17.275 -35.992 -41.241 1.00 25.00 H new ATOM 0 HA ALA A 466 -15.680 -36.974 -39.198 1.00 25.00 H new ATOM 0 HB1 ALA A 466 -16.870 -35.266 -37.822 1.00 25.00 H new ATOM 0 HB2 ALA A 466 -16.431 -34.629 -39.425 1.00 25.00 H new ATOM 0 HB3 ALA A 466 -18.108 -35.123 -39.093 1.00 25.00 H new ATOM 783 N GLN A 467 -18.779 -38.034 -38.959 1.00 25.00 N ATOM 784 CA GLN A 467 -19.624 -39.015 -38.275 1.00 25.00 C ATOM 785 C GLN A 467 -19.085 -40.433 -38.465 1.00 25.00 C ATOM 786 O GLN A 467 -19.010 -41.218 -37.522 1.00 25.00 O ATOM 787 CB GLN A 467 -21.031 -38.973 -38.860 1.00 25.00 C ATOM 788 CG GLN A 467 -21.782 -37.651 -38.661 1.00 25.00 C ATOM 789 CD GLN A 467 -22.238 -37.402 -37.242 1.00 25.00 C ATOM 790 OE1 GLN A 467 -22.285 -38.295 -36.413 1.00 25.00 O ATOM 791 NE2 GLN A 467 -22.587 -36.171 -36.963 1.00 25.00 N ATOM 0 H GLN A 467 -19.225 -37.571 -39.750 1.00 25.00 H new ATOM 0 HA GLN A 467 -19.631 -38.765 -37.214 1.00 25.00 H new ATOM 0 HB2 GLN A 467 -20.969 -39.180 -39.928 1.00 25.00 H new ATOM 0 HB3 GLN A 467 -21.617 -39.776 -38.413 1.00 25.00 H new ATOM 0 HG2 GLN A 467 -21.136 -36.830 -38.972 1.00 25.00 H new ATOM 0 HG3 GLN A 467 -22.652 -37.639 -39.317 1.00 25.00 H new ATOM 0 HE21 GLN A 467 -22.534 -35.450 -37.683 1.00 25.00 H new ATOM 0 HE22 GLN A 467 -22.912 -35.933 -36.026 1.00 25.00 H new ATOM 800 N ALA A 468 -18.721 -40.763 -39.696 1.00 25.00 N ATOM 801 CA ALA A 468 -18.235 -42.101 -40.014 1.00 25.00 C ATOM 802 C ALA A 468 -16.900 -42.376 -39.321 1.00 25.00 C ATOM 803 O ALA A 468 -16.691 -43.447 -38.747 1.00 25.00 O ATOM 804 CB ALA A 468 -18.090 -42.254 -41.535 1.00 25.00 C ATOM 0 H ALA A 468 -18.752 -40.125 -40.491 1.00 25.00 H new ATOM 0 HA ALA A 468 -18.959 -42.829 -39.649 1.00 25.00 H new ATOM 0 HB1 ALA A 468 -17.727 -43.255 -41.767 1.00 25.00 H new ATOM 0 HB2 ALA A 468 -19.059 -42.100 -42.010 1.00 25.00 H new ATOM 0 HB3 ALA A 468 -17.381 -41.515 -41.909 1.00 25.00 H new ATOM 810 N VAL A 469 -15.997 -41.407 -39.362 1.00 25.00 N ATOM 811 CA VAL A 469 -14.689 -41.578 -38.740 1.00 25.00 C ATOM 812 C VAL A 469 -14.826 -41.631 -37.231 1.00 25.00 C ATOM 813 O VAL A 469 -14.055 -42.306 -36.584 1.00 25.00 O ATOM 814 CB VAL A 469 -13.655 -40.483 -39.160 1.00 25.00 C ATOM 815 CG1 VAL A 469 -13.517 -40.446 -40.681 1.00 25.00 C ATOM 816 CG2 VAL A 469 -14.043 -39.115 -38.644 1.00 25.00 C ATOM 0 H VAL A 469 -16.141 -40.504 -39.813 1.00 25.00 H new ATOM 0 HA VAL A 469 -14.294 -42.527 -39.104 1.00 25.00 H new ATOM 0 HB VAL A 469 -12.697 -40.747 -38.713 1.00 25.00 H new ATOM 0 HG11 VAL A 469 -12.794 -39.680 -40.962 1.00 25.00 H new ATOM 0 HG12 VAL A 469 -13.174 -41.417 -41.039 1.00 25.00 H new ATOM 0 HG13 VAL A 469 -14.484 -40.215 -41.129 1.00 25.00 H new ATOM 0 HG21 VAL A 469 -13.299 -38.383 -38.958 1.00 25.00 H new ATOM 0 HG22 VAL A 469 -15.017 -38.837 -39.046 1.00 25.00 H new ATOM 0 HG23 VAL A 469 -14.093 -39.138 -37.555 1.00 25.00 H new ATOM 826 N ALA A 470 -15.807 -40.936 -36.665 1.00 25.00 N ATOM 827 CA ALA A 470 -15.997 -40.925 -35.210 1.00 25.00 C ATOM 828 C ALA A 470 -16.169 -42.343 -34.654 1.00 25.00 C ATOM 829 O ALA A 470 -15.714 -42.634 -33.547 1.00 25.00 O ATOM 830 CB ALA A 470 -17.200 -40.056 -34.830 1.00 25.00 C ATOM 0 H ALA A 470 -16.482 -40.374 -37.184 1.00 25.00 H new ATOM 0 HA ALA A 470 -15.099 -40.498 -34.765 1.00 25.00 H new ATOM 0 HB1 ALA A 470 -17.325 -40.061 -33.747 1.00 25.00 H new ATOM 0 HB2 ALA A 470 -17.033 -39.034 -35.172 1.00 25.00 H new ATOM 0 HB3 ALA A 470 -18.099 -40.454 -35.300 1.00 25.00 H new ATOM 836 N ALA A 471 -16.801 -43.224 -35.420 1.00 25.00 N ATOM 837 CA ALA A 471 -16.966 -44.612 -34.995 1.00 25.00 C ATOM 838 C ALA A 471 -15.592 -45.296 -34.889 1.00 25.00 C ATOM 839 O ALA A 471 -15.348 -46.083 -33.981 1.00 25.00 O ATOM 840 CB ALA A 471 -17.868 -45.360 -35.981 1.00 25.00 C ATOM 0 H ALA A 471 -17.205 -43.007 -36.331 1.00 25.00 H new ATOM 0 HA ALA A 471 -17.439 -44.631 -34.013 1.00 25.00 H new ATOM 0 HB1 ALA A 471 -17.985 -46.394 -35.655 1.00 25.00 H new ATOM 0 HB2 ALA A 471 -18.845 -44.879 -36.017 1.00 25.00 H new ATOM 0 HB3 ALA A 471 -17.417 -45.341 -36.973 1.00 25.00 H new ATOM 846 N ALA A 472 -14.695 -44.977 -35.810 1.00 25.00 N ATOM 847 CA ALA A 472 -13.338 -45.510 -35.776 1.00 25.00 C ATOM 848 C ALA A 472 -12.528 -44.854 -34.648 1.00 25.00 C ATOM 849 O ALA A 472 -11.676 -45.489 -34.046 1.00 25.00 O ATOM 850 CB ALA A 472 -12.649 -45.292 -37.131 1.00 25.00 C ATOM 0 H ALA A 472 -14.881 -44.350 -36.593 1.00 25.00 H new ATOM 0 HA ALA A 472 -13.390 -46.581 -35.580 1.00 25.00 H new ATOM 0 HB1 ALA A 472 -11.637 -45.694 -37.093 1.00 25.00 H new ATOM 0 HB2 ALA A 472 -13.213 -45.802 -37.912 1.00 25.00 H new ATOM 0 HB3 ALA A 472 -12.608 -44.225 -37.351 1.00 25.00 H new ATOM 856 N GLN A 473 -12.785 -43.584 -34.368 1.00 25.00 N ATOM 857 CA GLN A 473 -12.045 -42.869 -33.330 1.00 25.00 C ATOM 858 C GLN A 473 -12.376 -43.396 -31.945 1.00 25.00 C ATOM 859 O GLN A 473 -11.489 -43.640 -31.136 1.00 25.00 O ATOM 860 CB GLN A 473 -12.355 -41.364 -33.347 1.00 25.00 C ATOM 861 CG GLN A 473 -12.008 -40.630 -34.639 1.00 25.00 C ATOM 862 CD GLN A 473 -10.526 -40.455 -34.875 1.00 25.00 C ATOM 863 OE1 GLN A 473 -9.704 -40.691 -34.008 1.00 25.00 O ATOM 864 NE2 GLN A 473 -10.184 -40.037 -36.066 1.00 25.00 N ATOM 0 H GLN A 473 -13.497 -43.027 -34.841 1.00 25.00 H new ATOM 0 HA GLN A 473 -10.989 -43.032 -33.548 1.00 25.00 H new ATOM 0 HB2 GLN A 473 -13.418 -41.229 -33.149 1.00 25.00 H new ATOM 0 HB3 GLN A 473 -11.815 -40.892 -32.526 1.00 25.00 H new ATOM 0 HG2 GLN A 473 -12.436 -41.176 -35.480 1.00 25.00 H new ATOM 0 HG3 GLN A 473 -12.480 -39.648 -34.623 1.00 25.00 H new ATOM 0 HE21 GLN A 473 -10.902 -39.850 -36.766 1.00 25.00 H new ATOM 0 HE22 GLN A 473 -9.200 -39.898 -36.295 1.00 25.00 H new ATOM 873 N ARG A 474 -13.658 -43.586 -31.665 1.00 25.00 N ATOM 874 CA ARG A 474 -14.061 -44.120 -30.356 1.00 25.00 C ATOM 875 C ARG A 474 -13.504 -45.529 -30.197 1.00 25.00 C ATOM 876 O ARG A 474 -13.249 -45.984 -29.091 1.00 25.00 O ATOM 877 CB ARG A 474 -15.589 -44.107 -30.181 1.00 25.00 C ATOM 878 CG ARG A 474 -16.355 -44.989 -31.154 1.00 25.00 C ATOM 879 CD ARG A 474 -17.853 -44.905 -30.945 1.00 25.00 C ATOM 880 NE ARG A 474 -18.260 -45.514 -29.666 1.00 25.00 N ATOM 881 CZ ARG A 474 -19.510 -45.615 -29.225 1.00 25.00 C ATOM 882 NH1 ARG A 474 -20.532 -45.165 -29.912 1.00 25.00 N ATOM 883 NH2 ARG A 474 -19.734 -46.188 -28.076 1.00 25.00 N ATOM 0 H ARG A 474 -14.427 -43.386 -32.305 1.00 25.00 H new ATOM 0 HA ARG A 474 -13.651 -43.478 -29.576 1.00 25.00 H new ATOM 0 HB2 ARG A 474 -15.826 -44.422 -29.165 1.00 25.00 H new ATOM 0 HB3 ARG A 474 -15.943 -43.082 -30.288 1.00 25.00 H new ATOM 0 HG2 ARG A 474 -16.115 -44.694 -32.175 1.00 25.00 H new ATOM 0 HG3 ARG A 474 -16.031 -46.023 -31.037 1.00 25.00 H new ATOM 0 HD2 ARG A 474 -18.165 -43.861 -30.967 1.00 25.00 H new ATOM 0 HD3 ARG A 474 -18.364 -45.408 -31.766 1.00 25.00 H new ATOM 0 HE ARG A 474 -17.522 -45.889 -29.070 1.00 25.00 H new ATOM 0 HH11 ARG A 474 -20.382 -44.720 -30.817 1.00 25.00 H new ATOM 0 HH12 ARG A 474 -21.477 -45.260 -29.541 1.00 25.00 H new ATOM 0 HH21 ARG A 474 -18.955 -46.552 -27.527 1.00 25.00 H new ATOM 0 HH22 ARG A 474 -20.688 -46.272 -27.726 1.00 25.00 H new ATOM 897 N LEU A 475 -13.306 -46.200 -31.321 1.00 25.00 N ATOM 898 CA LEU A 475 -12.733 -47.533 -31.333 1.00 25.00 C ATOM 899 C LEU A 475 -11.228 -47.481 -31.043 1.00 25.00 C ATOM 900 O LEU A 475 -10.757 -48.188 -30.164 1.00 25.00 O ATOM 901 CB LEU A 475 -13.018 -48.190 -32.697 1.00 25.00 C ATOM 902 CG LEU A 475 -11.945 -49.104 -33.309 1.00 25.00 C ATOM 903 CD1 LEU A 475 -11.770 -50.386 -32.478 1.00 25.00 C ATOM 904 CD2 LEU A 475 -12.318 -49.468 -34.732 1.00 25.00 C ATOM 0 H LEU A 475 -13.537 -45.836 -32.245 1.00 25.00 H new ATOM 0 HA LEU A 475 -13.191 -48.134 -30.547 1.00 25.00 H new ATOM 0 HB2 LEU A 475 -13.934 -48.773 -32.599 1.00 25.00 H new ATOM 0 HB3 LEU A 475 -13.222 -47.393 -33.412 1.00 25.00 H new ATOM 0 HG LEU A 475 -11.001 -48.559 -33.309 1.00 25.00 H new ATOM 0 HD11 LEU A 475 -11.005 -51.014 -32.934 1.00 25.00 H new ATOM 0 HD12 LEU A 475 -11.467 -50.124 -31.464 1.00 25.00 H new ATOM 0 HD13 LEU A 475 -12.714 -50.930 -32.446 1.00 25.00 H new ATOM 0 HD21 LEU A 475 -11.550 -50.116 -35.155 1.00 25.00 H new ATOM 0 HD22 LEU A 475 -13.275 -49.990 -34.735 1.00 25.00 H new ATOM 0 HD23 LEU A 475 -12.397 -48.561 -35.331 1.00 25.00 H new ATOM 916 N VAL A 476 -10.466 -46.668 -31.768 1.00 25.00 N ATOM 917 CA VAL A 476 -9.009 -46.653 -31.587 1.00 25.00 C ATOM 918 C VAL A 476 -8.676 -46.190 -30.177 1.00 25.00 C ATOM 919 O VAL A 476 -7.748 -46.695 -29.538 1.00 25.00 O ATOM 920 CB VAL A 476 -8.272 -45.803 -32.677 1.00 25.00 C ATOM 921 CG1 VAL A 476 -8.671 -44.349 -32.643 1.00 25.00 C ATOM 922 CG2 VAL A 476 -6.750 -45.942 -32.539 1.00 25.00 C ATOM 0 H VAL A 476 -10.819 -46.021 -32.474 1.00 25.00 H new ATOM 0 HA VAL A 476 -8.641 -47.670 -31.718 1.00 25.00 H new ATOM 0 HB VAL A 476 -8.579 -46.199 -33.645 1.00 25.00 H new ATOM 0 HG11 VAL A 476 -8.131 -43.805 -33.418 1.00 25.00 H new ATOM 0 HG12 VAL A 476 -9.743 -44.262 -32.818 1.00 25.00 H new ATOM 0 HG13 VAL A 476 -8.427 -43.928 -31.668 1.00 25.00 H new ATOM 0 HG21 VAL A 476 -6.259 -45.343 -33.306 1.00 25.00 H new ATOM 0 HG22 VAL A 476 -6.441 -45.594 -31.554 1.00 25.00 H new ATOM 0 HG23 VAL A 476 -6.468 -46.988 -32.659 1.00 25.00 H new ATOM 932 N HIS A 477 -9.458 -45.249 -29.680 1.00 25.00 N ATOM 933 CA HIS A 477 -9.279 -44.737 -28.348 1.00 25.00 C ATOM 934 C HIS A 477 -9.509 -45.843 -27.331 1.00 25.00 C ATOM 935 O HIS A 477 -8.830 -45.892 -26.322 1.00 25.00 O ATOM 936 CB HIS A 477 -10.248 -43.586 -28.113 1.00 25.00 C ATOM 937 CG HIS A 477 -9.948 -42.803 -26.876 1.00 25.00 C ATOM 938 ND1 HIS A 477 -10.825 -41.944 -26.259 1.00 25.00 N ATOM 939 CD2 HIS A 477 -8.816 -42.748 -26.126 1.00 25.00 C ATOM 940 CE1 HIS A 477 -10.218 -41.428 -25.193 1.00 25.00 C ATOM 941 NE2 HIS A 477 -8.990 -41.888 -25.062 1.00 25.00 N ATOM 0 H HIS A 477 -10.231 -44.824 -30.192 1.00 25.00 H new ATOM 0 HA HIS A 477 -8.259 -44.370 -28.233 1.00 25.00 H new ATOM 0 HB2 HIS A 477 -10.222 -42.917 -28.973 1.00 25.00 H new ATOM 0 HB3 HIS A 477 -11.262 -43.981 -28.047 1.00 25.00 H new ATOM 0 HD2 HIS A 477 -7.910 -43.299 -26.333 1.00 25.00 H new ATOM 0 HE1 HIS A 477 -10.675 -40.720 -24.518 1.00 25.00 H new ATOM 0 HE2 HIS A 477 -8.315 -41.658 -24.333 1.00 25.00 H new ATOM 949 N ALA A 478 -10.449 -46.742 -27.596 1.00 25.00 N ATOM 950 CA ALA A 478 -10.730 -47.814 -26.655 1.00 25.00 C ATOM 951 C ALA A 478 -9.473 -48.652 -26.425 1.00 25.00 C ATOM 952 O ALA A 478 -9.127 -48.946 -25.289 1.00 25.00 O ATOM 953 CB ALA A 478 -11.878 -48.692 -27.165 1.00 25.00 C ATOM 0 H ALA A 478 -11.020 -46.750 -28.441 1.00 25.00 H new ATOM 0 HA ALA A 478 -11.035 -47.375 -25.705 1.00 25.00 H new ATOM 0 HB1 ALA A 478 -12.073 -49.489 -26.447 1.00 25.00 H new ATOM 0 HB2 ALA A 478 -12.775 -48.084 -27.286 1.00 25.00 H new ATOM 0 HB3 ALA A 478 -11.603 -49.128 -28.125 1.00 25.00 H new ATOM 959 N ILE A 479 -8.785 -49.026 -27.495 1.00 25.00 N ATOM 960 CA ILE A 479 -7.589 -49.863 -27.357 1.00 25.00 C ATOM 961 C ILE A 479 -6.476 -49.064 -26.707 1.00 25.00 C ATOM 962 O ILE A 479 -5.708 -49.593 -25.919 1.00 25.00 O ATOM 963 CB ILE A 479 -7.063 -50.401 -28.708 1.00 25.00 C ATOM 964 CG1 ILE A 479 -8.187 -51.073 -29.501 1.00 25.00 C ATOM 965 CG2 ILE A 479 -5.924 -51.427 -28.489 1.00 25.00 C ATOM 966 CD1 ILE A 479 -8.408 -50.398 -30.793 1.00 25.00 C ATOM 0 H ILE A 479 -9.024 -48.772 -28.454 1.00 25.00 H new ATOM 0 HA ILE A 479 -7.883 -50.715 -26.744 1.00 25.00 H new ATOM 0 HB ILE A 479 -6.680 -49.549 -29.270 1.00 25.00 H new ATOM 0 HG12 ILE A 479 -7.938 -52.120 -29.673 1.00 25.00 H new ATOM 0 HG13 ILE A 479 -9.107 -51.056 -28.917 1.00 25.00 H new ATOM 0 HG21 ILE A 479 -5.571 -51.790 -29.454 1.00 25.00 H new ATOM 0 HG22 ILE A 479 -5.101 -50.949 -27.958 1.00 25.00 H new ATOM 0 HG23 ILE A 479 -6.297 -52.265 -27.900 1.00 25.00 H new ATOM 0 HD11 ILE A 479 -9.212 -50.899 -31.332 1.00 25.00 H new ATOM 0 HD12 ILE A 479 -8.681 -49.358 -30.618 1.00 25.00 H new ATOM 0 HD13 ILE A 479 -7.494 -50.438 -31.385 1.00 25.00 H new ATOM 978 N ALA A 480 -6.402 -47.780 -27.025 1.00 25.00 N ATOM 979 CA ALA A 480 -5.374 -46.912 -26.468 1.00 25.00 C ATOM 980 C ALA A 480 -5.474 -46.905 -24.936 1.00 25.00 C ATOM 981 O ALA A 480 -4.491 -46.687 -24.244 1.00 25.00 O ATOM 982 CB ALA A 480 -5.525 -45.490 -27.041 1.00 25.00 C ATOM 0 H ALA A 480 -7.043 -47.315 -27.668 1.00 25.00 H new ATOM 0 HA ALA A 480 -4.389 -47.288 -26.744 1.00 25.00 H new ATOM 0 HB1 ALA A 480 -4.753 -44.845 -26.621 1.00 25.00 H new ATOM 0 HB2 ALA A 480 -5.421 -45.522 -28.126 1.00 25.00 H new ATOM 0 HB3 ALA A 480 -6.508 -45.096 -26.782 1.00 25.00 H new ATOM 988 N LEU A 481 -6.667 -47.149 -24.417 1.00 25.00 N ATOM 989 CA LEU A 481 -6.867 -47.254 -22.964 1.00 25.00 C ATOM 990 C LEU A 481 -6.484 -48.623 -22.459 1.00 25.00 C ATOM 991 O LEU A 481 -5.848 -48.755 -21.423 1.00 25.00 O ATOM 992 CB LEU A 481 -8.314 -46.970 -22.590 1.00 25.00 C ATOM 993 CG LEU A 481 -8.705 -45.585 -23.078 1.00 25.00 C ATOM 994 CD1 LEU A 481 -10.211 -45.524 -23.266 1.00 25.00 C ATOM 995 CD2 LEU A 481 -8.233 -44.483 -22.142 1.00 25.00 C ATOM 0 H LEU A 481 -7.514 -47.279 -24.970 1.00 25.00 H new ATOM 0 HA LEU A 481 -6.223 -46.509 -22.496 1.00 25.00 H new ATOM 0 HB2 LEU A 481 -8.969 -47.721 -23.033 1.00 25.00 H new ATOM 0 HB3 LEU A 481 -8.440 -47.035 -21.509 1.00 25.00 H new ATOM 0 HG LEU A 481 -8.207 -45.413 -24.032 1.00 25.00 H new ATOM 0 HD11 LEU A 481 -10.494 -44.531 -23.616 1.00 25.00 H new ATOM 0 HD12 LEU A 481 -10.516 -46.269 -24.001 1.00 25.00 H new ATOM 0 HD13 LEU A 481 -10.705 -45.728 -22.316 1.00 25.00 H new ATOM 0 HD21 LEU A 481 -8.538 -43.514 -22.537 1.00 25.00 H new ATOM 0 HD22 LEU A 481 -8.675 -44.629 -21.156 1.00 25.00 H new ATOM 0 HD23 LEU A 481 -7.147 -44.515 -22.060 1.00 25.00 H new ATOM 1007 N MET A 482 -6.886 -49.648 -23.198 1.00 25.00 N ATOM 1008 CA MET A 482 -6.626 -51.039 -22.814 1.00 25.00 C ATOM 1009 C MET A 482 -5.162 -51.321 -22.680 1.00 25.00 C ATOM 1010 O MET A 482 -4.762 -52.240 -21.984 1.00 25.00 O ATOM 1011 CB MET A 482 -7.184 -52.009 -23.853 1.00 25.00 C ATOM 1012 CG MET A 482 -8.641 -51.881 -23.974 1.00 25.00 C ATOM 1013 SD MET A 482 -9.472 -53.355 -24.588 1.00 25.00 S ATOM 1014 CE MET A 482 -9.258 -53.151 -26.349 1.00 25.00 C ATOM 0 H MET A 482 -7.398 -49.546 -24.074 1.00 25.00 H new ATOM 0 HA MET A 482 -7.117 -51.180 -21.851 1.00 25.00 H new ATOM 0 HB2 MET A 482 -6.718 -51.817 -24.820 1.00 25.00 H new ATOM 0 HB3 MET A 482 -6.929 -53.031 -23.573 1.00 25.00 H new ATOM 0 HG2 MET A 482 -9.053 -51.627 -22.997 1.00 25.00 H new ATOM 0 HG3 MET A 482 -8.866 -51.048 -24.641 1.00 25.00 H new ATOM 0 HE1 MET A 482 -9.721 -53.988 -26.871 1.00 25.00 H new ATOM 0 HE2 MET A 482 -9.728 -52.220 -26.667 1.00 25.00 H new ATOM 0 HE3 MET A 482 -8.194 -53.119 -26.585 1.00 25.00 H new ATOM 1024 N THR A 483 -4.352 -50.535 -23.357 1.00 25.00 N ATOM 1025 CA THR A 483 -2.915 -50.788 -23.327 1.00 25.00 C ATOM 1026 C THR A 483 -2.328 -50.258 -22.026 1.00 25.00 C ATOM 1027 O THR A 483 -1.376 -50.812 -21.486 1.00 25.00 O ATOM 1028 CB THR A 483 -2.236 -50.176 -24.546 1.00 25.00 C ATOM 1029 OG1 THR A 483 -2.587 -48.797 -24.636 1.00 25.00 O ATOM 1030 CG2 THR A 483 -2.713 -50.885 -25.817 1.00 25.00 C ATOM 0 H THR A 483 -4.645 -49.737 -23.921 1.00 25.00 H new ATOM 0 HA THR A 483 -2.736 -51.863 -23.366 1.00 25.00 H new ATOM 0 HB THR A 483 -1.156 -50.286 -24.446 1.00 25.00 H new ATOM 0 HG1 THR A 483 -2.151 -48.399 -25.418 1.00 25.00 H new ATOM 0 HG21 THR A 483 -2.224 -50.443 -26.685 1.00 25.00 H new ATOM 0 HG22 THR A 483 -2.462 -51.944 -25.759 1.00 25.00 H new ATOM 0 HG23 THR A 483 -3.793 -50.773 -25.913 1.00 25.00 H new ATOM 1038 N GLN A 484 -2.923 -49.197 -21.507 1.00 25.00 N ATOM 1039 CA GLN A 484 -2.488 -48.597 -20.247 1.00 25.00 C ATOM 1040 C GLN A 484 -3.034 -49.410 -19.100 1.00 25.00 C ATOM 1041 O GLN A 484 -2.357 -49.667 -18.109 1.00 25.00 O ATOM 1042 CB GLN A 484 -3.006 -47.169 -20.159 1.00 25.00 C ATOM 1043 CG GLN A 484 -2.659 -46.416 -21.395 1.00 25.00 C ATOM 1044 CD GLN A 484 -2.974 -44.943 -21.304 1.00 25.00 C ATOM 1045 OE1 GLN A 484 -2.569 -44.262 -20.379 1.00 25.00 O ATOM 1046 NE2 GLN A 484 -3.712 -44.450 -22.263 1.00 25.00 N ATOM 0 H GLN A 484 -3.717 -48.726 -21.941 1.00 25.00 H new ATOM 0 HA GLN A 484 -1.399 -48.585 -20.200 1.00 25.00 H new ATOM 0 HB2 GLN A 484 -4.087 -47.175 -20.020 1.00 25.00 H new ATOM 0 HB3 GLN A 484 -2.576 -46.672 -19.289 1.00 25.00 H new ATOM 0 HG2 GLN A 484 -1.596 -46.541 -21.602 1.00 25.00 H new ATOM 0 HG3 GLN A 484 -3.201 -46.845 -22.238 1.00 25.00 H new ATOM 0 HE21 GLN A 484 -4.032 -45.052 -23.021 1.00 25.00 H new ATOM 0 HE22 GLN A 484 -3.968 -43.463 -22.253 1.00 25.00 H new ATOM 1055 N PHE A 485 -4.274 -49.843 -19.267 1.00 25.00 N ATOM 1056 CA PHE A 485 -4.935 -50.709 -18.310 1.00 25.00 C ATOM 1057 C PHE A 485 -4.277 -52.084 -18.338 1.00 25.00 C ATOM 1058 O PHE A 485 -4.507 -52.907 -17.456 1.00 25.00 O ATOM 1059 CB PHE A 485 -6.410 -50.828 -18.685 1.00 25.00 C ATOM 1060 CG PHE A 485 -7.295 -49.836 -17.978 1.00 25.00 C ATOM 1061 CD1 PHE A 485 -7.936 -50.192 -16.775 1.00 25.00 C ATOM 1062 CD2 PHE A 485 -7.498 -48.543 -18.502 1.00 25.00 C ATOM 1063 CE1 PHE A 485 -8.773 -49.268 -16.098 1.00 25.00 C ATOM 1064 CE2 PHE A 485 -8.332 -47.611 -17.835 1.00 25.00 C ATOM 1065 CZ PHE A 485 -8.969 -47.977 -16.631 1.00 25.00 C ATOM 0 H PHE A 485 -4.850 -49.601 -20.073 1.00 25.00 H new ATOM 0 HA PHE A 485 -4.849 -50.293 -17.306 1.00 25.00 H new ATOM 0 HB2 PHE A 485 -6.514 -50.692 -19.761 1.00 25.00 H new ATOM 0 HB3 PHE A 485 -6.754 -51.837 -18.456 1.00 25.00 H new ATOM 0 HD1 PHE A 485 -7.789 -51.180 -16.363 1.00 25.00 H new ATOM 0 HD2 PHE A 485 -7.012 -48.259 -19.424 1.00 25.00 H new ATOM 0 HE1 PHE A 485 -9.259 -49.553 -15.176 1.00 25.00 H new ATOM 0 HE2 PHE A 485 -8.479 -46.624 -18.247 1.00 25.00 H new ATOM 0 HZ PHE A 485 -9.605 -47.271 -16.119 1.00 25.00 H new