USER MOD reduce.3.24.130724 H: found=0, std=0, add=604, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 607 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 Set 1.1: A 442 HIS : no HE2:sc= 0.0105 X(o=0.023,f=0) USER MOD Set 1.2: A 446 TYR OH : rot 119:sc= 0.0121 USER MOD Single : A 404 SER OG : rot 180:sc= 0 USER MOD Single : A 405 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00625) USER MOD Single : A 418 GLN : amide:sc= -0.643 K(o=-0.64,f=-1.8) USER MOD Single : A 419 SER OG : rot 171:sc= 0.0259 USER MOD Single : A 422 MET CE :methyl -163:sc= -0.0852 (180deg=-0.42) USER MOD Single : A 425 LYS NZ :NH3+ -123:sc= 0.779 (180deg=0.564) USER MOD Single : A 428 SER OG : rot 180:sc= 0.0161 USER MOD Single : A 429 THR OG1 : rot -150:sc= -0.124 USER MOD Single : A 431 TYR OH : rot 180:sc= 0 USER MOD Single : A 432 THR OG1 : rot 96:sc= 0.516 USER MOD Single : A 433 GLN : amide:sc= -0.587 K(o=-0.59,f=-1.5) USER MOD Single : A 437 MET CE :methyl 136:sc= -0.404 (180deg=-0.922) USER MOD Single : A 439 GLN : amide:sc= -0.112 X(o=-0.11,f=-0.55) USER MOD Single : A 443 TYR OH : rot 180:sc= 0 USER MOD Single : A 445 GLN : amide:sc= -0.0278 X(o=-0.028,f=-0.4) USER MOD Single : A 462 CYS SG : rot 71:sc= 1.25 USER MOD Single : A 463 GLN : amide:sc= -0.115 K(o=-0.11,f=-0.64) USER MOD Single : A 466 SER OG : rot 180:sc= 0 USER MOD Single : A 467 GLN : amide:sc= -0.249 X(o=-0.25,f=0) USER MOD Single : A 469 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 470 CYS SG : rot 59:sc= 0.347 USER MOD Single : A 475 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 403 -26.590 13.317 -1.445 1.00 44.23 N ATOM 2 CA GLY A 403 -26.873 13.204 -0.008 1.00 11.41 C ATOM 3 C GLY A 403 -25.947 14.067 0.811 1.00 52.44 C ATOM 4 O GLY A 403 -24.886 13.621 1.233 1.00 4.35 O ATOM 0 HA2 GLY A 403 -27.906 13.494 0.184 1.00 11.41 H new ATOM 0 HA3 GLY A 403 -26.771 12.164 0.302 1.00 11.41 H new ATOM 10 N SER A 404 -26.355 15.284 1.075 1.00 32.32 N ATOM 11 CA SER A 404 -25.508 16.219 1.780 1.00 0.22 C ATOM 12 C SER A 404 -25.581 16.038 3.307 1.00 20.40 C ATOM 13 O SER A 404 -24.937 16.761 4.047 1.00 53.32 O ATOM 14 CB SER A 404 -25.876 17.646 1.387 1.00 11.43 C ATOM 15 OG SER A 404 -25.807 17.804 -0.023 1.00 24.50 O ATOM 0 H SER A 404 -27.269 15.652 0.813 1.00 32.32 H new ATOM 0 HA SER A 404 -24.477 16.017 1.490 1.00 0.22 H new ATOM 0 HB2 SER A 404 -26.882 17.879 1.737 1.00 11.43 H new ATOM 0 HB3 SER A 404 -25.199 18.350 1.872 1.00 11.43 H new ATOM 0 HG SER A 404 -26.047 18.724 -0.261 1.00 24.50 H new ATOM 21 N LYS A 405 -26.348 15.048 3.764 1.00 41.23 N ATOM 22 CA LYS A 405 -26.508 14.796 5.211 1.00 61.31 C ATOM 23 C LYS A 405 -25.191 14.387 5.877 1.00 24.22 C ATOM 24 O LYS A 405 -24.988 14.603 7.069 1.00 5.10 O ATOM 25 CB LYS A 405 -27.618 13.750 5.543 1.00 63.43 C ATOM 26 CG LYS A 405 -27.283 12.310 5.193 1.00 54.53 C ATOM 27 CD LYS A 405 -27.014 12.165 3.737 1.00 23.41 C ATOM 28 CE LYS A 405 -26.531 10.820 3.377 1.00 20.23 C ATOM 29 NZ LYS A 405 -27.548 9.760 3.590 1.00 1.23 N ATOM 0 H LYS A 405 -26.868 14.407 3.165 1.00 41.23 H new ATOM 0 HA LYS A 405 -26.829 15.752 5.625 1.00 61.31 H new ATOM 0 HB2 LYS A 405 -27.838 13.805 6.609 1.00 63.43 H new ATOM 0 HB3 LYS A 405 -28.529 14.032 5.015 1.00 63.43 H new ATOM 0 HG2 LYS A 405 -26.411 11.987 5.762 1.00 54.53 H new ATOM 0 HG3 LYS A 405 -28.110 11.660 5.480 1.00 54.53 H new ATOM 0 HD2 LYS A 405 -27.926 12.380 3.180 1.00 23.41 H new ATOM 0 HD3 LYS A 405 -26.274 12.905 3.433 1.00 23.41 H new ATOM 0 HE2 LYS A 405 -26.226 10.818 2.330 1.00 20.23 H new ATOM 0 HE3 LYS A 405 -25.645 10.589 3.968 1.00 20.23 H new ATOM 0 HZ1 LYS A 405 -27.156 8.840 3.304 1.00 1.23 H new ATOM 0 HZ2 LYS A 405 -27.809 9.727 4.596 1.00 1.23 H new ATOM 0 HZ3 LYS A 405 -28.392 9.969 3.020 1.00 1.23 H new ATOM 43 N ILE A 406 -24.302 13.822 5.096 1.00 64.42 N ATOM 44 CA ILE A 406 -23.055 13.314 5.617 1.00 53.53 C ATOM 45 C ILE A 406 -21.931 14.363 5.481 1.00 31.12 C ATOM 46 O ILE A 406 -20.869 14.237 6.077 1.00 32.45 O ATOM 47 CB ILE A 406 -22.679 11.977 4.911 1.00 3.15 C ATOM 48 CG1 ILE A 406 -21.405 11.353 5.508 1.00 3.23 C ATOM 49 CG2 ILE A 406 -22.538 12.184 3.409 1.00 50.55 C ATOM 50 CD1 ILE A 406 -21.026 10.018 4.899 1.00 34.44 C ATOM 0 H ILE A 406 -24.420 13.702 4.090 1.00 64.42 H new ATOM 0 HA ILE A 406 -23.180 13.110 6.680 1.00 53.53 H new ATOM 0 HB ILE A 406 -23.492 11.272 5.085 1.00 3.15 H new ATOM 0 HG12 ILE A 406 -20.576 12.049 5.376 1.00 3.23 H new ATOM 0 HG13 ILE A 406 -21.545 11.224 6.581 1.00 3.23 H new ATOM 0 HG21 ILE A 406 -22.275 11.239 2.935 1.00 50.55 H new ATOM 0 HG22 ILE A 406 -23.482 12.544 3.001 1.00 50.55 H new ATOM 0 HG23 ILE A 406 -21.755 12.917 3.215 1.00 50.55 H new ATOM 0 HD11 ILE A 406 -20.118 9.646 5.374 1.00 34.44 H new ATOM 0 HD12 ILE A 406 -21.835 9.304 5.054 1.00 34.44 H new ATOM 0 HD13 ILE A 406 -20.852 10.142 3.830 1.00 34.44 H new ATOM 62 N GLU A 407 -22.204 15.422 4.750 1.00 53.23 N ATOM 63 CA GLU A 407 -21.213 16.465 4.515 1.00 24.11 C ATOM 64 C GLU A 407 -20.800 17.191 5.817 1.00 4.24 C ATOM 65 O GLU A 407 -19.606 17.337 6.076 1.00 43.22 O ATOM 66 CB GLU A 407 -21.668 17.434 3.427 1.00 71.34 C ATOM 67 CG GLU A 407 -21.955 16.743 2.106 1.00 13.03 C ATOM 68 CD GLU A 407 -20.768 15.980 1.576 1.00 50.43 C ATOM 69 OE1 GLU A 407 -19.911 16.586 0.902 1.00 40.30 O ATOM 70 OE2 GLU A 407 -20.671 14.765 1.812 1.00 60.40 O ATOM 0 H GLU A 407 -23.106 15.589 4.304 1.00 53.23 H new ATOM 0 HA GLU A 407 -20.313 15.973 4.148 1.00 24.11 H new ATOM 0 HB2 GLU A 407 -22.565 17.954 3.762 1.00 71.34 H new ATOM 0 HB3 GLU A 407 -20.898 18.191 3.276 1.00 71.34 H new ATOM 0 HG2 GLU A 407 -22.794 16.058 2.234 1.00 13.03 H new ATOM 0 HG3 GLU A 407 -22.261 17.487 1.371 1.00 13.03 H new ATOM 77 N PRO A 408 -21.770 17.648 6.683 1.00 30.14 N ATOM 78 CA PRO A 408 -21.431 18.243 7.985 1.00 31.42 C ATOM 79 C PRO A 408 -20.779 17.213 8.929 1.00 14.54 C ATOM 80 O PRO A 408 -20.177 17.568 9.931 1.00 31.01 O ATOM 81 CB PRO A 408 -22.787 18.690 8.546 1.00 4.11 C ATOM 82 CG PRO A 408 -23.779 17.851 7.830 1.00 21.24 C ATOM 83 CD PRO A 408 -23.234 17.681 6.454 1.00 63.34 C ATOM 0 HA PRO A 408 -20.711 19.056 7.888 1.00 31.42 H new ATOM 0 HB2 PRO A 408 -22.841 18.536 9.624 1.00 4.11 H new ATOM 0 HB3 PRO A 408 -22.961 19.751 8.366 1.00 4.11 H new ATOM 0 HG2 PRO A 408 -23.908 16.888 8.323 1.00 21.24 H new ATOM 0 HG3 PRO A 408 -24.757 18.331 7.809 1.00 21.24 H new ATOM 0 HD2 PRO A 408 -23.591 16.763 5.988 1.00 63.34 H new ATOM 0 HD3 PRO A 408 -23.523 18.504 5.800 1.00 63.34 H new ATOM 91 N VAL A 409 -20.906 15.941 8.578 1.00 12.14 N ATOM 92 CA VAL A 409 -20.316 14.842 9.341 1.00 50.55 C ATOM 93 C VAL A 409 -18.838 14.720 8.965 1.00 22.52 C ATOM 94 O VAL A 409 -17.996 14.338 9.777 1.00 10.32 O ATOM 95 CB VAL A 409 -21.050 13.499 9.042 1.00 2.14 C ATOM 96 CG1 VAL A 409 -20.476 12.345 9.859 1.00 71.23 C ATOM 97 CG2 VAL A 409 -22.543 13.637 9.286 1.00 3.04 C ATOM 0 H VAL A 409 -21.423 15.637 7.753 1.00 12.14 H new ATOM 0 HA VAL A 409 -20.418 15.052 10.406 1.00 50.55 H new ATOM 0 HB VAL A 409 -20.889 13.267 7.989 1.00 2.14 H new ATOM 0 HG11 VAL A 409 -21.015 11.428 9.621 1.00 71.23 H new ATOM 0 HG12 VAL A 409 -19.420 12.219 9.618 1.00 71.23 H new ATOM 0 HG13 VAL A 409 -20.582 12.563 10.922 1.00 71.23 H new ATOM 0 HG21 VAL A 409 -23.036 12.689 9.071 1.00 3.04 H new ATOM 0 HG22 VAL A 409 -22.718 13.910 10.327 1.00 3.04 H new ATOM 0 HG23 VAL A 409 -22.948 14.412 8.635 1.00 3.04 H new ATOM 107 N VAL A 410 -18.531 15.080 7.728 1.00 53.41 N ATOM 108 CA VAL A 410 -17.165 15.069 7.231 1.00 10.43 C ATOM 109 C VAL A 410 -16.335 16.129 7.953 1.00 53.23 C ATOM 110 O VAL A 410 -15.144 15.949 8.166 1.00 73.51 O ATOM 111 CB VAL A 410 -17.109 15.321 5.691 1.00 42.22 C ATOM 112 CG1 VAL A 410 -15.673 15.335 5.179 1.00 0.10 C ATOM 113 CG2 VAL A 410 -17.910 14.268 4.948 1.00 43.21 C ATOM 0 H VAL A 410 -19.221 15.387 7.042 1.00 53.41 H new ATOM 0 HA VAL A 410 -16.752 14.080 7.428 1.00 10.43 H new ATOM 0 HB VAL A 410 -17.547 16.302 5.505 1.00 42.22 H new ATOM 0 HG11 VAL A 410 -15.672 15.513 4.104 1.00 0.10 H new ATOM 0 HG12 VAL A 410 -15.116 16.128 5.679 1.00 0.10 H new ATOM 0 HG13 VAL A 410 -15.203 14.374 5.388 1.00 0.10 H new ATOM 0 HG21 VAL A 410 -17.859 14.461 3.876 1.00 43.21 H new ATOM 0 HG22 VAL A 410 -17.498 13.281 5.159 1.00 43.21 H new ATOM 0 HG23 VAL A 410 -18.950 14.304 5.274 1.00 43.21 H new ATOM 123 N LEU A 411 -16.993 17.216 8.350 1.00 61.44 N ATOM 124 CA LEU A 411 -16.332 18.321 9.041 1.00 51.41 C ATOM 125 C LEU A 411 -15.512 17.886 10.270 1.00 43.14 C ATOM 126 O LEU A 411 -14.297 18.106 10.294 1.00 4.14 O ATOM 127 CB LEU A 411 -17.304 19.437 9.403 1.00 70.23 C ATOM 128 CG LEU A 411 -17.945 20.182 8.236 1.00 42.25 C ATOM 129 CD1 LEU A 411 -18.867 21.250 8.754 1.00 40.21 C ATOM 130 CD2 LEU A 411 -16.885 20.793 7.328 1.00 65.10 C ATOM 0 H LEU A 411 -17.993 17.356 8.203 1.00 61.44 H new ATOM 0 HA LEU A 411 -15.616 18.714 8.319 1.00 51.41 H new ATOM 0 HB2 LEU A 411 -18.099 19.012 10.016 1.00 70.23 H new ATOM 0 HB3 LEU A 411 -16.777 20.162 10.023 1.00 70.23 H new ATOM 0 HG LEU A 411 -18.521 19.468 7.647 1.00 42.25 H new ATOM 0 HD11 LEU A 411 -19.321 21.777 7.915 1.00 40.21 H new ATOM 0 HD12 LEU A 411 -19.649 20.793 9.361 1.00 40.21 H new ATOM 0 HD13 LEU A 411 -18.301 21.955 9.363 1.00 40.21 H new ATOM 0 HD21 LEU A 411 -17.370 21.318 6.505 1.00 65.10 H new ATOM 0 HD22 LEU A 411 -16.278 21.496 7.899 1.00 65.10 H new ATOM 0 HD23 LEU A 411 -16.248 20.003 6.930 1.00 65.10 H new ATOM 142 N PRO A 412 -16.125 17.268 11.321 1.00 30.13 N ATOM 143 CA PRO A 412 -15.362 16.848 12.473 1.00 23.23 C ATOM 144 C PRO A 412 -14.470 15.642 12.144 1.00 72.13 C ATOM 145 O PRO A 412 -13.401 15.490 12.707 1.00 4.40 O ATOM 146 CB PRO A 412 -16.422 16.478 13.511 1.00 74.32 C ATOM 147 CG PRO A 412 -17.607 16.098 12.708 1.00 20.31 C ATOM 148 CD PRO A 412 -17.567 16.963 11.486 1.00 21.11 C ATOM 0 HA PRO A 412 -14.685 17.626 12.825 1.00 23.23 H new ATOM 0 HB2 PRO A 412 -16.089 15.654 14.143 1.00 74.32 H new ATOM 0 HB3 PRO A 412 -16.642 17.317 14.171 1.00 74.32 H new ATOM 0 HG2 PRO A 412 -17.576 15.042 12.440 1.00 20.31 H new ATOM 0 HG3 PRO A 412 -18.527 16.257 13.270 1.00 20.31 H new ATOM 0 HD2 PRO A 412 -17.969 16.445 10.615 1.00 21.11 H new ATOM 0 HD3 PRO A 412 -18.156 17.871 11.618 1.00 21.11 H new ATOM 156 N LEU A 413 -14.923 14.806 11.203 1.00 60.24 N ATOM 157 CA LEU A 413 -14.222 13.630 10.789 1.00 54.53 C ATOM 158 C LEU A 413 -12.851 14.019 10.212 1.00 4.21 C ATOM 159 O LEU A 413 -11.817 13.453 10.592 1.00 63.50 O ATOM 160 CB LEU A 413 -15.089 12.963 9.727 1.00 64.51 C ATOM 161 CG LEU A 413 -14.831 11.500 9.426 1.00 74.41 C ATOM 162 CD1 LEU A 413 -15.931 10.965 8.543 1.00 41.45 C ATOM 163 CD2 LEU A 413 -13.484 11.256 8.775 1.00 63.03 C ATOM 0 H LEU A 413 -15.805 14.949 10.711 1.00 60.24 H new ATOM 0 HA LEU A 413 -14.044 12.951 11.623 1.00 54.53 H new ATOM 0 HB2 LEU A 413 -16.131 13.064 10.032 1.00 64.51 H new ATOM 0 HB3 LEU A 413 -14.973 13.522 8.799 1.00 64.51 H new ATOM 0 HG LEU A 413 -14.818 10.974 10.381 1.00 74.41 H new ATOM 0 HD11 LEU A 413 -15.745 9.913 8.327 1.00 41.45 H new ATOM 0 HD12 LEU A 413 -16.889 11.067 9.053 1.00 41.45 H new ATOM 0 HD13 LEU A 413 -15.955 11.528 7.610 1.00 41.45 H new ATOM 0 HD21 LEU A 413 -13.360 10.190 8.585 1.00 63.03 H new ATOM 0 HD22 LEU A 413 -13.431 11.801 7.833 1.00 63.03 H new ATOM 0 HD23 LEU A 413 -12.691 11.601 9.439 1.00 63.03 H new ATOM 175 N LEU A 414 -12.859 15.023 9.350 1.00 65.13 N ATOM 176 CA LEU A 414 -11.654 15.541 8.721 1.00 1.02 C ATOM 177 C LEU A 414 -10.775 16.192 9.782 1.00 2.02 C ATOM 178 O LEU A 414 -9.529 16.127 9.732 1.00 45.54 O ATOM 179 CB LEU A 414 -12.052 16.575 7.655 1.00 15.00 C ATOM 180 CG LEU A 414 -10.925 17.205 6.840 1.00 10.14 C ATOM 181 CD1 LEU A 414 -10.203 16.152 6.020 1.00 72.45 C ATOM 182 CD2 LEU A 414 -11.476 18.301 5.939 1.00 63.35 C ATOM 0 H LEU A 414 -13.711 15.506 9.064 1.00 65.13 H new ATOM 0 HA LEU A 414 -11.098 14.732 8.247 1.00 1.02 H new ATOM 0 HB2 LEU A 414 -12.744 16.097 6.962 1.00 15.00 H new ATOM 0 HB3 LEU A 414 -12.600 17.377 8.150 1.00 15.00 H new ATOM 0 HG LEU A 414 -10.207 17.650 7.529 1.00 10.14 H new ATOM 0 HD11 LEU A 414 -9.404 16.622 5.447 1.00 72.45 H new ATOM 0 HD12 LEU A 414 -9.779 15.400 6.686 1.00 72.45 H new ATOM 0 HD13 LEU A 414 -10.907 15.676 5.338 1.00 72.45 H new ATOM 0 HD21 LEU A 414 -10.662 18.742 5.363 1.00 63.35 H new ATOM 0 HD22 LEU A 414 -12.213 17.876 5.258 1.00 63.35 H new ATOM 0 HD23 LEU A 414 -11.948 19.071 6.549 1.00 63.35 H new ATOM 194 N TRP A 415 -11.435 16.795 10.751 1.00 45.45 N ATOM 195 CA TRP A 415 -10.777 17.442 11.851 1.00 2.32 C ATOM 196 C TRP A 415 -10.021 16.408 12.693 1.00 32.54 C ATOM 197 O TRP A 415 -8.917 16.685 13.187 1.00 52.31 O ATOM 198 CB TRP A 415 -11.807 18.190 12.716 1.00 10.42 C ATOM 199 CG TRP A 415 -11.209 18.999 13.825 1.00 41.15 C ATOM 200 CD1 TRP A 415 -10.868 20.311 13.768 1.00 62.12 C ATOM 201 CD2 TRP A 415 -10.881 18.558 15.157 1.00 24.02 C ATOM 202 NE1 TRP A 415 -10.340 20.709 14.962 1.00 31.04 N ATOM 203 CE2 TRP A 415 -10.340 19.659 15.832 1.00 31.41 C ATOM 204 CE3 TRP A 415 -10.991 17.341 15.836 1.00 23.15 C ATOM 205 CZ2 TRP A 415 -9.908 19.587 17.152 1.00 14.10 C ATOM 206 CZ3 TRP A 415 -10.564 17.271 17.144 1.00 42.34 C ATOM 207 CH2 TRP A 415 -10.029 18.388 17.792 1.00 30.53 C ATOM 0 H TRP A 415 -12.453 16.846 10.790 1.00 45.45 H new ATOM 0 HA TRP A 415 -10.060 18.164 11.461 1.00 2.32 H new ATOM 0 HB2 TRP A 415 -12.391 18.850 12.075 1.00 10.42 H new ATOM 0 HB3 TRP A 415 -12.500 17.465 13.144 1.00 10.42 H new ATOM 0 HD1 TRP A 415 -10.996 20.947 12.905 1.00 62.12 H new ATOM 0 HE1 TRP A 415 -9.998 21.647 15.171 1.00 31.04 H new ATOM 0 HE3 TRP A 415 -11.403 16.472 15.344 1.00 23.15 H new ATOM 0 HZ2 TRP A 415 -9.492 20.449 17.652 1.00 14.10 H new ATOM 0 HZ3 TRP A 415 -10.644 16.336 17.678 1.00 42.34 H new ATOM 0 HH2 TRP A 415 -9.705 18.300 18.819 1.00 30.53 H new ATOM 218 N PHE A 416 -10.584 15.199 12.814 1.00 51.44 N ATOM 219 CA PHE A 416 -9.970 14.165 13.642 1.00 10.12 C ATOM 220 C PHE A 416 -8.679 13.699 13.036 1.00 14.51 C ATOM 221 O PHE A 416 -7.776 13.247 13.753 1.00 61.34 O ATOM 222 CB PHE A 416 -10.876 12.940 13.885 1.00 65.32 C ATOM 223 CG PHE A 416 -12.182 13.209 14.581 1.00 32.34 C ATOM 224 CD1 PHE A 416 -12.233 13.948 15.749 1.00 11.00 C ATOM 225 CD2 PHE A 416 -13.359 12.696 14.069 1.00 61.24 C ATOM 226 CE1 PHE A 416 -13.440 14.174 16.383 1.00 10.15 C ATOM 227 CE2 PHE A 416 -14.565 12.921 14.697 1.00 10.10 C ATOM 228 CZ PHE A 416 -14.607 13.662 15.856 1.00 44.05 C ATOM 0 H PHE A 416 -11.451 14.920 12.355 1.00 51.44 H new ATOM 0 HA PHE A 416 -9.795 14.636 14.609 1.00 10.12 H new ATOM 0 HB2 PHE A 416 -11.090 12.475 12.922 1.00 65.32 H new ATOM 0 HB3 PHE A 416 -10.318 12.212 14.473 1.00 65.32 H new ATOM 0 HD1 PHE A 416 -11.323 14.351 16.169 1.00 11.00 H new ATOM 0 HD2 PHE A 416 -13.333 12.110 13.162 1.00 61.24 H new ATOM 0 HE1 PHE A 416 -13.469 14.753 17.294 1.00 10.15 H new ATOM 0 HE2 PHE A 416 -15.476 12.517 14.280 1.00 10.10 H new ATOM 0 HZ PHE A 416 -15.550 13.842 16.351 1.00 44.05 H new ATOM 238 N GLU A 417 -8.588 13.810 11.730 1.00 71.33 N ATOM 239 CA GLU A 417 -7.421 13.396 11.019 1.00 40.54 C ATOM 240 C GLU A 417 -6.300 14.376 11.228 1.00 61.22 C ATOM 241 O GLU A 417 -5.197 13.996 11.596 1.00 3.12 O ATOM 242 CB GLU A 417 -7.693 13.276 9.528 1.00 60.42 C ATOM 243 CG GLU A 417 -8.694 12.220 9.131 1.00 51.04 C ATOM 244 CD GLU A 417 -8.666 11.983 7.644 1.00 63.55 C ATOM 245 OE1 GLU A 417 -7.851 11.144 7.192 1.00 71.24 O ATOM 246 OE2 GLU A 417 -9.424 12.625 6.896 1.00 15.25 O ATOM 0 H GLU A 417 -9.327 14.191 11.139 1.00 71.33 H new ATOM 0 HA GLU A 417 -7.137 12.418 11.408 1.00 40.54 H new ATOM 0 HB2 GLU A 417 -8.045 14.241 9.162 1.00 60.42 H new ATOM 0 HB3 GLU A 417 -6.751 13.067 9.021 1.00 60.42 H new ATOM 0 HG2 GLU A 417 -8.474 11.290 9.655 1.00 51.04 H new ATOM 0 HG3 GLU A 417 -9.694 12.529 9.435 1.00 51.04 H new ATOM 253 N GLN A 418 -6.604 15.648 11.038 1.00 41.21 N ATOM 254 CA GLN A 418 -5.594 16.687 11.109 1.00 54.31 C ATOM 255 C GLN A 418 -5.106 16.893 12.543 1.00 31.24 C ATOM 256 O GLN A 418 -3.951 17.252 12.777 1.00 30.12 O ATOM 257 CB GLN A 418 -6.103 17.996 10.440 1.00 64.24 C ATOM 258 CG GLN A 418 -7.268 18.730 11.134 1.00 12.44 C ATOM 259 CD GLN A 418 -6.844 19.515 12.374 1.00 11.24 C ATOM 260 OE1 GLN A 418 -5.716 19.992 12.466 1.00 60.25 O ATOM 261 NE2 GLN A 418 -7.726 19.648 13.319 1.00 4.23 N ATOM 0 H GLN A 418 -7.544 15.986 10.833 1.00 41.21 H new ATOM 0 HA GLN A 418 -4.722 16.365 10.540 1.00 54.31 H new ATOM 0 HB2 GLN A 418 -5.263 18.687 10.366 1.00 64.24 H new ATOM 0 HB3 GLN A 418 -6.411 17.758 9.422 1.00 64.24 H new ATOM 0 HG2 GLN A 418 -7.731 19.413 10.422 1.00 12.44 H new ATOM 0 HG3 GLN A 418 -8.028 18.002 11.417 1.00 12.44 H new ATOM 0 HE21 GLN A 418 -8.654 19.240 13.211 1.00 4.23 H new ATOM 0 HE22 GLN A 418 -7.490 20.161 14.168 1.00 4.23 H new ATOM 270 N SER A 419 -5.987 16.651 13.490 1.00 21.20 N ATOM 271 CA SER A 419 -5.666 16.793 14.882 1.00 44.21 C ATOM 272 C SER A 419 -4.975 15.530 15.386 1.00 42.12 C ATOM 273 O SER A 419 -4.087 15.589 16.230 1.00 75.52 O ATOM 274 CB SER A 419 -6.953 17.065 15.685 1.00 22.12 C ATOM 275 OG SER A 419 -6.693 17.250 17.068 1.00 45.31 O ATOM 0 H SER A 419 -6.945 16.350 13.310 1.00 21.20 H new ATOM 0 HA SER A 419 -4.986 17.635 15.015 1.00 44.21 H new ATOM 0 HB2 SER A 419 -7.446 17.952 15.288 1.00 22.12 H new ATOM 0 HB3 SER A 419 -7.643 16.231 15.555 1.00 22.12 H new ATOM 0 HG SER A 419 -7.507 17.564 17.515 1.00 45.31 H new ATOM 281 N GLY A 420 -5.365 14.385 14.834 1.00 3.21 N ATOM 282 CA GLY A 420 -4.835 13.126 15.308 1.00 0.52 C ATOM 283 C GLY A 420 -5.430 12.779 16.654 1.00 70.04 C ATOM 284 O GLY A 420 -4.871 11.990 17.417 1.00 4.23 O ATOM 0 H GLY A 420 -6.036 14.310 14.070 1.00 3.21 H new ATOM 0 HA2 GLY A 420 -5.058 12.337 14.590 1.00 0.52 H new ATOM 0 HA3 GLY A 420 -3.750 13.188 15.388 1.00 0.52 H new ATOM 288 N ALA A 421 -6.583 13.374 16.933 1.00 63.00 N ATOM 289 CA ALA A 421 -7.256 13.201 18.206 1.00 51.12 C ATOM 290 C ALA A 421 -7.871 11.818 18.318 1.00 60.11 C ATOM 291 O ALA A 421 -7.720 11.139 19.330 1.00 20.02 O ATOM 292 CB ALA A 421 -8.314 14.279 18.383 1.00 21.23 C ATOM 0 H ALA A 421 -7.074 13.988 16.283 1.00 63.00 H new ATOM 0 HA ALA A 421 -6.518 13.297 19.003 1.00 51.12 H new ATOM 0 HB1 ALA A 421 -8.815 14.143 19.341 1.00 21.23 H new ATOM 0 HB2 ALA A 421 -7.841 15.261 18.357 1.00 21.23 H new ATOM 0 HB3 ALA A 421 -9.045 14.207 17.578 1.00 21.23 H new ATOM 298 N MET A 422 -8.540 11.400 17.272 1.00 22.22 N ATOM 299 CA MET A 422 -9.154 10.081 17.242 1.00 33.24 C ATOM 300 C MET A 422 -8.339 9.172 16.323 1.00 15.41 C ATOM 301 O MET A 422 -8.602 7.985 16.201 1.00 72.12 O ATOM 302 CB MET A 422 -10.615 10.193 16.745 1.00 61.24 C ATOM 303 CG MET A 422 -11.407 8.884 16.746 1.00 2.33 C ATOM 304 SD MET A 422 -13.095 9.077 16.119 1.00 55.24 S ATOM 305 CE MET A 422 -13.795 10.207 17.332 1.00 15.50 C ATOM 0 H MET A 422 -8.678 11.950 16.424 1.00 22.22 H new ATOM 0 HA MET A 422 -9.166 9.654 18.245 1.00 33.24 H new ATOM 0 HB2 MET A 422 -11.139 10.917 17.369 1.00 61.24 H new ATOM 0 HB3 MET A 422 -10.607 10.593 15.731 1.00 61.24 H new ATOM 0 HG2 MET A 422 -10.882 8.148 16.138 1.00 2.33 H new ATOM 0 HG3 MET A 422 -11.445 8.490 17.762 1.00 2.33 H new ATOM 0 HE1 MET A 422 -14.883 10.185 17.265 1.00 15.50 H new ATOM 0 HE2 MET A 422 -13.487 9.903 18.333 1.00 15.50 H new ATOM 0 HE3 MET A 422 -13.440 11.218 17.135 1.00 15.50 H new ATOM 315 N GLY A 423 -7.333 9.760 15.684 1.00 23.22 N ATOM 316 CA GLY A 423 -6.523 9.029 14.727 1.00 11.54 C ATOM 317 C GLY A 423 -7.256 8.849 13.414 1.00 20.34 C ATOM 318 O GLY A 423 -6.894 8.009 12.591 1.00 42.23 O ATOM 0 H GLY A 423 -7.063 10.735 15.813 1.00 23.22 H new ATOM 0 HA2 GLY A 423 -5.588 9.563 14.555 1.00 11.54 H new ATOM 0 HA3 GLY A 423 -6.262 8.054 15.137 1.00 11.54 H new ATOM 322 N GLY A 424 -8.287 9.654 13.224 1.00 64.04 N ATOM 323 CA GLY A 424 -9.100 9.558 12.049 1.00 44.34 C ATOM 324 C GLY A 424 -10.064 8.399 12.146 1.00 53.41 C ATOM 325 O GLY A 424 -10.595 8.113 13.223 1.00 72.31 O ATOM 0 H GLY A 424 -8.573 10.382 13.879 1.00 64.04 H new ATOM 0 HA2 GLY A 424 -9.655 10.486 11.911 1.00 44.34 H new ATOM 0 HA3 GLY A 424 -8.464 9.433 11.173 1.00 44.34 H new ATOM 329 N LYS A 425 -10.282 7.749 11.041 1.00 13.40 N ATOM 330 CA LYS A 425 -11.143 6.579 10.927 1.00 20.12 C ATOM 331 C LYS A 425 -10.396 5.522 10.113 1.00 30.24 C ATOM 332 O LYS A 425 -9.338 5.830 9.563 1.00 3.21 O ATOM 333 CB LYS A 425 -12.489 6.933 10.216 1.00 72.12 C ATOM 334 CG LYS A 425 -13.613 7.492 11.104 1.00 4.33 C ATOM 335 CD LYS A 425 -13.285 8.812 11.756 1.00 32.01 C ATOM 336 CE LYS A 425 -14.436 9.287 12.622 1.00 64.31 C ATOM 337 NZ LYS A 425 -14.754 8.337 13.717 1.00 41.02 N ATOM 0 H LYS A 425 -9.856 8.018 10.154 1.00 13.40 H new ATOM 0 HA LYS A 425 -11.382 6.208 11.924 1.00 20.12 H new ATOM 0 HB2 LYS A 425 -12.279 7.662 9.434 1.00 72.12 H new ATOM 0 HB3 LYS A 425 -12.860 6.034 9.723 1.00 72.12 H new ATOM 0 HG2 LYS A 425 -14.513 7.611 10.500 1.00 4.33 H new ATOM 0 HG3 LYS A 425 -13.844 6.763 11.881 1.00 4.33 H new ATOM 0 HD2 LYS A 425 -12.386 8.709 12.363 1.00 32.01 H new ATOM 0 HD3 LYS A 425 -13.069 9.557 10.990 1.00 32.01 H new ATOM 0 HE2 LYS A 425 -14.188 10.259 13.049 1.00 64.31 H new ATOM 0 HE3 LYS A 425 -15.320 9.428 12.000 1.00 64.31 H new ATOM 0 HZ1 LYS A 425 -15.751 8.048 13.647 1.00 41.02 H new ATOM 0 HZ2 LYS A 425 -14.144 7.498 13.637 1.00 41.02 H new ATOM 0 HZ3 LYS A 425 -14.590 8.798 14.635 1.00 41.02 H new ATOM 351 N PRO A 426 -10.880 4.267 10.042 1.00 15.14 N ATOM 352 CA PRO A 426 -10.267 3.256 9.171 1.00 51.40 C ATOM 353 C PRO A 426 -10.515 3.593 7.686 1.00 32.20 C ATOM 354 O PRO A 426 -11.418 4.389 7.362 1.00 70.20 O ATOM 355 CB PRO A 426 -11.002 1.961 9.552 1.00 33.30 C ATOM 356 CG PRO A 426 -12.303 2.415 10.118 1.00 54.14 C ATOM 357 CD PRO A 426 -12.015 3.709 10.818 1.00 24.13 C ATOM 0 HA PRO A 426 -9.186 3.190 9.295 1.00 51.40 H new ATOM 0 HB2 PRO A 426 -11.151 1.320 8.683 1.00 33.30 H new ATOM 0 HB3 PRO A 426 -10.434 1.383 10.281 1.00 33.30 H new ATOM 0 HG2 PRO A 426 -13.045 2.553 9.331 1.00 54.14 H new ATOM 0 HG3 PRO A 426 -12.707 1.677 10.811 1.00 54.14 H new ATOM 0 HD2 PRO A 426 -12.878 4.375 10.805 1.00 24.13 H new ATOM 0 HD3 PRO A 426 -11.750 3.551 11.863 1.00 24.13 H new ATOM 365 N LEU A 427 -9.737 2.981 6.783 1.00 10.33 N ATOM 366 CA LEU A 427 -9.880 3.227 5.335 1.00 42.03 C ATOM 367 C LEU A 427 -11.289 2.899 4.842 1.00 21.44 C ATOM 368 O LEU A 427 -11.771 3.459 3.849 1.00 61.44 O ATOM 369 CB LEU A 427 -8.766 2.520 4.499 1.00 72.12 C ATOM 370 CG LEU A 427 -8.601 0.970 4.596 1.00 22.22 C ATOM 371 CD1 LEU A 427 -9.761 0.206 3.969 1.00 70.44 C ATOM 372 CD2 LEU A 427 -7.284 0.539 3.970 1.00 44.53 C ATOM 0 H LEU A 427 -9.004 2.314 7.025 1.00 10.33 H new ATOM 0 HA LEU A 427 -9.737 4.296 5.177 1.00 42.03 H new ATOM 0 HB2 LEU A 427 -8.938 2.766 3.451 1.00 72.12 H new ATOM 0 HB3 LEU A 427 -7.813 2.968 4.779 1.00 72.12 H new ATOM 0 HG LEU A 427 -8.600 0.721 5.657 1.00 22.22 H new ATOM 0 HD11 LEU A 427 -9.587 -0.865 4.069 1.00 70.44 H new ATOM 0 HD12 LEU A 427 -10.688 0.472 4.476 1.00 70.44 H new ATOM 0 HD13 LEU A 427 -9.838 0.464 2.913 1.00 70.44 H new ATOM 0 HD21 LEU A 427 -7.183 -0.544 4.045 1.00 44.53 H new ATOM 0 HD22 LEU A 427 -7.266 0.833 2.921 1.00 44.53 H new ATOM 0 HD23 LEU A 427 -6.458 1.018 4.495 1.00 44.53 H new ATOM 384 N SER A 428 -11.930 2.002 5.563 1.00 35.22 N ATOM 385 CA SER A 428 -13.269 1.562 5.301 1.00 5.41 C ATOM 386 C SER A 428 -14.254 2.751 5.288 1.00 2.13 C ATOM 387 O SER A 428 -15.214 2.768 4.523 1.00 34.41 O ATOM 388 CB SER A 428 -13.645 0.568 6.383 1.00 1.01 C ATOM 389 OG SER A 428 -12.636 -0.430 6.497 1.00 43.43 O ATOM 0 H SER A 428 -11.511 1.548 6.375 1.00 35.22 H new ATOM 0 HA SER A 428 -13.322 1.095 4.318 1.00 5.41 H new ATOM 0 HB2 SER A 428 -13.768 1.083 7.336 1.00 1.01 H new ATOM 0 HB3 SER A 428 -14.602 0.104 6.146 1.00 1.01 H new ATOM 0 HG SER A 428 -12.884 -1.068 7.199 1.00 43.43 H new ATOM 395 N THR A 429 -14.001 3.731 6.126 1.00 23.10 N ATOM 396 CA THR A 429 -14.837 4.895 6.196 1.00 44.54 C ATOM 397 C THR A 429 -14.550 5.826 5.001 1.00 2.54 C ATOM 398 O THR A 429 -15.474 6.330 4.339 1.00 73.24 O ATOM 399 CB THR A 429 -14.566 5.657 7.505 1.00 22.52 C ATOM 400 OG1 THR A 429 -14.628 4.740 8.611 1.00 54.41 O ATOM 401 CG2 THR A 429 -15.599 6.761 7.714 1.00 72.02 C ATOM 0 H THR A 429 -13.212 3.738 6.773 1.00 23.10 H new ATOM 0 HA THR A 429 -15.879 4.578 6.166 1.00 44.54 H new ATOM 0 HB THR A 429 -13.576 6.109 7.444 1.00 22.52 H new ATOM 0 HG1 THR A 429 -14.931 5.215 9.413 1.00 54.41 H new ATOM 0 HG21 THR A 429 -15.387 7.286 8.646 1.00 72.02 H new ATOM 0 HG22 THR A 429 -15.553 7.464 6.883 1.00 72.02 H new ATOM 0 HG23 THR A 429 -16.596 6.322 7.763 1.00 72.02 H new ATOM 409 N PHE A 430 -13.266 6.015 4.717 1.00 72.43 N ATOM 410 CA PHE A 430 -12.817 6.970 3.715 1.00 1.41 C ATOM 411 C PHE A 430 -13.135 6.614 2.285 1.00 24.31 C ATOM 412 O PHE A 430 -13.341 7.521 1.486 1.00 5.11 O ATOM 413 CB PHE A 430 -11.348 7.294 3.876 1.00 71.23 C ATOM 414 CG PHE A 430 -11.050 7.878 5.201 1.00 34.52 C ATOM 415 CD1 PHE A 430 -11.415 9.171 5.491 1.00 3.52 C ATOM 416 CD2 PHE A 430 -10.422 7.138 6.159 1.00 41.30 C ATOM 417 CE1 PHE A 430 -11.153 9.711 6.724 1.00 41.33 C ATOM 418 CE2 PHE A 430 -10.159 7.666 7.383 1.00 4.35 C ATOM 419 CZ PHE A 430 -10.523 8.956 7.677 1.00 4.31 C ATOM 0 H PHE A 430 -12.508 5.509 5.176 1.00 72.43 H new ATOM 0 HA PHE A 430 -13.411 7.862 3.917 1.00 1.41 H new ATOM 0 HB2 PHE A 430 -10.760 6.386 3.740 1.00 71.23 H new ATOM 0 HB3 PHE A 430 -11.043 7.992 3.096 1.00 71.23 H new ATOM 0 HD1 PHE A 430 -11.913 9.767 4.741 1.00 3.52 H new ATOM 0 HD2 PHE A 430 -10.130 6.121 5.942 1.00 41.30 H new ATOM 0 HE1 PHE A 430 -11.443 10.728 6.943 1.00 41.33 H new ATOM 0 HE2 PHE A 430 -9.660 7.066 8.130 1.00 4.35 H new ATOM 0 HZ PHE A 430 -10.314 9.372 8.652 1.00 4.31 H new ATOM 429 N TYR A 431 -13.199 5.318 1.935 1.00 4.32 N ATOM 430 CA TYR A 431 -13.487 4.953 0.532 1.00 33.42 C ATOM 431 C TYR A 431 -14.779 5.589 0.019 1.00 72.32 C ATOM 432 O TYR A 431 -14.892 5.909 -1.159 1.00 33.21 O ATOM 433 CB TYR A 431 -13.375 3.437 0.187 1.00 55.21 C ATOM 434 CG TYR A 431 -14.323 2.464 0.883 1.00 61.42 C ATOM 435 CD1 TYR A 431 -13.832 1.494 1.747 1.00 71.52 C ATOM 436 CD2 TYR A 431 -15.696 2.495 0.650 1.00 70.13 C ATOM 437 CE1 TYR A 431 -14.678 0.585 2.356 1.00 65.31 C ATOM 438 CE2 TYR A 431 -16.547 1.596 1.261 1.00 62.02 C ATOM 439 CZ TYR A 431 -16.031 0.641 2.112 1.00 2.22 C ATOM 440 OH TYR A 431 -16.874 -0.267 2.726 1.00 42.32 O ATOM 0 H TYR A 431 -13.062 4.533 2.572 1.00 4.32 H new ATOM 0 HA TYR A 431 -12.662 5.394 -0.027 1.00 33.42 H new ATOM 0 HB2 TYR A 431 -13.519 3.329 -0.888 1.00 55.21 H new ATOM 0 HB3 TYR A 431 -12.355 3.121 0.406 1.00 55.21 H new ATOM 0 HD1 TYR A 431 -12.772 1.449 1.947 1.00 71.52 H new ATOM 0 HD2 TYR A 431 -16.103 3.237 -0.022 1.00 70.13 H new ATOM 0 HE1 TYR A 431 -14.278 -0.166 3.021 1.00 65.31 H new ATOM 0 HE2 TYR A 431 -17.610 1.640 1.074 1.00 62.02 H new ATOM 0 HH TYR A 431 -17.798 -0.093 2.451 1.00 42.32 H new ATOM 450 N THR A 432 -15.731 5.770 0.927 1.00 32.32 N ATOM 451 CA THR A 432 -16.998 6.420 0.643 1.00 11.52 C ATOM 452 C THR A 432 -16.750 7.826 0.011 1.00 61.33 C ATOM 453 O THR A 432 -17.412 8.216 -0.951 1.00 31.14 O ATOM 454 CB THR A 432 -17.765 6.607 1.964 1.00 75.22 C ATOM 455 OG1 THR A 432 -17.723 5.374 2.714 1.00 4.22 O ATOM 456 CG2 THR A 432 -19.219 6.987 1.704 1.00 63.24 C ATOM 0 H THR A 432 -15.640 5.463 1.895 1.00 32.32 H new ATOM 0 HA THR A 432 -17.569 5.805 -0.052 1.00 11.52 H new ATOM 0 HB THR A 432 -17.293 7.412 2.528 1.00 75.22 H new ATOM 0 HG1 THR A 432 -16.995 5.414 3.369 1.00 4.22 H new ATOM 0 HG21 THR A 432 -19.738 7.113 2.654 1.00 63.24 H new ATOM 0 HG22 THR A 432 -19.256 7.921 1.144 1.00 63.24 H new ATOM 0 HG23 THR A 432 -19.704 6.199 1.128 1.00 63.24 H new ATOM 464 N GLN A 433 -15.784 8.559 0.566 1.00 60.34 N ATOM 465 CA GLN A 433 -15.427 9.883 0.067 1.00 4.13 C ATOM 466 C GLN A 433 -14.701 9.773 -1.261 1.00 52.45 C ATOM 467 O GLN A 433 -14.949 10.535 -2.180 1.00 1.03 O ATOM 468 CB GLN A 433 -14.546 10.629 1.070 1.00 22.40 C ATOM 469 CG GLN A 433 -15.192 10.875 2.416 1.00 72.15 C ATOM 470 CD GLN A 433 -14.280 11.625 3.364 1.00 44.13 C ATOM 471 OE1 GLN A 433 -13.521 11.032 4.116 1.00 52.31 O ATOM 472 NE2 GLN A 433 -14.341 12.926 3.328 1.00 10.40 N ATOM 0 H GLN A 433 -15.232 8.253 1.367 1.00 60.34 H new ATOM 0 HA GLN A 433 -16.351 10.444 -0.073 1.00 4.13 H new ATOM 0 HB2 GLN A 433 -13.628 10.060 1.221 1.00 22.40 H new ATOM 0 HB3 GLN A 433 -14.259 11.588 0.639 1.00 22.40 H new ATOM 0 HG2 GLN A 433 -16.112 11.442 2.276 1.00 72.15 H new ATOM 0 HG3 GLN A 433 -15.470 9.920 2.863 1.00 72.15 H new ATOM 0 HE21 GLN A 433 -14.986 13.389 2.688 1.00 10.40 H new ATOM 0 HE22 GLN A 433 -13.743 13.482 3.940 1.00 10.40 H new ATOM 481 N LEU A 434 -13.810 8.811 -1.345 1.00 30.42 N ATOM 482 CA LEU A 434 -13.014 8.589 -2.545 1.00 31.23 C ATOM 483 C LEU A 434 -13.857 8.258 -3.767 1.00 13.04 C ATOM 484 O LEU A 434 -13.654 8.843 -4.816 1.00 12.45 O ATOM 485 CB LEU A 434 -11.911 7.524 -2.329 1.00 24.23 C ATOM 486 CG LEU A 434 -10.635 7.948 -1.547 1.00 21.10 C ATOM 487 CD1 LEU A 434 -10.945 8.494 -0.168 1.00 33.10 C ATOM 488 CD2 LEU A 434 -9.688 6.774 -1.433 1.00 42.14 C ATOM 0 H LEU A 434 -13.612 8.157 -0.587 1.00 30.42 H new ATOM 0 HA LEU A 434 -12.523 9.541 -2.747 1.00 31.23 H new ATOM 0 HB2 LEU A 434 -12.359 6.679 -1.806 1.00 24.23 H new ATOM 0 HB3 LEU A 434 -11.598 7.162 -3.309 1.00 24.23 H new ATOM 0 HG LEU A 434 -10.168 8.754 -2.112 1.00 21.10 H new ATOM 0 HD11 LEU A 434 -10.016 8.773 0.330 1.00 33.10 H new ATOM 0 HD12 LEU A 434 -11.586 9.371 -0.260 1.00 33.10 H new ATOM 0 HD13 LEU A 434 -11.456 7.731 0.419 1.00 33.10 H new ATOM 0 HD21 LEU A 434 -8.796 7.078 -0.884 1.00 42.14 H new ATOM 0 HD22 LEU A 434 -10.181 5.959 -0.902 1.00 42.14 H new ATOM 0 HD23 LEU A 434 -9.403 6.438 -2.430 1.00 42.14 H new ATOM 500 N VAL A 435 -14.831 7.361 -3.615 1.00 50.33 N ATOM 501 CA VAL A 435 -15.664 6.915 -4.752 1.00 41.14 C ATOM 502 C VAL A 435 -16.469 8.046 -5.413 1.00 65.34 C ATOM 503 O VAL A 435 -16.828 7.955 -6.591 1.00 52.24 O ATOM 504 CB VAL A 435 -16.595 5.714 -4.405 1.00 11.44 C ATOM 505 CG1 VAL A 435 -15.779 4.502 -3.974 1.00 2.25 C ATOM 506 CG2 VAL A 435 -17.618 6.084 -3.339 1.00 0.32 C ATOM 0 H VAL A 435 -15.069 6.926 -2.724 1.00 50.33 H new ATOM 0 HA VAL A 435 -14.937 6.567 -5.485 1.00 41.14 H new ATOM 0 HB VAL A 435 -17.144 5.455 -5.310 1.00 11.44 H new ATOM 0 HG11 VAL A 435 -16.451 3.677 -3.737 1.00 2.25 H new ATOM 0 HG12 VAL A 435 -15.112 4.206 -4.784 1.00 2.25 H new ATOM 0 HG13 VAL A 435 -15.190 4.755 -3.093 1.00 2.25 H new ATOM 0 HG21 VAL A 435 -18.248 5.221 -3.124 1.00 0.32 H new ATOM 0 HG22 VAL A 435 -17.101 6.391 -2.430 1.00 0.32 H new ATOM 0 HG23 VAL A 435 -18.238 6.905 -3.699 1.00 0.32 H new ATOM 516 N LEU A 436 -16.745 9.104 -4.673 1.00 10.23 N ATOM 517 CA LEU A 436 -17.480 10.228 -5.217 1.00 53.33 C ATOM 518 C LEU A 436 -16.549 11.319 -5.727 1.00 42.30 C ATOM 519 O LEU A 436 -16.968 12.269 -6.405 1.00 13.50 O ATOM 520 CB LEU A 436 -18.464 10.766 -4.181 1.00 61.41 C ATOM 521 CG LEU A 436 -17.928 11.235 -2.841 1.00 51.11 C ATOM 522 CD1 LEU A 436 -17.265 12.591 -2.921 1.00 51.21 C ATOM 523 CD2 LEU A 436 -19.034 11.246 -1.878 1.00 54.40 C ATOM 0 H LEU A 436 -16.471 9.207 -3.696 1.00 10.23 H new ATOM 0 HA LEU A 436 -18.048 9.877 -6.078 1.00 53.33 H new ATOM 0 HB2 LEU A 436 -18.997 11.602 -4.634 1.00 61.41 H new ATOM 0 HB3 LEU A 436 -19.200 9.986 -3.988 1.00 61.41 H new ATOM 0 HG LEU A 436 -17.151 10.543 -2.516 1.00 51.11 H new ATOM 0 HD11 LEU A 436 -16.900 12.877 -1.934 1.00 51.21 H new ATOM 0 HD12 LEU A 436 -16.428 12.546 -3.618 1.00 51.21 H new ATOM 0 HD13 LEU A 436 -17.988 13.329 -3.268 1.00 51.21 H new ATOM 0 HD21 LEU A 436 -18.668 11.581 -0.907 1.00 54.40 H new ATOM 0 HD22 LEU A 436 -19.813 11.925 -2.226 1.00 54.40 H new ATOM 0 HD23 LEU A 436 -19.444 10.241 -1.784 1.00 54.40 H new ATOM 535 N MET A 437 -15.294 11.171 -5.387 1.00 12.31 N ATOM 536 CA MET A 437 -14.275 12.153 -5.659 1.00 4.31 C ATOM 537 C MET A 437 -13.495 11.752 -6.938 1.00 25.34 C ATOM 538 O MET A 437 -13.359 10.568 -7.216 1.00 73.14 O ATOM 539 CB MET A 437 -13.316 12.164 -4.454 1.00 22.30 C ATOM 540 CG MET A 437 -12.407 13.365 -4.363 1.00 22.00 C ATOM 541 SD MET A 437 -13.332 14.893 -4.077 1.00 12.45 S ATOM 542 CE MET A 437 -14.083 14.541 -2.473 1.00 73.12 C ATOM 0 H MET A 437 -14.944 10.345 -4.902 1.00 12.31 H new ATOM 0 HA MET A 437 -14.717 13.137 -5.814 1.00 4.31 H new ATOM 0 HB2 MET A 437 -13.907 12.106 -3.540 1.00 22.30 H new ATOM 0 HB3 MET A 437 -12.700 11.265 -4.493 1.00 22.30 H new ATOM 0 HG2 MET A 437 -11.691 13.218 -3.554 1.00 22.00 H new ATOM 0 HG3 MET A 437 -11.833 13.456 -5.285 1.00 22.00 H new ATOM 0 HE1 MET A 437 -13.992 15.416 -1.829 1.00 73.12 H new ATOM 0 HE2 MET A 437 -15.137 14.299 -2.610 1.00 73.12 H new ATOM 0 HE3 MET A 437 -13.574 13.696 -2.010 1.00 73.12 H new ATOM 552 N PRO A 438 -12.990 12.729 -7.745 1.00 44.31 N ATOM 553 CA PRO A 438 -12.130 12.448 -8.928 1.00 63.11 C ATOM 554 C PRO A 438 -10.917 11.576 -8.558 1.00 22.31 C ATOM 555 O PRO A 438 -10.381 10.835 -9.383 1.00 71.34 O ATOM 556 CB PRO A 438 -11.654 13.848 -9.371 1.00 4.41 C ATOM 557 CG PRO A 438 -12.042 14.769 -8.259 1.00 44.41 C ATOM 558 CD PRO A 438 -13.251 14.165 -7.628 1.00 21.35 C ATOM 0 HA PRO A 438 -12.667 11.900 -9.702 1.00 63.11 H new ATOM 0 HB2 PRO A 438 -10.577 13.863 -9.536 1.00 4.41 H new ATOM 0 HB3 PRO A 438 -12.124 14.144 -10.309 1.00 4.41 H new ATOM 0 HG2 PRO A 438 -11.233 14.869 -7.535 1.00 44.41 H new ATOM 0 HG3 PRO A 438 -12.257 15.768 -8.637 1.00 44.41 H new ATOM 0 HD2 PRO A 438 -13.362 14.473 -6.588 1.00 21.35 H new ATOM 0 HD3 PRO A 438 -14.166 14.454 -8.146 1.00 21.35 H new ATOM 566 N GLN A 439 -10.505 11.687 -7.310 1.00 71.23 N ATOM 567 CA GLN A 439 -9.390 10.947 -6.753 1.00 25.32 C ATOM 568 C GLN A 439 -9.580 9.408 -6.871 1.00 11.44 C ATOM 569 O GLN A 439 -8.597 8.663 -6.919 1.00 71.14 O ATOM 570 CB GLN A 439 -9.183 11.366 -5.295 1.00 52.43 C ATOM 571 CG GLN A 439 -8.054 10.645 -4.593 1.00 61.12 C ATOM 572 CD GLN A 439 -7.844 11.118 -3.175 1.00 34.43 C ATOM 573 OE1 GLN A 439 -8.781 11.559 -2.504 1.00 75.43 O ATOM 574 NE2 GLN A 439 -6.631 11.015 -2.704 1.00 42.12 N ATOM 0 H GLN A 439 -10.949 12.312 -6.637 1.00 71.23 H new ATOM 0 HA GLN A 439 -8.499 11.189 -7.333 1.00 25.32 H new ATOM 0 HB2 GLN A 439 -8.990 12.438 -5.262 1.00 52.43 H new ATOM 0 HB3 GLN A 439 -10.107 11.191 -4.745 1.00 52.43 H new ATOM 0 HG2 GLN A 439 -8.262 9.575 -4.586 1.00 61.12 H new ATOM 0 HG3 GLN A 439 -7.133 10.787 -5.158 1.00 61.12 H new ATOM 0 HE21 GLN A 439 -5.885 10.645 -3.293 1.00 42.12 H new ATOM 0 HE22 GLN A 439 -6.429 11.305 -1.747 1.00 42.12 H new ATOM 583 N VAL A 440 -10.842 8.939 -6.947 1.00 64.35 N ATOM 584 CA VAL A 440 -11.118 7.495 -7.040 1.00 3.21 C ATOM 585 C VAL A 440 -10.436 6.869 -8.262 1.00 52.31 C ATOM 586 O VAL A 440 -10.043 5.726 -8.220 1.00 2.35 O ATOM 587 CB VAL A 440 -12.648 7.142 -7.040 1.00 43.20 C ATOM 588 CG1 VAL A 440 -13.361 7.642 -8.281 1.00 13.32 C ATOM 589 CG2 VAL A 440 -12.871 5.645 -6.844 1.00 23.05 C ATOM 0 H VAL A 440 -11.673 9.530 -6.946 1.00 64.35 H new ATOM 0 HA VAL A 440 -10.695 7.066 -6.132 1.00 3.21 H new ATOM 0 HB VAL A 440 -13.088 7.666 -6.192 1.00 43.20 H new ATOM 0 HG11 VAL A 440 -14.415 7.371 -8.229 1.00 13.32 H new ATOM 0 HG12 VAL A 440 -13.268 8.726 -8.342 1.00 13.32 H new ATOM 0 HG13 VAL A 440 -12.913 7.189 -9.165 1.00 13.32 H new ATOM 0 HG21 VAL A 440 -13.940 5.433 -6.849 1.00 23.05 H new ATOM 0 HG22 VAL A 440 -12.389 5.096 -7.653 1.00 23.05 H new ATOM 0 HG23 VAL A 440 -12.444 5.335 -5.890 1.00 23.05 H new ATOM 599 N LEU A 441 -10.265 7.645 -9.330 1.00 33.00 N ATOM 600 CA LEU A 441 -9.618 7.137 -10.543 1.00 73.34 C ATOM 601 C LEU A 441 -8.155 6.760 -10.275 1.00 22.32 C ATOM 602 O LEU A 441 -7.638 5.792 -10.837 1.00 34.12 O ATOM 603 CB LEU A 441 -9.716 8.121 -11.738 1.00 23.14 C ATOM 604 CG LEU A 441 -11.108 8.405 -12.358 1.00 64.13 C ATOM 605 CD1 LEU A 441 -12.045 9.141 -11.407 1.00 10.51 C ATOM 606 CD2 LEU A 441 -10.945 9.182 -13.649 1.00 12.30 C ATOM 0 H LEU A 441 -10.561 8.620 -9.383 1.00 33.00 H new ATOM 0 HA LEU A 441 -10.166 6.239 -10.826 1.00 73.34 H new ATOM 0 HB2 LEU A 441 -9.297 9.074 -11.416 1.00 23.14 H new ATOM 0 HB3 LEU A 441 -9.072 7.742 -12.532 1.00 23.14 H new ATOM 0 HG LEU A 441 -11.572 7.440 -12.562 1.00 64.13 H new ATOM 0 HD11 LEU A 441 -13.003 9.311 -11.899 1.00 10.51 H new ATOM 0 HD12 LEU A 441 -12.199 8.541 -10.510 1.00 10.51 H new ATOM 0 HD13 LEU A 441 -11.604 10.099 -11.131 1.00 10.51 H new ATOM 0 HD21 LEU A 441 -11.926 9.379 -14.081 1.00 12.30 H new ATOM 0 HD22 LEU A 441 -10.442 10.127 -13.444 1.00 12.30 H new ATOM 0 HD23 LEU A 441 -10.349 8.599 -14.352 1.00 12.30 H new ATOM 618 N HIS A 442 -7.505 7.507 -9.389 1.00 4.30 N ATOM 619 CA HIS A 442 -6.122 7.231 -9.008 1.00 3.33 C ATOM 620 C HIS A 442 -6.094 5.924 -8.218 1.00 42.42 C ATOM 621 O HIS A 442 -5.176 5.115 -8.343 1.00 21.41 O ATOM 622 CB HIS A 442 -5.556 8.403 -8.158 1.00 11.31 C ATOM 623 CG HIS A 442 -4.086 8.302 -7.791 1.00 24.33 C ATOM 624 ND1 HIS A 442 -3.109 9.051 -8.407 1.00 42.53 N ATOM 625 CD2 HIS A 442 -3.443 7.565 -6.851 1.00 40.14 C ATOM 626 CE1 HIS A 442 -1.937 8.779 -7.871 1.00 0.21 C ATOM 627 NE2 HIS A 442 -2.108 7.882 -6.925 1.00 31.22 N ATOM 0 H HIS A 442 -7.916 8.313 -8.918 1.00 4.30 H new ATOM 0 HA HIS A 442 -5.498 7.135 -9.896 1.00 3.33 H new ATOM 0 HB2 HIS A 442 -5.712 9.333 -8.706 1.00 11.31 H new ATOM 0 HB3 HIS A 442 -6.137 8.474 -7.238 1.00 11.31 H new ATOM 0 HD1 HIS A 442 -3.269 9.716 -9.164 1.00 42.53 H new ATOM 0 HD2 HIS A 442 -3.896 6.860 -6.170 1.00 40.14 H new ATOM 0 HE1 HIS A 442 -0.994 9.219 -8.160 1.00 0.21 H new ATOM 636 N TYR A 443 -7.129 5.726 -7.426 1.00 71.41 N ATOM 637 CA TYR A 443 -7.288 4.525 -6.623 1.00 4.15 C ATOM 638 C TYR A 443 -7.755 3.328 -7.424 1.00 55.00 C ATOM 639 O TYR A 443 -7.465 2.208 -7.074 1.00 0.52 O ATOM 640 CB TYR A 443 -8.156 4.769 -5.393 1.00 4.23 C ATOM 641 CG TYR A 443 -7.438 5.547 -4.311 1.00 23.22 C ATOM 642 CD1 TYR A 443 -6.866 4.883 -3.234 1.00 44.44 C ATOM 643 CD2 TYR A 443 -7.309 6.925 -4.369 1.00 60.42 C ATOM 644 CE1 TYR A 443 -6.187 5.567 -2.251 1.00 23.21 C ATOM 645 CE2 TYR A 443 -6.631 7.619 -3.383 1.00 52.51 C ATOM 646 CZ TYR A 443 -6.072 6.934 -2.328 1.00 71.53 C ATOM 647 OH TYR A 443 -5.386 7.619 -1.352 1.00 3.02 O ATOM 0 H TYR A 443 -7.890 6.397 -7.319 1.00 71.41 H new ATOM 0 HA TYR A 443 -6.290 4.271 -6.266 1.00 4.15 H new ATOM 0 HB2 TYR A 443 -9.053 5.312 -5.690 1.00 4.23 H new ATOM 0 HB3 TYR A 443 -8.482 3.811 -4.989 1.00 4.23 H new ATOM 0 HD1 TYR A 443 -6.956 3.809 -3.166 1.00 44.44 H new ATOM 0 HD2 TYR A 443 -7.744 7.466 -5.196 1.00 60.42 H new ATOM 0 HE1 TYR A 443 -5.747 5.031 -1.423 1.00 23.21 H new ATOM 0 HE2 TYR A 443 -6.541 8.694 -3.441 1.00 52.51 H new ATOM 0 HH TYR A 443 -5.397 8.577 -1.556 1.00 3.02 H new ATOM 657 N ALA A 444 -8.476 3.574 -8.488 1.00 63.41 N ATOM 658 CA ALA A 444 -8.944 2.524 -9.401 1.00 53.35 C ATOM 659 C ALA A 444 -7.756 1.768 -9.969 1.00 12.11 C ATOM 660 O ALA A 444 -7.821 0.559 -10.212 1.00 23.15 O ATOM 661 CB ALA A 444 -9.790 3.119 -10.521 1.00 0.21 C ATOM 0 H ALA A 444 -8.766 4.513 -8.761 1.00 63.41 H new ATOM 0 HA ALA A 444 -9.570 1.828 -8.843 1.00 53.35 H new ATOM 0 HB1 ALA A 444 -10.126 2.323 -11.185 1.00 0.21 H new ATOM 0 HB2 ALA A 444 -10.656 3.625 -10.094 1.00 0.21 H new ATOM 0 HB3 ALA A 444 -9.194 3.836 -11.086 1.00 0.21 H new ATOM 667 N GLN A 445 -6.664 2.494 -10.158 1.00 54.23 N ATOM 668 CA GLN A 445 -5.409 1.921 -10.602 1.00 74.31 C ATOM 669 C GLN A 445 -4.934 0.880 -9.573 1.00 11.13 C ATOM 670 O GLN A 445 -4.397 -0.168 -9.927 1.00 21.12 O ATOM 671 CB GLN A 445 -4.355 3.019 -10.748 1.00 43.54 C ATOM 672 CG GLN A 445 -4.739 4.153 -11.695 1.00 53.34 C ATOM 673 CD GLN A 445 -4.987 3.691 -13.117 1.00 13.40 C ATOM 674 OE1 GLN A 445 -4.392 2.715 -13.592 1.00 42.42 O ATOM 675 NE2 GLN A 445 -5.859 4.374 -13.802 1.00 31.22 N ATOM 0 H GLN A 445 -6.627 3.502 -10.006 1.00 54.23 H new ATOM 0 HA GLN A 445 -5.554 1.440 -11.569 1.00 74.31 H new ATOM 0 HB2 GLN A 445 -4.151 3.440 -9.764 1.00 43.54 H new ATOM 0 HB3 GLN A 445 -3.427 2.568 -11.101 1.00 43.54 H new ATOM 0 HG2 GLN A 445 -5.637 4.643 -11.318 1.00 53.34 H new ATOM 0 HG3 GLN A 445 -3.945 4.900 -11.697 1.00 53.34 H new ATOM 0 HE21 GLN A 445 -6.329 5.173 -13.376 1.00 31.22 H new ATOM 0 HE22 GLN A 445 -6.072 4.110 -14.764 1.00 31.22 H new ATOM 684 N TYR A 446 -5.162 1.188 -8.301 1.00 13.11 N ATOM 685 CA TYR A 446 -4.818 0.297 -7.197 1.00 20.43 C ATOM 686 C TYR A 446 -5.794 -0.869 -7.133 1.00 32.14 C ATOM 687 O TYR A 446 -5.404 -2.013 -6.888 1.00 44.30 O ATOM 688 CB TYR A 446 -4.883 1.031 -5.855 1.00 52.13 C ATOM 689 CG TYR A 446 -3.890 2.146 -5.644 1.00 3.01 C ATOM 690 CD1 TYR A 446 -2.547 1.985 -5.939 1.00 4.25 C ATOM 691 CD2 TYR A 446 -4.297 3.351 -5.100 1.00 73.31 C ATOM 692 CE1 TYR A 446 -1.643 3.000 -5.701 1.00 11.32 C ATOM 693 CE2 TYR A 446 -3.405 4.368 -4.868 1.00 4.22 C ATOM 694 CZ TYR A 446 -2.083 4.190 -5.167 1.00 33.35 C ATOM 695 OH TYR A 446 -1.185 5.201 -4.919 1.00 24.32 O ATOM 0 H TYR A 446 -5.592 2.064 -8.005 1.00 13.11 H new ATOM 0 HA TYR A 446 -3.804 -0.060 -7.376 1.00 20.43 H new ATOM 0 HB2 TYR A 446 -5.886 1.442 -5.740 1.00 52.13 H new ATOM 0 HB3 TYR A 446 -4.746 0.298 -5.060 1.00 52.13 H new ATOM 0 HD1 TYR A 446 -2.202 1.053 -6.361 1.00 4.25 H new ATOM 0 HD2 TYR A 446 -5.338 3.495 -4.853 1.00 73.31 H new ATOM 0 HE1 TYR A 446 -0.597 2.862 -5.932 1.00 11.32 H new ATOM 0 HE2 TYR A 446 -3.746 5.304 -4.451 1.00 4.22 H new ATOM 0 HH TYR A 446 -1.419 5.986 -5.457 1.00 24.32 H new ATOM 705 N VAL A 447 -7.065 -0.566 -7.335 1.00 11.32 N ATOM 706 CA VAL A 447 -8.132 -1.562 -7.284 1.00 54.11 C ATOM 707 C VAL A 447 -7.938 -2.622 -8.375 1.00 55.34 C ATOM 708 O VAL A 447 -8.230 -3.806 -8.166 1.00 53.14 O ATOM 709 CB VAL A 447 -9.542 -0.904 -7.413 1.00 32.24 C ATOM 710 CG1 VAL A 447 -10.644 -1.946 -7.337 1.00 34.24 C ATOM 711 CG2 VAL A 447 -9.748 0.147 -6.336 1.00 75.53 C ATOM 0 H VAL A 447 -7.391 0.379 -7.540 1.00 11.32 H new ATOM 0 HA VAL A 447 -8.078 -2.047 -6.309 1.00 54.11 H new ATOM 0 HB VAL A 447 -9.590 -0.422 -8.389 1.00 32.24 H new ATOM 0 HG11 VAL A 447 -11.614 -1.457 -7.430 1.00 34.24 H new ATOM 0 HG12 VAL A 447 -10.521 -2.665 -8.147 1.00 34.24 H new ATOM 0 HG13 VAL A 447 -10.589 -2.464 -6.380 1.00 34.24 H new ATOM 0 HG21 VAL A 447 -10.737 0.592 -6.446 1.00 75.53 H new ATOM 0 HG22 VAL A 447 -9.666 -0.318 -5.354 1.00 75.53 H new ATOM 0 HG23 VAL A 447 -8.989 0.923 -6.435 1.00 75.53 H new ATOM 721 N LEU A 448 -7.378 -2.205 -9.508 1.00 12.34 N ATOM 722 CA LEU A 448 -7.135 -3.088 -10.614 1.00 40.43 C ATOM 723 C LEU A 448 -6.147 -4.161 -10.205 1.00 41.45 C ATOM 724 O LEU A 448 -6.258 -5.315 -10.603 1.00 34.20 O ATOM 725 CB LEU A 448 -6.572 -2.287 -11.787 1.00 32.25 C ATOM 726 CG LEU A 448 -6.177 -3.094 -13.008 1.00 42.35 C ATOM 727 CD1 LEU A 448 -7.387 -3.768 -13.645 1.00 23.11 C ATOM 728 CD2 LEU A 448 -5.419 -2.244 -14.008 1.00 63.02 C ATOM 0 H LEU A 448 -7.085 -1.242 -9.672 1.00 12.34 H new ATOM 0 HA LEU A 448 -8.070 -3.561 -10.913 1.00 40.43 H new ATOM 0 HB2 LEU A 448 -7.315 -1.548 -12.088 1.00 32.25 H new ATOM 0 HB3 LEU A 448 -5.697 -1.737 -11.440 1.00 32.25 H new ATOM 0 HG LEU A 448 -5.504 -3.885 -12.677 1.00 42.35 H new ATOM 0 HD11 LEU A 448 -7.068 -4.338 -14.518 1.00 23.11 H new ATOM 0 HD12 LEU A 448 -7.852 -4.439 -12.923 1.00 23.11 H new ATOM 0 HD13 LEU A 448 -8.107 -3.009 -13.951 1.00 23.11 H new ATOM 0 HD21 LEU A 448 -5.150 -2.852 -14.872 1.00 63.02 H new ATOM 0 HD22 LEU A 448 -6.047 -1.414 -14.330 1.00 63.02 H new ATOM 0 HD23 LEU A 448 -4.514 -1.855 -13.542 1.00 63.02 H new ATOM 740 N LEU A 449 -5.218 -3.774 -9.365 1.00 3.41 N ATOM 741 CA LEU A 449 -4.176 -4.657 -8.904 1.00 24.53 C ATOM 742 C LEU A 449 -4.756 -5.680 -7.941 1.00 42.35 C ATOM 743 O LEU A 449 -4.302 -6.831 -7.880 1.00 21.35 O ATOM 744 CB LEU A 449 -3.073 -3.850 -8.217 1.00 50.33 C ATOM 745 CG LEU A 449 -2.546 -2.644 -9.001 1.00 2.35 C ATOM 746 CD1 LEU A 449 -1.388 -1.986 -8.287 1.00 43.23 C ATOM 747 CD2 LEU A 449 -2.189 -3.018 -10.428 1.00 41.10 C ATOM 0 H LEU A 449 -5.164 -2.831 -8.980 1.00 3.41 H new ATOM 0 HA LEU A 449 -3.747 -5.180 -9.758 1.00 24.53 H new ATOM 0 HB2 LEU A 449 -3.450 -3.499 -7.256 1.00 50.33 H new ATOM 0 HB3 LEU A 449 -2.237 -4.517 -8.007 1.00 50.33 H new ATOM 0 HG LEU A 449 -3.351 -1.911 -9.055 1.00 2.35 H new ATOM 0 HD11 LEU A 449 -1.038 -1.134 -8.870 1.00 43.23 H new ATOM 0 HD12 LEU A 449 -1.713 -1.644 -7.304 1.00 43.23 H new ATOM 0 HD13 LEU A 449 -0.576 -2.704 -8.171 1.00 43.23 H new ATOM 0 HD21 LEU A 449 -1.819 -2.137 -10.953 1.00 41.10 H new ATOM 0 HD22 LEU A 449 -1.417 -3.787 -10.420 1.00 41.10 H new ATOM 0 HD23 LEU A 449 -3.075 -3.398 -10.937 1.00 41.10 H new ATOM 759 N GLY A 450 -5.771 -5.253 -7.200 1.00 73.03 N ATOM 760 CA GLY A 450 -6.419 -6.123 -6.257 1.00 71.31 C ATOM 761 C GLY A 450 -7.223 -7.193 -6.950 1.00 71.21 C ATOM 762 O GLY A 450 -7.055 -8.367 -6.673 1.00 44.25 O ATOM 0 H GLY A 450 -6.155 -4.309 -7.242 1.00 73.03 H new ATOM 0 HA2 GLY A 450 -5.670 -6.588 -5.616 1.00 71.31 H new ATOM 0 HA3 GLY A 450 -7.073 -5.537 -5.611 1.00 71.31 H new ATOM 766 N LEU A 451 -8.061 -6.790 -7.898 1.00 62.21 N ATOM 767 CA LEU A 451 -8.874 -7.749 -8.653 1.00 41.41 C ATOM 768 C LEU A 451 -8.026 -8.583 -9.591 1.00 14.40 C ATOM 769 O LEU A 451 -8.314 -9.763 -9.818 1.00 55.00 O ATOM 770 CB LEU A 451 -10.052 -7.091 -9.404 1.00 61.02 C ATOM 771 CG LEU A 451 -11.262 -6.629 -8.561 1.00 12.34 C ATOM 772 CD1 LEU A 451 -10.893 -5.571 -7.540 1.00 23.13 C ATOM 773 CD2 LEU A 451 -12.379 -6.134 -9.462 1.00 50.31 C ATOM 0 H LEU A 451 -8.198 -5.815 -8.164 1.00 62.21 H new ATOM 0 HA LEU A 451 -9.315 -8.414 -7.911 1.00 41.41 H new ATOM 0 HB2 LEU A 451 -9.667 -6.226 -9.943 1.00 61.02 H new ATOM 0 HB3 LEU A 451 -10.412 -7.798 -10.152 1.00 61.02 H new ATOM 0 HG LEU A 451 -11.610 -7.498 -8.003 1.00 12.34 H new ATOM 0 HD11 LEU A 451 -11.781 -5.284 -6.977 1.00 23.13 H new ATOM 0 HD12 LEU A 451 -10.143 -5.970 -6.857 1.00 23.13 H new ATOM 0 HD13 LEU A 451 -10.489 -4.697 -8.051 1.00 23.13 H new ATOM 0 HD21 LEU A 451 -13.223 -5.813 -8.852 1.00 50.31 H new ATOM 0 HD22 LEU A 451 -12.021 -5.294 -10.057 1.00 50.31 H new ATOM 0 HD23 LEU A 451 -12.696 -6.939 -10.125 1.00 50.31 H new ATOM 785 N GLY A 452 -6.980 -7.973 -10.125 1.00 31.42 N ATOM 786 CA GLY A 452 -6.060 -8.682 -10.980 1.00 61.14 C ATOM 787 C GLY A 452 -5.379 -9.807 -10.234 1.00 23.41 C ATOM 788 O GLY A 452 -5.208 -10.908 -10.771 1.00 2.24 O ATOM 0 H GLY A 452 -6.753 -6.990 -9.978 1.00 31.42 H new ATOM 0 HA2 GLY A 452 -6.595 -9.084 -11.841 1.00 61.14 H new ATOM 0 HA3 GLY A 452 -5.310 -7.991 -11.365 1.00 61.14 H new ATOM 792 N GLY A 453 -4.993 -9.534 -8.996 1.00 14.50 N ATOM 793 CA GLY A 453 -4.381 -10.542 -8.175 1.00 35.04 C ATOM 794 C GLY A 453 -5.396 -11.539 -7.649 1.00 50.13 C ATOM 795 O GLY A 453 -5.142 -12.750 -7.630 1.00 13.12 O ATOM 0 H GLY A 453 -5.097 -8.623 -8.549 1.00 14.50 H new ATOM 0 HA2 GLY A 453 -3.621 -11.068 -8.753 1.00 35.04 H new ATOM 0 HA3 GLY A 453 -3.871 -10.067 -7.337 1.00 35.04 H new ATOM 799 N LEU A 454 -6.550 -11.028 -7.238 1.00 25.12 N ATOM 800 CA LEU A 454 -7.643 -11.828 -6.676 1.00 52.22 C ATOM 801 C LEU A 454 -8.112 -12.898 -7.659 1.00 13.22 C ATOM 802 O LEU A 454 -8.528 -13.976 -7.250 1.00 21.24 O ATOM 803 CB LEU A 454 -8.822 -10.925 -6.290 1.00 33.45 C ATOM 804 CG LEU A 454 -10.013 -11.605 -5.603 1.00 74.22 C ATOM 805 CD1 LEU A 454 -9.604 -12.195 -4.260 1.00 74.15 C ATOM 806 CD2 LEU A 454 -11.159 -10.626 -5.434 1.00 62.15 C ATOM 0 H LEU A 454 -6.761 -10.031 -7.284 1.00 25.12 H new ATOM 0 HA LEU A 454 -7.263 -12.326 -5.784 1.00 52.22 H new ATOM 0 HB2 LEU A 454 -8.449 -10.142 -5.629 1.00 33.45 H new ATOM 0 HB3 LEU A 454 -9.185 -10.434 -7.193 1.00 33.45 H new ATOM 0 HG LEU A 454 -10.351 -12.423 -6.239 1.00 74.22 H new ATOM 0 HD11 LEU A 454 -10.467 -12.671 -3.794 1.00 74.15 H new ATOM 0 HD12 LEU A 454 -8.819 -12.936 -4.412 1.00 74.15 H new ATOM 0 HD13 LEU A 454 -9.233 -11.401 -3.612 1.00 74.15 H new ATOM 0 HD21 LEU A 454 -11.995 -11.126 -4.945 1.00 62.15 H new ATOM 0 HD22 LEU A 454 -10.832 -9.785 -4.823 1.00 62.15 H new ATOM 0 HD23 LEU A 454 -11.475 -10.263 -6.412 1.00 62.15 H new ATOM 818 N LEU A 455 -8.007 -12.597 -8.949 1.00 72.10 N ATOM 819 CA LEU A 455 -8.447 -13.491 -10.025 1.00 25.21 C ATOM 820 C LEU A 455 -7.743 -14.865 -9.953 1.00 63.03 C ATOM 821 O LEU A 455 -8.319 -15.888 -10.336 1.00 33.22 O ATOM 822 CB LEU A 455 -8.172 -12.823 -11.385 1.00 51.11 C ATOM 823 CG LEU A 455 -8.632 -13.584 -12.634 1.00 75.13 C ATOM 824 CD1 LEU A 455 -10.143 -13.741 -12.646 1.00 62.30 C ATOM 825 CD2 LEU A 455 -8.153 -12.882 -13.894 1.00 51.22 C ATOM 0 H LEU A 455 -7.611 -11.719 -9.285 1.00 72.10 H new ATOM 0 HA LEU A 455 -9.516 -13.668 -9.907 1.00 25.21 H new ATOM 0 HB2 LEU A 455 -8.653 -11.845 -11.387 1.00 51.11 H new ATOM 0 HB3 LEU A 455 -7.099 -12.651 -11.468 1.00 51.11 H new ATOM 0 HG LEU A 455 -8.190 -14.580 -12.608 1.00 75.13 H new ATOM 0 HD11 LEU A 455 -10.445 -14.284 -13.542 1.00 62.30 H new ATOM 0 HD12 LEU A 455 -10.458 -14.295 -11.762 1.00 62.30 H new ATOM 0 HD13 LEU A 455 -10.611 -12.757 -12.643 1.00 62.30 H new ATOM 0 HD21 LEU A 455 -8.489 -13.437 -14.770 1.00 51.22 H new ATOM 0 HD22 LEU A 455 -8.562 -11.872 -13.925 1.00 51.22 H new ATOM 0 HD23 LEU A 455 -7.064 -12.833 -13.892 1.00 51.22 H new ATOM 837 N LEU A 456 -6.523 -14.879 -9.436 1.00 32.41 N ATOM 838 CA LEU A 456 -5.763 -16.115 -9.278 1.00 41.14 C ATOM 839 C LEU A 456 -6.316 -16.930 -8.110 1.00 20.31 C ATOM 840 O LEU A 456 -6.303 -18.163 -8.122 1.00 25.34 O ATOM 841 CB LEU A 456 -4.274 -15.787 -9.044 1.00 41.53 C ATOM 842 CG LEU A 456 -3.323 -16.970 -8.817 1.00 32.03 C ATOM 843 CD1 LEU A 456 -3.318 -17.908 -10.009 1.00 3.14 C ATOM 844 CD2 LEU A 456 -1.923 -16.466 -8.543 1.00 41.41 C ATOM 0 H LEU A 456 -6.034 -14.043 -9.116 1.00 32.41 H new ATOM 0 HA LEU A 456 -5.856 -16.708 -10.188 1.00 41.14 H new ATOM 0 HB2 LEU A 456 -3.913 -15.223 -9.904 1.00 41.53 H new ATOM 0 HB3 LEU A 456 -4.205 -15.127 -8.179 1.00 41.53 H new ATOM 0 HG LEU A 456 -3.678 -17.529 -7.951 1.00 32.03 H new ATOM 0 HD11 LEU A 456 -2.635 -18.736 -9.818 1.00 3.14 H new ATOM 0 HD12 LEU A 456 -4.323 -18.297 -10.170 1.00 3.14 H new ATOM 0 HD13 LEU A 456 -2.992 -17.366 -10.897 1.00 3.14 H new ATOM 0 HD21 LEU A 456 -1.256 -17.313 -8.383 1.00 41.41 H new ATOM 0 HD22 LEU A 456 -1.573 -15.884 -9.395 1.00 41.41 H new ATOM 0 HD23 LEU A 456 -1.930 -15.837 -7.653 1.00 41.41 H new ATOM 856 N LEU A 457 -6.796 -16.235 -7.109 1.00 25.32 N ATOM 857 CA LEU A 457 -7.354 -16.855 -5.922 1.00 60.44 C ATOM 858 C LEU A 457 -8.750 -17.408 -6.176 1.00 60.12 C ATOM 859 O LEU A 457 -9.127 -18.407 -5.590 1.00 74.01 O ATOM 860 CB LEU A 457 -7.384 -15.882 -4.719 1.00 51.44 C ATOM 861 CG LEU A 457 -6.040 -15.482 -4.059 1.00 52.43 C ATOM 862 CD1 LEU A 457 -5.105 -14.772 -5.020 1.00 63.42 C ATOM 863 CD2 LEU A 457 -6.300 -14.608 -2.847 1.00 54.11 C ATOM 0 H LEU A 457 -6.813 -15.215 -7.090 1.00 25.32 H new ATOM 0 HA LEU A 457 -6.693 -17.685 -5.673 1.00 60.44 H new ATOM 0 HB2 LEU A 457 -7.879 -14.967 -5.045 1.00 51.44 H new ATOM 0 HB3 LEU A 457 -8.013 -16.327 -3.948 1.00 51.44 H new ATOM 0 HG LEU A 457 -5.545 -16.404 -3.754 1.00 52.43 H new ATOM 0 HD11 LEU A 457 -4.180 -14.515 -4.504 1.00 63.42 H new ATOM 0 HD12 LEU A 457 -4.882 -15.428 -5.861 1.00 63.42 H new ATOM 0 HD13 LEU A 457 -5.581 -13.862 -5.386 1.00 63.42 H new ATOM 0 HD21 LEU A 457 -5.351 -14.331 -2.388 1.00 54.11 H new ATOM 0 HD22 LEU A 457 -6.831 -13.707 -3.155 1.00 54.11 H new ATOM 0 HD23 LEU A 457 -6.905 -15.157 -2.126 1.00 54.11 H new ATOM 875 N VAL A 458 -9.493 -16.760 -7.079 1.00 72.23 N ATOM 876 CA VAL A 458 -10.913 -17.091 -7.368 1.00 21.35 C ATOM 877 C VAL A 458 -11.215 -18.616 -7.532 1.00 14.02 C ATOM 878 O VAL A 458 -12.119 -19.128 -6.850 1.00 64.23 O ATOM 879 CB VAL A 458 -11.486 -16.280 -8.577 1.00 63.22 C ATOM 880 CG1 VAL A 458 -12.930 -16.668 -8.853 1.00 11.20 C ATOM 881 CG2 VAL A 458 -11.406 -14.790 -8.303 1.00 35.24 C ATOM 0 H VAL A 458 -9.135 -15.986 -7.638 1.00 72.23 H new ATOM 0 HA VAL A 458 -11.437 -16.781 -6.464 1.00 21.35 H new ATOM 0 HB VAL A 458 -10.883 -16.517 -9.454 1.00 63.22 H new ATOM 0 HG11 VAL A 458 -13.307 -16.091 -9.698 1.00 11.20 H new ATOM 0 HG12 VAL A 458 -12.983 -17.731 -9.087 1.00 11.20 H new ATOM 0 HG13 VAL A 458 -13.537 -16.460 -7.972 1.00 11.20 H new ATOM 0 HG21 VAL A 458 -11.809 -14.241 -9.154 1.00 35.24 H new ATOM 0 HG22 VAL A 458 -11.986 -14.552 -7.411 1.00 35.24 H new ATOM 0 HG23 VAL A 458 -10.366 -14.504 -8.146 1.00 35.24 H new ATOM 891 N PRO A 459 -10.483 -19.377 -8.406 1.00 1.34 N ATOM 892 CA PRO A 459 -10.724 -20.820 -8.578 1.00 73.44 C ATOM 893 C PRO A 459 -10.574 -21.578 -7.255 1.00 3.35 C ATOM 894 O PRO A 459 -11.292 -22.547 -6.989 1.00 25.02 O ATOM 895 CB PRO A 459 -9.634 -21.267 -9.577 1.00 21.32 C ATOM 896 CG PRO A 459 -8.639 -20.157 -9.589 1.00 22.44 C ATOM 897 CD PRO A 459 -9.411 -18.907 -9.301 1.00 60.40 C ATOM 0 HA PRO A 459 -11.736 -21.025 -8.927 1.00 73.44 H new ATOM 0 HB2 PRO A 459 -9.174 -22.205 -9.265 1.00 21.32 H new ATOM 0 HB3 PRO A 459 -10.053 -21.432 -10.570 1.00 21.32 H new ATOM 0 HG2 PRO A 459 -7.865 -20.319 -8.839 1.00 22.44 H new ATOM 0 HG3 PRO A 459 -8.138 -20.092 -10.555 1.00 22.44 H new ATOM 0 HD2 PRO A 459 -8.789 -18.150 -8.823 1.00 60.40 H new ATOM 0 HD3 PRO A 459 -9.812 -18.462 -10.212 1.00 60.40 H new ATOM 905 N ILE A 460 -9.673 -21.094 -6.418 1.00 41.42 N ATOM 906 CA ILE A 460 -9.396 -21.705 -5.141 1.00 61.03 C ATOM 907 C ILE A 460 -10.440 -21.264 -4.114 1.00 71.50 C ATOM 908 O ILE A 460 -10.896 -22.061 -3.316 1.00 21.21 O ATOM 909 CB ILE A 460 -7.965 -21.352 -4.644 1.00 34.31 C ATOM 910 CG1 ILE A 460 -6.914 -21.786 -5.682 1.00 20.43 C ATOM 911 CG2 ILE A 460 -7.669 -21.987 -3.286 1.00 40.42 C ATOM 912 CD1 ILE A 460 -6.926 -23.270 -6.013 1.00 51.41 C ATOM 0 H ILE A 460 -9.114 -20.263 -6.611 1.00 41.42 H new ATOM 0 HA ILE A 460 -9.448 -22.787 -5.263 1.00 61.03 H new ATOM 0 HB ILE A 460 -7.914 -20.270 -4.521 1.00 34.31 H new ATOM 0 HG12 ILE A 460 -7.075 -21.221 -6.600 1.00 20.43 H new ATOM 0 HG13 ILE A 460 -5.925 -21.518 -5.312 1.00 20.43 H new ATOM 0 HG21 ILE A 460 -6.661 -21.719 -2.971 1.00 40.42 H new ATOM 0 HG22 ILE A 460 -8.388 -21.625 -2.551 1.00 40.42 H new ATOM 0 HG23 ILE A 460 -7.747 -23.071 -3.366 1.00 40.42 H new ATOM 0 HD11 ILE A 460 -6.154 -23.484 -6.752 1.00 51.41 H new ATOM 0 HD12 ILE A 460 -6.733 -23.846 -5.108 1.00 51.41 H new ATOM 0 HD13 ILE A 460 -7.900 -23.545 -6.417 1.00 51.41 H new ATOM 924 N ILE A 461 -10.842 -20.000 -4.173 1.00 41.14 N ATOM 925 CA ILE A 461 -11.858 -19.458 -3.258 1.00 60.41 C ATOM 926 C ILE A 461 -13.174 -20.234 -3.394 1.00 63.40 C ATOM 927 O ILE A 461 -13.881 -20.454 -2.415 1.00 33.44 O ATOM 928 CB ILE A 461 -12.111 -17.932 -3.491 1.00 72.30 C ATOM 929 CG1 ILE A 461 -10.827 -17.134 -3.230 1.00 41.44 C ATOM 930 CG2 ILE A 461 -13.248 -17.419 -2.597 1.00 24.54 C ATOM 931 CD1 ILE A 461 -10.967 -15.642 -3.466 1.00 70.33 C ATOM 0 H ILE A 461 -10.482 -19.323 -4.846 1.00 41.14 H new ATOM 0 HA ILE A 461 -11.471 -19.577 -2.246 1.00 60.41 H new ATOM 0 HB ILE A 461 -12.408 -17.792 -4.530 1.00 72.30 H new ATOM 0 HG12 ILE A 461 -10.512 -17.300 -2.200 1.00 41.44 H new ATOM 0 HG13 ILE A 461 -10.035 -17.520 -3.872 1.00 41.44 H new ATOM 0 HG21 ILE A 461 -13.403 -16.356 -2.779 1.00 24.54 H new ATOM 0 HG22 ILE A 461 -14.164 -17.963 -2.825 1.00 24.54 H new ATOM 0 HG23 ILE A 461 -12.986 -17.573 -1.550 1.00 24.54 H new ATOM 0 HD11 ILE A 461 -10.016 -15.150 -3.260 1.00 70.33 H new ATOM 0 HD12 ILE A 461 -11.251 -15.463 -4.503 1.00 70.33 H new ATOM 0 HD13 ILE A 461 -11.735 -15.240 -2.805 1.00 70.33 H new ATOM 943 N CYS A 462 -13.456 -20.699 -4.592 1.00 2.21 N ATOM 944 CA CYS A 462 -14.674 -21.451 -4.841 1.00 3.21 C ATOM 945 C CYS A 462 -14.560 -22.830 -4.186 1.00 21.21 C ATOM 946 O CYS A 462 -15.548 -23.408 -3.738 1.00 71.25 O ATOM 947 CB CYS A 462 -14.921 -21.569 -6.340 1.00 2.44 C ATOM 948 SG CYS A 462 -14.993 -19.973 -7.198 1.00 22.43 S ATOM 0 H CYS A 462 -12.861 -20.571 -5.411 1.00 2.21 H new ATOM 0 HA CYS A 462 -15.525 -20.929 -4.405 1.00 3.21 H new ATOM 0 HB2 CYS A 462 -14.129 -22.173 -6.783 1.00 2.44 H new ATOM 0 HB3 CYS A 462 -15.858 -22.101 -6.504 1.00 2.44 H new ATOM 0 HG CYS A 462 -13.804 -19.450 -7.242 1.00 22.43 H new ATOM 954 N GLN A 463 -13.330 -23.322 -4.090 1.00 11.53 N ATOM 955 CA GLN A 463 -13.058 -24.580 -3.426 1.00 2.21 C ATOM 956 C GLN A 463 -13.280 -24.379 -1.938 1.00 42.31 C ATOM 957 O GLN A 463 -13.796 -25.250 -1.238 1.00 23.41 O ATOM 958 CB GLN A 463 -11.621 -25.027 -3.672 1.00 25.03 C ATOM 959 CG GLN A 463 -11.223 -25.111 -5.135 1.00 12.13 C ATOM 960 CD GLN A 463 -12.150 -25.953 -5.982 1.00 61.33 C ATOM 961 OE1 GLN A 463 -12.772 -26.901 -5.512 1.00 64.30 O ATOM 962 NE2 GLN A 463 -12.238 -25.614 -7.237 1.00 2.03 N ATOM 0 H GLN A 463 -12.503 -22.860 -4.469 1.00 11.53 H new ATOM 0 HA GLN A 463 -13.721 -25.351 -3.819 1.00 2.21 H new ATOM 0 HB2 GLN A 463 -10.948 -24.335 -3.166 1.00 25.03 H new ATOM 0 HB3 GLN A 463 -11.476 -26.005 -3.214 1.00 25.03 H new ATOM 0 HG2 GLN A 463 -11.186 -24.103 -5.548 1.00 12.13 H new ATOM 0 HG3 GLN A 463 -10.215 -25.520 -5.203 1.00 12.13 H new ATOM 0 HE21 GLN A 463 -11.705 -24.819 -7.589 1.00 2.03 H new ATOM 0 HE22 GLN A 463 -12.840 -26.143 -7.867 1.00 2.03 H new ATOM 971 N LEU A 464 -12.893 -23.205 -1.454 1.00 34.41 N ATOM 972 CA LEU A 464 -13.153 -22.819 -0.078 1.00 23.22 C ATOM 973 C LEU A 464 -14.629 -22.723 0.178 1.00 32.22 C ATOM 974 O LEU A 464 -15.072 -23.070 1.229 1.00 10.35 O ATOM 975 CB LEU A 464 -12.451 -21.513 0.327 1.00 5.33 C ATOM 976 CG LEU A 464 -10.964 -21.595 0.715 1.00 41.45 C ATOM 977 CD1 LEU A 464 -10.123 -22.198 -0.379 1.00 22.04 C ATOM 978 CD2 LEU A 464 -10.451 -20.219 1.086 1.00 53.20 C ATOM 0 H LEU A 464 -12.395 -22.502 -2.000 1.00 34.41 H new ATOM 0 HA LEU A 464 -12.731 -23.607 0.546 1.00 23.22 H new ATOM 0 HB2 LEU A 464 -12.544 -20.811 -0.501 1.00 5.33 H new ATOM 0 HB3 LEU A 464 -12.995 -21.086 1.170 1.00 5.33 H new ATOM 0 HG LEU A 464 -10.883 -22.255 1.578 1.00 41.45 H new ATOM 0 HD11 LEU A 464 -9.082 -22.235 -0.059 1.00 22.04 H new ATOM 0 HD12 LEU A 464 -10.473 -23.208 -0.592 1.00 22.04 H new ATOM 0 HD13 LEU A 464 -10.205 -21.588 -1.279 1.00 22.04 H new ATOM 0 HD21 LEU A 464 -9.398 -20.285 1.359 1.00 53.20 H new ATOM 0 HD22 LEU A 464 -10.564 -19.547 0.235 1.00 53.20 H new ATOM 0 HD23 LEU A 464 -11.022 -19.833 1.931 1.00 53.20 H new ATOM 990 N ARG A 465 -15.391 -22.290 -0.817 1.00 2.03 N ATOM 991 CA ARG A 465 -16.849 -22.196 -0.677 1.00 11.52 C ATOM 992 C ARG A 465 -17.479 -23.586 -0.566 1.00 73.14 C ATOM 993 O ARG A 465 -18.626 -23.729 -0.165 1.00 34.12 O ATOM 994 CB ARG A 465 -17.492 -21.419 -1.835 1.00 73.11 C ATOM 995 CG ARG A 465 -16.988 -19.993 -2.009 1.00 62.11 C ATOM 996 CD ARG A 465 -17.100 -19.201 -0.720 1.00 32.13 C ATOM 997 NE ARG A 465 -16.713 -17.800 -0.906 1.00 64.40 N ATOM 998 CZ ARG A 465 -16.462 -16.921 0.083 1.00 4.12 C ATOM 999 NH1 ARG A 465 -16.595 -17.274 1.369 1.00 24.25 N ATOM 1000 NH2 ARG A 465 -16.110 -15.677 -0.221 1.00 4.02 N ATOM 0 H ARG A 465 -15.033 -21.999 -1.727 1.00 2.03 H new ATOM 0 HA ARG A 465 -17.042 -21.644 0.243 1.00 11.52 H new ATOM 0 HB2 ARG A 465 -17.317 -21.966 -2.761 1.00 73.11 H new ATOM 0 HB3 ARG A 465 -18.571 -21.391 -1.680 1.00 73.11 H new ATOM 0 HG2 ARG A 465 -15.949 -20.011 -2.337 1.00 62.11 H new ATOM 0 HG3 ARG A 465 -17.561 -19.497 -2.793 1.00 62.11 H new ATOM 0 HD2 ARG A 465 -18.125 -19.249 -0.352 1.00 32.13 H new ATOM 0 HD3 ARG A 465 -16.466 -19.655 0.042 1.00 32.13 H new ATOM 0 HE ARG A 465 -16.626 -17.462 -1.865 1.00 64.40 H new ATOM 0 HH11 ARG A 465 -16.890 -18.220 1.610 1.00 24.25 H new ATOM 0 HH12 ARG A 465 -16.401 -16.597 2.106 1.00 24.25 H new ATOM 0 HH21 ARG A 465 -16.031 -15.393 -1.198 1.00 4.02 H new ATOM 0 HH22 ARG A 465 -15.918 -15.005 0.522 1.00 4.02 H new ATOM 1014 N SER A 466 -16.728 -24.595 -0.935 1.00 63.35 N ATOM 1015 CA SER A 466 -17.167 -25.957 -0.812 1.00 54.13 C ATOM 1016 C SER A 466 -16.794 -26.485 0.585 1.00 14.44 C ATOM 1017 O SER A 466 -17.562 -27.226 1.207 1.00 72.01 O ATOM 1018 CB SER A 466 -16.532 -26.811 -1.921 1.00 2.31 C ATOM 1019 OG SER A 466 -16.998 -28.143 -1.889 1.00 23.32 O ATOM 0 H SER A 466 -15.793 -24.491 -1.330 1.00 63.35 H new ATOM 0 HA SER A 466 -18.250 -26.013 -0.925 1.00 54.13 H new ATOM 0 HB2 SER A 466 -16.757 -26.371 -2.892 1.00 2.31 H new ATOM 0 HB3 SER A 466 -15.448 -26.803 -1.810 1.00 2.31 H new ATOM 0 HG SER A 466 -16.574 -28.655 -2.609 1.00 23.32 H new ATOM 1025 N GLN A 467 -15.622 -26.064 1.077 1.00 1.35 N ATOM 1026 CA GLN A 467 -15.130 -26.460 2.403 1.00 4.34 C ATOM 1027 C GLN A 467 -15.887 -25.711 3.503 1.00 22.23 C ATOM 1028 O GLN A 467 -16.378 -26.303 4.468 1.00 22.21 O ATOM 1029 CB GLN A 467 -13.635 -26.172 2.511 1.00 43.13 C ATOM 1030 CG GLN A 467 -12.772 -26.949 1.535 1.00 63.44 C ATOM 1031 CD GLN A 467 -11.310 -26.593 1.668 1.00 4.44 C ATOM 1032 OE1 GLN A 467 -10.579 -27.196 2.448 1.00 55.24 O ATOM 1033 NE2 GLN A 467 -10.867 -25.627 0.906 1.00 45.11 N ATOM 0 H GLN A 467 -14.991 -25.443 0.571 1.00 1.35 H new ATOM 0 HA GLN A 467 -15.299 -27.529 2.531 1.00 4.34 H new ATOM 0 HB2 GLN A 467 -13.471 -25.106 2.352 1.00 43.13 H new ATOM 0 HB3 GLN A 467 -13.307 -26.398 3.526 1.00 43.13 H new ATOM 0 HG2 GLN A 467 -12.902 -28.018 1.706 1.00 63.44 H new ATOM 0 HG3 GLN A 467 -13.104 -26.747 0.517 1.00 63.44 H new ATOM 0 HE21 GLN A 467 -11.503 -25.147 0.269 1.00 45.11 H new ATOM 0 HE22 GLN A 467 -9.885 -25.353 0.949 1.00 45.11 H new ATOM 1042 N GLU A 468 -15.987 -24.411 3.323 1.00 42.21 N ATOM 1043 CA GLU A 468 -16.712 -23.504 4.212 1.00 12.34 C ATOM 1044 C GLU A 468 -18.209 -23.796 4.083 1.00 71.13 C ATOM 1045 O GLU A 468 -19.008 -23.515 4.992 1.00 13.01 O ATOM 1046 CB GLU A 468 -16.414 -22.069 3.749 1.00 3.33 C ATOM 1047 CG GLU A 468 -17.051 -20.953 4.544 1.00 74.32 C ATOM 1048 CD GLU A 468 -16.790 -19.609 3.904 1.00 61.31 C ATOM 1049 OE1 GLU A 468 -17.548 -19.226 2.981 1.00 33.31 O ATOM 1050 OE2 GLU A 468 -15.832 -18.911 4.298 1.00 31.35 O ATOM 0 H GLU A 468 -15.555 -23.933 2.532 1.00 42.21 H new ATOM 0 HA GLU A 468 -16.410 -23.632 5.252 1.00 12.34 H new ATOM 0 HB2 GLU A 468 -15.334 -21.924 3.764 1.00 3.33 H new ATOM 0 HB3 GLU A 468 -16.734 -21.973 2.711 1.00 3.33 H new ATOM 0 HG2 GLU A 468 -18.125 -21.122 4.617 1.00 74.32 H new ATOM 0 HG3 GLU A 468 -16.658 -20.957 5.561 1.00 74.32 H new ATOM 1057 N LYS A 469 -18.547 -24.410 2.950 1.00 73.42 N ATOM 1058 CA LYS A 469 -19.893 -24.780 2.562 1.00 42.24 C ATOM 1059 C LYS A 469 -20.781 -23.597 2.271 1.00 63.42 C ATOM 1060 O LYS A 469 -20.425 -22.444 2.514 1.00 40.35 O ATOM 1061 CB LYS A 469 -20.568 -25.754 3.544 1.00 71.14 C ATOM 1062 CG LYS A 469 -19.895 -27.085 3.626 1.00 74.44 C ATOM 1063 CD LYS A 469 -20.684 -28.045 4.480 1.00 75.31 C ATOM 1064 CE LYS A 469 -20.019 -29.380 4.463 1.00 52.23 C ATOM 1065 NZ LYS A 469 -20.775 -30.416 5.206 1.00 41.53 N ATOM 0 H LYS A 469 -17.852 -24.672 2.250 1.00 73.42 H new ATOM 0 HA LYS A 469 -19.763 -25.317 1.622 1.00 42.24 H new ATOM 0 HB2 LYS A 469 -20.584 -25.303 4.536 1.00 71.14 H new ATOM 0 HB3 LYS A 469 -21.605 -25.899 3.243 1.00 71.14 H new ATOM 0 HG2 LYS A 469 -19.777 -27.498 2.624 1.00 74.44 H new ATOM 0 HG3 LYS A 469 -18.894 -26.964 4.040 1.00 74.44 H new ATOM 0 HD2 LYS A 469 -20.749 -27.671 5.502 1.00 75.31 H new ATOM 0 HD3 LYS A 469 -21.704 -28.129 4.105 1.00 75.31 H new ATOM 0 HE2 LYS A 469 -19.892 -29.703 3.430 1.00 52.23 H new ATOM 0 HE3 LYS A 469 -19.022 -29.288 4.893 1.00 52.23 H new ATOM 0 HZ1 LYS A 469 -20.263 -31.320 5.158 1.00 41.53 H new ATOM 0 HZ2 LYS A 469 -20.875 -30.127 6.200 1.00 41.53 H new ATOM 0 HZ3 LYS A 469 -21.718 -30.529 4.782 1.00 41.53 H new ATOM 1079 N CYS A 470 -21.904 -23.892 1.713 1.00 33.51 N ATOM 1080 CA CYS A 470 -22.925 -22.935 1.408 1.00 72.00 C ATOM 1081 C CYS A 470 -24.236 -23.625 1.678 1.00 40.43 C ATOM 1082 O CYS A 470 -24.229 -24.841 1.952 1.00 33.22 O ATOM 1083 CB CYS A 470 -22.840 -22.506 -0.065 1.00 3.31 C ATOM 1084 SG CYS A 470 -21.256 -21.761 -0.535 1.00 40.41 S ATOM 0 H CYS A 470 -22.152 -24.844 1.444 1.00 33.51 H new ATOM 0 HA CYS A 470 -22.816 -22.033 2.011 1.00 72.00 H new ATOM 0 HB2 CYS A 470 -23.020 -23.377 -0.696 1.00 3.31 H new ATOM 0 HB3 CYS A 470 -23.639 -21.793 -0.270 1.00 3.31 H new ATOM 0 HG CYS A 470 -20.294 -22.606 -0.307 1.00 40.41 H new ATOM 1090 N PHE A 471 -25.348 -22.881 1.635 1.00 50.41 N ATOM 1091 CA PHE A 471 -26.684 -23.449 1.841 1.00 54.03 C ATOM 1092 C PHE A 471 -26.820 -23.933 3.315 1.00 53.05 C ATOM 1093 O PHE A 471 -27.631 -24.801 3.639 1.00 13.12 O ATOM 1094 CB PHE A 471 -26.893 -24.601 0.805 1.00 21.12 C ATOM 1095 CG PHE A 471 -28.263 -25.208 0.741 1.00 54.35 C ATOM 1096 CD1 PHE A 471 -29.306 -24.514 0.173 1.00 54.01 C ATOM 1097 CD2 PHE A 471 -28.496 -26.485 1.225 1.00 64.10 C ATOM 1098 CE1 PHE A 471 -30.559 -25.071 0.089 1.00 13.22 C ATOM 1099 CE2 PHE A 471 -29.749 -27.048 1.147 1.00 62.41 C ATOM 1100 CZ PHE A 471 -30.783 -26.339 0.579 1.00 15.35 C ATOM 0 H PHE A 471 -25.347 -21.876 1.458 1.00 50.41 H new ATOM 0 HA PHE A 471 -27.463 -22.704 1.679 1.00 54.03 H new ATOM 0 HB2 PHE A 471 -26.644 -24.218 -0.185 1.00 21.12 H new ATOM 0 HB3 PHE A 471 -26.179 -25.394 1.029 1.00 21.12 H new ATOM 0 HD1 PHE A 471 -29.138 -23.519 -0.212 1.00 54.01 H new ATOM 0 HD2 PHE A 471 -27.686 -27.045 1.668 1.00 64.10 H new ATOM 0 HE1 PHE A 471 -31.368 -24.515 -0.361 1.00 13.22 H new ATOM 0 HE2 PHE A 471 -29.921 -28.043 1.530 1.00 62.41 H new ATOM 0 HZ PHE A 471 -31.769 -26.776 0.518 1.00 15.35 H new ATOM 1110 N LEU A 472 -26.032 -23.311 4.215 1.00 24.13 N ATOM 1111 CA LEU A 472 -26.057 -23.676 5.645 1.00 64.23 C ATOM 1112 C LEU A 472 -27.430 -23.437 6.230 1.00 42.12 C ATOM 1113 O LEU A 472 -27.982 -24.290 6.925 1.00 12.51 O ATOM 1114 CB LEU A 472 -25.013 -22.897 6.496 1.00 14.24 C ATOM 1115 CG LEU A 472 -23.513 -23.158 6.248 1.00 11.52 C ATOM 1116 CD1 LEU A 472 -23.178 -24.634 6.360 1.00 54.44 C ATOM 1117 CD2 LEU A 472 -23.035 -22.573 4.938 1.00 24.31 C ATOM 0 H LEU A 472 -25.379 -22.563 3.981 1.00 24.13 H new ATOM 0 HA LEU A 472 -25.799 -24.734 5.686 1.00 64.23 H new ATOM 0 HB2 LEU A 472 -25.193 -21.832 6.346 1.00 14.24 H new ATOM 0 HB3 LEU A 472 -25.217 -23.110 7.545 1.00 14.24 H new ATOM 0 HG LEU A 472 -22.969 -22.638 7.037 1.00 11.52 H new ATOM 0 HD11 LEU A 472 -22.113 -24.780 6.179 1.00 54.44 H new ATOM 0 HD12 LEU A 472 -23.429 -24.989 7.360 1.00 54.44 H new ATOM 0 HD13 LEU A 472 -23.752 -25.194 5.622 1.00 54.44 H new ATOM 0 HD21 LEU A 472 -21.973 -22.784 4.811 1.00 24.31 H new ATOM 0 HD22 LEU A 472 -23.594 -23.018 4.115 1.00 24.31 H new ATOM 0 HD23 LEU A 472 -23.192 -21.494 4.942 1.00 24.31 H new ATOM 1129 N PHE A 473 -27.990 -22.305 5.916 1.00 14.34 N ATOM 1130 CA PHE A 473 -29.301 -21.963 6.402 1.00 61.02 C ATOM 1131 C PHE A 473 -30.245 -21.670 5.254 1.00 53.51 C ATOM 1132 O PHE A 473 -31.430 -21.988 5.330 1.00 54.12 O ATOM 1133 CB PHE A 473 -29.241 -20.806 7.420 1.00 34.42 C ATOM 1134 CG PHE A 473 -28.566 -19.544 6.931 1.00 75.34 C ATOM 1135 CD1 PHE A 473 -29.296 -18.542 6.319 1.00 25.53 C ATOM 1136 CD2 PHE A 473 -27.201 -19.363 7.096 1.00 23.10 C ATOM 1137 CE1 PHE A 473 -28.681 -17.391 5.881 1.00 71.24 C ATOM 1138 CE2 PHE A 473 -26.583 -18.210 6.656 1.00 44.12 C ATOM 1139 CZ PHE A 473 -27.326 -17.224 6.048 1.00 44.12 C ATOM 0 H PHE A 473 -27.558 -21.597 5.322 1.00 14.34 H new ATOM 0 HA PHE A 473 -29.700 -22.826 6.934 1.00 61.02 H new ATOM 0 HB2 PHE A 473 -30.258 -20.559 7.724 1.00 34.42 H new ATOM 0 HB3 PHE A 473 -28.718 -21.155 8.311 1.00 34.42 H new ATOM 0 HD1 PHE A 473 -30.360 -18.664 6.183 1.00 25.53 H new ATOM 0 HD2 PHE A 473 -26.615 -20.133 7.574 1.00 23.10 H new ATOM 0 HE1 PHE A 473 -29.264 -16.617 5.405 1.00 71.24 H new ATOM 0 HE2 PHE A 473 -25.519 -18.082 6.789 1.00 44.12 H new ATOM 0 HZ PHE A 473 -26.846 -16.320 5.702 1.00 44.12 H new ATOM 1149 N TRP A 474 -29.693 -21.089 4.192 1.00 35.14 N ATOM 1150 CA TRP A 474 -30.412 -20.747 2.971 1.00 52.51 C ATOM 1151 C TRP A 474 -31.579 -19.793 3.227 1.00 55.22 C ATOM 1152 O TRP A 474 -32.681 -20.205 3.607 1.00 32.24 O ATOM 1153 CB TRP A 474 -30.856 -21.998 2.195 1.00 22.11 C ATOM 1154 CG TRP A 474 -31.546 -21.690 0.898 1.00 2.43 C ATOM 1155 CD1 TRP A 474 -32.867 -21.852 0.612 1.00 1.14 C ATOM 1156 CD2 TRP A 474 -30.942 -21.148 -0.284 1.00 22.41 C ATOM 1157 NE1 TRP A 474 -33.125 -21.453 -0.673 1.00 2.11 N ATOM 1158 CE2 TRP A 474 -31.958 -21.017 -1.246 1.00 14.15 C ATOM 1159 CE3 TRP A 474 -29.637 -20.764 -0.619 1.00 61.02 C ATOM 1160 CZ2 TRP A 474 -31.713 -20.516 -2.519 1.00 44.01 C ATOM 1161 CZ3 TRP A 474 -29.399 -20.268 -1.882 1.00 72.03 C ATOM 1162 CH2 TRP A 474 -30.432 -20.148 -2.819 1.00 53.42 C ATOM 0 H TRP A 474 -28.705 -20.837 4.158 1.00 35.14 H new ATOM 0 HA TRP A 474 -29.705 -20.210 2.338 1.00 52.51 H new ATOM 0 HB2 TRP A 474 -29.983 -22.619 1.993 1.00 22.11 H new ATOM 0 HB3 TRP A 474 -31.526 -22.585 2.823 1.00 22.11 H new ATOM 0 HD1 TRP A 474 -33.605 -22.239 1.299 1.00 1.14 H new ATOM 0 HE1 TRP A 474 -34.037 -21.476 -1.129 1.00 2.11 H new ATOM 0 HE3 TRP A 474 -28.834 -20.855 0.098 1.00 61.02 H new ATOM 0 HZ2 TRP A 474 -32.507 -20.421 -3.245 1.00 44.01 H new ATOM 0 HZ3 TRP A 474 -28.398 -19.967 -2.154 1.00 72.03 H new ATOM 0 HH2 TRP A 474 -30.211 -19.756 -3.801 1.00 53.42 H new ATOM 1173 N SER A 475 -31.324 -18.533 3.044 1.00 0.30 N ATOM 1174 CA SER A 475 -32.318 -17.528 3.225 1.00 55.20 C ATOM 1175 C SER A 475 -31.965 -16.364 2.305 1.00 63.33 C ATOM 1176 O SER A 475 -31.282 -15.434 2.743 1.00 36.67 O ATOM 1177 CB SER A 475 -32.365 -17.096 4.717 1.00 35.41 C ATOM 1178 OG SER A 475 -33.442 -16.200 4.996 1.00 34.34 O ATOM 1179 OXT SER A 475 -32.329 -16.416 1.113 1.00 36.67 O ATOM 0 H SER A 475 -30.412 -18.174 2.763 1.00 0.30 H new ATOM 0 HA SER A 475 -33.311 -17.899 2.971 1.00 55.20 H new ATOM 0 HB2 SER A 475 -32.462 -17.982 5.345 1.00 35.41 H new ATOM 0 HB3 SER A 475 -31.422 -16.619 4.983 1.00 35.41 H new ATOM 0 HG SER A 475 -33.430 -15.959 5.946 1.00 34.34 H new TER 1185 SER A 475