USER MOD reduce.3.24.130724 H: found=0, std=0, add=329, rem=0, adj=6 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 176:sc= 0 (180deg=-0.0134) USER MOD Single : A 433 MET CE :methyl -167:sc= 0 (180deg=-0.21) USER MOD Single : A 434 THR OG1 : rot 76:sc= 1.29 USER MOD Single : A 436 GLN : amide:sc= 0.32 X(o=0.32,f=-0.00044) USER MOD Single : A 464 GLN : amide:sc= -0.125 X(o=-0.13,f=-0.36) USER MOD Single : A 467 GLN : amide:sc= -0.0121 K(o=-0.012,f=-0.54) USER MOD Single : A 473 GLN : amide:sc= 0 K(o=0,f=-0.8) USER MOD Single : A 477 HIS : no HD1:sc= -0.145 X(o=-0.15,f=-0.005) USER MOD Single : A 482 MET CE :methyl 178:sc= 0 (180deg=-0.0175) USER MOD Single : A 483 THR OG1 : rot 180:sc= 0 USER MOD Single : A 484 GLN : amide:sc= 0.362 X(o=0.36,f=0) USER MOD ----------------------------------------------------------------- ATOM 113 N GLU A 419 -44.562 -17.357 -35.060 1.00 25.00 N ATOM 114 CA GLU A 419 -43.109 -17.521 -35.085 1.00 25.00 C ATOM 115 C GLU A 419 -42.634 -17.816 -36.506 1.00 25.00 C ATOM 116 O GLU A 419 -41.614 -17.314 -36.935 1.00 25.00 O ATOM 117 CB GLU A 419 -42.706 -18.657 -34.134 1.00 25.00 C ATOM 118 CG GLU A 419 -43.099 -18.391 -32.662 1.00 25.00 C ATOM 119 CD GLU A 419 -42.951 -19.620 -31.758 1.00 25.00 C ATOM 120 OE1 GLU A 419 -42.449 -20.668 -32.215 1.00 25.00 O ATOM 121 OE2 GLU A 419 -43.368 -19.539 -30.582 1.00 25.00 O ATOM 0 HA GLU A 419 -42.636 -16.596 -34.754 1.00 25.00 H new ATOM 0 HB2 GLU A 419 -43.175 -19.583 -34.466 1.00 25.00 H new ATOM 0 HB3 GLU A 419 -41.628 -18.806 -34.194 1.00 25.00 H new ATOM 0 HG2 GLU A 419 -42.480 -17.584 -32.269 1.00 25.00 H new ATOM 0 HG3 GLU A 419 -44.132 -18.046 -32.627 1.00 25.00 H new ATOM 128 N VAL A 420 -43.391 -18.619 -37.242 1.00 25.00 N ATOM 129 CA VAL A 420 -43.057 -18.942 -38.633 1.00 25.00 C ATOM 130 C VAL A 420 -43.167 -17.690 -39.514 1.00 25.00 C ATOM 131 O VAL A 420 -42.386 -17.509 -40.450 1.00 25.00 O ATOM 132 CB VAL A 420 -43.976 -20.089 -39.160 1.00 25.00 C ATOM 133 CG1 VAL A 420 -43.828 -20.294 -40.677 1.00 25.00 C ATOM 134 CG2 VAL A 420 -43.627 -21.408 -38.438 1.00 25.00 C ATOM 0 H VAL A 420 -44.244 -19.063 -36.902 1.00 25.00 H new ATOM 0 HA VAL A 420 -42.026 -19.292 -38.676 1.00 25.00 H new ATOM 0 HB VAL A 420 -45.007 -19.802 -38.955 1.00 25.00 H new ATOM 0 HG11 VAL A 420 -44.485 -21.101 -41.001 1.00 25.00 H new ATOM 0 HG12 VAL A 420 -44.099 -19.375 -41.197 1.00 25.00 H new ATOM 0 HG13 VAL A 420 -42.795 -20.551 -40.910 1.00 25.00 H new ATOM 0 HG21 VAL A 420 -44.270 -22.207 -38.808 1.00 25.00 H new ATOM 0 HG22 VAL A 420 -42.585 -21.663 -38.630 1.00 25.00 H new ATOM 0 HG23 VAL A 420 -43.779 -21.287 -37.365 1.00 25.00 H new ATOM 144 N SER A 421 -44.114 -16.813 -39.215 1.00 25.00 N ATOM 145 CA SER A 421 -44.259 -15.581 -39.990 1.00 25.00 C ATOM 146 C SER A 421 -43.054 -14.672 -39.747 1.00 25.00 C ATOM 147 O SER A 421 -42.531 -14.052 -40.674 1.00 25.00 O ATOM 148 CB SER A 421 -45.541 -14.849 -39.600 1.00 25.00 C ATOM 149 OG SER A 421 -46.678 -15.676 -39.810 1.00 25.00 O ATOM 0 H SER A 421 -44.785 -16.924 -38.455 1.00 25.00 H new ATOM 0 HA SER A 421 -44.312 -15.840 -41.047 1.00 25.00 H new ATOM 0 HB2 SER A 421 -45.491 -14.551 -38.553 1.00 25.00 H new ATOM 0 HB3 SER A 421 -45.637 -13.936 -40.187 1.00 25.00 H new ATOM 0 HG SER A 421 -47.489 -15.189 -39.553 1.00 25.00 H new ATOM 155 N ASP A 422 -42.610 -14.610 -38.501 1.00 25.00 N ATOM 156 CA ASP A 422 -41.453 -13.795 -38.131 1.00 25.00 C ATOM 157 C ASP A 422 -40.182 -14.422 -38.692 1.00 25.00 C ATOM 158 O ASP A 422 -39.240 -13.724 -39.054 1.00 25.00 O ATOM 159 CB ASP A 422 -41.349 -13.674 -36.606 1.00 25.00 C ATOM 160 CG ASP A 422 -42.502 -12.879 -35.998 1.00 25.00 C ATOM 161 OD1 ASP A 422 -43.018 -11.954 -36.664 1.00 25.00 O ATOM 162 OD2 ASP A 422 -42.886 -13.177 -34.843 1.00 25.00 O ATOM 0 H ASP A 422 -43.033 -15.115 -37.722 1.00 25.00 H new ATOM 0 HA ASP A 422 -41.577 -12.797 -38.550 1.00 25.00 H new ATOM 0 HB2 ASP A 422 -41.330 -14.671 -36.167 1.00 25.00 H new ATOM 0 HB3 ASP A 422 -40.405 -13.193 -36.347 1.00 25.00 H new ATOM 167 N MET A 423 -40.166 -15.743 -38.780 1.00 25.00 N ATOM 168 CA MET A 423 -39.027 -16.469 -39.336 1.00 25.00 C ATOM 169 C MET A 423 -38.828 -16.117 -40.799 1.00 25.00 C ATOM 170 O MET A 423 -37.707 -15.936 -41.256 1.00 25.00 O ATOM 171 CB MET A 423 -39.245 -17.972 -39.215 1.00 25.00 C ATOM 172 CG MET A 423 -38.523 -18.586 -38.046 1.00 25.00 C ATOM 173 SD MET A 423 -39.446 -19.953 -37.282 1.00 25.00 S ATOM 174 CE MET A 423 -39.642 -21.102 -38.656 1.00 25.00 C ATOM 0 H MET A 423 -40.933 -16.341 -38.472 1.00 25.00 H new ATOM 0 HA MET A 423 -38.140 -16.180 -38.772 1.00 25.00 H new ATOM 0 HB2 MET A 423 -40.312 -18.171 -39.119 1.00 25.00 H new ATOM 0 HB3 MET A 423 -38.912 -18.456 -40.133 1.00 25.00 H new ATOM 0 HG2 MET A 423 -37.551 -18.951 -38.377 1.00 25.00 H new ATOM 0 HG3 MET A 423 -38.336 -17.817 -37.296 1.00 25.00 H new ATOM 0 HE1 MET A 423 -40.128 -22.012 -38.303 1.00 25.00 H new ATOM 0 HE2 MET A 423 -40.254 -20.641 -39.431 1.00 25.00 H new ATOM 0 HE3 MET A 423 -38.663 -21.350 -39.066 1.00 25.00 H new ATOM 184 N ALA A 424 -39.919 -16.008 -41.538 1.00 25.00 N ATOM 185 CA ALA A 424 -39.822 -15.675 -42.948 1.00 25.00 C ATOM 186 C ALA A 424 -39.331 -14.228 -43.113 1.00 25.00 C ATOM 187 O ALA A 424 -38.623 -13.895 -44.064 1.00 25.00 O ATOM 188 CB ALA A 424 -41.186 -15.864 -43.624 1.00 25.00 C ATOM 0 H ALA A 424 -40.869 -16.143 -41.191 1.00 25.00 H new ATOM 0 HA ALA A 424 -39.103 -16.340 -43.426 1.00 25.00 H new ATOM 0 HB1 ALA A 424 -41.106 -15.612 -44.682 1.00 25.00 H new ATOM 0 HB2 ALA A 424 -41.502 -16.902 -43.521 1.00 25.00 H new ATOM 0 HB3 ALA A 424 -41.920 -15.212 -43.151 1.00 25.00 H new ATOM 194 N ALA A 425 -39.718 -13.371 -42.179 1.00 25.00 N ATOM 195 CA ALA A 425 -39.318 -11.971 -42.220 1.00 25.00 C ATOM 196 C ALA A 425 -37.827 -11.807 -41.894 1.00 25.00 C ATOM 197 O ALA A 425 -37.116 -11.057 -42.562 1.00 25.00 O ATOM 198 CB ALA A 425 -40.166 -11.161 -41.231 1.00 25.00 C ATOM 0 H ALA A 425 -40.308 -13.620 -41.385 1.00 25.00 H new ATOM 0 HA ALA A 425 -39.482 -11.598 -43.231 1.00 25.00 H new ATOM 0 HB1 ALA A 425 -39.864 -10.114 -41.265 1.00 25.00 H new ATOM 0 HB2 ALA A 425 -41.219 -11.244 -41.502 1.00 25.00 H new ATOM 0 HB3 ALA A 425 -40.019 -11.549 -40.223 1.00 25.00 H new ATOM 204 N VAL A 426 -37.359 -12.498 -40.863 1.00 25.00 N ATOM 205 CA VAL A 426 -35.962 -12.377 -40.450 1.00 25.00 C ATOM 206 C VAL A 426 -35.031 -12.986 -41.488 1.00 25.00 C ATOM 207 O VAL A 426 -33.927 -12.513 -41.680 1.00 25.00 O ATOM 208 CB VAL A 426 -35.728 -12.972 -39.034 1.00 25.00 C ATOM 209 CG1 VAL A 426 -35.812 -14.484 -39.009 1.00 25.00 C ATOM 210 CG2 VAL A 426 -34.396 -12.514 -38.479 1.00 25.00 C ATOM 0 H VAL A 426 -37.916 -13.142 -40.301 1.00 25.00 H new ATOM 0 HA VAL A 426 -35.725 -11.315 -40.385 1.00 25.00 H new ATOM 0 HB VAL A 426 -36.534 -12.598 -38.402 1.00 25.00 H new ATOM 0 HG11 VAL A 426 -35.640 -14.841 -37.994 1.00 25.00 H new ATOM 0 HG12 VAL A 426 -36.801 -14.799 -39.342 1.00 25.00 H new ATOM 0 HG13 VAL A 426 -35.055 -14.901 -39.673 1.00 25.00 H new ATOM 0 HG21 VAL A 426 -34.249 -12.941 -37.487 1.00 25.00 H new ATOM 0 HG22 VAL A 426 -33.594 -12.845 -39.139 1.00 25.00 H new ATOM 0 HG23 VAL A 426 -34.385 -11.426 -38.412 1.00 25.00 H new ATOM 220 N GLU A 427 -35.486 -14.014 -42.182 1.00 25.00 N ATOM 221 CA GLU A 427 -34.693 -14.604 -43.271 1.00 25.00 C ATOM 222 C GLU A 427 -34.329 -13.521 -44.291 1.00 25.00 C ATOM 223 O GLU A 427 -33.187 -13.435 -44.745 1.00 25.00 O ATOM 224 CB GLU A 427 -35.465 -15.722 -43.987 1.00 25.00 C ATOM 225 CG GLU A 427 -35.223 -17.116 -43.421 1.00 25.00 C ATOM 226 CD GLU A 427 -35.769 -18.213 -44.337 1.00 25.00 C ATOM 227 OE1 GLU A 427 -36.984 -18.204 -44.639 1.00 25.00 O ATOM 228 OE2 GLU A 427 -34.972 -19.083 -44.767 1.00 25.00 O ATOM 0 H GLU A 427 -36.389 -14.461 -42.022 1.00 25.00 H new ATOM 0 HA GLU A 427 -33.791 -15.030 -42.832 1.00 25.00 H new ATOM 0 HB2 GLU A 427 -36.531 -15.502 -43.935 1.00 25.00 H new ATOM 0 HB3 GLU A 427 -35.190 -15.719 -45.042 1.00 25.00 H new ATOM 0 HG2 GLU A 427 -34.153 -17.266 -43.274 1.00 25.00 H new ATOM 0 HG3 GLU A 427 -35.694 -17.195 -42.441 1.00 25.00 H new ATOM 235 N ALA A 428 -35.295 -12.682 -44.643 1.00 25.00 N ATOM 236 CA ALA A 428 -35.050 -11.596 -45.586 1.00 25.00 C ATOM 237 C ALA A 428 -34.116 -10.540 -44.976 1.00 25.00 C ATOM 238 O ALA A 428 -33.262 -9.976 -45.669 1.00 25.00 O ATOM 239 CB ALA A 428 -36.383 -10.957 -46.003 1.00 25.00 C ATOM 0 H ALA A 428 -36.251 -12.731 -44.292 1.00 25.00 H new ATOM 0 HA ALA A 428 -34.561 -12.007 -46.469 1.00 25.00 H new ATOM 0 HB1 ALA A 428 -36.194 -10.147 -46.707 1.00 25.00 H new ATOM 0 HB2 ALA A 428 -37.015 -11.709 -46.476 1.00 25.00 H new ATOM 0 HB3 ALA A 428 -36.888 -10.561 -45.122 1.00 25.00 H new ATOM 245 N ALA A 429 -34.279 -10.282 -43.684 1.00 25.00 N ATOM 246 CA ALA A 429 -33.453 -9.299 -42.988 1.00 25.00 C ATOM 247 C ALA A 429 -31.987 -9.749 -42.956 1.00 25.00 C ATOM 248 O ALA A 429 -31.087 -8.958 -43.196 1.00 25.00 O ATOM 249 CB ALA A 429 -33.980 -9.081 -41.561 1.00 25.00 C ATOM 0 H ALA A 429 -34.975 -10.739 -43.096 1.00 25.00 H new ATOM 0 HA ALA A 429 -33.507 -8.355 -43.530 1.00 25.00 H new ATOM 0 HB1 ALA A 429 -33.357 -8.346 -41.051 1.00 25.00 H new ATOM 0 HB2 ALA A 429 -35.007 -8.718 -41.604 1.00 25.00 H new ATOM 0 HB3 ALA A 429 -33.951 -10.024 -41.014 1.00 25.00 H new ATOM 255 N GLU A 430 -31.755 -11.020 -42.670 1.00 25.00 N ATOM 256 CA GLU A 430 -30.400 -11.569 -42.631 1.00 25.00 C ATOM 257 C GLU A 430 -29.757 -11.417 -43.989 1.00 25.00 C ATOM 258 O GLU A 430 -28.616 -10.972 -44.114 1.00 25.00 O ATOM 259 CB GLU A 430 -30.446 -13.055 -42.301 1.00 25.00 C ATOM 260 CG GLU A 430 -30.818 -13.352 -40.881 1.00 25.00 C ATOM 261 CD GLU A 430 -29.686 -13.051 -39.913 1.00 25.00 C ATOM 262 OE1 GLU A 430 -28.597 -13.648 -40.060 1.00 25.00 O ATOM 263 OE2 GLU A 430 -29.881 -12.210 -39.010 1.00 25.00 O ATOM 0 H GLU A 430 -32.488 -11.697 -42.460 1.00 25.00 H new ATOM 0 HA GLU A 430 -29.831 -11.033 -41.871 1.00 25.00 H new ATOM 0 HB2 GLU A 430 -31.162 -13.542 -42.963 1.00 25.00 H new ATOM 0 HB3 GLU A 430 -29.470 -13.493 -42.510 1.00 25.00 H new ATOM 0 HG2 GLU A 430 -31.694 -12.764 -40.607 1.00 25.00 H new ATOM 0 HG3 GLU A 430 -31.099 -14.402 -40.793 1.00 25.00 H new ATOM 270 N LEU A 431 -30.505 -11.781 -45.015 1.00 25.00 N ATOM 271 CA LEU A 431 -30.007 -11.687 -46.383 1.00 25.00 C ATOM 272 C LEU A 431 -29.590 -10.262 -46.745 1.00 25.00 C ATOM 273 O LEU A 431 -28.527 -10.066 -47.340 1.00 25.00 O ATOM 274 CB LEU A 431 -31.062 -12.189 -47.375 1.00 25.00 C ATOM 275 CG LEU A 431 -31.241 -13.716 -47.437 1.00 25.00 C ATOM 276 CD1 LEU A 431 -32.512 -14.053 -48.216 1.00 25.00 C ATOM 277 CD2 LEU A 431 -30.034 -14.398 -48.100 1.00 25.00 C ATOM 0 H LEU A 431 -31.455 -12.143 -44.932 1.00 25.00 H new ATOM 0 HA LEU A 431 -29.121 -12.319 -46.446 1.00 25.00 H new ATOM 0 HB2 LEU A 431 -32.021 -11.739 -47.118 1.00 25.00 H new ATOM 0 HB3 LEU A 431 -30.799 -11.831 -48.370 1.00 25.00 H new ATOM 0 HG LEU A 431 -31.321 -14.088 -46.416 1.00 25.00 H new ATOM 0 HD11 LEU A 431 -32.637 -15.135 -48.259 1.00 25.00 H new ATOM 0 HD12 LEU A 431 -33.373 -13.608 -47.717 1.00 25.00 H new ATOM 0 HD13 LEU A 431 -32.434 -13.657 -49.228 1.00 25.00 H new ATOM 0 HD21 LEU A 431 -30.195 -15.476 -48.127 1.00 25.00 H new ATOM 0 HD22 LEU A 431 -29.917 -14.023 -49.117 1.00 25.00 H new ATOM 0 HD23 LEU A 431 -29.133 -14.180 -47.527 1.00 25.00 H new ATOM 289 N GLU A 432 -30.387 -9.256 -46.404 1.00 25.00 N ATOM 290 CA GLU A 432 -29.989 -7.885 -46.722 1.00 25.00 C ATOM 291 C GLU A 432 -28.879 -7.369 -45.797 1.00 25.00 C ATOM 292 O GLU A 432 -28.026 -6.595 -46.238 1.00 25.00 O ATOM 293 CB GLU A 432 -31.179 -6.915 -46.780 1.00 25.00 C ATOM 294 CG GLU A 432 -31.818 -6.538 -45.453 1.00 25.00 C ATOM 295 CD GLU A 432 -32.933 -5.511 -45.629 1.00 25.00 C ATOM 296 OE1 GLU A 432 -33.009 -4.891 -46.720 1.00 25.00 O ATOM 297 OE2 GLU A 432 -33.724 -5.313 -44.685 1.00 25.00 O ATOM 0 H GLU A 432 -31.282 -9.353 -45.924 1.00 25.00 H new ATOM 0 HA GLU A 432 -29.573 -7.924 -47.729 1.00 25.00 H new ATOM 0 HB2 GLU A 432 -30.848 -6.000 -47.271 1.00 25.00 H new ATOM 0 HB3 GLU A 432 -31.947 -7.357 -47.414 1.00 25.00 H new ATOM 0 HG2 GLU A 432 -32.220 -7.432 -44.977 1.00 25.00 H new ATOM 0 HG3 GLU A 432 -31.056 -6.136 -44.785 1.00 25.00 H new ATOM 304 N MET A 433 -28.855 -7.793 -44.538 1.00 25.00 N ATOM 305 CA MET A 433 -27.801 -7.366 -43.612 1.00 25.00 C ATOM 306 C MET A 433 -26.464 -7.947 -44.034 1.00 25.00 C ATOM 307 O MET A 433 -25.429 -7.302 -43.878 1.00 25.00 O ATOM 308 CB MET A 433 -28.098 -7.793 -42.172 1.00 25.00 C ATOM 309 CG MET A 433 -29.119 -6.906 -41.483 1.00 25.00 C ATOM 310 SD MET A 433 -29.284 -7.272 -39.716 1.00 25.00 S ATOM 311 CE MET A 433 -30.069 -8.914 -39.734 1.00 25.00 C ATOM 0 H MET A 433 -29.545 -8.426 -44.134 1.00 25.00 H new ATOM 0 HA MET A 433 -27.765 -6.277 -43.647 1.00 25.00 H new ATOM 0 HB2 MET A 433 -28.461 -8.821 -42.172 1.00 25.00 H new ATOM 0 HB3 MET A 433 -27.171 -7.782 -41.598 1.00 25.00 H new ATOM 0 HG2 MET A 433 -28.831 -5.862 -41.608 1.00 25.00 H new ATOM 0 HG3 MET A 433 -30.088 -7.030 -41.967 1.00 25.00 H new ATOM 0 HE1 MET A 433 -30.434 -9.154 -38.735 1.00 25.00 H new ATOM 0 HE2 MET A 433 -30.904 -8.910 -40.435 1.00 25.00 H new ATOM 0 HE3 MET A 433 -29.339 -9.663 -40.043 1.00 25.00 H new ATOM 321 N THR A 434 -26.486 -9.152 -44.589 1.00 25.00 N ATOM 322 CA THR A 434 -25.273 -9.799 -45.095 1.00 25.00 C ATOM 323 C THR A 434 -24.607 -8.890 -46.127 1.00 25.00 C ATOM 324 O THR A 434 -23.386 -8.787 -46.194 1.00 25.00 O ATOM 325 CB THR A 434 -25.596 -11.174 -45.745 1.00 25.00 C ATOM 326 OG1 THR A 434 -26.214 -12.027 -44.778 1.00 25.00 O ATOM 327 CG2 THR A 434 -24.339 -11.880 -46.223 1.00 25.00 C ATOM 0 H THR A 434 -27.334 -9.707 -44.702 1.00 25.00 H new ATOM 0 HA THR A 434 -24.599 -9.970 -44.255 1.00 25.00 H new ATOM 0 HB THR A 434 -26.252 -10.981 -46.594 1.00 25.00 H new ATOM 0 HG1 THR A 434 -27.144 -11.749 -44.644 1.00 25.00 H new ATOM 0 HG21 THR A 434 -24.607 -12.837 -46.671 1.00 25.00 H new ATOM 0 HG22 THR A 434 -23.834 -11.261 -46.964 1.00 25.00 H new ATOM 0 HG23 THR A 434 -23.673 -12.049 -45.377 1.00 25.00 H new ATOM 335 N ARG A 435 -25.406 -8.201 -46.928 1.00 25.00 N ATOM 336 CA ARG A 435 -24.850 -7.303 -47.941 1.00 25.00 C ATOM 337 C ARG A 435 -24.119 -6.151 -47.282 1.00 25.00 C ATOM 338 O ARG A 435 -23.070 -5.731 -47.741 1.00 25.00 O ATOM 339 CB ARG A 435 -25.955 -6.744 -48.835 1.00 25.00 C ATOM 340 CG ARG A 435 -26.825 -7.820 -49.443 1.00 25.00 C ATOM 341 CD ARG A 435 -27.819 -7.239 -50.433 1.00 25.00 C ATOM 342 NE ARG A 435 -27.146 -6.710 -51.633 1.00 25.00 N ATOM 343 CZ ARG A 435 -27.746 -6.066 -52.626 1.00 25.00 C ATOM 344 NH1 ARG A 435 -29.036 -5.825 -52.626 1.00 25.00 N ATOM 345 NH2 ARG A 435 -27.033 -5.647 -53.634 1.00 25.00 N ATOM 0 H ARG A 435 -26.425 -8.241 -46.902 1.00 25.00 H new ATOM 0 HA ARG A 435 -24.153 -7.879 -48.549 1.00 25.00 H new ATOM 0 HB2 ARG A 435 -26.579 -6.067 -48.252 1.00 25.00 H new ATOM 0 HB3 ARG A 435 -25.505 -6.154 -49.634 1.00 25.00 H new ATOM 0 HG2 ARG A 435 -26.197 -8.556 -49.946 1.00 25.00 H new ATOM 0 HG3 ARG A 435 -27.362 -8.345 -48.653 1.00 25.00 H new ATOM 0 HD2 ARG A 435 -28.533 -8.008 -50.726 1.00 25.00 H new ATOM 0 HD3 ARG A 435 -28.387 -6.442 -49.953 1.00 25.00 H new ATOM 0 HE ARG A 435 -26.138 -6.850 -51.706 1.00 25.00 H new ATOM 0 HH11 ARG A 435 -29.613 -6.136 -51.844 1.00 25.00 H new ATOM 0 HH12 ARG A 435 -29.462 -5.327 -53.408 1.00 25.00 H new ATOM 0 HH21 ARG A 435 -26.027 -5.816 -53.652 1.00 25.00 H new ATOM 0 HH22 ARG A 435 -27.481 -5.151 -54.404 1.00 25.00 H new ATOM 359 N GLN A 436 -24.690 -5.637 -46.206 1.00 25.00 N ATOM 360 CA GLN A 436 -24.102 -4.488 -45.518 1.00 25.00 C ATOM 361 C GLN A 436 -22.778 -4.846 -44.851 1.00 25.00 C ATOM 362 O GLN A 436 -21.817 -4.091 -44.937 1.00 25.00 O ATOM 363 CB GLN A 436 -25.045 -3.921 -44.443 1.00 25.00 C ATOM 364 CG GLN A 436 -26.515 -3.808 -44.841 1.00 25.00 C ATOM 365 CD GLN A 436 -26.745 -3.148 -46.181 1.00 25.00 C ATOM 366 OE1 GLN A 436 -26.128 -2.151 -46.527 1.00 25.00 O ATOM 367 NE2 GLN A 436 -27.639 -3.711 -46.946 1.00 25.00 N ATOM 0 H GLN A 436 -25.552 -5.989 -45.789 1.00 25.00 H new ATOM 0 HA GLN A 436 -23.932 -3.735 -46.287 1.00 25.00 H new ATOM 0 HB2 GLN A 436 -24.976 -4.551 -43.557 1.00 25.00 H new ATOM 0 HB3 GLN A 436 -24.688 -2.931 -44.159 1.00 25.00 H new ATOM 0 HG2 GLN A 436 -26.952 -4.806 -44.860 1.00 25.00 H new ATOM 0 HG3 GLN A 436 -27.045 -3.243 -44.074 1.00 25.00 H new ATOM 0 HE21 GLN A 436 -28.135 -4.542 -46.624 1.00 25.00 H new ATOM 0 HE22 GLN A 436 -27.842 -3.320 -47.866 1.00 25.00 H new ATOM 376 N VAL A 437 -22.728 -5.988 -44.177 1.00 25.00 N ATOM 377 CA VAL A 437 -21.518 -6.376 -43.447 1.00 25.00 C ATOM 378 C VAL A 437 -20.357 -6.713 -44.373 1.00 25.00 C ATOM 379 O VAL A 437 -19.207 -6.465 -44.043 1.00 25.00 O ATOM 380 CB VAL A 437 -21.767 -7.560 -42.470 1.00 25.00 C ATOM 381 CG1 VAL A 437 -22.719 -7.120 -41.339 1.00 25.00 C ATOM 382 CG2 VAL A 437 -22.335 -8.780 -43.163 1.00 25.00 C ATOM 0 H VAL A 437 -23.496 -6.656 -44.118 1.00 25.00 H new ATOM 0 HA VAL A 437 -21.245 -5.498 -42.862 1.00 25.00 H new ATOM 0 HB VAL A 437 -20.797 -7.840 -42.059 1.00 25.00 H new ATOM 0 HG11 VAL A 437 -22.888 -7.956 -40.660 1.00 25.00 H new ATOM 0 HG12 VAL A 437 -22.273 -6.290 -40.790 1.00 25.00 H new ATOM 0 HG13 VAL A 437 -23.670 -6.803 -41.767 1.00 25.00 H new ATOM 0 HG21 VAL A 437 -22.488 -9.575 -42.433 1.00 25.00 H new ATOM 0 HG22 VAL A 437 -23.288 -8.524 -43.627 1.00 25.00 H new ATOM 0 HG23 VAL A 437 -21.638 -9.121 -43.929 1.00 25.00 H new ATOM 392 N LEU A 438 -20.660 -7.254 -45.540 1.00 25.00 N ATOM 393 CA LEU A 438 -19.626 -7.564 -46.532 1.00 25.00 C ATOM 394 C LEU A 438 -19.016 -6.291 -47.122 1.00 25.00 C ATOM 395 O LEU A 438 -17.917 -6.320 -47.667 1.00 25.00 O ATOM 396 CB LEU A 438 -20.210 -8.422 -47.662 1.00 25.00 C ATOM 397 CG LEU A 438 -20.522 -9.885 -47.301 1.00 25.00 C ATOM 398 CD1 LEU A 438 -21.280 -10.539 -48.458 1.00 25.00 C ATOM 399 CD2 LEU A 438 -19.248 -10.680 -47.002 1.00 25.00 C ATOM 0 H LEU A 438 -21.609 -7.490 -45.831 1.00 25.00 H new ATOM 0 HA LEU A 438 -18.839 -8.119 -46.022 1.00 25.00 H new ATOM 0 HB2 LEU A 438 -21.128 -7.951 -48.013 1.00 25.00 H new ATOM 0 HB3 LEU A 438 -19.509 -8.415 -48.497 1.00 25.00 H new ATOM 0 HG LEU A 438 -21.134 -9.890 -46.399 1.00 25.00 H new ATOM 0 HD11 LEU A 438 -21.503 -11.576 -48.207 1.00 25.00 H new ATOM 0 HD12 LEU A 438 -22.211 -10.000 -48.634 1.00 25.00 H new ATOM 0 HD13 LEU A 438 -20.667 -10.508 -49.359 1.00 25.00 H new ATOM 0 HD21 LEU A 438 -19.511 -11.708 -46.751 1.00 25.00 H new ATOM 0 HD22 LEU A 438 -18.601 -10.674 -47.879 1.00 25.00 H new ATOM 0 HD23 LEU A 438 -18.724 -10.225 -46.162 1.00 25.00 H new ATOM 720 N ALA A 462 -19.496 -33.179 -45.162 1.00 25.00 N ATOM 721 CA ALA A 462 -18.451 -33.109 -44.153 1.00 25.00 C ATOM 722 C ALA A 462 -18.841 -33.915 -42.907 1.00 25.00 C ATOM 723 O ALA A 462 -18.042 -34.703 -42.397 1.00 25.00 O ATOM 724 CB ALA A 462 -18.187 -31.650 -43.780 1.00 25.00 C ATOM 0 HA ALA A 462 -17.540 -33.543 -44.565 1.00 25.00 H new ATOM 0 HB1 ALA A 462 -17.403 -31.604 -43.024 1.00 25.00 H new ATOM 0 HB2 ALA A 462 -17.869 -31.100 -44.666 1.00 25.00 H new ATOM 0 HB3 ALA A 462 -19.100 -31.205 -43.384 1.00 25.00 H new ATOM 730 N LEU A 463 -20.059 -33.723 -42.411 1.00 25.00 N ATOM 731 CA LEU A 463 -20.493 -34.420 -41.202 1.00 25.00 C ATOM 732 C LEU A 463 -20.576 -35.921 -41.427 1.00 25.00 C ATOM 733 O LEU A 463 -20.224 -36.674 -40.546 1.00 25.00 O ATOM 734 CB LEU A 463 -21.809 -33.843 -40.645 1.00 25.00 C ATOM 735 CG LEU A 463 -23.184 -34.397 -41.076 1.00 25.00 C ATOM 736 CD1 LEU A 463 -23.612 -35.651 -40.297 1.00 25.00 C ATOM 737 CD2 LEU A 463 -24.222 -33.316 -40.851 1.00 25.00 C ATOM 0 H LEU A 463 -20.756 -33.100 -42.819 1.00 25.00 H new ATOM 0 HA LEU A 463 -19.733 -34.251 -40.439 1.00 25.00 H new ATOM 0 HB2 LEU A 463 -21.759 -33.932 -39.560 1.00 25.00 H new ATOM 0 HB3 LEU A 463 -21.810 -32.778 -40.878 1.00 25.00 H new ATOM 0 HG LEU A 463 -23.102 -34.685 -42.124 1.00 25.00 H new ATOM 0 HD11 LEU A 463 -24.587 -35.985 -40.652 1.00 25.00 H new ATOM 0 HD12 LEU A 463 -22.879 -36.443 -40.451 1.00 25.00 H new ATOM 0 HD13 LEU A 463 -23.674 -35.416 -39.235 1.00 25.00 H new ATOM 0 HD21 LEU A 463 -25.203 -33.686 -41.149 1.00 25.00 H new ATOM 0 HD22 LEU A 463 -24.242 -33.045 -39.795 1.00 25.00 H new ATOM 0 HD23 LEU A 463 -23.969 -32.439 -41.446 1.00 25.00 H new ATOM 749 N GLN A 464 -21.011 -36.371 -42.595 1.00 25.00 N ATOM 750 CA GLN A 464 -21.056 -37.807 -42.870 1.00 25.00 C ATOM 751 C GLN A 464 -19.675 -38.432 -42.724 1.00 25.00 C ATOM 752 O GLN A 464 -19.536 -39.551 -42.233 1.00 25.00 O ATOM 753 CB GLN A 464 -21.612 -38.069 -44.271 1.00 25.00 C ATOM 754 CG GLN A 464 -23.115 -37.823 -44.390 1.00 25.00 C ATOM 755 CD GLN A 464 -23.925 -38.823 -43.605 1.00 25.00 C ATOM 756 OE1 GLN A 464 -24.198 -38.644 -42.433 1.00 25.00 O ATOM 757 NE2 GLN A 464 -24.302 -39.887 -44.248 1.00 25.00 N ATOM 0 H GLN A 464 -21.334 -35.777 -43.359 1.00 25.00 H new ATOM 0 HA GLN A 464 -21.720 -38.269 -42.140 1.00 25.00 H new ATOM 0 HB2 GLN A 464 -21.091 -37.431 -44.985 1.00 25.00 H new ATOM 0 HB3 GLN A 464 -21.398 -39.101 -44.550 1.00 25.00 H new ATOM 0 HG2 GLN A 464 -23.345 -36.817 -44.038 1.00 25.00 H new ATOM 0 HG3 GLN A 464 -23.406 -37.868 -45.440 1.00 25.00 H new ATOM 0 HE21 GLN A 464 -24.055 -40.003 -45.231 1.00 25.00 H new ATOM 0 HE22 GLN A 464 -24.845 -40.606 -43.770 1.00 25.00 H new ATOM 766 N GLY A 465 -18.653 -37.694 -43.124 1.00 25.00 N ATOM 767 CA GLY A 465 -17.293 -38.159 -42.960 1.00 25.00 C ATOM 768 C GLY A 465 -16.958 -38.165 -41.488 1.00 25.00 C ATOM 769 O GLY A 465 -16.470 -39.154 -40.968 1.00 25.00 O ATOM 0 H GLY A 465 -18.742 -36.777 -43.561 1.00 25.00 H new ATOM 0 HA2 GLY A 465 -17.183 -39.160 -43.377 1.00 25.00 H new ATOM 0 HA3 GLY A 465 -16.604 -37.511 -43.502 1.00 25.00 H new ATOM 773 N ALA A 466 -17.243 -37.062 -40.810 1.00 25.00 N ATOM 774 CA ALA A 466 -16.971 -36.931 -39.380 1.00 25.00 C ATOM 775 C ALA A 466 -17.623 -38.050 -38.555 1.00 25.00 C ATOM 776 O ALA A 466 -17.042 -38.527 -37.599 1.00 25.00 O ATOM 777 CB ALA A 466 -17.457 -35.566 -38.886 1.00 25.00 C ATOM 0 H ALA A 466 -17.667 -36.235 -41.230 1.00 25.00 H new ATOM 0 HA ALA A 466 -15.893 -37.016 -39.242 1.00 25.00 H new ATOM 0 HB1 ALA A 466 -17.253 -35.471 -37.819 1.00 25.00 H new ATOM 0 HB2 ALA A 466 -16.935 -34.776 -39.427 1.00 25.00 H new ATOM 0 HB3 ALA A 466 -18.529 -35.477 -39.059 1.00 25.00 H new ATOM 783 N GLN A 467 -18.817 -38.472 -38.930 1.00 25.00 N ATOM 784 CA GLN A 467 -19.507 -39.541 -38.212 1.00 25.00 C ATOM 785 C GLN A 467 -18.827 -40.880 -38.462 1.00 25.00 C ATOM 786 O GLN A 467 -18.628 -41.675 -37.541 1.00 25.00 O ATOM 787 CB GLN A 467 -20.948 -39.639 -38.696 1.00 25.00 C ATOM 788 CG GLN A 467 -21.831 -38.435 -38.345 1.00 25.00 C ATOM 789 CD GLN A 467 -22.083 -38.272 -36.863 1.00 25.00 C ATOM 790 OE1 GLN A 467 -22.071 -39.225 -36.101 1.00 25.00 O ATOM 791 NE2 GLN A 467 -22.320 -37.052 -36.454 1.00 25.00 N ATOM 0 H GLN A 467 -19.332 -38.095 -39.725 1.00 25.00 H new ATOM 0 HA GLN A 467 -19.477 -39.309 -37.147 1.00 25.00 H new ATOM 0 HB2 GLN A 467 -20.944 -39.765 -39.779 1.00 25.00 H new ATOM 0 HB3 GLN A 467 -21.398 -40.537 -38.272 1.00 25.00 H new ATOM 0 HG2 GLN A 467 -21.360 -37.528 -38.726 1.00 25.00 H new ATOM 0 HG3 GLN A 467 -22.788 -38.537 -38.857 1.00 25.00 H new ATOM 0 HE21 GLN A 467 -22.321 -36.281 -37.122 1.00 25.00 H new ATOM 0 HE22 GLN A 467 -22.503 -36.872 -35.467 1.00 25.00 H new ATOM 800 N ALA A 468 -18.473 -41.135 -39.716 1.00 25.00 N ATOM 801 CA ALA A 468 -17.835 -42.392 -40.081 1.00 25.00 C ATOM 802 C ALA A 468 -16.488 -42.510 -39.373 1.00 25.00 C ATOM 803 O ALA A 468 -16.150 -43.562 -38.825 1.00 25.00 O ATOM 804 CB ALA A 468 -17.654 -42.467 -41.605 1.00 25.00 C ATOM 0 H ALA A 468 -18.616 -40.491 -40.494 1.00 25.00 H new ATOM 0 HA ALA A 468 -18.468 -43.222 -39.769 1.00 25.00 H new ATOM 0 HB1 ALA A 468 -17.176 -43.410 -41.869 1.00 25.00 H new ATOM 0 HB2 ALA A 468 -18.628 -42.405 -42.091 1.00 25.00 H new ATOM 0 HB3 ALA A 468 -17.029 -41.638 -41.938 1.00 25.00 H new ATOM 810 N VAL A 469 -15.718 -41.431 -39.369 1.00 25.00 N ATOM 811 CA VAL A 469 -14.421 -41.465 -38.713 1.00 25.00 C ATOM 812 C VAL A 469 -14.610 -41.513 -37.202 1.00 25.00 C ATOM 813 O VAL A 469 -13.832 -42.147 -36.533 1.00 25.00 O ATOM 814 CB VAL A 469 -13.476 -40.283 -39.131 1.00 25.00 C ATOM 815 CG1 VAL A 469 -13.325 -40.239 -40.661 1.00 25.00 C ATOM 816 CG2 VAL A 469 -13.966 -38.951 -38.618 1.00 25.00 C ATOM 0 H VAL A 469 -15.962 -40.540 -39.802 1.00 25.00 H new ATOM 0 HA VAL A 469 -13.917 -42.372 -39.047 1.00 25.00 H new ATOM 0 HB VAL A 469 -12.504 -40.469 -38.675 1.00 25.00 H new ATOM 0 HG11 VAL A 469 -12.667 -39.415 -40.938 1.00 25.00 H new ATOM 0 HG12 VAL A 469 -12.897 -41.178 -41.012 1.00 25.00 H new ATOM 0 HG13 VAL A 469 -14.303 -40.092 -41.119 1.00 25.00 H new ATOM 0 HG21 VAL A 469 -13.279 -38.165 -38.933 1.00 25.00 H new ATOM 0 HG22 VAL A 469 -14.958 -38.749 -39.021 1.00 25.00 H new ATOM 0 HG23 VAL A 469 -14.014 -38.976 -37.529 1.00 25.00 H new ATOM 826 N ALA A 470 -15.641 -40.874 -36.660 1.00 25.00 N ATOM 827 CA ALA A 470 -15.866 -40.880 -35.209 1.00 25.00 C ATOM 828 C ALA A 470 -16.062 -42.298 -34.687 1.00 25.00 C ATOM 829 O ALA A 470 -15.626 -42.620 -33.582 1.00 25.00 O ATOM 830 CB ALA A 470 -17.075 -40.012 -34.841 1.00 25.00 C ATOM 0 H ALA A 470 -16.332 -40.348 -37.194 1.00 25.00 H new ATOM 0 HA ALA A 470 -14.977 -40.461 -34.737 1.00 25.00 H new ATOM 0 HB1 ALA A 470 -17.222 -40.032 -33.761 1.00 25.00 H new ATOM 0 HB2 ALA A 470 -16.898 -38.986 -35.164 1.00 25.00 H new ATOM 0 HB3 ALA A 470 -17.965 -40.400 -35.336 1.00 25.00 H new ATOM 836 N ALA A 471 -16.702 -43.149 -35.477 1.00 25.00 N ATOM 837 CA ALA A 471 -16.887 -44.542 -35.088 1.00 25.00 C ATOM 838 C ALA A 471 -15.518 -45.228 -34.979 1.00 25.00 C ATOM 839 O ALA A 471 -15.292 -46.037 -34.087 1.00 25.00 O ATOM 840 CB ALA A 471 -17.778 -45.261 -36.107 1.00 25.00 C ATOM 0 H ALA A 471 -17.099 -42.903 -36.384 1.00 25.00 H new ATOM 0 HA ALA A 471 -17.380 -44.586 -34.117 1.00 25.00 H new ATOM 0 HB1 ALA A 471 -17.909 -46.300 -35.806 1.00 25.00 H new ATOM 0 HB2 ALA A 471 -18.750 -44.770 -36.150 1.00 25.00 H new ATOM 0 HB3 ALA A 471 -17.309 -45.224 -37.090 1.00 25.00 H new ATOM 846 N ALA A 472 -14.605 -44.886 -35.877 1.00 25.00 N ATOM 847 CA ALA A 472 -13.252 -45.427 -35.827 1.00 25.00 C ATOM 848 C ALA A 472 -12.464 -44.804 -34.663 1.00 25.00 C ATOM 849 O ALA A 472 -11.685 -45.480 -34.011 1.00 25.00 O ATOM 850 CB ALA A 472 -12.531 -45.181 -37.161 1.00 25.00 C ATOM 0 H ALA A 472 -14.774 -44.239 -36.647 1.00 25.00 H new ATOM 0 HA ALA A 472 -13.314 -46.502 -35.660 1.00 25.00 H new ATOM 0 HB1 ALA A 472 -11.522 -45.590 -37.110 1.00 25.00 H new ATOM 0 HB2 ALA A 472 -13.080 -45.669 -37.967 1.00 25.00 H new ATOM 0 HB3 ALA A 472 -12.479 -44.110 -37.354 1.00 25.00 H new ATOM 856 N GLN A 473 -12.666 -43.518 -34.405 1.00 25.00 N ATOM 857 CA GLN A 473 -11.953 -42.835 -33.325 1.00 25.00 C ATOM 858 C GLN A 473 -12.333 -43.388 -31.959 1.00 25.00 C ATOM 859 O GLN A 473 -11.472 -43.653 -31.132 1.00 25.00 O ATOM 860 CB GLN A 473 -12.248 -41.323 -33.308 1.00 25.00 C ATOM 861 CG GLN A 473 -11.868 -40.535 -34.568 1.00 25.00 C ATOM 862 CD GLN A 473 -10.400 -40.237 -34.708 1.00 25.00 C ATOM 863 OE1 GLN A 473 -9.595 -40.516 -33.837 1.00 25.00 O ATOM 864 NE2 GLN A 473 -10.050 -39.649 -35.823 1.00 25.00 N ATOM 0 H GLN A 473 -13.314 -42.926 -34.925 1.00 25.00 H new ATOM 0 HA GLN A 473 -10.894 -43.008 -33.519 1.00 25.00 H new ATOM 0 HB2 GLN A 473 -13.314 -41.186 -33.129 1.00 25.00 H new ATOM 0 HB3 GLN A 473 -11.723 -40.883 -32.460 1.00 25.00 H new ATOM 0 HG2 GLN A 473 -12.195 -41.097 -35.443 1.00 25.00 H new ATOM 0 HG3 GLN A 473 -12.417 -39.593 -34.570 1.00 25.00 H new ATOM 0 HE21 GLN A 473 -10.754 -39.432 -36.528 1.00 25.00 H new ATOM 0 HE22 GLN A 473 -9.073 -39.408 -35.987 1.00 25.00 H new ATOM 873 N ARG A 474 -13.623 -43.565 -31.706 1.00 25.00 N ATOM 874 CA ARG A 474 -14.059 -44.082 -30.403 1.00 25.00 C ATOM 875 C ARG A 474 -13.549 -45.503 -30.223 1.00 25.00 C ATOM 876 O ARG A 474 -13.319 -45.955 -29.109 1.00 25.00 O ATOM 877 CB ARG A 474 -15.587 -44.001 -30.249 1.00 25.00 C ATOM 878 CG ARG A 474 -16.394 -44.891 -31.183 1.00 25.00 C ATOM 879 CD ARG A 474 -17.879 -44.552 -31.119 1.00 25.00 C ATOM 880 NE ARG A 474 -18.445 -44.780 -29.776 1.00 25.00 N ATOM 881 CZ ARG A 474 -19.681 -44.465 -29.403 1.00 25.00 C ATOM 882 NH1 ARG A 474 -20.540 -43.905 -30.220 1.00 25.00 N ATOM 883 NH2 ARG A 474 -20.057 -44.710 -28.177 1.00 25.00 N ATOM 0 H ARG A 474 -14.376 -43.365 -32.365 1.00 25.00 H new ATOM 0 HA ARG A 474 -13.634 -43.459 -29.616 1.00 25.00 H new ATOM 0 HB2 ARG A 474 -15.844 -44.257 -29.221 1.00 25.00 H new ATOM 0 HB3 ARG A 474 -15.895 -42.967 -30.406 1.00 25.00 H new ATOM 0 HG2 ARG A 474 -16.034 -44.771 -32.205 1.00 25.00 H new ATOM 0 HG3 ARG A 474 -16.245 -45.936 -30.913 1.00 25.00 H new ATOM 0 HD2 ARG A 474 -18.024 -43.509 -31.400 1.00 25.00 H new ATOM 0 HD3 ARG A 474 -18.420 -45.157 -31.847 1.00 25.00 H new ATOM 0 HE ARG A 474 -17.840 -45.214 -29.079 1.00 25.00 H new ATOM 0 HH11 ARG A 474 -20.268 -43.696 -31.181 1.00 25.00 H new ATOM 0 HH12 ARG A 474 -21.480 -43.679 -29.895 1.00 25.00 H new ATOM 0 HH21 ARG A 474 -19.405 -45.138 -27.519 1.00 25.00 H new ATOM 0 HH22 ARG A 474 -21.003 -44.474 -27.877 1.00 25.00 H new ATOM 897 N LEU A 475 -13.357 -46.189 -31.336 1.00 25.00 N ATOM 898 CA LEU A 475 -12.808 -47.533 -31.334 1.00 25.00 C ATOM 899 C LEU A 475 -11.304 -47.503 -31.020 1.00 25.00 C ATOM 900 O LEU A 475 -10.860 -48.202 -30.120 1.00 25.00 O ATOM 901 CB LEU A 475 -13.087 -48.191 -32.697 1.00 25.00 C ATOM 902 CG LEU A 475 -12.020 -49.107 -33.315 1.00 25.00 C ATOM 903 CD1 LEU A 475 -11.843 -50.392 -32.490 1.00 25.00 C ATOM 904 CD2 LEU A 475 -12.405 -49.467 -34.737 1.00 25.00 C ATOM 0 H LEU A 475 -13.577 -45.830 -32.265 1.00 25.00 H new ATOM 0 HA LEU A 475 -13.287 -48.125 -30.554 1.00 25.00 H new ATOM 0 HB2 LEU A 475 -14.004 -48.773 -32.600 1.00 25.00 H new ATOM 0 HB3 LEU A 475 -13.290 -47.394 -33.412 1.00 25.00 H new ATOM 0 HG LEU A 475 -11.074 -48.566 -33.317 1.00 25.00 H new ATOM 0 HD11 LEU A 475 -11.081 -51.019 -32.953 1.00 25.00 H new ATOM 0 HD12 LEU A 475 -11.534 -50.134 -31.477 1.00 25.00 H new ATOM 0 HD13 LEU A 475 -12.788 -50.935 -32.455 1.00 25.00 H new ATOM 0 HD21 LEU A 475 -11.643 -50.117 -35.167 1.00 25.00 H new ATOM 0 HD22 LEU A 475 -13.364 -49.985 -34.734 1.00 25.00 H new ATOM 0 HD23 LEU A 475 -12.486 -48.558 -35.333 1.00 25.00 H new ATOM 916 N VAL A 476 -10.518 -46.718 -31.749 1.00 25.00 N ATOM 917 CA VAL A 476 -9.066 -46.723 -31.547 1.00 25.00 C ATOM 918 C VAL A 476 -8.737 -46.241 -30.143 1.00 25.00 C ATOM 919 O VAL A 476 -7.816 -46.742 -29.495 1.00 25.00 O ATOM 920 CB VAL A 476 -8.296 -45.907 -32.644 1.00 25.00 C ATOM 921 CG1 VAL A 476 -8.605 -44.426 -32.591 1.00 25.00 C ATOM 922 CG2 VAL A 476 -6.791 -46.126 -32.515 1.00 25.00 C ATOM 0 H VAL A 476 -10.849 -46.080 -32.473 1.00 25.00 H new ATOM 0 HA VAL A 476 -8.719 -47.751 -31.653 1.00 25.00 H new ATOM 0 HB VAL A 476 -8.639 -46.278 -33.610 1.00 25.00 H new ATOM 0 HG11 VAL A 476 -8.046 -43.910 -33.371 1.00 25.00 H new ATOM 0 HG12 VAL A 476 -9.673 -44.271 -32.747 1.00 25.00 H new ATOM 0 HG13 VAL A 476 -8.319 -44.029 -31.617 1.00 25.00 H new ATOM 0 HG21 VAL A 476 -6.273 -45.553 -33.284 1.00 25.00 H new ATOM 0 HG22 VAL A 476 -6.458 -45.797 -31.531 1.00 25.00 H new ATOM 0 HG23 VAL A 476 -6.566 -47.185 -32.639 1.00 25.00 H new ATOM 932 N HIS A 477 -9.510 -45.286 -29.656 1.00 25.00 N ATOM 933 CA HIS A 477 -9.312 -44.759 -28.327 1.00 25.00 C ATOM 934 C HIS A 477 -9.550 -45.843 -27.281 1.00 25.00 C ATOM 935 O HIS A 477 -8.885 -45.863 -26.261 1.00 25.00 O ATOM 936 CB HIS A 477 -10.239 -43.567 -28.097 1.00 25.00 C ATOM 937 CG HIS A 477 -9.765 -42.647 -27.018 1.00 25.00 C ATOM 938 ND1 HIS A 477 -10.402 -41.492 -26.639 1.00 25.00 N ATOM 939 CD2 HIS A 477 -8.659 -42.713 -26.230 1.00 25.00 C ATOM 940 CE1 HIS A 477 -9.691 -40.925 -25.667 1.00 25.00 C ATOM 941 NE2 HIS A 477 -8.618 -41.630 -25.374 1.00 25.00 N ATOM 0 H HIS A 477 -10.283 -44.861 -30.168 1.00 25.00 H new ATOM 0 HA HIS A 477 -8.280 -44.420 -28.230 1.00 25.00 H new ATOM 0 HB2 HIS A 477 -10.335 -43.006 -29.027 1.00 25.00 H new ATOM 0 HB3 HIS A 477 -11.233 -43.933 -27.841 1.00 25.00 H new ATOM 0 HD2 HIS A 477 -7.919 -43.499 -26.268 1.00 25.00 H new ATOM 0 HE1 HIS A 477 -9.961 -40.000 -25.179 1.00 25.00 H new ATOM 0 HE2 HIS A 477 -7.911 -41.422 -24.669 1.00 25.00 H new ATOM 949 N ALA A 478 -10.475 -46.760 -27.537 1.00 25.00 N ATOM 950 CA ALA A 478 -10.743 -47.830 -26.586 1.00 25.00 C ATOM 951 C ALA A 478 -9.488 -48.691 -26.398 1.00 25.00 C ATOM 952 O ALA A 478 -9.137 -49.050 -25.280 1.00 25.00 O ATOM 953 CB ALA A 478 -11.923 -48.687 -27.064 1.00 25.00 C ATOM 0 H ALA A 478 -11.045 -46.785 -28.383 1.00 25.00 H new ATOM 0 HA ALA A 478 -11.010 -47.390 -25.625 1.00 25.00 H new ATOM 0 HB1 ALA A 478 -12.111 -49.482 -26.343 1.00 25.00 H new ATOM 0 HB2 ALA A 478 -12.812 -48.063 -27.156 1.00 25.00 H new ATOM 0 HB3 ALA A 478 -11.685 -49.125 -28.033 1.00 25.00 H new ATOM 959 N ILE A 479 -8.806 -49.011 -27.488 1.00 25.00 N ATOM 960 CA ILE A 479 -7.594 -49.829 -27.407 1.00 25.00 C ATOM 961 C ILE A 479 -6.463 -49.023 -26.796 1.00 25.00 C ATOM 962 O ILE A 479 -5.642 -49.558 -26.072 1.00 25.00 O ATOM 963 CB ILE A 479 -7.135 -50.328 -28.789 1.00 25.00 C ATOM 964 CG1 ILE A 479 -8.270 -51.080 -29.485 1.00 25.00 C ATOM 965 CG2 ILE A 479 -5.910 -51.269 -28.677 1.00 25.00 C ATOM 966 CD1 ILE A 479 -8.537 -50.518 -30.809 1.00 25.00 C ATOM 0 H ILE A 479 -9.063 -48.723 -28.432 1.00 25.00 H new ATOM 0 HA ILE A 479 -7.837 -50.692 -26.787 1.00 25.00 H new ATOM 0 HB ILE A 479 -6.853 -49.451 -29.372 1.00 25.00 H new ATOM 0 HG12 ILE A 479 -8.008 -52.134 -29.579 1.00 25.00 H new ATOM 0 HG13 ILE A 479 -9.172 -51.029 -28.876 1.00 25.00 H new ATOM 0 HG21 ILE A 479 -5.614 -51.601 -29.672 1.00 25.00 H new ATOM 0 HG22 ILE A 479 -5.082 -50.734 -28.212 1.00 25.00 H new ATOM 0 HG23 ILE A 479 -6.171 -52.135 -28.068 1.00 25.00 H new ATOM 0 HD11 ILE A 479 -9.348 -51.071 -31.282 1.00 25.00 H new ATOM 0 HD12 ILE A 479 -8.822 -49.471 -30.709 1.00 25.00 H new ATOM 0 HD13 ILE A 479 -7.640 -50.593 -31.424 1.00 25.00 H new ATOM 978 N ALA A 480 -6.431 -47.727 -27.071 1.00 25.00 N ATOM 979 CA ALA A 480 -5.394 -46.858 -26.525 1.00 25.00 C ATOM 980 C ALA A 480 -5.430 -46.904 -24.991 1.00 25.00 C ATOM 981 O ALA A 480 -4.422 -46.693 -24.318 1.00 25.00 O ATOM 982 CB ALA A 480 -5.582 -45.425 -27.036 1.00 25.00 C ATOM 0 H ALA A 480 -7.109 -47.253 -27.668 1.00 25.00 H new ATOM 0 HA ALA A 480 -4.418 -47.210 -26.857 1.00 25.00 H new ATOM 0 HB1 ALA A 480 -4.802 -44.786 -26.622 1.00 25.00 H new ATOM 0 HB2 ALA A 480 -5.519 -45.416 -28.124 1.00 25.00 H new ATOM 0 HB3 ALA A 480 -6.559 -45.053 -26.726 1.00 25.00 H new ATOM 988 N LEU A 481 -6.598 -47.192 -24.439 1.00 25.00 N ATOM 989 CA LEU A 481 -6.726 -47.330 -22.988 1.00 25.00 C ATOM 990 C LEU A 481 -6.201 -48.680 -22.565 1.00 25.00 C ATOM 991 O LEU A 481 -5.492 -48.799 -21.587 1.00 25.00 O ATOM 992 CB LEU A 481 -8.172 -47.183 -22.543 1.00 25.00 C ATOM 993 CG LEU A 481 -8.707 -45.818 -22.948 1.00 25.00 C ATOM 994 CD1 LEU A 481 -10.219 -45.879 -23.048 1.00 25.00 C ATOM 995 CD2 LEU A 481 -8.276 -44.717 -21.983 1.00 25.00 C ATOM 0 H LEU A 481 -7.463 -47.334 -24.961 1.00 25.00 H new ATOM 0 HA LEU A 481 -6.145 -46.537 -22.516 1.00 25.00 H new ATOM 0 HB2 LEU A 481 -8.780 -47.968 -22.992 1.00 25.00 H new ATOM 0 HB3 LEU A 481 -8.242 -47.304 -21.462 1.00 25.00 H new ATOM 0 HG LEU A 481 -8.283 -45.566 -23.920 1.00 25.00 H new ATOM 0 HD11 LEU A 481 -10.604 -44.901 -23.338 1.00 25.00 H new ATOM 0 HD12 LEU A 481 -10.505 -46.618 -23.796 1.00 25.00 H new ATOM 0 HD13 LEU A 481 -10.636 -46.161 -22.081 1.00 25.00 H new ATOM 0 HD21 LEU A 481 -8.683 -43.762 -22.315 1.00 25.00 H new ATOM 0 HD22 LEU A 481 -8.649 -44.942 -20.984 1.00 25.00 H new ATOM 0 HD23 LEU A 481 -7.188 -44.659 -21.960 1.00 25.00 H new ATOM 1007 N MET A 482 -6.540 -49.707 -23.320 1.00 25.00 N ATOM 1008 CA MET A 482 -6.093 -51.059 -22.996 1.00 25.00 C ATOM 1009 C MET A 482 -4.593 -51.181 -23.044 1.00 25.00 C ATOM 1010 O MET A 482 -4.018 -52.023 -22.371 1.00 25.00 O ATOM 1011 CB MET A 482 -6.695 -52.065 -23.965 1.00 25.00 C ATOM 1012 CG MET A 482 -8.164 -52.000 -23.925 1.00 25.00 C ATOM 1013 SD MET A 482 -8.981 -53.508 -24.486 1.00 25.00 S ATOM 1014 CE MET A 482 -8.808 -53.363 -26.269 1.00 25.00 C ATOM 0 H MET A 482 -7.119 -49.638 -24.157 1.00 25.00 H new ATOM 0 HA MET A 482 -6.429 -51.268 -21.980 1.00 25.00 H new ATOM 0 HB2 MET A 482 -6.343 -51.861 -24.976 1.00 25.00 H new ATOM 0 HB3 MET A 482 -6.362 -53.071 -23.708 1.00 25.00 H new ATOM 0 HG2 MET A 482 -8.480 -51.786 -22.904 1.00 25.00 H new ATOM 0 HG3 MET A 482 -8.498 -51.167 -24.543 1.00 25.00 H new ATOM 0 HE1 MET A 482 -9.236 -54.243 -26.749 1.00 25.00 H new ATOM 0 HE2 MET A 482 -9.331 -52.471 -26.614 1.00 25.00 H new ATOM 0 HE3 MET A 482 -7.752 -53.287 -26.527 1.00 25.00 H new ATOM 1024 N THR A 483 -3.946 -50.341 -23.827 1.00 25.00 N ATOM 1025 CA THR A 483 -2.495 -50.453 -23.956 1.00 25.00 C ATOM 1026 C THR A 483 -1.803 -49.819 -22.756 1.00 25.00 C ATOM 1027 O THR A 483 -0.781 -50.319 -22.283 1.00 25.00 O ATOM 1028 CB THR A 483 -2.003 -49.845 -25.271 1.00 25.00 C ATOM 1029 OG1 THR A 483 -2.486 -48.508 -25.388 1.00 25.00 O ATOM 1030 CG2 THR A 483 -2.533 -50.654 -26.452 1.00 25.00 C ATOM 0 H THR A 483 -4.378 -49.594 -24.370 1.00 25.00 H new ATOM 0 HA THR A 483 -2.237 -51.512 -23.976 1.00 25.00 H new ATOM 0 HB THR A 483 -0.913 -49.856 -25.275 1.00 25.00 H new ATOM 0 HG1 THR A 483 -2.170 -48.118 -26.230 1.00 25.00 H new ATOM 0 HG21 THR A 483 -2.178 -50.214 -27.384 1.00 25.00 H new ATOM 0 HG22 THR A 483 -2.178 -51.682 -26.378 1.00 25.00 H new ATOM 0 HG23 THR A 483 -3.623 -50.645 -26.439 1.00 25.00 H new ATOM 1038 N GLN A 484 -2.360 -48.735 -22.234 1.00 25.00 N ATOM 1039 CA GLN A 484 -1.784 -48.111 -21.046 1.00 25.00 C ATOM 1040 C GLN A 484 -2.206 -48.870 -19.784 1.00 25.00 C ATOM 1041 O GLN A 484 -1.430 -48.968 -18.838 1.00 25.00 O ATOM 1042 CB GLN A 484 -2.124 -46.612 -20.972 1.00 25.00 C ATOM 1043 CG GLN A 484 -3.600 -46.277 -20.918 1.00 25.00 C ATOM 1044 CD GLN A 484 -3.861 -44.801 -21.082 1.00 25.00 C ATOM 1045 OE1 GLN A 484 -3.762 -44.034 -20.143 1.00 25.00 O ATOM 1046 NE2 GLN A 484 -4.202 -44.400 -22.279 1.00 25.00 N ATOM 0 H GLN A 484 -3.193 -48.275 -22.603 1.00 25.00 H new ATOM 0 HA GLN A 484 -0.698 -48.174 -21.117 1.00 25.00 H new ATOM 0 HB2 GLN A 484 -1.642 -46.192 -20.089 1.00 25.00 H new ATOM 0 HB3 GLN A 484 -1.689 -46.116 -21.840 1.00 25.00 H new ATOM 0 HG2 GLN A 484 -4.123 -46.825 -21.702 1.00 25.00 H new ATOM 0 HG3 GLN A 484 -4.011 -46.612 -19.966 1.00 25.00 H new ATOM 0 HE21 GLN A 484 -4.274 -45.074 -23.041 1.00 25.00 H new ATOM 0 HE22 GLN A 484 -4.396 -43.413 -22.450 1.00 25.00 H new ATOM 1055 N PHE A 485 -3.407 -49.438 -19.767 1.00 25.00 N ATOM 1056 CA PHE A 485 -3.851 -50.226 -18.629 1.00 25.00 C ATOM 1057 C PHE A 485 -3.102 -51.558 -18.626 1.00 25.00 C ATOM 1058 O PHE A 485 -2.881 -52.158 -17.576 1.00 25.00 O ATOM 1059 CB PHE A 485 -5.359 -50.458 -18.712 1.00 25.00 C ATOM 1060 CG PHE A 485 -6.176 -49.387 -18.023 1.00 25.00 C ATOM 1061 CD1 PHE A 485 -6.311 -48.098 -18.581 1.00 25.00 C ATOM 1062 CD2 PHE A 485 -6.819 -49.666 -16.802 1.00 25.00 C ATOM 1063 CE1 PHE A 485 -7.078 -47.101 -17.935 1.00 25.00 C ATOM 1064 CE2 PHE A 485 -7.597 -48.675 -16.147 1.00 25.00 C ATOM 1065 CZ PHE A 485 -7.722 -47.390 -16.716 1.00 25.00 C ATOM 0 H PHE A 485 -4.085 -49.367 -20.525 1.00 25.00 H new ATOM 0 HA PHE A 485 -3.639 -49.692 -17.703 1.00 25.00 H new ATOM 0 HB2 PHE A 485 -5.653 -50.509 -19.760 1.00 25.00 H new ATOM 0 HB3 PHE A 485 -5.594 -51.425 -18.267 1.00 25.00 H new ATOM 0 HD1 PHE A 485 -5.821 -47.869 -19.516 1.00 25.00 H new ATOM 0 HD2 PHE A 485 -6.719 -50.646 -16.358 1.00 25.00 H new ATOM 0 HE1 PHE A 485 -7.170 -46.119 -18.376 1.00 25.00 H new ATOM 0 HE2 PHE A 485 -8.092 -48.904 -15.215 1.00 25.00 H new ATOM 0 HZ PHE A 485 -8.309 -46.631 -16.219 1.00 25.00 H new