USER MOD reduce.3.24.130724 H: found=0, std=0, add=604, rem=0, adj=15 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 428 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 429 THR OG1 : rot 180:sc= 0 USER MOD Single : A 404 SER OG : rot 180:sc= 0.0139 USER MOD Single : A 405 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0413) USER MOD Single : A 418 GLN : amide:sc= -0.618 K(o=-0.62,f=-1.3) USER MOD Single : A 419 SER OG : rot 180:sc= 0 USER MOD Single : A 422 MET CE :methyl -115:sc=-0.000101 (180deg=-1.28) USER MOD Single : A 425 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 431 TYR OH : rot 180:sc= 0 USER MOD Single : A 432 THR OG1 : rot 180:sc= 0 USER MOD Single : A 433 GLN : amide:sc= -1.96! C(o=-2!,f=-3.3!) USER MOD Single : A 437 MET CE :methyl -157:sc= -0.337 (180deg=-1.2) USER MOD Single : A 439 GLN : amide:sc= -0.971 X(o=-0.97,f=-0.54) USER MOD Single : A 442 HIS : no HD1:sc= 0 X(o=0,f=-0.0074) USER MOD Single : A 443 TYR OH : rot 180:sc= 0 USER MOD Single : A 445 GLN : amide:sc= -0.0166 K(o=-0.017,f=-0.6) USER MOD Single : A 446 TYR OH : rot 180:sc= 0 USER MOD Single : A 462 CYS SG : rot 180:sc= 0 USER MOD Single : A 463 GLN : amide:sc= -0.621 K(o=-0.62,f=-0.03) USER MOD Single : A 466 SER OG : rot 180:sc= 0 USER MOD Single : A 467 GLN : amide:sc= -0.133 X(o=-0.13,f=-0.23) USER MOD Single : A 469 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 470 CYS SG : rot 140:sc= -0.792 USER MOD Single : A 475 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 403 18.400 27.776 14.779 1.00 13.00 N ATOM 2 CA GLY A 403 18.438 29.152 15.241 1.00 45.03 C ATOM 3 C GLY A 403 17.249 29.906 14.722 1.00 14.20 C ATOM 4 O GLY A 403 16.381 29.317 14.084 1.00 25.33 O ATOM 0 HA2 GLY A 403 18.446 29.177 16.331 1.00 45.03 H new ATOM 0 HA3 GLY A 403 19.357 29.631 14.904 1.00 45.03 H new ATOM 10 N SER A 404 17.213 31.189 14.963 1.00 13.41 N ATOM 11 CA SER A 404 16.098 32.013 14.564 1.00 14.04 C ATOM 12 C SER A 404 16.314 32.630 13.180 1.00 4.01 C ATOM 13 O SER A 404 15.387 33.148 12.570 1.00 54.13 O ATOM 14 CB SER A 404 15.888 33.100 15.619 1.00 72.52 C ATOM 15 OG SER A 404 17.106 33.812 15.855 1.00 42.21 O ATOM 0 H SER A 404 17.957 31.696 15.443 1.00 13.41 H new ATOM 0 HA SER A 404 15.206 31.390 14.493 1.00 14.04 H new ATOM 0 HB2 SER A 404 15.114 33.792 15.287 1.00 72.52 H new ATOM 0 HB3 SER A 404 15.537 32.650 16.548 1.00 72.52 H new ATOM 0 HG SER A 404 16.954 34.505 16.531 1.00 42.21 H new ATOM 21 N LYS A 405 17.532 32.543 12.680 1.00 52.03 N ATOM 22 CA LYS A 405 17.893 33.172 11.418 1.00 51.12 C ATOM 23 C LYS A 405 17.214 32.489 10.218 1.00 14.13 C ATOM 24 O LYS A 405 16.906 33.139 9.222 1.00 21.15 O ATOM 25 CB LYS A 405 19.420 33.169 11.253 1.00 74.53 C ATOM 26 CG LYS A 405 19.949 33.928 10.045 1.00 4.51 C ATOM 27 CD LYS A 405 19.586 35.402 10.109 1.00 22.54 C ATOM 28 CE LYS A 405 20.173 36.097 11.332 1.00 64.44 C ATOM 29 NZ LYS A 405 21.653 36.109 11.325 1.00 34.41 N ATOM 0 H LYS A 405 18.296 32.039 13.131 1.00 52.03 H new ATOM 0 HA LYS A 405 17.535 34.201 11.442 1.00 51.12 H new ATOM 0 HB2 LYS A 405 19.866 33.595 12.152 1.00 74.53 H new ATOM 0 HB3 LYS A 405 19.759 32.135 11.188 1.00 74.53 H new ATOM 0 HG2 LYS A 405 21.033 33.821 9.993 1.00 4.51 H new ATOM 0 HG3 LYS A 405 19.542 33.491 9.133 1.00 4.51 H new ATOM 0 HD2 LYS A 405 19.942 35.900 9.207 1.00 22.54 H new ATOM 0 HD3 LYS A 405 18.501 35.505 10.123 1.00 22.54 H new ATOM 0 HE2 LYS A 405 19.805 37.122 11.374 1.00 64.44 H new ATOM 0 HE3 LYS A 405 19.822 35.595 12.234 1.00 64.44 H new ATOM 0 HZ1 LYS A 405 21.999 36.679 12.123 1.00 34.41 H new ATOM 0 HZ2 LYS A 405 22.008 35.136 11.415 1.00 34.41 H new ATOM 0 HZ3 LYS A 405 21.993 36.520 10.432 1.00 34.41 H new ATOM 43 N ILE A 406 16.954 31.202 10.334 1.00 73.30 N ATOM 44 CA ILE A 406 16.370 30.446 9.227 1.00 34.21 C ATOM 45 C ILE A 406 14.821 30.453 9.310 1.00 11.45 C ATOM 46 O ILE A 406 14.122 30.008 8.388 1.00 73.03 O ATOM 47 CB ILE A 406 16.909 28.982 9.213 1.00 71.33 C ATOM 48 CG1 ILE A 406 16.458 28.236 7.942 1.00 23.01 C ATOM 49 CG2 ILE A 406 16.455 28.240 10.471 1.00 54.31 C ATOM 50 CD1 ILE A 406 16.987 26.821 7.833 1.00 64.42 C ATOM 0 H ILE A 406 17.134 30.654 11.175 1.00 73.30 H new ATOM 0 HA ILE A 406 16.665 30.930 8.296 1.00 34.21 H new ATOM 0 HB ILE A 406 17.998 29.018 9.205 1.00 71.33 H new ATOM 0 HG12 ILE A 406 15.369 28.208 7.918 1.00 23.01 H new ATOM 0 HG13 ILE A 406 16.782 28.801 7.068 1.00 23.01 H new ATOM 0 HG21 ILE A 406 16.837 27.220 10.449 1.00 54.31 H new ATOM 0 HG22 ILE A 406 16.838 28.752 11.354 1.00 54.31 H new ATOM 0 HG23 ILE A 406 15.366 28.219 10.508 1.00 54.31 H new ATOM 0 HD11 ILE A 406 16.624 26.367 6.911 1.00 64.42 H new ATOM 0 HD12 ILE A 406 18.077 26.840 7.823 1.00 64.42 H new ATOM 0 HD13 ILE A 406 16.642 26.237 8.686 1.00 64.42 H new ATOM 62 N GLU A 407 14.301 31.008 10.386 1.00 2.31 N ATOM 63 CA GLU A 407 12.860 31.034 10.623 1.00 61.43 C ATOM 64 C GLU A 407 12.104 31.848 9.554 1.00 71.11 C ATOM 65 O GLU A 407 11.147 31.347 8.965 1.00 12.50 O ATOM 66 CB GLU A 407 12.538 31.507 12.039 1.00 75.24 C ATOM 67 CG GLU A 407 13.065 30.585 13.118 1.00 2.44 C ATOM 68 CD GLU A 407 12.451 29.213 13.048 1.00 15.42 C ATOM 69 OE1 GLU A 407 11.391 29.003 13.663 1.00 54.24 O ATOM 70 OE2 GLU A 407 13.017 28.322 12.392 1.00 71.01 O ATOM 0 H GLU A 407 14.854 31.452 11.119 1.00 2.31 H new ATOM 0 HA GLU A 407 12.503 30.008 10.534 1.00 61.43 H new ATOM 0 HB2 GLU A 407 12.958 32.502 12.185 1.00 75.24 H new ATOM 0 HB3 GLU A 407 11.457 31.598 12.146 1.00 75.24 H new ATOM 0 HG2 GLU A 407 14.148 30.501 13.024 1.00 2.44 H new ATOM 0 HG3 GLU A 407 12.863 31.021 14.096 1.00 2.44 H new ATOM 77 N PRO A 408 12.508 33.106 9.265 1.00 31.30 N ATOM 78 CA PRO A 408 11.877 33.888 8.202 1.00 23.22 C ATOM 79 C PRO A 408 12.265 33.376 6.804 1.00 44.42 C ATOM 80 O PRO A 408 11.645 33.733 5.820 1.00 74.14 O ATOM 81 CB PRO A 408 12.446 35.292 8.421 1.00 31.33 C ATOM 82 CG PRO A 408 13.765 35.049 9.054 1.00 32.04 C ATOM 83 CD PRO A 408 13.555 33.897 9.967 1.00 52.03 C ATOM 0 HA PRO A 408 10.789 33.837 8.242 1.00 23.22 H new ATOM 0 HB2 PRO A 408 12.548 35.833 7.480 1.00 31.33 H new ATOM 0 HB3 PRO A 408 11.799 35.889 9.063 1.00 31.33 H new ATOM 0 HG2 PRO A 408 14.525 34.824 8.306 1.00 32.04 H new ATOM 0 HG3 PRO A 408 14.106 35.928 9.601 1.00 32.04 H new ATOM 0 HD2 PRO A 408 14.470 33.321 10.109 1.00 52.03 H new ATOM 0 HD3 PRO A 408 13.225 34.219 10.955 1.00 52.03 H new ATOM 91 N VAL A 409 13.279 32.522 6.740 1.00 72.35 N ATOM 92 CA VAL A 409 13.790 32.016 5.465 1.00 63.44 C ATOM 93 C VAL A 409 12.903 30.899 4.926 1.00 11.34 C ATOM 94 O VAL A 409 12.663 30.808 3.727 1.00 3.30 O ATOM 95 CB VAL A 409 15.261 31.512 5.592 1.00 41.44 C ATOM 96 CG1 VAL A 409 15.790 30.994 4.254 1.00 14.31 C ATOM 97 CG2 VAL A 409 16.156 32.618 6.116 1.00 72.14 C ATOM 0 H VAL A 409 13.768 32.162 7.559 1.00 72.35 H new ATOM 0 HA VAL A 409 13.776 32.849 4.762 1.00 63.44 H new ATOM 0 HB VAL A 409 15.269 30.684 6.301 1.00 41.44 H new ATOM 0 HG11 VAL A 409 16.817 30.651 4.377 1.00 14.31 H new ATOM 0 HG12 VAL A 409 15.169 30.166 3.913 1.00 14.31 H new ATOM 0 HG13 VAL A 409 15.762 31.796 3.516 1.00 14.31 H new ATOM 0 HG21 VAL A 409 17.179 32.250 6.199 1.00 72.14 H new ATOM 0 HG22 VAL A 409 16.129 33.464 5.429 1.00 72.14 H new ATOM 0 HG23 VAL A 409 15.804 32.936 7.097 1.00 72.14 H new ATOM 107 N VAL A 410 12.393 30.069 5.813 1.00 53.13 N ATOM 108 CA VAL A 410 11.540 28.965 5.391 1.00 43.13 C ATOM 109 C VAL A 410 10.164 29.447 4.942 1.00 10.10 C ATOM 110 O VAL A 410 9.442 28.730 4.247 1.00 63.10 O ATOM 111 CB VAL A 410 11.404 27.868 6.470 1.00 74.04 C ATOM 112 CG1 VAL A 410 12.759 27.274 6.783 1.00 33.15 C ATOM 113 CG2 VAL A 410 10.756 28.412 7.732 1.00 43.43 C ATOM 0 H VAL A 410 12.548 30.132 6.819 1.00 53.13 H new ATOM 0 HA VAL A 410 12.041 28.516 4.533 1.00 43.13 H new ATOM 0 HB VAL A 410 10.757 27.084 6.076 1.00 74.04 H new ATOM 0 HG11 VAL A 410 12.651 26.502 7.545 1.00 33.15 H new ATOM 0 HG12 VAL A 410 13.181 26.835 5.879 1.00 33.15 H new ATOM 0 HG13 VAL A 410 13.423 28.056 7.151 1.00 33.15 H new ATOM 0 HG21 VAL A 410 10.675 27.615 8.472 1.00 43.43 H new ATOM 0 HG22 VAL A 410 11.366 29.220 8.135 1.00 43.43 H new ATOM 0 HG23 VAL A 410 9.762 28.791 7.496 1.00 43.43 H new ATOM 123 N LEU A 411 9.815 30.673 5.330 1.00 74.21 N ATOM 124 CA LEU A 411 8.539 31.261 4.963 1.00 25.14 C ATOM 125 C LEU A 411 8.357 31.370 3.449 1.00 20.52 C ATOM 126 O LEU A 411 7.429 30.764 2.910 1.00 53.25 O ATOM 127 CB LEU A 411 8.310 32.603 5.635 1.00 11.14 C ATOM 128 CG LEU A 411 8.192 32.585 7.153 1.00 33.10 C ATOM 129 CD1 LEU A 411 7.950 33.971 7.660 1.00 44.44 C ATOM 130 CD2 LEU A 411 7.078 31.649 7.611 1.00 13.13 C ATOM 0 H LEU A 411 10.406 31.277 5.902 1.00 74.21 H new ATOM 0 HA LEU A 411 7.778 30.573 5.332 1.00 25.14 H new ATOM 0 HB2 LEU A 411 9.131 33.266 5.363 1.00 11.14 H new ATOM 0 HB3 LEU A 411 7.399 33.040 5.226 1.00 11.14 H new ATOM 0 HG LEU A 411 9.129 32.211 7.565 1.00 33.10 H new ATOM 0 HD11 LEU A 411 7.866 33.952 8.747 1.00 44.44 H new ATOM 0 HD12 LEU A 411 8.781 34.614 7.371 1.00 44.44 H new ATOM 0 HD13 LEU A 411 7.026 34.359 7.232 1.00 44.44 H new ATOM 0 HD21 LEU A 411 7.019 31.658 8.699 1.00 13.13 H new ATOM 0 HD22 LEU A 411 6.128 31.982 7.193 1.00 13.13 H new ATOM 0 HD23 LEU A 411 7.290 30.636 7.268 1.00 13.13 H new ATOM 142 N PRO A 412 9.235 32.126 2.708 1.00 72.22 N ATOM 143 CA PRO A 412 9.095 32.229 1.276 1.00 4.50 C ATOM 144 C PRO A 412 9.291 30.873 0.599 1.00 40.43 C ATOM 145 O PRO A 412 8.689 30.601 -0.422 1.00 72.45 O ATOM 146 CB PRO A 412 10.183 33.220 0.845 1.00 53.12 C ATOM 147 CG PRO A 412 11.168 33.204 1.952 1.00 33.31 C ATOM 148 CD PRO A 412 10.376 32.935 3.193 1.00 1.40 C ATOM 0 HA PRO A 412 8.098 32.562 0.989 1.00 4.50 H new ATOM 0 HB2 PRO A 412 10.641 32.919 -0.097 1.00 53.12 H new ATOM 0 HB3 PRO A 412 9.772 34.218 0.695 1.00 53.12 H new ATOM 0 HG2 PRO A 412 11.922 32.433 1.794 1.00 33.31 H new ATOM 0 HG3 PRO A 412 11.694 34.156 2.022 1.00 33.31 H new ATOM 0 HD2 PRO A 412 10.964 32.395 3.935 1.00 1.40 H new ATOM 0 HD3 PRO A 412 10.041 33.859 3.663 1.00 1.40 H new ATOM 156 N LEU A 413 10.119 30.017 1.206 1.00 21.54 N ATOM 157 CA LEU A 413 10.379 28.688 0.671 1.00 23.34 C ATOM 158 C LEU A 413 9.113 27.847 0.639 1.00 13.11 C ATOM 159 O LEU A 413 8.844 27.150 -0.348 1.00 73.03 O ATOM 160 CB LEU A 413 11.478 27.985 1.446 1.00 41.23 C ATOM 161 CG LEU A 413 12.851 28.654 1.405 1.00 72.45 C ATOM 162 CD1 LEU A 413 13.850 27.818 2.150 1.00 12.52 C ATOM 163 CD2 LEU A 413 13.314 28.881 -0.032 1.00 15.31 C ATOM 0 H LEU A 413 10.619 30.227 2.070 1.00 21.54 H new ATOM 0 HA LEU A 413 10.723 28.812 -0.356 1.00 23.34 H new ATOM 0 HB2 LEU A 413 11.166 27.901 2.487 1.00 41.23 H new ATOM 0 HB3 LEU A 413 11.577 26.970 1.060 1.00 41.23 H new ATOM 0 HG LEU A 413 12.770 29.629 1.886 1.00 72.45 H new ATOM 0 HD11 LEU A 413 14.826 28.301 2.116 1.00 12.52 H new ATOM 0 HD12 LEU A 413 13.534 27.711 3.188 1.00 12.52 H new ATOM 0 HD13 LEU A 413 13.917 26.833 1.688 1.00 12.52 H new ATOM 0 HD21 LEU A 413 14.294 29.358 -0.027 1.00 15.31 H new ATOM 0 HD22 LEU A 413 13.379 27.924 -0.549 1.00 15.31 H new ATOM 0 HD23 LEU A 413 12.600 29.523 -0.547 1.00 15.31 H new ATOM 175 N LEU A 414 8.336 27.910 1.714 1.00 0.14 N ATOM 176 CA LEU A 414 7.046 27.234 1.761 1.00 44.40 C ATOM 177 C LEU A 414 6.090 27.912 0.802 1.00 74.13 C ATOM 178 O LEU A 414 5.320 27.260 0.115 1.00 24.11 O ATOM 179 CB LEU A 414 6.460 27.243 3.182 1.00 11.03 C ATOM 180 CG LEU A 414 5.035 26.670 3.331 1.00 22.00 C ATOM 181 CD1 LEU A 414 4.964 25.216 2.886 1.00 34.41 C ATOM 182 CD2 LEU A 414 4.535 26.823 4.757 1.00 22.42 C ATOM 0 H LEU A 414 8.577 28.421 2.563 1.00 0.14 H new ATOM 0 HA LEU A 414 7.190 26.194 1.468 1.00 44.40 H new ATOM 0 HB2 LEU A 414 7.127 26.677 3.832 1.00 11.03 H new ATOM 0 HB3 LEU A 414 6.457 28.271 3.545 1.00 11.03 H new ATOM 0 HG LEU A 414 4.382 27.246 2.675 1.00 22.00 H new ATOM 0 HD11 LEU A 414 3.945 24.848 3.006 1.00 34.41 H new ATOM 0 HD12 LEU A 414 5.256 25.141 1.838 1.00 34.41 H new ATOM 0 HD13 LEU A 414 5.640 24.616 3.495 1.00 34.41 H new ATOM 0 HD21 LEU A 414 3.529 26.412 4.836 1.00 22.42 H new ATOM 0 HD22 LEU A 414 5.200 26.288 5.435 1.00 22.42 H new ATOM 0 HD23 LEU A 414 4.517 27.879 5.025 1.00 22.42 H new ATOM 194 N TRP A 415 6.172 29.224 0.752 1.00 30.12 N ATOM 195 CA TRP A 415 5.357 30.035 -0.128 1.00 42.55 C ATOM 196 C TRP A 415 5.557 29.626 -1.607 1.00 54.11 C ATOM 197 O TRP A 415 4.622 29.685 -2.407 1.00 24.34 O ATOM 198 CB TRP A 415 5.670 31.520 0.123 1.00 24.00 C ATOM 199 CG TRP A 415 4.937 32.493 -0.741 1.00 20.34 C ATOM 200 CD1 TRP A 415 3.606 32.785 -0.712 1.00 53.23 C ATOM 201 CD2 TRP A 415 5.513 33.340 -1.735 1.00 51.41 C ATOM 202 NE1 TRP A 415 3.320 33.744 -1.650 1.00 21.42 N ATOM 203 CE2 TRP A 415 4.476 34.101 -2.289 1.00 71.31 C ATOM 204 CE3 TRP A 415 6.812 33.519 -2.216 1.00 23.21 C ATOM 205 CZ2 TRP A 415 4.694 35.032 -3.299 1.00 12.31 C ATOM 206 CZ3 TRP A 415 7.024 34.443 -3.215 1.00 62.22 C ATOM 207 CH2 TRP A 415 5.968 35.188 -3.747 1.00 65.11 C ATOM 0 H TRP A 415 6.815 29.765 1.329 1.00 30.12 H new ATOM 0 HA TRP A 415 4.302 29.869 0.090 1.00 42.55 H new ATOM 0 HB2 TRP A 415 5.446 31.748 1.165 1.00 24.00 H new ATOM 0 HB3 TRP A 415 6.740 31.675 -0.015 1.00 24.00 H new ATOM 0 HD1 TRP A 415 2.885 32.330 -0.050 1.00 53.23 H new ATOM 0 HE1 TRP A 415 2.395 34.129 -1.840 1.00 21.42 H new ATOM 0 HE3 TRP A 415 7.633 32.945 -1.813 1.00 23.21 H new ATOM 0 HZ2 TRP A 415 3.881 35.610 -3.712 1.00 12.31 H new ATOM 0 HZ3 TRP A 415 8.024 34.595 -3.594 1.00 62.22 H new ATOM 0 HH2 TRP A 415 6.168 35.903 -4.531 1.00 65.11 H new ATOM 218 N PHE A 416 6.758 29.179 -1.961 1.00 62.52 N ATOM 219 CA PHE A 416 6.997 28.713 -3.322 1.00 23.31 C ATOM 220 C PHE A 416 6.348 27.356 -3.552 1.00 20.41 C ATOM 221 O PHE A 416 5.873 27.054 -4.657 1.00 73.42 O ATOM 222 CB PHE A 416 8.480 28.683 -3.727 1.00 35.41 C ATOM 223 CG PHE A 416 9.190 30.012 -3.738 1.00 4.51 C ATOM 224 CD1 PHE A 416 10.279 30.235 -2.913 1.00 72.45 C ATOM 225 CD2 PHE A 416 8.775 31.032 -4.571 1.00 32.32 C ATOM 226 CE1 PHE A 416 10.938 31.449 -2.920 1.00 44.24 C ATOM 227 CE2 PHE A 416 9.429 32.249 -4.583 1.00 30.42 C ATOM 228 CZ PHE A 416 10.512 32.457 -3.755 1.00 74.43 C ATOM 0 H PHE A 416 7.565 29.130 -1.339 1.00 62.52 H new ATOM 0 HA PHE A 416 6.529 29.453 -3.971 1.00 23.31 H new ATOM 0 HB2 PHE A 416 9.009 28.017 -3.045 1.00 35.41 H new ATOM 0 HB3 PHE A 416 8.555 28.245 -4.722 1.00 35.41 H new ATOM 0 HD1 PHE A 416 10.618 29.449 -2.255 1.00 72.45 H new ATOM 0 HD2 PHE A 416 7.928 30.876 -5.222 1.00 32.32 H new ATOM 0 HE1 PHE A 416 11.787 31.607 -2.271 1.00 44.24 H new ATOM 0 HE2 PHE A 416 9.092 33.037 -5.240 1.00 30.42 H new ATOM 0 HZ PHE A 416 11.024 33.408 -3.762 1.00 74.43 H new ATOM 238 N GLU A 417 6.294 26.549 -2.506 1.00 71.31 N ATOM 239 CA GLU A 417 5.650 25.249 -2.573 1.00 31.12 C ATOM 240 C GLU A 417 4.177 25.423 -2.824 1.00 10.44 C ATOM 241 O GLU A 417 3.535 24.581 -3.440 1.00 20.33 O ATOM 242 CB GLU A 417 5.836 24.470 -1.286 1.00 54.05 C ATOM 243 CG GLU A 417 7.247 24.035 -0.989 1.00 73.23 C ATOM 244 CD GLU A 417 7.322 23.198 0.259 1.00 1.25 C ATOM 245 OE1 GLU A 417 7.772 23.695 1.302 1.00 43.25 O ATOM 246 OE2 GLU A 417 6.917 22.012 0.214 1.00 4.51 O ATOM 0 H GLU A 417 6.692 26.774 -1.594 1.00 71.31 H new ATOM 0 HA GLU A 417 6.112 24.693 -3.388 1.00 31.12 H new ATOM 0 HB2 GLU A 417 5.481 25.082 -0.457 1.00 54.05 H new ATOM 0 HB3 GLU A 417 5.202 23.584 -1.323 1.00 54.05 H new ATOM 0 HG2 GLU A 417 7.637 23.466 -1.833 1.00 73.23 H new ATOM 0 HG3 GLU A 417 7.882 24.914 -0.876 1.00 73.23 H new ATOM 253 N GLN A 418 3.659 26.548 -2.369 1.00 33.22 N ATOM 254 CA GLN A 418 2.257 26.879 -2.499 1.00 14.13 C ATOM 255 C GLN A 418 1.920 27.223 -3.955 1.00 44.23 C ATOM 256 O GLN A 418 0.758 27.213 -4.364 1.00 70.43 O ATOM 257 CB GLN A 418 1.912 28.036 -1.571 1.00 53.40 C ATOM 258 CG GLN A 418 2.340 27.775 -0.153 1.00 63.54 C ATOM 259 CD GLN A 418 1.967 28.878 0.815 1.00 0.03 C ATOM 260 OE1 GLN A 418 1.897 30.055 0.453 1.00 43.14 O ATOM 261 NE2 GLN A 418 1.713 28.510 2.045 1.00 15.33 N ATOM 0 H GLN A 418 4.208 27.264 -1.894 1.00 33.22 H new ATOM 0 HA GLN A 418 1.658 26.014 -2.213 1.00 14.13 H new ATOM 0 HB2 GLN A 418 2.393 28.945 -1.932 1.00 53.40 H new ATOM 0 HB3 GLN A 418 0.837 28.212 -1.597 1.00 53.40 H new ATOM 0 HG2 GLN A 418 1.891 26.841 0.185 1.00 63.54 H new ATOM 0 HG3 GLN A 418 3.421 27.636 -0.130 1.00 63.54 H new ATOM 0 HE21 GLN A 418 1.781 27.527 2.308 1.00 15.33 H new ATOM 0 HE22 GLN A 418 1.447 29.206 2.741 1.00 15.33 H new ATOM 270 N SER A 419 2.947 27.526 -4.725 1.00 41.31 N ATOM 271 CA SER A 419 2.809 27.787 -6.136 1.00 43.40 C ATOM 272 C SER A 419 2.972 26.468 -6.893 1.00 52.15 C ATOM 273 O SER A 419 2.541 26.316 -8.045 1.00 24.34 O ATOM 274 CB SER A 419 3.885 28.806 -6.580 1.00 52.45 C ATOM 275 OG SER A 419 3.792 29.127 -7.961 1.00 52.33 O ATOM 0 H SER A 419 3.905 27.597 -4.382 1.00 41.31 H new ATOM 0 HA SER A 419 1.827 28.208 -6.351 1.00 43.40 H new ATOM 0 HB2 SER A 419 3.783 29.717 -5.991 1.00 52.45 H new ATOM 0 HB3 SER A 419 4.874 28.400 -6.370 1.00 52.45 H new ATOM 0 HG SER A 419 4.490 29.774 -8.194 1.00 52.33 H new ATOM 281 N GLY A 420 3.554 25.498 -6.212 1.00 51.44 N ATOM 282 CA GLY A 420 3.876 24.254 -6.842 1.00 2.42 C ATOM 283 C GLY A 420 5.154 24.390 -7.623 1.00 71.24 C ATOM 284 O GLY A 420 5.383 23.684 -8.597 1.00 4.10 O ATOM 0 H GLY A 420 3.808 25.558 -5.226 1.00 51.44 H new ATOM 0 HA2 GLY A 420 3.981 23.472 -6.090 1.00 2.42 H new ATOM 0 HA3 GLY A 420 3.065 23.952 -7.505 1.00 2.42 H new ATOM 288 N ALA A 421 6.002 25.302 -7.169 1.00 3.34 N ATOM 289 CA ALA A 421 7.256 25.611 -7.836 1.00 42.42 C ATOM 290 C ALA A 421 8.236 24.436 -7.793 1.00 0.24 C ATOM 291 O ALA A 421 9.108 24.319 -8.642 1.00 63.31 O ATOM 292 CB ALA A 421 7.861 26.870 -7.242 1.00 22.11 C ATOM 0 H ALA A 421 5.838 25.850 -6.324 1.00 3.34 H new ATOM 0 HA ALA A 421 7.045 25.792 -8.890 1.00 42.42 H new ATOM 0 HB1 ALA A 421 8.800 27.095 -7.747 1.00 22.11 H new ATOM 0 HB2 ALA A 421 7.170 27.703 -7.373 1.00 22.11 H new ATOM 0 HB3 ALA A 421 8.048 26.717 -6.179 1.00 22.11 H new ATOM 298 N MET A 422 8.081 23.571 -6.807 1.00 53.30 N ATOM 299 CA MET A 422 8.912 22.375 -6.694 1.00 12.31 C ATOM 300 C MET A 422 8.318 21.231 -7.496 1.00 52.24 C ATOM 301 O MET A 422 8.894 20.146 -7.578 1.00 40.41 O ATOM 302 CB MET A 422 9.097 21.934 -5.230 1.00 31.43 C ATOM 303 CG MET A 422 9.870 22.908 -4.342 1.00 33.51 C ATOM 304 SD MET A 422 9.031 24.486 -4.073 1.00 44.33 S ATOM 305 CE MET A 422 10.239 25.310 -3.038 1.00 70.22 C ATOM 0 H MET A 422 7.386 23.671 -6.068 1.00 53.30 H new ATOM 0 HA MET A 422 9.892 22.633 -7.096 1.00 12.31 H new ATOM 0 HB2 MET A 422 8.113 21.772 -4.791 1.00 31.43 H new ATOM 0 HB3 MET A 422 9.612 20.974 -5.221 1.00 31.43 H new ATOM 0 HG2 MET A 422 10.052 22.436 -3.376 1.00 33.51 H new ATOM 0 HG3 MET A 422 10.844 23.099 -4.792 1.00 33.51 H new ATOM 0 HE1 MET A 422 9.815 25.478 -2.048 1.00 70.22 H new ATOM 0 HE2 MET A 422 11.129 24.687 -2.951 1.00 70.22 H new ATOM 0 HE3 MET A 422 10.509 26.267 -3.485 1.00 70.22 H new ATOM 315 N GLY A 423 7.158 21.476 -8.084 1.00 1.32 N ATOM 316 CA GLY A 423 6.478 20.468 -8.869 1.00 74.12 C ATOM 317 C GLY A 423 5.957 19.336 -8.011 1.00 75.50 C ATOM 318 O GLY A 423 5.824 18.203 -8.475 1.00 22.04 O ATOM 0 H GLY A 423 6.669 22.369 -8.030 1.00 1.32 H new ATOM 0 HA2 GLY A 423 5.648 20.926 -9.407 1.00 74.12 H new ATOM 0 HA3 GLY A 423 7.162 20.070 -9.618 1.00 74.12 H new ATOM 322 N GLY A 424 5.675 19.634 -6.761 1.00 34.43 N ATOM 323 CA GLY A 424 5.185 18.630 -5.867 1.00 23.22 C ATOM 324 C GLY A 424 4.961 19.169 -4.480 1.00 53.14 C ATOM 325 O GLY A 424 5.609 20.146 -4.064 1.00 40.31 O ATOM 0 H GLY A 424 5.779 20.562 -6.350 1.00 34.43 H new ATOM 0 HA2 GLY A 424 4.250 18.226 -6.254 1.00 23.22 H new ATOM 0 HA3 GLY A 424 5.896 17.805 -5.825 1.00 23.22 H new ATOM 329 N LYS A 425 4.031 18.561 -3.780 1.00 75.45 N ATOM 330 CA LYS A 425 3.696 18.907 -2.403 1.00 33.15 C ATOM 331 C LYS A 425 3.562 17.593 -1.619 1.00 14.31 C ATOM 332 O LYS A 425 3.592 16.513 -2.242 1.00 45.31 O ATOM 333 CB LYS A 425 2.353 19.730 -2.293 1.00 63.42 C ATOM 334 CG LYS A 425 2.331 21.138 -2.941 1.00 65.24 C ATOM 335 CD LYS A 425 2.242 21.114 -4.468 1.00 10.30 C ATOM 336 CE LYS A 425 0.923 20.512 -4.938 1.00 31.42 C ATOM 337 NZ LYS A 425 0.818 20.485 -6.405 1.00 55.13 N ATOM 0 H LYS A 425 3.470 17.795 -4.153 1.00 75.45 H new ATOM 0 HA LYS A 425 4.484 19.543 -1.998 1.00 33.15 H new ATOM 0 HB2 LYS A 425 1.556 19.138 -2.743 1.00 63.42 H new ATOM 0 HB3 LYS A 425 2.110 19.840 -1.236 1.00 63.42 H new ATOM 0 HG2 LYS A 425 1.482 21.696 -2.546 1.00 65.24 H new ATOM 0 HG3 LYS A 425 3.232 21.677 -2.647 1.00 65.24 H new ATOM 0 HD2 LYS A 425 2.340 22.128 -4.856 1.00 10.30 H new ATOM 0 HD3 LYS A 425 3.073 20.536 -4.874 1.00 10.30 H new ATOM 0 HE2 LYS A 425 0.829 19.498 -4.550 1.00 31.42 H new ATOM 0 HE3 LYS A 425 0.095 21.089 -4.526 1.00 31.42 H new ATOM 0 HZ1 LYS A 425 -0.094 20.068 -6.680 1.00 55.13 H new ATOM 0 HZ2 LYS A 425 0.881 21.455 -6.775 1.00 55.13 H new ATOM 0 HZ3 LYS A 425 1.593 19.913 -6.798 1.00 55.13 H new ATOM 351 N PRO A 426 3.471 17.633 -0.269 1.00 5.21 N ATOM 352 CA PRO A 426 3.235 16.430 0.543 1.00 13.42 C ATOM 353 C PRO A 426 1.973 15.675 0.093 1.00 31.32 C ATOM 354 O PRO A 426 0.984 16.288 -0.353 1.00 35.15 O ATOM 355 CB PRO A 426 3.054 16.992 1.948 1.00 50.41 C ATOM 356 CG PRO A 426 3.857 18.230 1.938 1.00 71.34 C ATOM 357 CD PRO A 426 3.643 18.825 0.587 1.00 24.44 C ATOM 0 HA PRO A 426 4.046 15.706 0.463 1.00 13.42 H new ATOM 0 HB2 PRO A 426 2.006 17.197 2.165 1.00 50.41 H new ATOM 0 HB3 PRO A 426 3.406 16.293 2.707 1.00 50.41 H new ATOM 0 HG2 PRO A 426 3.537 18.913 2.724 1.00 71.34 H new ATOM 0 HG3 PRO A 426 4.912 18.017 2.112 1.00 71.34 H new ATOM 0 HD2 PRO A 426 2.765 19.471 0.563 1.00 24.44 H new ATOM 0 HD3 PRO A 426 4.493 19.431 0.272 1.00 24.44 H new ATOM 365 N LEU A 427 2.009 14.362 0.234 1.00 41.03 N ATOM 366 CA LEU A 427 0.951 13.475 -0.248 1.00 23.32 C ATOM 367 C LEU A 427 -0.393 13.756 0.400 1.00 23.32 C ATOM 368 O LEU A 427 -1.429 13.617 -0.249 1.00 64.54 O ATOM 369 CB LEU A 427 1.320 11.979 -0.083 1.00 52.33 C ATOM 370 CG LEU A 427 2.477 11.412 -0.949 1.00 71.42 C ATOM 371 CD1 LEU A 427 3.822 12.050 -0.621 1.00 2.23 C ATOM 372 CD2 LEU A 427 2.558 9.902 -0.806 1.00 61.25 C ATOM 0 H LEU A 427 2.778 13.871 0.690 1.00 41.03 H new ATOM 0 HA LEU A 427 0.857 13.689 -1.313 1.00 23.32 H new ATOM 0 HB2 LEU A 427 1.574 11.812 0.964 1.00 52.33 H new ATOM 0 HB3 LEU A 427 0.427 11.390 -0.293 1.00 52.33 H new ATOM 0 HG LEU A 427 2.250 11.663 -1.985 1.00 71.42 H new ATOM 0 HD11 LEU A 427 4.595 11.616 -1.256 1.00 2.23 H new ATOM 0 HD12 LEU A 427 3.768 13.124 -0.797 1.00 2.23 H new ATOM 0 HD13 LEU A 427 4.066 11.866 0.425 1.00 2.23 H new ATOM 0 HD21 LEU A 427 3.374 9.522 -1.420 1.00 61.25 H new ATOM 0 HD22 LEU A 427 2.738 9.645 0.238 1.00 61.25 H new ATOM 0 HD23 LEU A 427 1.619 9.455 -1.133 1.00 61.25 H new ATOM 384 N SER A 428 -0.368 14.182 1.656 1.00 21.41 N ATOM 385 CA SER A 428 -1.575 14.457 2.437 1.00 41.12 C ATOM 386 C SER A 428 -2.517 15.440 1.727 1.00 75.04 C ATOM 387 O SER A 428 -3.745 15.310 1.795 1.00 11.20 O ATOM 388 CB SER A 428 -1.173 14.998 3.815 1.00 64.55 C ATOM 389 OG SER A 428 -0.326 16.148 3.692 1.00 40.50 O ATOM 0 H SER A 428 0.497 14.349 2.170 1.00 21.41 H new ATOM 0 HA SER A 428 -2.124 13.522 2.550 1.00 41.12 H new ATOM 0 HB2 SER A 428 -2.067 15.260 4.381 1.00 64.55 H new ATOM 0 HB3 SER A 428 -0.656 14.221 4.378 1.00 64.55 H new ATOM 0 HG SER A 428 -0.086 16.474 4.584 1.00 40.50 H new ATOM 395 N THR A 429 -1.930 16.385 1.024 1.00 21.32 N ATOM 396 CA THR A 429 -2.665 17.405 0.342 1.00 63.40 C ATOM 397 C THR A 429 -3.391 16.836 -0.889 1.00 53.42 C ATOM 398 O THR A 429 -4.505 17.234 -1.204 1.00 3.10 O ATOM 399 CB THR A 429 -1.692 18.526 -0.074 1.00 52.32 C ATOM 400 OG1 THR A 429 -0.978 18.968 1.094 1.00 23.11 O ATOM 401 CG2 THR A 429 -2.432 19.709 -0.684 1.00 32.32 C ATOM 0 H THR A 429 -0.919 16.459 0.915 1.00 21.32 H new ATOM 0 HA THR A 429 -3.425 17.807 1.012 1.00 63.40 H new ATOM 0 HB THR A 429 -1.007 18.132 -0.825 1.00 52.32 H new ATOM 0 HG1 THR A 429 -0.353 19.681 0.845 1.00 23.11 H new ATOM 0 HG21 THR A 429 -1.715 20.480 -0.966 1.00 32.32 H new ATOM 0 HG22 THR A 429 -2.977 19.380 -1.568 1.00 32.32 H new ATOM 0 HG23 THR A 429 -3.134 20.114 0.045 1.00 32.32 H new ATOM 409 N PHE A 430 -2.774 15.875 -1.549 1.00 55.03 N ATOM 410 CA PHE A 430 -3.327 15.321 -2.769 1.00 3.42 C ATOM 411 C PHE A 430 -4.590 14.509 -2.572 1.00 64.31 C ATOM 412 O PHE A 430 -5.488 14.595 -3.391 1.00 41.52 O ATOM 413 CB PHE A 430 -2.285 14.533 -3.550 1.00 10.22 C ATOM 414 CG PHE A 430 -1.208 15.401 -4.087 1.00 14.10 C ATOM 415 CD1 PHE A 430 -1.300 15.919 -5.362 1.00 34.44 C ATOM 416 CD2 PHE A 430 -0.121 15.719 -3.319 1.00 42.22 C ATOM 417 CE1 PHE A 430 -0.314 16.739 -5.857 1.00 23.51 C ATOM 418 CE2 PHE A 430 0.862 16.530 -3.800 1.00 74.41 C ATOM 419 CZ PHE A 430 0.771 17.045 -5.075 1.00 33.15 C ATOM 0 H PHE A 430 -1.888 15.461 -1.260 1.00 55.03 H new ATOM 0 HA PHE A 430 -3.626 16.187 -3.360 1.00 3.42 H new ATOM 0 HB2 PHE A 430 -1.847 13.773 -2.903 1.00 10.22 H new ATOM 0 HB3 PHE A 430 -2.771 14.009 -4.373 1.00 10.22 H new ATOM 0 HD1 PHE A 430 -2.154 15.678 -5.977 1.00 34.44 H new ATOM 0 HD2 PHE A 430 -0.041 15.322 -2.318 1.00 42.22 H new ATOM 0 HE1 PHE A 430 -0.393 17.140 -6.857 1.00 23.51 H new ATOM 0 HE2 PHE A 430 1.714 16.770 -3.181 1.00 74.41 H new ATOM 0 HZ PHE A 430 1.551 17.687 -5.457 1.00 33.15 H new ATOM 429 N TYR A 431 -4.685 13.757 -1.475 1.00 14.44 N ATOM 430 CA TYR A 431 -5.851 12.866 -1.242 1.00 33.00 C ATOM 431 C TYR A 431 -7.199 13.591 -1.388 1.00 34.11 C ATOM 432 O TYR A 431 -8.150 13.040 -1.950 1.00 33.24 O ATOM 433 CB TYR A 431 -5.782 12.173 0.128 1.00 12.40 C ATOM 434 CG TYR A 431 -4.621 11.217 0.320 1.00 63.02 C ATOM 435 CD1 TYR A 431 -3.438 11.645 0.888 1.00 4.40 C ATOM 436 CD2 TYR A 431 -4.723 9.881 -0.055 1.00 55.43 C ATOM 437 CE1 TYR A 431 -2.381 10.778 1.082 1.00 71.21 C ATOM 438 CE2 TYR A 431 -3.667 9.008 0.132 1.00 1.11 C ATOM 439 CZ TYR A 431 -2.500 9.464 0.703 1.00 24.41 C ATOM 440 OH TYR A 431 -1.444 8.596 0.904 1.00 43.01 O ATOM 0 H TYR A 431 -3.984 13.738 -0.734 1.00 14.44 H new ATOM 0 HA TYR A 431 -5.793 12.108 -2.023 1.00 33.00 H new ATOM 0 HB2 TYR A 431 -5.730 12.940 0.901 1.00 12.40 H new ATOM 0 HB3 TYR A 431 -6.711 11.625 0.285 1.00 12.40 H new ATOM 0 HD1 TYR A 431 -3.337 12.678 1.186 1.00 4.40 H new ATOM 0 HD2 TYR A 431 -5.640 9.521 -0.498 1.00 55.43 H new ATOM 0 HE1 TYR A 431 -1.464 11.132 1.530 1.00 71.21 H new ATOM 0 HE2 TYR A 431 -3.757 7.974 -0.168 1.00 1.11 H new ATOM 0 HH TYR A 431 -1.689 7.703 0.583 1.00 43.01 H new ATOM 450 N THR A 432 -7.273 14.820 -0.910 1.00 64.43 N ATOM 451 CA THR A 432 -8.504 15.573 -0.991 1.00 24.22 C ATOM 452 C THR A 432 -8.809 16.037 -2.448 1.00 75.44 C ATOM 453 O THR A 432 -9.970 16.180 -2.827 1.00 72.34 O ATOM 454 CB THR A 432 -8.558 16.741 0.054 1.00 3.45 C ATOM 455 OG1 THR A 432 -9.842 17.389 0.048 1.00 24.41 O ATOM 456 CG2 THR A 432 -7.466 17.763 -0.182 1.00 13.52 C ATOM 0 H THR A 432 -6.499 15.312 -0.465 1.00 64.43 H new ATOM 0 HA THR A 432 -9.312 14.895 -0.715 1.00 24.22 H new ATOM 0 HB THR A 432 -8.396 16.290 1.033 1.00 3.45 H new ATOM 0 HG1 THR A 432 -9.847 18.112 0.710 1.00 24.41 H new ATOM 0 HG21 THR A 432 -7.541 18.554 0.564 1.00 13.52 H new ATOM 0 HG22 THR A 432 -6.492 17.280 -0.103 1.00 13.52 H new ATOM 0 HG23 THR A 432 -7.578 18.192 -1.178 1.00 13.52 H new ATOM 464 N GLN A 433 -7.765 16.280 -3.246 1.00 70.21 N ATOM 465 CA GLN A 433 -7.953 16.576 -4.676 1.00 4.45 C ATOM 466 C GLN A 433 -8.354 15.321 -5.458 1.00 63.23 C ATOM 467 O GLN A 433 -9.244 15.367 -6.310 1.00 64.54 O ATOM 468 CB GLN A 433 -6.724 17.247 -5.342 1.00 4.25 C ATOM 469 CG GLN A 433 -6.541 18.751 -5.080 1.00 12.52 C ATOM 470 CD GLN A 433 -6.335 19.118 -3.633 1.00 10.51 C ATOM 471 OE1 GLN A 433 -7.289 19.380 -2.905 1.00 14.31 O ATOM 472 NE2 GLN A 433 -5.107 19.167 -3.211 1.00 13.24 N ATOM 0 H GLN A 433 -6.793 16.279 -2.936 1.00 70.21 H new ATOM 0 HA GLN A 433 -8.766 17.301 -4.715 1.00 4.45 H new ATOM 0 HB2 GLN A 433 -5.827 16.729 -5.003 1.00 4.25 H new ATOM 0 HB3 GLN A 433 -6.793 17.094 -6.419 1.00 4.25 H new ATOM 0 HG2 GLN A 433 -5.686 19.105 -5.656 1.00 12.52 H new ATOM 0 HG3 GLN A 433 -7.418 19.280 -5.454 1.00 12.52 H new ATOM 0 HE21 GLN A 433 -4.340 18.942 -3.845 1.00 13.24 H new ATOM 0 HE22 GLN A 433 -4.910 19.430 -2.245 1.00 13.24 H new ATOM 481 N LEU A 434 -7.714 14.197 -5.135 1.00 53.23 N ATOM 482 CA LEU A 434 -7.954 12.917 -5.831 1.00 13.41 C ATOM 483 C LEU A 434 -9.398 12.487 -5.819 1.00 63.14 C ATOM 484 O LEU A 434 -9.893 12.011 -6.816 1.00 54.43 O ATOM 485 CB LEU A 434 -7.072 11.773 -5.284 1.00 2.31 C ATOM 486 CG LEU A 434 -5.645 11.600 -5.857 1.00 44.31 C ATOM 487 CD1 LEU A 434 -4.822 12.859 -5.759 1.00 52.41 C ATOM 488 CD2 LEU A 434 -4.945 10.462 -5.134 1.00 33.52 C ATOM 0 H LEU A 434 -7.019 14.140 -4.391 1.00 53.23 H new ATOM 0 HA LEU A 434 -7.675 13.115 -6.866 1.00 13.41 H new ATOM 0 HB2 LEU A 434 -6.982 11.911 -4.207 1.00 2.31 H new ATOM 0 HB3 LEU A 434 -7.608 10.837 -5.442 1.00 2.31 H new ATOM 0 HG LEU A 434 -5.744 11.370 -6.918 1.00 44.31 H new ATOM 0 HD11 LEU A 434 -3.831 12.679 -6.176 1.00 52.41 H new ATOM 0 HD12 LEU A 434 -5.311 13.658 -6.317 1.00 52.41 H new ATOM 0 HD13 LEU A 434 -4.728 13.152 -4.713 1.00 52.41 H new ATOM 0 HD21 LEU A 434 -3.940 10.339 -5.537 1.00 33.52 H new ATOM 0 HD22 LEU A 434 -4.884 10.690 -4.070 1.00 33.52 H new ATOM 0 HD23 LEU A 434 -5.508 9.540 -5.276 1.00 33.52 H new ATOM 500 N VAL A 435 -10.084 12.687 -4.712 1.00 23.23 N ATOM 501 CA VAL A 435 -11.475 12.247 -4.605 1.00 75.03 C ATOM 502 C VAL A 435 -12.390 12.887 -5.669 1.00 74.22 C ATOM 503 O VAL A 435 -13.395 12.295 -6.056 1.00 13.41 O ATOM 504 CB VAL A 435 -12.078 12.455 -3.182 1.00 42.03 C ATOM 505 CG1 VAL A 435 -11.284 11.683 -2.140 1.00 30.15 C ATOM 506 CG2 VAL A 435 -12.158 13.930 -2.813 1.00 14.42 C ATOM 0 H VAL A 435 -9.714 13.145 -3.879 1.00 23.23 H new ATOM 0 HA VAL A 435 -11.438 11.174 -4.794 1.00 75.03 H new ATOM 0 HB VAL A 435 -13.096 12.065 -3.200 1.00 42.03 H new ATOM 0 HG11 VAL A 435 -11.723 11.843 -1.155 1.00 30.15 H new ATOM 0 HG12 VAL A 435 -11.307 10.620 -2.379 1.00 30.15 H new ATOM 0 HG13 VAL A 435 -10.251 12.032 -2.138 1.00 30.15 H new ATOM 0 HG21 VAL A 435 -12.583 14.033 -1.815 1.00 14.42 H new ATOM 0 HG22 VAL A 435 -11.158 14.363 -2.828 1.00 14.42 H new ATOM 0 HG23 VAL A 435 -12.790 14.451 -3.532 1.00 14.42 H new ATOM 516 N LEU A 436 -12.029 14.066 -6.156 1.00 74.30 N ATOM 517 CA LEU A 436 -12.862 14.761 -7.119 1.00 44.02 C ATOM 518 C LEU A 436 -12.267 14.811 -8.527 1.00 4.14 C ATOM 519 O LEU A 436 -12.997 14.894 -9.524 1.00 73.23 O ATOM 520 CB LEU A 436 -13.162 16.168 -6.605 1.00 62.13 C ATOM 521 CG LEU A 436 -11.983 17.089 -6.313 1.00 41.43 C ATOM 522 CD1 LEU A 436 -11.438 17.750 -7.559 1.00 62.13 C ATOM 523 CD2 LEU A 436 -12.396 18.086 -5.327 1.00 43.31 C ATOM 0 H LEU A 436 -11.171 14.556 -5.901 1.00 74.30 H new ATOM 0 HA LEU A 436 -13.785 14.190 -7.215 1.00 44.02 H new ATOM 0 HB2 LEU A 436 -13.799 16.663 -7.338 1.00 62.13 H new ATOM 0 HB3 LEU A 436 -13.746 16.072 -5.689 1.00 62.13 H new ATOM 0 HG LEU A 436 -11.168 16.486 -5.913 1.00 41.43 H new ATOM 0 HD11 LEU A 436 -10.600 18.394 -7.292 1.00 62.13 H new ATOM 0 HD12 LEU A 436 -11.099 16.985 -8.258 1.00 62.13 H new ATOM 0 HD13 LEU A 436 -12.221 18.347 -8.026 1.00 62.13 H new ATOM 0 HD21 LEU A 436 -11.560 18.751 -5.110 1.00 43.31 H new ATOM 0 HD22 LEU A 436 -13.228 18.667 -5.724 1.00 43.31 H new ATOM 0 HD23 LEU A 436 -12.708 17.584 -4.411 1.00 43.31 H new ATOM 535 N MET A 437 -10.959 14.735 -8.613 1.00 62.23 N ATOM 536 CA MET A 437 -10.262 15.010 -9.859 1.00 30.34 C ATOM 537 C MET A 437 -9.920 13.729 -10.633 1.00 52.43 C ATOM 538 O MET A 437 -9.511 12.739 -10.036 1.00 3.44 O ATOM 539 CB MET A 437 -9.002 15.829 -9.537 1.00 1.43 C ATOM 540 CG MET A 437 -8.283 16.427 -10.731 1.00 54.51 C ATOM 541 SD MET A 437 -6.879 17.457 -10.241 1.00 4.44 S ATOM 542 CE MET A 437 -7.683 18.651 -9.147 1.00 22.23 C ATOM 0 H MET A 437 -10.350 14.484 -7.834 1.00 62.23 H new ATOM 0 HA MET A 437 -10.919 15.582 -10.515 1.00 30.34 H new ATOM 0 HB2 MET A 437 -9.280 16.638 -8.861 1.00 1.43 H new ATOM 0 HB3 MET A 437 -8.303 15.189 -8.998 1.00 1.43 H new ATOM 0 HG2 MET A 437 -7.933 15.625 -11.381 1.00 54.51 H new ATOM 0 HG3 MET A 437 -8.984 17.025 -11.313 1.00 54.51 H new ATOM 0 HE1 MET A 437 -7.081 19.558 -9.093 1.00 22.23 H new ATOM 0 HE2 MET A 437 -8.671 18.894 -9.538 1.00 22.23 H new ATOM 0 HE3 MET A 437 -7.783 18.222 -8.150 1.00 22.23 H new ATOM 552 N PRO A 438 -10.094 13.758 -11.996 1.00 70.20 N ATOM 553 CA PRO A 438 -9.792 12.632 -12.930 1.00 24.14 C ATOM 554 C PRO A 438 -8.496 11.847 -12.634 1.00 65.14 C ATOM 555 O PRO A 438 -8.400 10.668 -12.977 1.00 34.13 O ATOM 556 CB PRO A 438 -9.690 13.337 -14.271 1.00 52.41 C ATOM 557 CG PRO A 438 -10.712 14.409 -14.176 1.00 12.25 C ATOM 558 CD PRO A 438 -10.661 14.906 -12.753 1.00 12.14 C ATOM 0 HA PRO A 438 -10.558 11.860 -12.858 1.00 24.14 H new ATOM 0 HB2 PRO A 438 -8.693 13.746 -14.435 1.00 52.41 H new ATOM 0 HB3 PRO A 438 -9.896 12.658 -15.098 1.00 52.41 H new ATOM 0 HG2 PRO A 438 -10.499 15.215 -14.879 1.00 12.25 H new ATOM 0 HG3 PRO A 438 -11.703 14.026 -14.421 1.00 12.25 H new ATOM 0 HD2 PRO A 438 -10.035 15.794 -12.662 1.00 12.14 H new ATOM 0 HD3 PRO A 438 -11.652 15.176 -12.388 1.00 12.14 H new ATOM 566 N GLN A 439 -7.512 12.498 -12.013 1.00 62.20 N ATOM 567 CA GLN A 439 -6.248 11.847 -11.631 1.00 42.32 C ATOM 568 C GLN A 439 -6.484 10.591 -10.773 1.00 71.05 C ATOM 569 O GLN A 439 -5.656 9.673 -10.766 1.00 15.34 O ATOM 570 CB GLN A 439 -5.312 12.830 -10.904 1.00 64.23 C ATOM 571 CG GLN A 439 -5.909 13.460 -9.653 1.00 70.12 C ATOM 572 CD GLN A 439 -4.959 14.421 -8.949 1.00 41.33 C ATOM 573 OE1 GLN A 439 -5.388 15.383 -8.332 1.00 41.24 O ATOM 574 NE2 GLN A 439 -3.673 14.153 -9.011 1.00 23.04 N ATOM 0 H GLN A 439 -7.563 13.485 -11.760 1.00 62.20 H new ATOM 0 HA GLN A 439 -5.764 11.530 -12.554 1.00 42.32 H new ATOM 0 HB2 GLN A 439 -4.396 12.306 -10.630 1.00 64.23 H new ATOM 0 HB3 GLN A 439 -5.030 13.623 -11.596 1.00 64.23 H new ATOM 0 HG2 GLN A 439 -6.820 13.994 -9.923 1.00 70.12 H new ATOM 0 HG3 GLN A 439 -6.196 12.670 -8.959 1.00 70.12 H new ATOM 0 HE21 GLN A 439 -3.346 13.341 -9.535 1.00 23.04 H new ATOM 0 HE22 GLN A 439 -3.003 14.757 -8.535 1.00 23.04 H new ATOM 583 N VAL A 440 -7.622 10.550 -10.073 1.00 60.43 N ATOM 584 CA VAL A 440 -7.983 9.412 -9.245 1.00 61.30 C ATOM 585 C VAL A 440 -8.090 8.126 -10.083 1.00 30.22 C ATOM 586 O VAL A 440 -7.800 7.053 -9.593 1.00 44.24 O ATOM 587 CB VAL A 440 -9.302 9.642 -8.440 1.00 63.13 C ATOM 588 CG1 VAL A 440 -10.527 9.769 -9.340 1.00 63.44 C ATOM 589 CG2 VAL A 440 -9.504 8.564 -7.384 1.00 75.44 C ATOM 0 H VAL A 440 -8.310 11.303 -10.069 1.00 60.43 H new ATOM 0 HA VAL A 440 -7.178 9.297 -8.520 1.00 61.30 H new ATOM 0 HB VAL A 440 -9.189 10.599 -7.930 1.00 63.13 H new ATOM 0 HG11 VAL A 440 -11.414 9.927 -8.727 1.00 63.44 H new ATOM 0 HG12 VAL A 440 -10.397 10.615 -10.015 1.00 63.44 H new ATOM 0 HG13 VAL A 440 -10.647 8.855 -9.922 1.00 63.44 H new ATOM 0 HG21 VAL A 440 -10.431 8.754 -6.842 1.00 75.44 H new ATOM 0 HG22 VAL A 440 -9.559 7.588 -7.866 1.00 75.44 H new ATOM 0 HG23 VAL A 440 -8.667 8.577 -6.686 1.00 75.44 H new ATOM 599 N LEU A 441 -8.471 8.252 -11.365 1.00 55.51 N ATOM 600 CA LEU A 441 -8.608 7.083 -12.242 1.00 71.13 C ATOM 601 C LEU A 441 -7.308 6.297 -12.380 1.00 11.44 C ATOM 602 O LEU A 441 -7.330 5.072 -12.531 1.00 1.52 O ATOM 603 CB LEU A 441 -9.215 7.404 -13.631 1.00 41.20 C ATOM 604 CG LEU A 441 -10.731 7.719 -13.698 1.00 52.31 C ATOM 605 CD1 LEU A 441 -11.097 8.996 -12.971 1.00 14.12 C ATOM 606 CD2 LEU A 441 -11.196 7.770 -15.139 1.00 53.10 C ATOM 0 H LEU A 441 -8.687 9.143 -11.811 1.00 55.51 H new ATOM 0 HA LEU A 441 -9.331 6.445 -11.734 1.00 71.13 H new ATOM 0 HB2 LEU A 441 -8.676 8.257 -14.044 1.00 41.20 H new ATOM 0 HB3 LEU A 441 -9.019 6.556 -14.287 1.00 41.20 H new ATOM 0 HG LEU A 441 -11.248 6.909 -13.183 1.00 52.31 H new ATOM 0 HD11 LEU A 441 -12.171 9.166 -13.052 1.00 14.12 H new ATOM 0 HD12 LEU A 441 -10.821 8.908 -11.920 1.00 14.12 H new ATOM 0 HD13 LEU A 441 -10.563 9.835 -13.417 1.00 14.12 H new ATOM 0 HD21 LEU A 441 -12.263 7.992 -15.169 1.00 53.10 H new ATOM 0 HD22 LEU A 441 -10.648 8.548 -15.671 1.00 53.10 H new ATOM 0 HD23 LEU A 441 -11.012 6.807 -15.615 1.00 53.10 H new ATOM 618 N HIS A 442 -6.180 6.984 -12.307 1.00 31.04 N ATOM 619 CA HIS A 442 -4.891 6.315 -12.362 1.00 54.13 C ATOM 620 C HIS A 442 -4.695 5.467 -11.103 1.00 34.31 C ATOM 621 O HIS A 442 -4.150 4.380 -11.161 1.00 72.34 O ATOM 622 CB HIS A 442 -3.748 7.331 -12.533 1.00 3.45 C ATOM 623 CG HIS A 442 -2.375 6.715 -12.611 1.00 74.42 C ATOM 624 ND1 HIS A 442 -1.318 7.146 -11.854 1.00 21.10 N ATOM 625 CD2 HIS A 442 -1.889 5.720 -13.391 1.00 4.14 C ATOM 626 CE1 HIS A 442 -0.248 6.451 -12.154 1.00 65.15 C ATOM 627 NE2 HIS A 442 -0.567 5.580 -13.082 1.00 72.23 N ATOM 0 H HIS A 442 -6.130 7.998 -12.210 1.00 31.04 H new ATOM 0 HA HIS A 442 -4.872 5.658 -13.231 1.00 54.13 H new ATOM 0 HB2 HIS A 442 -3.925 7.910 -13.439 1.00 3.45 H new ATOM 0 HB3 HIS A 442 -3.772 8.031 -11.698 1.00 3.45 H new ATOM 0 HD2 HIS A 442 -2.443 5.146 -14.119 1.00 4.14 H new ATOM 0 HE1 HIS A 442 0.730 6.574 -11.712 1.00 65.15 H new ATOM 0 HE2 HIS A 442 0.071 4.906 -13.505 1.00 72.23 H new ATOM 636 N TYR A 443 -5.176 5.970 -9.985 1.00 61.54 N ATOM 637 CA TYR A 443 -5.104 5.249 -8.717 1.00 34.54 C ATOM 638 C TYR A 443 -6.167 4.168 -8.670 1.00 11.21 C ATOM 639 O TYR A 443 -5.990 3.145 -8.037 1.00 72.35 O ATOM 640 CB TYR A 443 -5.245 6.203 -7.535 1.00 22.35 C ATOM 641 CG TYR A 443 -4.131 7.212 -7.456 1.00 15.21 C ATOM 642 CD1 TYR A 443 -2.984 6.948 -6.726 1.00 24.23 C ATOM 643 CD2 TYR A 443 -4.224 8.428 -8.116 1.00 21.13 C ATOM 644 CE1 TYR A 443 -1.956 7.870 -6.657 1.00 2.02 C ATOM 645 CE2 TYR A 443 -3.208 9.352 -8.052 1.00 54.15 C ATOM 646 CZ TYR A 443 -2.076 9.071 -7.321 1.00 61.10 C ATOM 647 OH TYR A 443 -1.055 9.993 -7.264 1.00 71.25 O ATOM 0 H TYR A 443 -5.626 6.883 -9.922 1.00 61.54 H new ATOM 0 HA TYR A 443 -4.124 4.777 -8.644 1.00 34.54 H new ATOM 0 HB2 TYR A 443 -6.198 6.727 -7.610 1.00 22.35 H new ATOM 0 HB3 TYR A 443 -5.271 5.626 -6.611 1.00 22.35 H new ATOM 0 HD1 TYR A 443 -2.891 6.008 -6.203 1.00 24.23 H new ATOM 0 HD2 TYR A 443 -5.110 8.653 -8.691 1.00 21.13 H new ATOM 0 HE1 TYR A 443 -1.066 7.650 -6.087 1.00 2.02 H new ATOM 0 HE2 TYR A 443 -3.298 10.294 -8.573 1.00 54.15 H new ATOM 0 HH TYR A 443 -1.300 10.785 -7.787 1.00 71.25 H new ATOM 657 N ALA A 444 -7.265 4.411 -9.368 1.00 62.41 N ATOM 658 CA ALA A 444 -8.351 3.445 -9.503 1.00 2.20 C ATOM 659 C ALA A 444 -7.837 2.177 -10.156 1.00 40.00 C ATOM 660 O ALA A 444 -8.302 1.084 -9.849 1.00 72.10 O ATOM 661 CB ALA A 444 -9.507 4.030 -10.293 1.00 61.41 C ATOM 0 H ALA A 444 -7.432 5.288 -9.861 1.00 62.41 H new ATOM 0 HA ALA A 444 -8.723 3.201 -8.508 1.00 2.20 H new ATOM 0 HB1 ALA A 444 -10.302 3.289 -10.378 1.00 61.41 H new ATOM 0 HB2 ALA A 444 -9.888 4.913 -9.780 1.00 61.41 H new ATOM 0 HB3 ALA A 444 -9.163 4.309 -11.289 1.00 61.41 H new ATOM 667 N GLN A 445 -6.867 2.340 -11.064 1.00 3.32 N ATOM 668 CA GLN A 445 -6.189 1.205 -11.682 1.00 60.31 C ATOM 669 C GLN A 445 -5.541 0.370 -10.590 1.00 61.34 C ATOM 670 O GLN A 445 -5.749 -0.823 -10.510 1.00 21.04 O ATOM 671 CB GLN A 445 -5.115 1.686 -12.660 1.00 3.40 C ATOM 672 CG GLN A 445 -5.640 2.468 -13.850 1.00 75.30 C ATOM 673 CD GLN A 445 -4.521 2.991 -14.733 1.00 5.35 C ATOM 674 OE1 GLN A 445 -3.453 2.398 -14.821 1.00 61.03 O ATOM 675 NE2 GLN A 445 -4.762 4.096 -15.396 1.00 72.03 N ATOM 0 H GLN A 445 -6.537 3.250 -11.384 1.00 3.32 H new ATOM 0 HA GLN A 445 -6.917 0.610 -12.233 1.00 60.31 H new ATOM 0 HB2 GLN A 445 -4.404 2.310 -12.118 1.00 3.40 H new ATOM 0 HB3 GLN A 445 -4.564 0.820 -13.027 1.00 3.40 H new ATOM 0 HG2 GLN A 445 -6.298 1.830 -14.440 1.00 75.30 H new ATOM 0 HG3 GLN A 445 -6.242 3.305 -13.496 1.00 75.30 H new ATOM 0 HE21 GLN A 445 -5.663 4.563 -15.298 1.00 72.03 H new ATOM 0 HE22 GLN A 445 -4.048 4.489 -16.010 1.00 72.03 H new ATOM 684 N TYR A 446 -4.794 1.043 -9.723 1.00 63.40 N ATOM 685 CA TYR A 446 -4.134 0.417 -8.579 1.00 44.24 C ATOM 686 C TYR A 446 -5.139 -0.275 -7.662 1.00 44.31 C ATOM 687 O TYR A 446 -4.887 -1.387 -7.169 1.00 31.12 O ATOM 688 CB TYR A 446 -3.289 1.452 -7.816 1.00 20.14 C ATOM 689 CG TYR A 446 -2.020 1.841 -8.543 1.00 62.42 C ATOM 690 CD1 TYR A 446 -0.849 1.127 -8.338 1.00 31.31 C ATOM 691 CD2 TYR A 446 -1.990 2.903 -9.433 1.00 1.22 C ATOM 692 CE1 TYR A 446 0.312 1.456 -8.997 1.00 23.12 C ATOM 693 CE2 TYR A 446 -0.828 3.242 -10.097 1.00 63.33 C ATOM 694 CZ TYR A 446 0.319 2.511 -9.875 1.00 22.11 C ATOM 695 OH TYR A 446 1.481 2.835 -10.541 1.00 4.32 O ATOM 0 H TYR A 446 -4.627 2.047 -9.793 1.00 63.40 H new ATOM 0 HA TYR A 446 -3.464 -0.357 -8.954 1.00 44.24 H new ATOM 0 HB2 TYR A 446 -3.889 2.345 -7.644 1.00 20.14 H new ATOM 0 HB3 TYR A 446 -3.030 1.049 -6.837 1.00 20.14 H new ATOM 0 HD1 TYR A 446 -0.849 0.297 -7.647 1.00 31.31 H new ATOM 0 HD2 TYR A 446 -2.889 3.474 -9.610 1.00 1.22 H new ATOM 0 HE1 TYR A 446 1.214 0.887 -8.825 1.00 23.12 H new ATOM 0 HE2 TYR A 446 -0.818 4.074 -10.785 1.00 63.33 H new ATOM 0 HH TYR A 446 1.319 3.604 -11.126 1.00 4.32 H new ATOM 705 N VAL A 447 -6.276 0.368 -7.460 1.00 54.23 N ATOM 706 CA VAL A 447 -7.367 -0.194 -6.674 1.00 32.00 C ATOM 707 C VAL A 447 -7.901 -1.465 -7.348 1.00 1.23 C ATOM 708 O VAL A 447 -8.178 -2.462 -6.686 1.00 72.55 O ATOM 709 CB VAL A 447 -8.530 0.833 -6.492 1.00 13.44 C ATOM 710 CG1 VAL A 447 -9.686 0.229 -5.701 1.00 63.03 C ATOM 711 CG2 VAL A 447 -8.026 2.092 -5.803 1.00 43.12 C ATOM 0 H VAL A 447 -6.472 1.296 -7.836 1.00 54.23 H new ATOM 0 HA VAL A 447 -6.974 -0.440 -5.688 1.00 32.00 H new ATOM 0 HB VAL A 447 -8.899 1.095 -7.484 1.00 13.44 H new ATOM 0 HG11 VAL A 447 -10.479 0.969 -5.592 1.00 63.03 H new ATOM 0 HG12 VAL A 447 -10.073 -0.642 -6.230 1.00 63.03 H new ATOM 0 HG13 VAL A 447 -9.334 -0.073 -4.715 1.00 63.03 H new ATOM 0 HG21 VAL A 447 -8.849 2.796 -5.684 1.00 43.12 H new ATOM 0 HG22 VAL A 447 -7.625 1.835 -4.823 1.00 43.12 H new ATOM 0 HG23 VAL A 447 -7.242 2.549 -6.407 1.00 43.12 H new ATOM 721 N LEU A 448 -7.982 -1.432 -8.670 1.00 11.24 N ATOM 722 CA LEU A 448 -8.492 -2.525 -9.450 1.00 4.32 C ATOM 723 C LEU A 448 -7.531 -3.697 -9.407 1.00 44.32 C ATOM 724 O LEU A 448 -7.948 -4.857 -9.414 1.00 20.25 O ATOM 725 CB LEU A 448 -8.716 -2.059 -10.893 1.00 21.04 C ATOM 726 CG LEU A 448 -9.137 -3.122 -11.895 1.00 1.12 C ATOM 727 CD1 LEU A 448 -10.462 -3.760 -11.504 1.00 75.21 C ATOM 728 CD2 LEU A 448 -9.205 -2.539 -13.294 1.00 73.14 C ATOM 0 H LEU A 448 -7.689 -0.630 -9.228 1.00 11.24 H new ATOM 0 HA LEU A 448 -9.443 -2.855 -9.032 1.00 4.32 H new ATOM 0 HB2 LEU A 448 -9.477 -1.279 -10.885 1.00 21.04 H new ATOM 0 HB3 LEU A 448 -7.794 -1.601 -11.250 1.00 21.04 H new ATOM 0 HG LEU A 448 -8.382 -3.908 -11.888 1.00 1.12 H new ATOM 0 HD11 LEU A 448 -10.734 -4.515 -12.241 1.00 75.21 H new ATOM 0 HD12 LEU A 448 -10.366 -4.228 -10.524 1.00 75.21 H new ATOM 0 HD13 LEU A 448 -11.237 -2.995 -11.466 1.00 75.21 H new ATOM 0 HD21 LEU A 448 -9.508 -3.315 -13.997 1.00 73.14 H new ATOM 0 HD22 LEU A 448 -9.932 -1.727 -13.315 1.00 73.14 H new ATOM 0 HD23 LEU A 448 -8.224 -2.156 -13.577 1.00 73.14 H new ATOM 740 N LEU A 449 -6.255 -3.392 -9.341 1.00 41.02 N ATOM 741 CA LEU A 449 -5.236 -4.413 -9.284 1.00 24.30 C ATOM 742 C LEU A 449 -5.318 -5.117 -7.933 1.00 24.22 C ATOM 743 O LEU A 449 -5.304 -6.354 -7.855 1.00 72.21 O ATOM 744 CB LEU A 449 -3.837 -3.801 -9.470 1.00 73.13 C ATOM 745 CG LEU A 449 -3.650 -2.869 -10.675 1.00 34.04 C ATOM 746 CD1 LEU A 449 -2.208 -2.439 -10.830 1.00 74.11 C ATOM 747 CD2 LEU A 449 -4.200 -3.466 -11.954 1.00 34.34 C ATOM 0 H LEU A 449 -5.897 -2.437 -9.325 1.00 41.02 H new ATOM 0 HA LEU A 449 -5.402 -5.128 -10.090 1.00 24.30 H new ATOM 0 HB2 LEU A 449 -3.585 -3.245 -8.567 1.00 73.13 H new ATOM 0 HB3 LEU A 449 -3.117 -4.615 -9.554 1.00 73.13 H new ATOM 0 HG LEU A 449 -4.236 -1.972 -10.473 1.00 34.04 H new ATOM 0 HD11 LEU A 449 -2.116 -1.780 -11.693 1.00 74.11 H new ATOM 0 HD12 LEU A 449 -1.888 -1.909 -9.933 1.00 74.11 H new ATOM 0 HD13 LEU A 449 -1.580 -3.318 -10.975 1.00 74.11 H new ATOM 0 HD21 LEU A 449 -4.044 -2.769 -12.777 1.00 34.34 H new ATOM 0 HD22 LEU A 449 -3.686 -4.403 -12.169 1.00 34.34 H new ATOM 0 HD23 LEU A 449 -5.267 -3.656 -11.837 1.00 34.34 H new ATOM 759 N GLY A 450 -5.429 -4.309 -6.877 1.00 75.15 N ATOM 760 CA GLY A 450 -5.536 -4.826 -5.530 1.00 41.21 C ATOM 761 C GLY A 450 -6.803 -5.617 -5.332 1.00 41.22 C ATOM 762 O GLY A 450 -6.776 -6.719 -4.767 1.00 3.33 O ATOM 0 H GLY A 450 -5.446 -3.291 -6.939 1.00 75.15 H new ATOM 0 HA2 GLY A 450 -4.675 -5.459 -5.314 1.00 41.21 H new ATOM 0 HA3 GLY A 450 -5.509 -3.999 -4.820 1.00 41.21 H new ATOM 766 N LEU A 451 -7.911 -5.072 -5.808 1.00 32.21 N ATOM 767 CA LEU A 451 -9.192 -5.738 -5.712 1.00 75.54 C ATOM 768 C LEU A 451 -9.189 -7.002 -6.552 1.00 31.44 C ATOM 769 O LEU A 451 -9.717 -8.007 -6.144 1.00 61.32 O ATOM 770 CB LEU A 451 -10.335 -4.806 -6.147 1.00 2.44 C ATOM 771 CG LEU A 451 -11.753 -5.400 -6.102 1.00 23.12 C ATOM 772 CD1 LEU A 451 -12.122 -5.831 -4.691 1.00 14.42 C ATOM 773 CD2 LEU A 451 -12.762 -4.403 -6.636 1.00 53.31 C ATOM 0 H LEU A 451 -7.944 -4.162 -6.268 1.00 32.21 H new ATOM 0 HA LEU A 451 -9.358 -6.008 -4.669 1.00 75.54 H new ATOM 0 HB2 LEU A 451 -10.315 -3.920 -5.512 1.00 2.44 H new ATOM 0 HB3 LEU A 451 -10.136 -4.473 -7.165 1.00 2.44 H new ATOM 0 HG LEU A 451 -11.769 -6.285 -6.738 1.00 23.12 H new ATOM 0 HD11 LEU A 451 -13.129 -6.247 -4.689 1.00 14.42 H new ATOM 0 HD12 LEU A 451 -11.417 -6.587 -4.345 1.00 14.42 H new ATOM 0 HD13 LEU A 451 -12.085 -4.968 -4.026 1.00 14.42 H new ATOM 0 HD21 LEU A 451 -13.760 -4.839 -6.597 1.00 53.31 H new ATOM 0 HD22 LEU A 451 -12.737 -3.499 -6.028 1.00 53.31 H new ATOM 0 HD23 LEU A 451 -12.515 -4.153 -7.668 1.00 53.31 H new ATOM 785 N GLY A 452 -8.560 -6.934 -7.712 1.00 13.40 N ATOM 786 CA GLY A 452 -8.484 -8.077 -8.598 1.00 72.11 C ATOM 787 C GLY A 452 -7.697 -9.216 -7.995 1.00 5.21 C ATOM 788 O GLY A 452 -8.112 -10.376 -8.069 1.00 42.41 O ATOM 0 H GLY A 452 -8.094 -6.096 -8.061 1.00 13.40 H new ATOM 0 HA2 GLY A 452 -9.492 -8.419 -8.834 1.00 72.11 H new ATOM 0 HA3 GLY A 452 -8.021 -7.776 -9.538 1.00 72.11 H new ATOM 792 N GLY A 453 -6.571 -8.884 -7.386 1.00 70.43 N ATOM 793 CA GLY A 453 -5.749 -9.881 -6.735 1.00 22.34 C ATOM 794 C GLY A 453 -6.456 -10.496 -5.549 1.00 2.23 C ATOM 795 O GLY A 453 -6.332 -11.693 -5.289 1.00 32.41 O ATOM 0 H GLY A 453 -6.209 -7.932 -7.331 1.00 70.43 H new ATOM 0 HA2 GLY A 453 -5.489 -10.662 -7.449 1.00 22.34 H new ATOM 0 HA3 GLY A 453 -4.815 -9.425 -6.407 1.00 22.34 H new ATOM 799 N LEU A 454 -7.216 -9.673 -4.841 1.00 73.11 N ATOM 800 CA LEU A 454 -7.986 -10.119 -3.689 1.00 41.12 C ATOM 801 C LEU A 454 -9.204 -10.921 -4.150 1.00 75.34 C ATOM 802 O LEU A 454 -9.655 -11.844 -3.481 1.00 31.31 O ATOM 803 CB LEU A 454 -8.422 -8.912 -2.846 1.00 43.20 C ATOM 804 CG LEU A 454 -9.201 -9.219 -1.561 1.00 23.03 C ATOM 805 CD1 LEU A 454 -8.364 -10.052 -0.598 1.00 22.22 C ATOM 806 CD2 LEU A 454 -9.658 -7.934 -0.895 1.00 65.32 C ATOM 0 H LEU A 454 -7.316 -8.679 -5.048 1.00 73.11 H new ATOM 0 HA LEU A 454 -7.360 -10.764 -3.072 1.00 41.12 H new ATOM 0 HB2 LEU A 454 -7.531 -8.344 -2.577 1.00 43.20 H new ATOM 0 HB3 LEU A 454 -9.037 -8.264 -3.471 1.00 43.20 H new ATOM 0 HG LEU A 454 -10.082 -9.801 -1.832 1.00 23.03 H new ATOM 0 HD11 LEU A 454 -8.941 -10.255 0.304 1.00 22.22 H new ATOM 0 HD12 LEU A 454 -8.092 -10.994 -1.074 1.00 22.22 H new ATOM 0 HD13 LEU A 454 -7.459 -9.504 -0.334 1.00 22.22 H new ATOM 0 HD21 LEU A 454 -10.209 -8.172 0.015 1.00 65.32 H new ATOM 0 HD22 LEU A 454 -8.789 -7.325 -0.645 1.00 65.32 H new ATOM 0 HD23 LEU A 454 -10.304 -7.381 -1.576 1.00 65.32 H new ATOM 818 N LEU A 455 -9.724 -10.556 -5.307 1.00 65.21 N ATOM 819 CA LEU A 455 -10.875 -11.215 -5.912 1.00 44.50 C ATOM 820 C LEU A 455 -10.547 -12.658 -6.248 1.00 31.33 C ATOM 821 O LEU A 455 -11.422 -13.502 -6.241 1.00 11.35 O ATOM 822 CB LEU A 455 -11.340 -10.453 -7.167 1.00 44.10 C ATOM 823 CG LEU A 455 -12.576 -10.999 -7.896 1.00 61.21 C ATOM 824 CD1 LEU A 455 -13.801 -10.979 -6.993 1.00 43.35 C ATOM 825 CD2 LEU A 455 -12.834 -10.201 -9.162 1.00 42.21 C ATOM 0 H LEU A 455 -9.357 -9.784 -5.863 1.00 65.21 H new ATOM 0 HA LEU A 455 -11.692 -11.210 -5.191 1.00 44.50 H new ATOM 0 HB2 LEU A 455 -11.544 -9.421 -6.881 1.00 44.10 H new ATOM 0 HB3 LEU A 455 -10.512 -10.430 -7.875 1.00 44.10 H new ATOM 0 HG LEU A 455 -12.379 -12.036 -8.168 1.00 61.21 H new ATOM 0 HD11 LEU A 455 -14.660 -11.371 -7.537 1.00 43.35 H new ATOM 0 HD12 LEU A 455 -13.615 -11.596 -6.114 1.00 43.35 H new ATOM 0 HD13 LEU A 455 -14.006 -9.955 -6.681 1.00 43.35 H new ATOM 0 HD21 LEU A 455 -13.713 -10.598 -9.670 1.00 42.21 H new ATOM 0 HD22 LEU A 455 -13.005 -9.156 -8.905 1.00 42.21 H new ATOM 0 HD23 LEU A 455 -11.969 -10.276 -9.822 1.00 42.21 H new ATOM 837 N LEU A 456 -9.264 -12.929 -6.506 1.00 13.03 N ATOM 838 CA LEU A 456 -8.792 -14.275 -6.841 1.00 64.24 C ATOM 839 C LEU A 456 -9.106 -15.263 -5.724 1.00 34.32 C ATOM 840 O LEU A 456 -9.374 -16.430 -5.987 1.00 73.02 O ATOM 841 CB LEU A 456 -7.276 -14.270 -7.089 1.00 73.32 C ATOM 842 CG LEU A 456 -6.763 -13.439 -8.271 1.00 34.34 C ATOM 843 CD1 LEU A 456 -5.243 -13.461 -8.308 1.00 31.13 C ATOM 844 CD2 LEU A 456 -7.317 -13.977 -9.579 1.00 30.02 C ATOM 0 H LEU A 456 -8.527 -12.225 -6.489 1.00 13.03 H new ATOM 0 HA LEU A 456 -9.312 -14.585 -7.748 1.00 64.24 H new ATOM 0 HB2 LEU A 456 -6.787 -13.909 -6.184 1.00 73.32 H new ATOM 0 HB3 LEU A 456 -6.954 -15.301 -7.236 1.00 73.32 H new ATOM 0 HG LEU A 456 -7.102 -12.411 -8.142 1.00 34.34 H new ATOM 0 HD11 LEU A 456 -4.891 -12.867 -9.152 1.00 31.13 H new ATOM 0 HD12 LEU A 456 -4.850 -13.043 -7.381 1.00 31.13 H new ATOM 0 HD13 LEU A 456 -4.897 -14.489 -8.418 1.00 31.13 H new ATOM 0 HD21 LEU A 456 -6.943 -13.376 -10.407 1.00 30.02 H new ATOM 0 HD22 LEU A 456 -7.001 -15.012 -9.710 1.00 30.02 H new ATOM 0 HD23 LEU A 456 -8.406 -13.930 -9.560 1.00 30.02 H new ATOM 856 N LEU A 457 -9.109 -14.782 -4.483 1.00 13.50 N ATOM 857 CA LEU A 457 -9.383 -15.635 -3.330 1.00 13.43 C ATOM 858 C LEU A 457 -10.815 -16.144 -3.340 1.00 30.55 C ATOM 859 O LEU A 457 -11.073 -17.269 -2.912 1.00 75.30 O ATOM 860 CB LEU A 457 -9.103 -14.929 -1.977 1.00 4.31 C ATOM 861 CG LEU A 457 -7.639 -14.604 -1.605 1.00 54.02 C ATOM 862 CD1 LEU A 457 -7.016 -13.598 -2.547 1.00 62.44 C ATOM 863 CD2 LEU A 457 -7.556 -14.109 -0.170 1.00 64.42 C ATOM 0 H LEU A 457 -8.925 -13.806 -4.250 1.00 13.50 H new ATOM 0 HA LEU A 457 -8.697 -16.477 -3.421 1.00 13.43 H new ATOM 0 HB2 LEU A 457 -9.663 -13.994 -1.969 1.00 4.31 H new ATOM 0 HB3 LEU A 457 -9.515 -15.554 -1.185 1.00 4.31 H new ATOM 0 HG LEU A 457 -7.069 -15.528 -1.700 1.00 54.02 H new ATOM 0 HD11 LEU A 457 -5.988 -13.403 -2.243 1.00 62.44 H new ATOM 0 HD12 LEU A 457 -7.025 -13.996 -3.562 1.00 62.44 H new ATOM 0 HD13 LEU A 457 -7.586 -12.669 -2.516 1.00 62.44 H new ATOM 0 HD21 LEU A 457 -6.519 -13.884 0.078 1.00 64.42 H new ATOM 0 HD22 LEU A 457 -8.159 -13.208 -0.061 1.00 64.42 H new ATOM 0 HD23 LEU A 457 -7.931 -14.880 0.503 1.00 64.42 H new ATOM 875 N VAL A 458 -11.727 -15.328 -3.860 1.00 12.14 N ATOM 876 CA VAL A 458 -13.160 -15.639 -3.864 1.00 72.04 C ATOM 877 C VAL A 458 -13.497 -16.989 -4.567 1.00 4.13 C ATOM 878 O VAL A 458 -14.084 -17.873 -3.925 1.00 42.53 O ATOM 879 CB VAL A 458 -14.032 -14.458 -4.409 1.00 30.00 C ATOM 880 CG1 VAL A 458 -15.507 -14.819 -4.425 1.00 34.41 C ATOM 881 CG2 VAL A 458 -13.807 -13.208 -3.564 1.00 12.45 C ATOM 0 H VAL A 458 -11.498 -14.432 -4.291 1.00 12.14 H new ATOM 0 HA VAL A 458 -13.429 -15.771 -2.816 1.00 72.04 H new ATOM 0 HB VAL A 458 -13.725 -14.259 -5.436 1.00 30.00 H new ATOM 0 HG11 VAL A 458 -16.083 -13.977 -4.809 1.00 34.41 H new ATOM 0 HG12 VAL A 458 -15.662 -15.687 -5.066 1.00 34.41 H new ATOM 0 HG13 VAL A 458 -15.836 -15.052 -3.412 1.00 34.41 H new ATOM 0 HG21 VAL A 458 -14.418 -12.392 -3.951 1.00 12.45 H new ATOM 0 HG22 VAL A 458 -14.087 -13.412 -2.531 1.00 12.45 H new ATOM 0 HG23 VAL A 458 -12.755 -12.925 -3.606 1.00 12.45 H new ATOM 891 N PRO A 459 -13.133 -17.200 -5.874 1.00 25.22 N ATOM 892 CA PRO A 459 -13.398 -18.474 -6.554 1.00 74.23 C ATOM 893 C PRO A 459 -12.663 -19.623 -5.884 1.00 33.53 C ATOM 894 O PRO A 459 -13.172 -20.742 -5.816 1.00 50.21 O ATOM 895 CB PRO A 459 -12.843 -18.262 -7.963 1.00 64.33 C ATOM 896 CG PRO A 459 -12.802 -16.794 -8.131 1.00 65.32 C ATOM 897 CD PRO A 459 -12.474 -16.249 -6.785 1.00 20.24 C ATOM 0 HA PRO A 459 -14.457 -18.732 -6.536 1.00 74.23 H new ATOM 0 HB2 PRO A 459 -11.851 -18.701 -8.068 1.00 64.33 H new ATOM 0 HB3 PRO A 459 -13.480 -18.729 -8.714 1.00 64.33 H new ATOM 0 HG2 PRO A 459 -12.051 -16.504 -8.866 1.00 65.32 H new ATOM 0 HG3 PRO A 459 -13.759 -16.413 -8.486 1.00 65.32 H new ATOM 0 HD2 PRO A 459 -11.398 -16.209 -6.617 1.00 20.24 H new ATOM 0 HD3 PRO A 459 -12.855 -15.236 -6.656 1.00 20.24 H new ATOM 905 N ILE A 460 -11.475 -19.333 -5.358 1.00 42.02 N ATOM 906 CA ILE A 460 -10.666 -20.337 -4.693 1.00 22.41 C ATOM 907 C ILE A 460 -11.388 -20.891 -3.458 1.00 2.41 C ATOM 908 O ILE A 460 -11.326 -22.082 -3.189 1.00 43.42 O ATOM 909 CB ILE A 460 -9.246 -19.807 -4.332 1.00 51.52 C ATOM 910 CG1 ILE A 460 -8.505 -19.407 -5.619 1.00 72.34 C ATOM 911 CG2 ILE A 460 -8.450 -20.864 -3.573 1.00 23.14 C ATOM 912 CD1 ILE A 460 -7.110 -18.856 -5.396 1.00 34.31 C ATOM 0 H ILE A 460 -11.054 -18.404 -5.383 1.00 42.02 H new ATOM 0 HA ILE A 460 -10.523 -21.156 -5.398 1.00 22.41 H new ATOM 0 HB ILE A 460 -9.350 -18.934 -3.687 1.00 51.52 H new ATOM 0 HG12 ILE A 460 -8.438 -20.278 -6.270 1.00 72.34 H new ATOM 0 HG13 ILE A 460 -9.097 -18.659 -6.147 1.00 72.34 H new ATOM 0 HG21 ILE A 460 -7.462 -20.472 -3.332 1.00 23.14 H new ATOM 0 HG22 ILE A 460 -8.973 -21.122 -2.652 1.00 23.14 H new ATOM 0 HG23 ILE A 460 -8.345 -21.755 -4.192 1.00 23.14 H new ATOM 0 HD11 ILE A 460 -6.662 -18.600 -6.356 1.00 34.31 H new ATOM 0 HD12 ILE A 460 -7.167 -17.964 -4.773 1.00 34.31 H new ATOM 0 HD13 ILE A 460 -6.497 -19.608 -4.898 1.00 34.31 H new ATOM 924 N ILE A 461 -12.119 -20.031 -2.753 1.00 22.55 N ATOM 925 CA ILE A 461 -12.907 -20.463 -1.594 1.00 51.12 C ATOM 926 C ILE A 461 -13.910 -21.542 -2.021 1.00 43.42 C ATOM 927 O ILE A 461 -14.084 -22.550 -1.342 1.00 21.11 O ATOM 928 CB ILE A 461 -13.668 -19.274 -0.935 1.00 33.41 C ATOM 929 CG1 ILE A 461 -12.677 -18.209 -0.465 1.00 21.34 C ATOM 930 CG2 ILE A 461 -14.516 -19.761 0.237 1.00 10.13 C ATOM 931 CD1 ILE A 461 -13.325 -16.981 0.131 1.00 1.40 C ATOM 0 H ILE A 461 -12.184 -19.034 -2.960 1.00 22.55 H new ATOM 0 HA ILE A 461 -12.215 -20.868 -0.856 1.00 51.12 H new ATOM 0 HB ILE A 461 -14.331 -18.834 -1.680 1.00 33.41 H new ATOM 0 HG12 ILE A 461 -12.011 -18.650 0.276 1.00 21.34 H new ATOM 0 HG13 ILE A 461 -12.058 -17.906 -1.310 1.00 21.34 H new ATOM 0 HG21 ILE A 461 -15.039 -18.916 0.684 1.00 10.13 H new ATOM 0 HG22 ILE A 461 -15.243 -20.491 -0.119 1.00 10.13 H new ATOM 0 HG23 ILE A 461 -13.872 -20.225 0.984 1.00 10.13 H new ATOM 0 HD11 ILE A 461 -12.553 -16.276 0.439 1.00 1.40 H new ATOM 0 HD12 ILE A 461 -13.969 -16.512 -0.613 1.00 1.40 H new ATOM 0 HD13 ILE A 461 -13.921 -17.268 0.998 1.00 1.40 H new ATOM 943 N CYS A 462 -14.506 -21.351 -3.188 1.00 72.14 N ATOM 944 CA CYS A 462 -15.487 -22.286 -3.704 1.00 24.52 C ATOM 945 C CYS A 462 -14.785 -23.570 -4.153 1.00 1.01 C ATOM 946 O CYS A 462 -15.336 -24.672 -4.043 1.00 50.34 O ATOM 947 CB CYS A 462 -16.278 -21.657 -4.858 1.00 63.32 C ATOM 948 SG CYS A 462 -17.587 -22.702 -5.531 1.00 12.52 S ATOM 0 H CYS A 462 -14.325 -20.552 -3.796 1.00 72.14 H new ATOM 0 HA CYS A 462 -16.196 -22.533 -2.914 1.00 24.52 H new ATOM 0 HB2 CYS A 462 -16.719 -20.723 -4.511 1.00 63.32 H new ATOM 0 HB3 CYS A 462 -15.585 -21.404 -5.660 1.00 63.32 H new ATOM 0 HG CYS A 462 -18.191 -22.074 -6.496 1.00 12.52 H new ATOM 954 N GLN A 463 -13.549 -23.422 -4.624 1.00 74.03 N ATOM 955 CA GLN A 463 -12.738 -24.563 -5.022 1.00 10.53 C ATOM 956 C GLN A 463 -12.490 -25.432 -3.802 1.00 60.35 C ATOM 957 O GLN A 463 -12.589 -26.655 -3.863 1.00 44.24 O ATOM 958 CB GLN A 463 -11.407 -24.104 -5.628 1.00 3.23 C ATOM 959 CG GLN A 463 -11.545 -23.235 -6.871 1.00 75.42 C ATOM 960 CD GLN A 463 -12.249 -23.919 -8.031 1.00 55.14 C ATOM 961 OE1 GLN A 463 -12.925 -23.265 -8.817 1.00 40.23 O ATOM 962 NE2 GLN A 463 -12.073 -25.212 -8.175 1.00 74.12 N ATOM 0 H GLN A 463 -13.089 -22.519 -4.738 1.00 74.03 H new ATOM 0 HA GLN A 463 -13.268 -25.134 -5.784 1.00 10.53 H new ATOM 0 HB2 GLN A 463 -10.850 -23.549 -4.872 1.00 3.23 H new ATOM 0 HB3 GLN A 463 -10.814 -24.984 -5.879 1.00 3.23 H new ATOM 0 HG2 GLN A 463 -12.094 -22.330 -6.610 1.00 75.42 H new ATOM 0 HG3 GLN A 463 -10.552 -22.923 -7.195 1.00 75.42 H new ATOM 0 HE21 GLN A 463 -11.504 -25.727 -7.503 1.00 74.12 H new ATOM 0 HE22 GLN A 463 -12.505 -25.701 -8.959 1.00 74.12 H new ATOM 971 N LEU A 464 -12.197 -24.777 -2.686 1.00 34.42 N ATOM 972 CA LEU A 464 -12.030 -25.445 -1.410 1.00 73.04 C ATOM 973 C LEU A 464 -13.313 -26.094 -0.937 1.00 54.03 C ATOM 974 O LEU A 464 -13.280 -27.191 -0.417 1.00 65.21 O ATOM 975 CB LEU A 464 -11.456 -24.514 -0.337 1.00 71.12 C ATOM 976 CG LEU A 464 -9.923 -24.337 -0.295 1.00 33.53 C ATOM 977 CD1 LEU A 464 -9.365 -23.815 -1.597 1.00 52.24 C ATOM 978 CD2 LEU A 464 -9.533 -23.434 0.856 1.00 22.05 C ATOM 0 H LEU A 464 -12.069 -23.766 -2.644 1.00 34.42 H new ATOM 0 HA LEU A 464 -11.301 -26.238 -1.575 1.00 73.04 H new ATOM 0 HB2 LEU A 464 -11.905 -23.530 -0.470 1.00 71.12 H new ATOM 0 HB3 LEU A 464 -11.779 -24.883 0.637 1.00 71.12 H new ATOM 0 HG LEU A 464 -9.487 -25.324 -0.141 1.00 33.53 H new ATOM 0 HD11 LEU A 464 -8.283 -23.709 -1.513 1.00 52.24 H new ATOM 0 HD12 LEU A 464 -9.600 -24.514 -2.400 1.00 52.24 H new ATOM 0 HD13 LEU A 464 -9.808 -22.844 -1.820 1.00 52.24 H new ATOM 0 HD21 LEU A 464 -8.450 -23.317 0.875 1.00 22.05 H new ATOM 0 HD22 LEU A 464 -10.001 -22.458 0.728 1.00 22.05 H new ATOM 0 HD23 LEU A 464 -9.867 -23.876 1.795 1.00 22.05 H new ATOM 990 N ARG A 465 -14.454 -25.433 -1.154 1.00 44.52 N ATOM 991 CA ARG A 465 -15.755 -26.004 -0.748 1.00 63.23 C ATOM 992 C ARG A 465 -16.034 -27.285 -1.535 1.00 64.13 C ATOM 993 O ARG A 465 -16.775 -28.159 -1.092 1.00 2.43 O ATOM 994 CB ARG A 465 -16.914 -25.022 -0.992 1.00 60.24 C ATOM 995 CG ARG A 465 -16.776 -23.662 -0.330 1.00 22.24 C ATOM 996 CD ARG A 465 -16.524 -23.769 1.156 1.00 51.32 C ATOM 997 NE ARG A 465 -16.510 -22.454 1.792 1.00 42.23 N ATOM 998 CZ ARG A 465 -15.865 -22.149 2.919 1.00 54.23 C ATOM 999 NH1 ARG A 465 -15.121 -23.061 3.534 1.00 22.30 N ATOM 1000 NH2 ARG A 465 -15.968 -20.929 3.429 1.00 3.13 N ATOM 0 H ARG A 465 -14.511 -24.518 -1.600 1.00 44.52 H new ATOM 0 HA ARG A 465 -15.693 -26.215 0.320 1.00 63.23 H new ATOM 0 HB2 ARG A 465 -17.020 -24.873 -2.067 1.00 60.24 H new ATOM 0 HB3 ARG A 465 -17.837 -25.484 -0.642 1.00 60.24 H new ATOM 0 HG2 ARG A 465 -15.957 -23.115 -0.796 1.00 22.24 H new ATOM 0 HG3 ARG A 465 -17.684 -23.083 -0.501 1.00 22.24 H new ATOM 0 HD2 ARG A 465 -17.296 -24.388 1.614 1.00 51.32 H new ATOM 0 HD3 ARG A 465 -15.571 -24.269 1.330 1.00 51.32 H new ATOM 0 HE ARG A 465 -17.036 -21.708 1.337 1.00 42.23 H new ATOM 0 HH11 ARG A 465 -15.041 -24.000 3.145 1.00 22.30 H new ATOM 0 HH12 ARG A 465 -14.630 -22.822 4.396 1.00 22.30 H new ATOM 0 HH21 ARG A 465 -16.539 -20.227 2.960 1.00 3.13 H new ATOM 0 HH22 ARG A 465 -15.476 -20.693 4.291 1.00 3.13 H new ATOM 1014 N SER A 466 -15.410 -27.395 -2.683 1.00 50.50 N ATOM 1015 CA SER A 466 -15.544 -28.549 -3.516 1.00 24.23 C ATOM 1016 C SER A 466 -14.504 -29.610 -3.093 1.00 3.32 C ATOM 1017 O SER A 466 -14.719 -30.806 -3.263 1.00 30.31 O ATOM 1018 CB SER A 466 -15.378 -28.128 -4.988 1.00 13.14 C ATOM 1019 OG SER A 466 -15.610 -29.197 -5.888 1.00 61.24 O ATOM 0 H SER A 466 -14.792 -26.677 -3.061 1.00 50.50 H new ATOM 0 HA SER A 466 -16.533 -28.994 -3.404 1.00 24.23 H new ATOM 0 HB2 SER A 466 -16.069 -27.314 -5.210 1.00 13.14 H new ATOM 0 HB3 SER A 466 -14.370 -27.741 -5.140 1.00 13.14 H new ATOM 0 HG SER A 466 -15.494 -28.881 -6.808 1.00 61.24 H new ATOM 1025 N GLN A 467 -13.394 -29.155 -2.505 1.00 71.15 N ATOM 1026 CA GLN A 467 -12.354 -30.058 -2.006 1.00 52.21 C ATOM 1027 C GLN A 467 -12.768 -30.649 -0.674 1.00 72.32 C ATOM 1028 O GLN A 467 -12.204 -31.642 -0.219 1.00 14.12 O ATOM 1029 CB GLN A 467 -11.007 -29.338 -1.858 1.00 2.23 C ATOM 1030 CG GLN A 467 -10.433 -28.816 -3.161 1.00 50.31 C ATOM 1031 CD GLN A 467 -10.176 -29.917 -4.167 1.00 73.42 C ATOM 1032 OE1 GLN A 467 -11.045 -30.261 -4.970 1.00 74.00 O ATOM 1033 NE2 GLN A 467 -9.000 -30.474 -4.132 1.00 64.31 N ATOM 0 H GLN A 467 -13.193 -28.165 -2.363 1.00 71.15 H new ATOM 0 HA GLN A 467 -12.233 -30.858 -2.736 1.00 52.21 H new ATOM 0 HB2 GLN A 467 -11.128 -28.503 -1.168 1.00 2.23 H new ATOM 0 HB3 GLN A 467 -10.289 -30.023 -1.407 1.00 2.23 H new ATOM 0 HG2 GLN A 467 -11.122 -28.089 -3.592 1.00 50.31 H new ATOM 0 HG3 GLN A 467 -9.500 -28.290 -2.958 1.00 50.31 H new ATOM 0 HE21 GLN A 467 -8.307 -30.161 -3.452 1.00 64.31 H new ATOM 0 HE22 GLN A 467 -8.771 -31.224 -4.785 1.00 64.31 H new ATOM 1042 N GLU A 468 -13.736 -30.016 -0.044 1.00 24.03 N ATOM 1043 CA GLU A 468 -14.290 -30.493 1.208 1.00 73.43 C ATOM 1044 C GLU A 468 -15.054 -31.784 0.984 1.00 1.21 C ATOM 1045 O GLU A 468 -15.010 -32.683 1.817 1.00 71.25 O ATOM 1046 CB GLU A 468 -15.214 -29.433 1.822 1.00 25.22 C ATOM 1047 CG GLU A 468 -14.515 -28.160 2.259 1.00 65.24 C ATOM 1048 CD GLU A 468 -13.493 -28.403 3.336 1.00 44.34 C ATOM 1049 OE1 GLU A 468 -12.316 -28.628 3.015 1.00 64.11 O ATOM 1050 OE2 GLU A 468 -13.856 -28.379 4.536 1.00 5.53 O ATOM 0 H GLU A 468 -14.162 -29.155 -0.386 1.00 24.03 H new ATOM 0 HA GLU A 468 -13.470 -30.684 1.900 1.00 73.43 H new ATOM 0 HB2 GLU A 468 -15.985 -29.177 1.095 1.00 25.22 H new ATOM 0 HB3 GLU A 468 -15.721 -29.867 2.684 1.00 25.22 H new ATOM 0 HG2 GLU A 468 -14.028 -27.703 1.398 1.00 65.24 H new ATOM 0 HG3 GLU A 468 -15.257 -27.448 2.621 1.00 65.24 H new ATOM 1057 N LYS A 469 -15.719 -31.862 -0.175 1.00 31.44 N ATOM 1058 CA LYS A 469 -16.531 -33.013 -0.589 1.00 15.32 C ATOM 1059 C LYS A 469 -17.599 -33.407 0.421 1.00 43.31 C ATOM 1060 O LYS A 469 -17.336 -34.103 1.409 1.00 4.50 O ATOM 1061 CB LYS A 469 -15.692 -34.228 -1.001 1.00 63.24 C ATOM 1062 CG LYS A 469 -14.854 -34.014 -2.223 1.00 13.31 C ATOM 1063 CD LYS A 469 -14.174 -35.297 -2.626 1.00 14.14 C ATOM 1064 CE LYS A 469 -13.346 -35.092 -3.857 1.00 51.33 C ATOM 1065 NZ LYS A 469 -12.694 -36.340 -4.300 1.00 54.21 N ATOM 0 H LYS A 469 -15.707 -31.111 -0.866 1.00 31.44 H new ATOM 0 HA LYS A 469 -17.055 -32.662 -1.478 1.00 15.32 H new ATOM 0 HB2 LYS A 469 -15.040 -34.502 -0.172 1.00 63.24 H new ATOM 0 HB3 LYS A 469 -16.359 -35.073 -1.176 1.00 63.24 H new ATOM 0 HG2 LYS A 469 -15.478 -33.653 -3.041 1.00 13.31 H new ATOM 0 HG3 LYS A 469 -14.107 -33.245 -2.029 1.00 13.31 H new ATOM 0 HD2 LYS A 469 -13.542 -35.651 -1.811 1.00 14.14 H new ATOM 0 HD3 LYS A 469 -14.921 -36.069 -2.809 1.00 14.14 H new ATOM 0 HE2 LYS A 469 -13.977 -34.709 -4.659 1.00 51.33 H new ATOM 0 HE3 LYS A 469 -12.586 -34.336 -3.661 1.00 51.33 H new ATOM 0 HZ1 LYS A 469 -12.131 -36.153 -5.154 1.00 54.21 H new ATOM 0 HZ2 LYS A 469 -12.071 -36.693 -3.546 1.00 54.21 H new ATOM 0 HZ3 LYS A 469 -13.420 -37.054 -4.513 1.00 54.21 H new ATOM 1079 N CYS A 470 -18.781 -32.968 0.173 1.00 30.11 N ATOM 1080 CA CYS A 470 -19.884 -33.309 0.997 1.00 64.14 C ATOM 1081 C CYS A 470 -21.018 -33.736 0.094 1.00 44.11 C ATOM 1082 O CYS A 470 -21.082 -33.315 -1.066 1.00 20.34 O ATOM 1083 CB CYS A 470 -20.294 -32.110 1.863 1.00 3.22 C ATOM 1084 SG CYS A 470 -21.612 -32.454 3.056 1.00 40.30 S ATOM 0 H CYS A 470 -19.011 -32.359 -0.612 1.00 30.11 H new ATOM 0 HA CYS A 470 -19.620 -34.122 1.673 1.00 64.14 H new ATOM 0 HB2 CYS A 470 -19.417 -31.753 2.404 1.00 3.22 H new ATOM 0 HB3 CYS A 470 -20.617 -31.300 1.209 1.00 3.22 H new ATOM 0 HG CYS A 470 -21.349 -31.853 4.178 1.00 40.30 H new ATOM 1090 N PHE A 471 -21.890 -34.567 0.605 1.00 4.20 N ATOM 1091 CA PHE A 471 -23.021 -35.044 -0.154 1.00 24.41 C ATOM 1092 C PHE A 471 -24.288 -34.956 0.699 1.00 65.44 C ATOM 1093 O PHE A 471 -25.335 -34.505 0.234 1.00 30.13 O ATOM 1094 CB PHE A 471 -22.773 -36.489 -0.625 1.00 64.43 C ATOM 1095 CG PHE A 471 -23.844 -37.024 -1.534 1.00 23.20 C ATOM 1096 CD1 PHE A 471 -24.884 -37.790 -1.037 1.00 52.42 C ATOM 1097 CD2 PHE A 471 -23.809 -36.750 -2.889 1.00 13.12 C ATOM 1098 CE1 PHE A 471 -25.869 -38.273 -1.875 1.00 51.23 C ATOM 1099 CE2 PHE A 471 -24.788 -37.232 -3.731 1.00 65.43 C ATOM 1100 CZ PHE A 471 -25.821 -37.993 -3.226 1.00 63.33 C ATOM 0 H PHE A 471 -21.838 -34.932 1.556 1.00 4.20 H new ATOM 0 HA PHE A 471 -23.153 -34.419 -1.037 1.00 24.41 H new ATOM 0 HB2 PHE A 471 -21.815 -36.533 -1.143 1.00 64.43 H new ATOM 0 HB3 PHE A 471 -22.693 -37.137 0.248 1.00 64.43 H new ATOM 0 HD1 PHE A 471 -24.925 -38.013 0.019 1.00 52.42 H new ATOM 0 HD2 PHE A 471 -23.005 -36.152 -3.292 1.00 13.12 H new ATOM 0 HE1 PHE A 471 -26.676 -38.869 -1.474 1.00 51.23 H new ATOM 0 HE2 PHE A 471 -24.746 -37.013 -4.788 1.00 65.43 H new ATOM 0 HZ PHE A 471 -26.590 -38.369 -3.885 1.00 63.33 H new ATOM 1110 N LEU A 472 -24.169 -35.354 1.959 1.00 54.55 N ATOM 1111 CA LEU A 472 -25.296 -35.364 2.890 1.00 34.20 C ATOM 1112 C LEU A 472 -25.823 -33.934 3.114 1.00 23.31 C ATOM 1113 O LEU A 472 -27.020 -33.697 3.069 1.00 3.04 O ATOM 1114 CB LEU A 472 -24.855 -36.050 4.228 1.00 54.45 C ATOM 1115 CG LEU A 472 -25.925 -36.331 5.337 1.00 30.53 C ATOM 1116 CD1 LEU A 472 -25.320 -37.209 6.417 1.00 43.20 C ATOM 1117 CD2 LEU A 472 -26.442 -35.050 5.989 1.00 64.11 C ATOM 0 H LEU A 472 -23.292 -35.679 2.366 1.00 54.55 H new ATOM 0 HA LEU A 472 -26.120 -35.941 2.470 1.00 34.20 H new ATOM 0 HB2 LEU A 472 -24.393 -37.003 3.970 1.00 54.45 H new ATOM 0 HB3 LEU A 472 -24.078 -35.429 4.673 1.00 54.45 H new ATOM 0 HG LEU A 472 -26.765 -36.827 4.851 1.00 30.53 H new ATOM 0 HD11 LEU A 472 -26.066 -37.404 7.188 1.00 43.20 H new ATOM 0 HD12 LEU A 472 -24.996 -38.153 5.979 1.00 43.20 H new ATOM 0 HD13 LEU A 472 -24.463 -36.702 6.861 1.00 43.20 H new ATOM 0 HD21 LEU A 472 -27.181 -35.302 6.750 1.00 64.11 H new ATOM 0 HD22 LEU A 472 -25.612 -34.517 6.452 1.00 64.11 H new ATOM 0 HD23 LEU A 472 -26.903 -34.416 5.231 1.00 64.11 H new ATOM 1129 N PHE A 473 -24.919 -32.990 3.308 1.00 45.34 N ATOM 1130 CA PHE A 473 -25.306 -31.603 3.578 1.00 11.33 C ATOM 1131 C PHE A 473 -25.175 -30.777 2.279 1.00 62.41 C ATOM 1132 O PHE A 473 -25.304 -29.557 2.261 1.00 61.55 O ATOM 1133 CB PHE A 473 -24.400 -31.049 4.709 1.00 10.11 C ATOM 1134 CG PHE A 473 -24.768 -29.684 5.248 1.00 33.42 C ATOM 1135 CD1 PHE A 473 -24.095 -28.545 4.834 1.00 64.33 C ATOM 1136 CD2 PHE A 473 -25.785 -29.553 6.178 1.00 60.14 C ATOM 1137 CE1 PHE A 473 -24.428 -27.303 5.335 1.00 43.34 C ATOM 1138 CE2 PHE A 473 -26.124 -28.311 6.683 1.00 43.43 C ATOM 1139 CZ PHE A 473 -25.444 -27.185 6.262 1.00 54.41 C ATOM 0 H PHE A 473 -23.912 -33.151 3.285 1.00 45.34 H new ATOM 0 HA PHE A 473 -26.343 -31.542 3.907 1.00 11.33 H new ATOM 0 HB2 PHE A 473 -24.411 -31.759 5.536 1.00 10.11 H new ATOM 0 HB3 PHE A 473 -23.376 -31.007 4.339 1.00 10.11 H new ATOM 0 HD1 PHE A 473 -23.299 -28.631 4.109 1.00 64.33 H new ATOM 0 HD2 PHE A 473 -26.319 -30.430 6.513 1.00 60.14 H new ATOM 0 HE1 PHE A 473 -23.895 -26.425 5.002 1.00 43.34 H new ATOM 0 HE2 PHE A 473 -26.921 -28.222 7.407 1.00 43.43 H new ATOM 0 HZ PHE A 473 -25.706 -26.215 6.657 1.00 54.41 H new ATOM 1149 N TRP A 474 -24.953 -31.473 1.199 1.00 25.20 N ATOM 1150 CA TRP A 474 -24.758 -30.870 -0.081 1.00 74.32 C ATOM 1151 C TRP A 474 -26.088 -30.714 -0.782 1.00 23.14 C ATOM 1152 O TRP A 474 -26.749 -31.696 -1.126 1.00 74.55 O ATOM 1153 CB TRP A 474 -23.791 -31.723 -0.892 1.00 1.22 C ATOM 1154 CG TRP A 474 -23.513 -31.249 -2.281 1.00 14.22 C ATOM 1155 CD1 TRP A 474 -22.907 -30.087 -2.646 1.00 13.21 C ATOM 1156 CD2 TRP A 474 -23.787 -31.960 -3.492 1.00 62.15 C ATOM 1157 NE1 TRP A 474 -22.818 -30.018 -4.011 1.00 13.13 N ATOM 1158 CE2 TRP A 474 -23.346 -31.155 -4.555 1.00 63.34 C ATOM 1159 CE3 TRP A 474 -24.378 -33.195 -3.782 1.00 3.03 C ATOM 1160 CZ2 TRP A 474 -23.466 -31.541 -5.886 1.00 54.43 C ATOM 1161 CZ3 TRP A 474 -24.495 -33.580 -5.101 1.00 54.40 C ATOM 1162 CH2 TRP A 474 -24.044 -32.755 -6.139 1.00 45.52 C ATOM 0 H TRP A 474 -24.902 -32.492 1.188 1.00 25.20 H new ATOM 0 HA TRP A 474 -24.326 -29.876 0.032 1.00 74.32 H new ATOM 0 HB2 TRP A 474 -22.846 -31.780 -0.352 1.00 1.22 H new ATOM 0 HB3 TRP A 474 -24.188 -32.736 -0.947 1.00 1.22 H new ATOM 0 HD1 TRP A 474 -22.550 -29.332 -1.962 1.00 13.21 H new ATOM 0 HE1 TRP A 474 -22.420 -29.241 -4.538 1.00 13.13 H new ATOM 0 HE3 TRP A 474 -24.736 -33.834 -2.988 1.00 3.03 H new ATOM 0 HZ2 TRP A 474 -23.117 -30.907 -6.688 1.00 54.43 H new ATOM 0 HZ3 TRP A 474 -24.942 -34.534 -5.338 1.00 54.40 H new ATOM 0 HH2 TRP A 474 -24.155 -33.084 -7.162 1.00 45.52 H new ATOM 1173 N SER A 475 -26.480 -29.501 -0.945 1.00 32.51 N ATOM 1174 CA SER A 475 -27.704 -29.155 -1.596 1.00 51.42 C ATOM 1175 C SER A 475 -27.407 -28.014 -2.567 1.00 42.51 C ATOM 1176 O SER A 475 -27.414 -26.841 -2.138 1.00 39.28 O ATOM 1177 CB SER A 475 -28.757 -28.740 -0.539 1.00 24.13 C ATOM 1178 OG SER A 475 -30.051 -28.529 -1.117 1.00 63.33 O ATOM 1179 OXT SER A 475 -27.127 -28.282 -3.758 1.00 39.28 O ATOM 0 H SER A 475 -25.946 -28.694 -0.622 1.00 32.51 H new ATOM 0 HA SER A 475 -28.111 -30.003 -2.147 1.00 51.42 H new ATOM 0 HB2 SER A 475 -28.825 -29.513 0.227 1.00 24.13 H new ATOM 0 HB3 SER A 475 -28.430 -27.827 -0.042 1.00 24.13 H new ATOM 0 HG SER A 475 -30.684 -28.270 -0.415 1.00 63.33 H new TER 1185 SER A 475