USER MOD reduce.3.24.130724 H: found=0, std=0, add=522, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 523 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 493 ASN : amide:sc= 0 X(o=0,f=0.0073) USER MOD Set 1.2: A 494 SER OG : rot 180:sc= 0 USER MOD Single : A 477 SER OG : rot 180:sc= 0 USER MOD Single : A 481 LYS NZ :NH3+ 156:sc= 0 (180deg=-0.739) USER MOD Single : A 485 CYS SG : rot -105:sc= 0.126 USER MOD Single : A 486 ASN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 487 TYR OH : rot 180:sc= 0 USER MOD Single : A 490 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 495 SER OG : rot 180:sc= 0 USER MOD Single : A 498 SER OG : rot 180:sc= 0 USER MOD Single : A 500 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 501 GLN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 511 SER OG : rot 180:sc= 0 USER MOD Single : A 513 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.0574) USER MOD Single : A 516 LYS NZ :NH3+ -108:sc= 0.0394 (180deg=0) USER MOD Single : A 523 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 526 TYR OH : rot 180:sc= 0 USER MOD Single : A 529 TYR OH : rot 180:sc= 0 USER MOD Single : A 530 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 533 THR OG1 : rot 14:sc= 1.04 USER MOD Single : A 535 TYR OH : rot 180:sc= 0 USER MOD Single : A 540 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 473 -3.248 0.143 2.162 1.00 0.00 N ATOM 2 CA GLY A 473 -2.137 0.145 3.142 1.00 0.00 C ATOM 3 C GLY A 473 -1.083 1.203 2.821 1.00 0.00 C ATOM 4 O GLY A 473 -1.322 2.071 1.973 1.00 0.00 O ATOM 0 HA2 GLY A 473 -2.536 0.324 4.140 1.00 0.00 H new ATOM 0 HA3 GLY A 473 -1.668 -0.839 3.158 1.00 0.00 H new ATOM 8 N PRO A 474 0.078 1.175 3.504 1.00 0.00 N ATOM 9 CA PRO A 474 1.147 2.170 3.361 1.00 0.00 C ATOM 10 C PRO A 474 1.887 2.043 2.015 1.00 0.00 C ATOM 11 O PRO A 474 2.809 1.235 1.861 1.00 0.00 O ATOM 12 CB PRO A 474 2.061 1.957 4.576 1.00 0.00 C ATOM 13 CG PRO A 474 1.887 0.474 4.903 1.00 0.00 C ATOM 14 CD PRO A 474 0.425 0.209 4.542 1.00 0.00 C ATOM 0 HA PRO A 474 0.755 3.187 3.343 1.00 0.00 H new ATOM 0 HB2 PRO A 474 3.099 2.197 4.344 1.00 0.00 H new ATOM 0 HB3 PRO A 474 1.767 2.589 5.414 1.00 0.00 H new ATOM 0 HG2 PRO A 474 2.565 -0.150 4.321 1.00 0.00 H new ATOM 0 HG3 PRO A 474 2.087 0.267 5.954 1.00 0.00 H new ATOM 0 HD2 PRO A 474 0.292 -0.812 4.183 1.00 0.00 H new ATOM 0 HD3 PRO A 474 -0.218 0.327 5.414 1.00 0.00 H new ATOM 22 N LEU A 475 1.479 2.846 1.024 1.00 0.00 N ATOM 23 CA LEU A 475 2.100 2.906 -0.309 1.00 0.00 C ATOM 24 C LEU A 475 3.557 3.404 -0.253 1.00 0.00 C ATOM 25 O LEU A 475 4.448 2.797 -0.854 1.00 0.00 O ATOM 26 CB LEU A 475 1.232 3.823 -1.197 1.00 0.00 C ATOM 27 CG LEU A 475 1.748 4.012 -2.639 1.00 0.00 C ATOM 28 CD1 LEU A 475 1.713 2.713 -3.445 1.00 0.00 C ATOM 29 CD2 LEU A 475 0.891 5.051 -3.363 1.00 0.00 C ATOM 0 H LEU A 475 0.692 3.486 1.127 1.00 0.00 H new ATOM 0 HA LEU A 475 2.144 1.901 -0.729 1.00 0.00 H new ATOM 0 HB2 LEU A 475 0.223 3.414 -1.239 1.00 0.00 H new ATOM 0 HB3 LEU A 475 1.160 4.801 -0.722 1.00 0.00 H new ATOM 0 HG LEU A 475 2.784 4.342 -2.564 1.00 0.00 H new ATOM 0 HD11 LEU A 475 2.086 2.900 -4.452 1.00 0.00 H new ATOM 0 HD12 LEU A 475 2.340 1.966 -2.958 1.00 0.00 H new ATOM 0 HD13 LEU A 475 0.688 2.346 -3.500 1.00 0.00 H new ATOM 0 HD21 LEU A 475 1.259 5.181 -4.381 1.00 0.00 H new ATOM 0 HD22 LEU A 475 -0.145 4.712 -3.392 1.00 0.00 H new ATOM 0 HD23 LEU A 475 0.947 6.002 -2.833 1.00 0.00 H new ATOM 41 N GLY A 476 3.789 4.500 0.480 1.00 0.00 N ATOM 42 CA GLY A 476 5.060 5.233 0.543 1.00 0.00 C ATOM 43 C GLY A 476 5.342 6.078 -0.712 1.00 0.00 C ATOM 44 O GLY A 476 5.173 5.618 -1.846 1.00 0.00 O ATOM 0 H GLY A 476 3.068 4.917 1.069 1.00 0.00 H new ATOM 0 HA2 GLY A 476 5.052 5.885 1.416 1.00 0.00 H new ATOM 0 HA3 GLY A 476 5.874 4.522 0.684 1.00 0.00 H new ATOM 48 N SER A 477 5.798 7.318 -0.516 1.00 0.00 N ATOM 49 CA SER A 477 6.222 8.240 -1.586 1.00 0.00 C ATOM 50 C SER A 477 7.187 9.322 -1.072 1.00 0.00 C ATOM 51 O SER A 477 7.325 9.535 0.139 1.00 0.00 O ATOM 52 CB SER A 477 5.003 8.885 -2.269 1.00 0.00 C ATOM 53 OG SER A 477 4.239 9.676 -1.369 1.00 0.00 O ATOM 0 H SER A 477 5.887 7.724 0.415 1.00 0.00 H new ATOM 0 HA SER A 477 6.763 7.645 -2.322 1.00 0.00 H new ATOM 0 HB2 SER A 477 5.340 9.506 -3.099 1.00 0.00 H new ATOM 0 HB3 SER A 477 4.370 8.104 -2.691 1.00 0.00 H new ATOM 0 HG SER A 477 3.477 10.068 -1.844 1.00 0.00 H new ATOM 59 N GLY A 478 7.871 10.008 -1.996 1.00 0.00 N ATOM 60 CA GLY A 478 8.913 10.997 -1.685 1.00 0.00 C ATOM 61 C GLY A 478 10.236 10.379 -1.202 1.00 0.00 C ATOM 62 O GLY A 478 10.402 9.154 -1.166 1.00 0.00 O ATOM 0 H GLY A 478 7.714 9.890 -2.997 1.00 0.00 H new ATOM 0 HA2 GLY A 478 9.107 11.597 -2.574 1.00 0.00 H new ATOM 0 HA3 GLY A 478 8.539 11.675 -0.918 1.00 0.00 H new ATOM 66 N ALA A 479 11.181 11.244 -0.823 1.00 0.00 N ATOM 67 CA ALA A 479 12.527 10.874 -0.357 1.00 0.00 C ATOM 68 C ALA A 479 12.966 11.632 0.919 1.00 0.00 C ATOM 69 O ALA A 479 14.143 11.605 1.289 1.00 0.00 O ATOM 70 CB ALA A 479 13.501 11.078 -1.528 1.00 0.00 C ATOM 0 H ALA A 479 11.029 12.253 -0.831 1.00 0.00 H new ATOM 0 HA ALA A 479 12.524 9.827 -0.053 1.00 0.00 H new ATOM 0 HB1 ALA A 479 14.510 10.811 -1.213 1.00 0.00 H new ATOM 0 HB2 ALA A 479 13.203 10.445 -2.364 1.00 0.00 H new ATOM 0 HB3 ALA A 479 13.482 12.122 -1.839 1.00 0.00 H new ATOM 76 N LEU A 480 12.025 12.311 1.590 1.00 0.00 N ATOM 77 CA LEU A 480 12.249 13.176 2.758 1.00 0.00 C ATOM 78 C LEU A 480 11.163 12.905 3.821 1.00 0.00 C ATOM 79 O LEU A 480 9.968 13.033 3.538 1.00 0.00 O ATOM 80 CB LEU A 480 12.230 14.664 2.328 1.00 0.00 C ATOM 81 CG LEU A 480 13.188 15.070 1.187 1.00 0.00 C ATOM 82 CD1 LEU A 480 12.854 16.480 0.697 1.00 0.00 C ATOM 83 CD2 LEU A 480 14.651 15.058 1.629 1.00 0.00 C ATOM 0 H LEU A 480 11.042 12.271 1.321 1.00 0.00 H new ATOM 0 HA LEU A 480 13.225 12.955 3.189 1.00 0.00 H new ATOM 0 HB2 LEU A 480 11.214 14.917 2.025 1.00 0.00 H new ATOM 0 HB3 LEU A 480 12.464 15.273 3.201 1.00 0.00 H new ATOM 0 HG LEU A 480 13.055 14.338 0.391 1.00 0.00 H new ATOM 0 HD11 LEU A 480 13.535 16.757 -0.108 1.00 0.00 H new ATOM 0 HD12 LEU A 480 11.829 16.504 0.328 1.00 0.00 H new ATOM 0 HD13 LEU A 480 12.960 17.186 1.521 1.00 0.00 H new ATOM 0 HD21 LEU A 480 15.286 15.350 0.793 1.00 0.00 H new ATOM 0 HD22 LEU A 480 14.788 15.760 2.452 1.00 0.00 H new ATOM 0 HD23 LEU A 480 14.923 14.055 1.958 1.00 0.00 H new ATOM 95 N LYS A 481 11.574 12.548 5.046 1.00 0.00 N ATOM 96 CA LYS A 481 10.686 12.241 6.189 1.00 0.00 C ATOM 97 C LYS A 481 10.710 13.376 7.217 1.00 0.00 C ATOM 98 O LYS A 481 11.435 13.328 8.211 1.00 0.00 O ATOM 99 CB LYS A 481 11.047 10.884 6.824 1.00 0.00 C ATOM 100 CG LYS A 481 10.689 9.691 5.922 1.00 0.00 C ATOM 101 CD LYS A 481 10.815 8.327 6.627 1.00 0.00 C ATOM 102 CE LYS A 481 12.234 7.733 6.683 1.00 0.00 C ATOM 103 NZ LYS A 481 13.134 8.415 7.655 1.00 0.00 N ATOM 0 H LYS A 481 12.563 12.461 5.282 1.00 0.00 H new ATOM 0 HA LYS A 481 9.665 12.159 5.816 1.00 0.00 H new ATOM 0 HB2 LYS A 481 12.115 10.862 7.041 1.00 0.00 H new ATOM 0 HB3 LYS A 481 10.526 10.783 7.776 1.00 0.00 H new ATOM 0 HG2 LYS A 481 9.667 9.812 5.562 1.00 0.00 H new ATOM 0 HG3 LYS A 481 11.339 9.700 5.047 1.00 0.00 H new ATOM 0 HD2 LYS A 481 10.444 8.430 7.647 1.00 0.00 H new ATOM 0 HD3 LYS A 481 10.163 7.615 6.121 1.00 0.00 H new ATOM 0 HE2 LYS A 481 12.166 6.677 6.945 1.00 0.00 H new ATOM 0 HE3 LYS A 481 12.680 7.787 5.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 481 13.890 7.763 7.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 481 13.554 9.255 7.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 481 12.587 8.704 8.491 1.00 0.00 H new ATOM 117 N TRP A 482 9.939 14.426 6.946 1.00 0.00 N ATOM 118 CA TRP A 482 9.750 15.562 7.857 1.00 0.00 C ATOM 119 C TRP A 482 8.899 15.178 9.081 1.00 0.00 C ATOM 120 O TRP A 482 8.169 14.181 9.065 1.00 0.00 O ATOM 121 CB TRP A 482 9.107 16.726 7.086 1.00 0.00 C ATOM 122 CG TRP A 482 9.962 17.325 6.008 1.00 0.00 C ATOM 123 CD1 TRP A 482 10.265 16.741 4.826 1.00 0.00 C ATOM 124 CD2 TRP A 482 10.648 18.618 5.993 1.00 0.00 C ATOM 125 NE1 TRP A 482 11.106 17.559 4.099 1.00 0.00 N ATOM 126 CE2 TRP A 482 11.392 18.720 4.780 1.00 0.00 C ATOM 127 CE3 TRP A 482 10.723 19.717 6.877 1.00 0.00 C ATOM 128 CZ2 TRP A 482 12.191 19.829 4.472 1.00 0.00 C ATOM 129 CZ3 TRP A 482 11.518 20.842 6.580 1.00 0.00 C ATOM 130 CH2 TRP A 482 12.259 20.897 5.384 1.00 0.00 C ATOM 0 H TRP A 482 9.418 14.517 6.074 1.00 0.00 H new ATOM 0 HA TRP A 482 10.725 15.870 8.235 1.00 0.00 H new ATOM 0 HB2 TRP A 482 8.177 16.375 6.638 1.00 0.00 H new ATOM 0 HB3 TRP A 482 8.843 17.510 7.796 1.00 0.00 H new ATOM 0 HD1 TRP A 482 9.903 15.777 4.500 1.00 0.00 H new ATOM 0 HE1 TRP A 482 11.470 17.332 3.174 1.00 0.00 H new ATOM 0 HE3 TRP A 482 10.160 19.695 7.798 1.00 0.00 H new ATOM 0 HZ2 TRP A 482 12.747 19.863 3.547 1.00 0.00 H new ATOM 0 HZ3 TRP A 482 11.559 21.668 7.275 1.00 0.00 H new ATOM 0 HH2 TRP A 482 12.877 21.756 5.168 1.00 0.00 H new ATOM 141 N VAL A 483 8.951 16.010 10.124 1.00 0.00 N ATOM 142 CA VAL A 483 8.114 15.893 11.329 1.00 0.00 C ATOM 143 C VAL A 483 7.440 17.235 11.625 1.00 0.00 C ATOM 144 O VAL A 483 8.095 18.271 11.770 1.00 0.00 O ATOM 145 CB VAL A 483 8.888 15.347 12.550 1.00 0.00 C ATOM 146 CG1 VAL A 483 9.098 13.835 12.417 1.00 0.00 C ATOM 147 CG2 VAL A 483 10.262 15.994 12.787 1.00 0.00 C ATOM 0 H VAL A 483 9.590 16.804 10.159 1.00 0.00 H new ATOM 0 HA VAL A 483 7.341 15.152 11.126 1.00 0.00 H new ATOM 0 HB VAL A 483 8.261 15.598 13.405 1.00 0.00 H new ATOM 0 HG11 VAL A 483 9.645 13.466 13.285 1.00 0.00 H new ATOM 0 HG12 VAL A 483 8.130 13.337 12.359 1.00 0.00 H new ATOM 0 HG13 VAL A 483 9.669 13.625 11.512 1.00 0.00 H new ATOM 0 HG21 VAL A 483 10.728 15.546 13.665 1.00 0.00 H new ATOM 0 HG22 VAL A 483 10.896 15.831 11.916 1.00 0.00 H new ATOM 0 HG23 VAL A 483 10.137 17.065 12.949 1.00 0.00 H new ATOM 157 N LEU A 484 6.105 17.217 11.658 1.00 0.00 N ATOM 158 CA LEU A 484 5.277 18.374 11.995 1.00 0.00 C ATOM 159 C LEU A 484 5.177 18.504 13.522 1.00 0.00 C ATOM 160 O LEU A 484 5.084 17.499 14.231 1.00 0.00 O ATOM 161 CB LEU A 484 3.881 18.191 11.359 1.00 0.00 C ATOM 162 CG LEU A 484 3.045 19.488 11.287 1.00 0.00 C ATOM 163 CD1 LEU A 484 3.669 20.535 10.360 1.00 0.00 C ATOM 164 CD2 LEU A 484 1.647 19.174 10.757 1.00 0.00 C ATOM 0 H LEU A 484 5.560 16.381 11.447 1.00 0.00 H new ATOM 0 HA LEU A 484 5.723 19.289 11.605 1.00 0.00 H new ATOM 0 HB2 LEU A 484 4.002 17.793 10.351 1.00 0.00 H new ATOM 0 HB3 LEU A 484 3.328 17.446 11.931 1.00 0.00 H new ATOM 0 HG LEU A 484 3.007 19.892 12.299 1.00 0.00 H new ATOM 0 HD11 LEU A 484 3.043 21.427 10.345 1.00 0.00 H new ATOM 0 HD12 LEU A 484 4.663 20.796 10.723 1.00 0.00 H new ATOM 0 HD13 LEU A 484 3.746 20.128 9.352 1.00 0.00 H new ATOM 0 HD21 LEU A 484 1.062 20.092 10.708 1.00 0.00 H new ATOM 0 HD22 LEU A 484 1.725 18.740 9.760 1.00 0.00 H new ATOM 0 HD23 LEU A 484 1.156 18.466 11.424 1.00 0.00 H new ATOM 176 N CYS A 485 5.170 19.725 14.049 1.00 0.00 N ATOM 177 CA CYS A 485 4.925 19.947 15.474 1.00 0.00 C ATOM 178 C CYS A 485 3.426 19.814 15.831 1.00 0.00 C ATOM 179 O CYS A 485 2.553 20.081 15.001 1.00 0.00 O ATOM 180 CB CYS A 485 5.442 21.343 15.821 1.00 0.00 C ATOM 181 SG CYS A 485 5.942 21.396 17.559 1.00 0.00 S ATOM 0 H CYS A 485 5.331 20.577 13.512 1.00 0.00 H new ATOM 0 HA CYS A 485 5.447 19.187 16.055 1.00 0.00 H new ATOM 0 HB2 CYS A 485 6.288 21.597 15.182 1.00 0.00 H new ATOM 0 HB3 CYS A 485 4.666 22.085 15.633 1.00 0.00 H new ATOM 0 HG CYS A 485 5.050 22.044 18.248 1.00 0.00 H new ATOM 187 N ASN A 486 3.123 19.477 17.090 1.00 0.00 N ATOM 188 CA ASN A 486 1.762 19.430 17.644 1.00 0.00 C ATOM 189 C ASN A 486 1.517 20.534 18.698 1.00 0.00 C ATOM 190 O ASN A 486 0.379 20.974 18.876 1.00 0.00 O ATOM 191 CB ASN A 486 1.526 18.022 18.231 1.00 0.00 C ATOM 192 CG ASN A 486 0.062 17.600 18.311 1.00 0.00 C ATOM 193 OD1 ASN A 486 -0.863 18.293 17.910 1.00 0.00 O ATOM 194 ND2 ASN A 486 -0.195 16.408 18.805 1.00 0.00 N ATOM 0 H ASN A 486 3.837 19.222 17.772 1.00 0.00 H new ATOM 0 HA ASN A 486 1.046 19.624 16.845 1.00 0.00 H new ATOM 0 HB2 ASN A 486 2.066 17.295 17.624 1.00 0.00 H new ATOM 0 HB3 ASN A 486 1.956 17.984 19.232 1.00 0.00 H new ATOM 0 HD21 ASN A 486 -1.157 16.071 18.850 1.00 0.00 H new ATOM 0 HD22 ASN A 486 0.568 15.821 19.143 1.00 0.00 H new ATOM 201 N TYR A 487 2.579 21.016 19.361 1.00 0.00 N ATOM 202 CA TYR A 487 2.531 22.027 20.428 1.00 0.00 C ATOM 203 C TYR A 487 3.808 22.879 20.431 1.00 0.00 C ATOM 204 O TYR A 487 4.917 22.342 20.427 1.00 0.00 O ATOM 205 CB TYR A 487 2.400 21.342 21.800 1.00 0.00 C ATOM 206 CG TYR A 487 1.194 20.436 21.936 1.00 0.00 C ATOM 207 CD1 TYR A 487 -0.065 20.979 22.261 1.00 0.00 C ATOM 208 CD2 TYR A 487 1.323 19.056 21.677 1.00 0.00 C ATOM 209 CE1 TYR A 487 -1.199 20.144 22.312 1.00 0.00 C ATOM 210 CE2 TYR A 487 0.194 18.220 21.723 1.00 0.00 C ATOM 211 CZ TYR A 487 -1.074 18.765 22.036 1.00 0.00 C ATOM 212 OH TYR A 487 -2.179 17.970 22.068 1.00 0.00 O ATOM 0 H TYR A 487 3.529 20.701 19.162 1.00 0.00 H new ATOM 0 HA TYR A 487 1.668 22.666 20.242 1.00 0.00 H new ATOM 0 HB2 TYR A 487 3.301 20.758 21.988 1.00 0.00 H new ATOM 0 HB3 TYR A 487 2.351 22.110 22.572 1.00 0.00 H new ATOM 0 HD1 TYR A 487 -0.161 22.034 22.471 1.00 0.00 H new ATOM 0 HD2 TYR A 487 2.292 18.640 21.443 1.00 0.00 H new ATOM 0 HE1 TYR A 487 -2.164 20.559 22.562 1.00 0.00 H new ATOM 0 HE2 TYR A 487 0.294 17.164 21.520 1.00 0.00 H new ATOM 0 HH TYR A 487 -1.925 17.048 21.855 1.00 0.00 H new ATOM 222 N ASP A 488 3.666 24.206 20.461 1.00 0.00 N ATOM 223 CA ASP A 488 4.802 25.132 20.540 1.00 0.00 C ATOM 224 C ASP A 488 5.689 24.923 21.787 1.00 0.00 C ATOM 225 O ASP A 488 5.214 24.549 22.865 1.00 0.00 O ATOM 226 CB ASP A 488 4.304 26.582 20.457 1.00 0.00 C ATOM 227 CG ASP A 488 3.482 27.019 21.682 1.00 0.00 C ATOM 228 OD1 ASP A 488 2.270 26.696 21.747 1.00 0.00 O ATOM 229 OD2 ASP A 488 4.033 27.729 22.557 1.00 0.00 O ATOM 0 H ASP A 488 2.759 24.671 20.431 1.00 0.00 H new ATOM 0 HA ASP A 488 5.442 24.914 19.685 1.00 0.00 H new ATOM 0 HB2 ASP A 488 5.161 27.247 20.348 1.00 0.00 H new ATOM 0 HB3 ASP A 488 3.695 26.698 19.560 1.00 0.00 H new ATOM 234 N PHE A 489 6.987 25.204 21.634 1.00 0.00 N ATOM 235 CA PHE A 489 8.007 25.099 22.684 1.00 0.00 C ATOM 236 C PHE A 489 9.132 26.106 22.407 1.00 0.00 C ATOM 237 O PHE A 489 9.918 25.939 21.472 1.00 0.00 O ATOM 238 CB PHE A 489 8.534 23.654 22.751 1.00 0.00 C ATOM 239 CG PHE A 489 9.617 23.392 23.784 1.00 0.00 C ATOM 240 CD1 PHE A 489 9.277 23.225 25.140 1.00 0.00 C ATOM 241 CD2 PHE A 489 10.967 23.284 23.393 1.00 0.00 C ATOM 242 CE1 PHE A 489 10.278 22.987 26.100 1.00 0.00 C ATOM 243 CE2 PHE A 489 11.963 23.020 24.348 1.00 0.00 C ATOM 244 CZ PHE A 489 11.625 22.899 25.704 1.00 0.00 C ATOM 0 H PHE A 489 7.371 25.522 20.744 1.00 0.00 H new ATOM 0 HA PHE A 489 7.574 25.339 23.655 1.00 0.00 H new ATOM 0 HB2 PHE A 489 7.694 22.990 22.956 1.00 0.00 H new ATOM 0 HB3 PHE A 489 8.922 23.383 21.769 1.00 0.00 H new ATOM 0 HD1 PHE A 489 8.242 23.280 25.445 1.00 0.00 H new ATOM 0 HD2 PHE A 489 11.237 23.405 22.354 1.00 0.00 H new ATOM 0 HE1 PHE A 489 10.012 22.872 27.140 1.00 0.00 H new ATOM 0 HE2 PHE A 489 12.991 22.910 24.037 1.00 0.00 H new ATOM 0 HZ PHE A 489 12.397 22.739 26.442 1.00 0.00 H new ATOM 254 N GLN A 490 9.182 27.182 23.196 1.00 0.00 N ATOM 255 CA GLN A 490 10.279 28.158 23.172 1.00 0.00 C ATOM 256 C GLN A 490 11.571 27.540 23.742 1.00 0.00 C ATOM 257 O GLN A 490 11.576 27.015 24.860 1.00 0.00 O ATOM 258 CB GLN A 490 9.855 29.444 23.911 1.00 0.00 C ATOM 259 CG GLN A 490 9.529 29.281 25.409 1.00 0.00 C ATOM 260 CD GLN A 490 8.896 30.541 26.000 1.00 0.00 C ATOM 261 OE1 GLN A 490 9.485 31.616 26.032 1.00 0.00 O ATOM 262 NE2 GLN A 490 7.674 30.467 26.491 1.00 0.00 N ATOM 0 H GLN A 490 8.456 27.404 23.877 1.00 0.00 H new ATOM 0 HA GLN A 490 10.498 28.434 22.141 1.00 0.00 H new ATOM 0 HB2 GLN A 490 10.654 30.178 23.810 1.00 0.00 H new ATOM 0 HB3 GLN A 490 8.979 29.856 23.411 1.00 0.00 H new ATOM 0 HG2 GLN A 490 8.851 28.438 25.542 1.00 0.00 H new ATOM 0 HG3 GLN A 490 10.442 29.044 25.955 1.00 0.00 H new ATOM 0 HE21 GLN A 490 7.170 29.581 26.472 1.00 0.00 H new ATOM 0 HE22 GLN A 490 7.233 31.296 26.889 1.00 0.00 H new ATOM 271 N ALA A 491 12.668 27.591 22.977 1.00 0.00 N ATOM 272 CA ALA A 491 13.959 27.034 23.379 1.00 0.00 C ATOM 273 C ALA A 491 15.122 27.665 22.589 1.00 0.00 C ATOM 274 O ALA A 491 15.146 27.605 21.359 1.00 0.00 O ATOM 275 CB ALA A 491 13.940 25.525 23.173 1.00 0.00 C ATOM 0 H ALA A 491 12.681 28.025 22.054 1.00 0.00 H new ATOM 0 HA ALA A 491 14.120 27.263 24.433 1.00 0.00 H new ATOM 0 HB1 ALA A 491 14.901 25.105 23.471 1.00 0.00 H new ATOM 0 HB2 ALA A 491 13.148 25.085 23.779 1.00 0.00 H new ATOM 0 HB3 ALA A 491 13.758 25.304 22.121 1.00 0.00 H new ATOM 281 N ARG A 492 16.085 28.274 23.284 1.00 0.00 N ATOM 282 CA ARG A 492 17.231 29.014 22.694 1.00 0.00 C ATOM 283 C ARG A 492 18.476 28.979 23.599 1.00 0.00 C ATOM 284 O ARG A 492 19.355 29.839 23.510 1.00 0.00 O ATOM 285 CB ARG A 492 16.817 30.468 22.358 1.00 0.00 C ATOM 286 CG ARG A 492 15.826 30.576 21.184 1.00 0.00 C ATOM 287 CD ARG A 492 15.539 32.033 20.808 1.00 0.00 C ATOM 288 NE ARG A 492 14.672 32.108 19.613 1.00 0.00 N ATOM 289 CZ ARG A 492 13.784 33.043 19.318 1.00 0.00 C ATOM 290 NH1 ARG A 492 13.541 34.055 20.105 1.00 0.00 N ATOM 291 NH2 ARG A 492 13.109 32.977 18.205 1.00 0.00 N ATOM 0 H ARG A 492 16.100 28.273 24.304 1.00 0.00 H new ATOM 0 HA ARG A 492 17.508 28.510 21.768 1.00 0.00 H new ATOM 0 HB2 ARG A 492 16.369 30.922 23.242 1.00 0.00 H new ATOM 0 HB3 ARG A 492 17.711 31.045 22.121 1.00 0.00 H new ATOM 0 HG2 ARG A 492 16.231 30.051 20.319 1.00 0.00 H new ATOM 0 HG3 ARG A 492 14.893 30.080 21.450 1.00 0.00 H new ATOM 0 HD2 ARG A 492 15.058 32.541 21.644 1.00 0.00 H new ATOM 0 HD3 ARG A 492 16.477 32.555 20.615 1.00 0.00 H new ATOM 0 HE ARG A 492 14.770 31.350 18.937 1.00 0.00 H new ATOM 0 HH11 ARG A 492 14.045 34.148 20.987 1.00 0.00 H new ATOM 0 HH12 ARG A 492 12.847 34.754 19.838 1.00 0.00 H new ATOM 0 HH21 ARG A 492 13.265 32.203 17.559 1.00 0.00 H new ATOM 0 HH22 ARG A 492 12.425 33.699 17.980 1.00 0.00 H new ATOM 305 N ASN A 493 18.537 27.992 24.494 1.00 0.00 N ATOM 306 CA ASN A 493 19.567 27.843 25.530 1.00 0.00 C ATOM 307 C ASN A 493 19.965 26.367 25.693 1.00 0.00 C ATOM 308 O ASN A 493 19.253 25.490 25.210 1.00 0.00 O ATOM 309 CB ASN A 493 19.045 28.457 26.846 1.00 0.00 C ATOM 310 CG ASN A 493 17.744 27.829 27.329 1.00 0.00 C ATOM 311 OD1 ASN A 493 16.655 28.301 27.028 1.00 0.00 O ATOM 312 ND2 ASN A 493 17.803 26.753 28.081 1.00 0.00 N ATOM 0 H ASN A 493 17.844 27.244 24.520 1.00 0.00 H new ATOM 0 HA ASN A 493 20.471 28.376 25.237 1.00 0.00 H new ATOM 0 HB2 ASN A 493 19.805 28.342 27.619 1.00 0.00 H new ATOM 0 HB3 ASN A 493 18.893 29.527 26.705 1.00 0.00 H new ATOM 0 HD21 ASN A 493 16.944 26.314 28.412 1.00 0.00 H new ATOM 0 HD22 ASN A 493 18.708 26.357 28.334 1.00 0.00 H new ATOM 319 N SER A 494 21.086 26.076 26.364 1.00 0.00 N ATOM 320 CA SER A 494 21.622 24.709 26.568 1.00 0.00 C ATOM 321 C SER A 494 21.538 23.789 25.324 1.00 0.00 C ATOM 322 O SER A 494 21.157 22.619 25.416 1.00 0.00 O ATOM 323 CB SER A 494 21.034 24.082 27.848 1.00 0.00 C ATOM 324 OG SER A 494 19.620 23.975 27.815 1.00 0.00 O ATOM 0 H SER A 494 21.666 26.797 26.794 1.00 0.00 H new ATOM 0 HA SER A 494 22.697 24.815 26.717 1.00 0.00 H new ATOM 0 HB2 SER A 494 21.464 23.091 27.991 1.00 0.00 H new ATOM 0 HB3 SER A 494 21.327 24.684 28.708 1.00 0.00 H new ATOM 0 HG SER A 494 19.303 23.570 28.649 1.00 0.00 H new ATOM 330 N SER A 495 21.863 24.346 24.147 1.00 0.00 N ATOM 331 CA SER A 495 21.815 23.711 22.810 1.00 0.00 C ATOM 332 C SER A 495 20.416 23.273 22.315 1.00 0.00 C ATOM 333 O SER A 495 20.295 22.427 21.429 1.00 0.00 O ATOM 334 CB SER A 495 22.867 22.591 22.694 1.00 0.00 C ATOM 335 OG SER A 495 24.165 23.088 23.003 1.00 0.00 O ATOM 0 H SER A 495 22.187 25.312 24.094 1.00 0.00 H new ATOM 0 HA SER A 495 22.074 24.508 22.114 1.00 0.00 H new ATOM 0 HB2 SER A 495 22.614 21.775 23.371 1.00 0.00 H new ATOM 0 HB3 SER A 495 22.860 22.181 21.684 1.00 0.00 H new ATOM 0 HG SER A 495 24.820 22.363 22.926 1.00 0.00 H new ATOM 341 N GLU A 496 19.337 23.843 22.849 1.00 0.00 N ATOM 342 CA GLU A 496 17.941 23.601 22.440 1.00 0.00 C ATOM 343 C GLU A 496 17.512 24.430 21.202 1.00 0.00 C ATOM 344 O GLU A 496 18.255 25.300 20.734 1.00 0.00 O ATOM 345 CB GLU A 496 17.021 23.921 23.629 1.00 0.00 C ATOM 346 CG GLU A 496 17.233 22.964 24.814 1.00 0.00 C ATOM 347 CD GLU A 496 16.439 23.348 26.086 1.00 0.00 C ATOM 348 OE1 GLU A 496 15.849 24.453 26.174 1.00 0.00 O ATOM 349 OE2 GLU A 496 16.409 22.527 27.036 1.00 0.00 O ATOM 0 H GLU A 496 19.407 24.516 23.612 1.00 0.00 H new ATOM 0 HA GLU A 496 17.859 22.554 22.149 1.00 0.00 H new ATOM 0 HB2 GLU A 496 17.200 24.945 23.957 1.00 0.00 H new ATOM 0 HB3 GLU A 496 15.982 23.867 23.305 1.00 0.00 H new ATOM 0 HG2 GLU A 496 16.946 21.957 24.510 1.00 0.00 H new ATOM 0 HG3 GLU A 496 18.295 22.933 25.057 1.00 0.00 H new ATOM 356 N LEU A 497 16.300 24.180 20.680 1.00 0.00 N ATOM 357 CA LEU A 497 15.728 24.871 19.512 1.00 0.00 C ATOM 358 C LEU A 497 14.213 25.122 19.645 1.00 0.00 C ATOM 359 O LEU A 497 13.462 24.282 20.139 1.00 0.00 O ATOM 360 CB LEU A 497 16.040 24.011 18.271 1.00 0.00 C ATOM 361 CG LEU A 497 16.259 24.724 16.928 1.00 0.00 C ATOM 362 CD1 LEU A 497 14.989 25.349 16.393 1.00 0.00 C ATOM 363 CD2 LEU A 497 17.361 25.785 16.938 1.00 0.00 C ATOM 0 H LEU A 497 15.675 23.474 21.068 1.00 0.00 H new ATOM 0 HA LEU A 497 16.177 25.861 19.427 1.00 0.00 H new ATOM 0 HB2 LEU A 497 16.935 23.427 18.487 1.00 0.00 H new ATOM 0 HB3 LEU A 497 15.221 23.303 18.142 1.00 0.00 H new ATOM 0 HG LEU A 497 16.586 23.920 16.268 1.00 0.00 H new ATOM 0 HD11 LEU A 497 15.198 25.840 15.443 1.00 0.00 H new ATOM 0 HD12 LEU A 497 14.237 24.574 16.244 1.00 0.00 H new ATOM 0 HD13 LEU A 497 14.616 26.084 17.107 1.00 0.00 H new ATOM 0 HD21 LEU A 497 17.443 26.234 15.948 1.00 0.00 H new ATOM 0 HD22 LEU A 497 17.116 26.557 17.667 1.00 0.00 H new ATOM 0 HD23 LEU A 497 18.310 25.321 17.206 1.00 0.00 H new ATOM 375 N SER A 498 13.764 26.294 19.195 1.00 0.00 N ATOM 376 CA SER A 498 12.364 26.731 19.292 1.00 0.00 C ATOM 377 C SER A 498 11.491 26.153 18.169 1.00 0.00 C ATOM 378 O SER A 498 11.901 26.119 17.005 1.00 0.00 O ATOM 379 CB SER A 498 12.272 28.267 19.337 1.00 0.00 C ATOM 380 OG SER A 498 12.588 28.903 18.108 1.00 0.00 O ATOM 0 H SER A 498 14.370 26.980 18.745 1.00 0.00 H new ATOM 0 HA SER A 498 11.969 26.336 20.228 1.00 0.00 H new ATOM 0 HB2 SER A 498 11.262 28.551 19.632 1.00 0.00 H new ATOM 0 HB3 SER A 498 12.946 28.638 20.109 1.00 0.00 H new ATOM 0 HG SER A 498 12.507 29.874 18.212 1.00 0.00 H new ATOM 386 N VAL A 499 10.265 25.741 18.504 1.00 0.00 N ATOM 387 CA VAL A 499 9.275 25.190 17.557 1.00 0.00 C ATOM 388 C VAL A 499 7.882 25.771 17.803 1.00 0.00 C ATOM 389 O VAL A 499 7.568 26.223 18.907 1.00 0.00 O ATOM 390 CB VAL A 499 9.216 23.644 17.600 1.00 0.00 C ATOM 391 CG1 VAL A 499 10.508 23.004 17.084 1.00 0.00 C ATOM 392 CG2 VAL A 499 8.926 23.078 18.993 1.00 0.00 C ATOM 0 H VAL A 499 9.919 25.780 19.463 1.00 0.00 H new ATOM 0 HA VAL A 499 9.609 25.485 16.562 1.00 0.00 H new ATOM 0 HB VAL A 499 8.383 23.390 16.944 1.00 0.00 H new ATOM 0 HG11 VAL A 499 10.421 21.919 17.133 1.00 0.00 H new ATOM 0 HG12 VAL A 499 10.678 23.308 16.051 1.00 0.00 H new ATOM 0 HG13 VAL A 499 11.346 23.329 17.700 1.00 0.00 H new ATOM 0 HG21 VAL A 499 8.900 21.989 18.945 1.00 0.00 H new ATOM 0 HG22 VAL A 499 9.709 23.392 19.684 1.00 0.00 H new ATOM 0 HG23 VAL A 499 7.963 23.449 19.343 1.00 0.00 H new ATOM 402 N LYS A 500 7.029 25.730 16.774 1.00 0.00 N ATOM 403 CA LYS A 500 5.648 26.249 16.778 1.00 0.00 C ATOM 404 C LYS A 500 4.699 25.172 16.253 1.00 0.00 C ATOM 405 O LYS A 500 5.085 24.361 15.421 1.00 0.00 O ATOM 406 CB LYS A 500 5.523 27.490 15.866 1.00 0.00 C ATOM 407 CG LYS A 500 6.553 28.617 16.042 1.00 0.00 C ATOM 408 CD LYS A 500 6.252 29.647 17.141 1.00 0.00 C ATOM 409 CE LYS A 500 6.585 29.149 18.550 1.00 0.00 C ATOM 410 NZ LYS A 500 6.367 30.216 19.565 1.00 0.00 N ATOM 0 H LYS A 500 7.288 25.319 15.877 1.00 0.00 H new ATOM 0 HA LYS A 500 5.392 26.526 17.801 1.00 0.00 H new ATOM 0 HB2 LYS A 500 5.571 27.151 14.831 1.00 0.00 H new ATOM 0 HB3 LYS A 500 4.531 27.917 16.016 1.00 0.00 H new ATOM 0 HG2 LYS A 500 7.522 28.165 16.253 1.00 0.00 H new ATOM 0 HG3 LYS A 500 6.647 29.146 15.094 1.00 0.00 H new ATOM 0 HD2 LYS A 500 6.819 30.556 16.942 1.00 0.00 H new ATOM 0 HD3 LYS A 500 5.196 29.914 17.098 1.00 0.00 H new ATOM 0 HE2 LYS A 500 5.965 28.285 18.789 1.00 0.00 H new ATOM 0 HE3 LYS A 500 7.623 28.817 18.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 500 6.601 29.849 20.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 500 6.977 31.030 19.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 500 5.371 30.515 19.546 1.00 0.00 H new ATOM 424 N GLN A 501 3.430 25.245 16.644 1.00 0.00 N ATOM 425 CA GLN A 501 2.367 24.301 16.234 1.00 0.00 C ATOM 426 C GLN A 501 2.120 24.256 14.705 1.00 0.00 C ATOM 427 O GLN A 501 1.565 23.285 14.187 1.00 0.00 O ATOM 428 CB GLN A 501 1.094 24.653 17.026 1.00 0.00 C ATOM 429 CG GLN A 501 -0.093 23.711 16.757 1.00 0.00 C ATOM 430 CD GLN A 501 -1.293 23.954 17.676 1.00 0.00 C ATOM 431 OE1 GLN A 501 -1.192 24.437 18.800 1.00 0.00 O ATOM 432 NE2 GLN A 501 -2.494 23.650 17.224 1.00 0.00 N ATOM 0 H GLN A 501 3.093 25.976 17.270 1.00 0.00 H new ATOM 0 HA GLN A 501 2.691 23.287 16.470 1.00 0.00 H new ATOM 0 HB2 GLN A 501 1.325 24.634 18.091 1.00 0.00 H new ATOM 0 HB3 GLN A 501 0.797 25.673 16.782 1.00 0.00 H new ATOM 0 HG2 GLN A 501 -0.411 23.828 15.721 1.00 0.00 H new ATOM 0 HG3 GLN A 501 0.240 22.680 16.874 1.00 0.00 H new ATOM 0 HE21 GLN A 501 -2.602 23.248 16.293 1.00 0.00 H new ATOM 0 HE22 GLN A 501 -3.315 23.817 17.805 1.00 0.00 H new ATOM 441 N ARG A 502 2.579 25.283 13.976 1.00 0.00 N ATOM 442 CA ARG A 502 2.448 25.450 12.514 1.00 0.00 C ATOM 443 C ARG A 502 3.799 25.470 11.781 1.00 0.00 C ATOM 444 O ARG A 502 3.890 25.942 10.646 1.00 0.00 O ATOM 445 CB ARG A 502 1.569 26.685 12.225 1.00 0.00 C ATOM 446 CG ARG A 502 2.157 28.007 12.758 1.00 0.00 C ATOM 447 CD ARG A 502 1.294 29.220 12.383 1.00 0.00 C ATOM 448 NE ARG A 502 -0.061 29.158 12.973 1.00 0.00 N ATOM 449 CZ ARG A 502 -0.428 29.514 14.193 1.00 0.00 C ATOM 450 NH1 ARG A 502 0.413 29.986 15.071 1.00 0.00 N ATOM 451 NH2 ARG A 502 -1.673 29.398 14.560 1.00 0.00 N ATOM 0 H ARG A 502 3.077 26.061 14.408 1.00 0.00 H new ATOM 0 HA ARG A 502 1.949 24.571 12.106 1.00 0.00 H new ATOM 0 HB2 ARG A 502 1.423 26.771 11.148 1.00 0.00 H new ATOM 0 HB3 ARG A 502 0.585 26.531 12.669 1.00 0.00 H new ATOM 0 HG2 ARG A 502 2.249 27.950 13.843 1.00 0.00 H new ATOM 0 HG3 ARG A 502 3.163 28.142 12.360 1.00 0.00 H new ATOM 0 HD2 ARG A 502 1.790 30.131 12.717 1.00 0.00 H new ATOM 0 HD3 ARG A 502 1.211 29.281 11.298 1.00 0.00 H new ATOM 0 HE ARG A 502 -0.799 28.798 12.368 1.00 0.00 H new ATOM 0 HH11 ARG A 502 1.398 30.093 14.828 1.00 0.00 H new ATOM 0 HH12 ARG A 502 0.086 30.248 16.001 1.00 0.00 H new ATOM 0 HH21 ARG A 502 -2.365 29.032 13.906 1.00 0.00 H new ATOM 0 HH22 ARG A 502 -1.955 29.673 15.501 1.00 0.00 H new ATOM 465 N ASP A 503 4.844 24.953 12.427 1.00 0.00 N ATOM 466 CA ASP A 503 6.199 24.837 11.883 1.00 0.00 C ATOM 467 C ASP A 503 6.553 23.361 11.617 1.00 0.00 C ATOM 468 O ASP A 503 6.214 22.466 12.399 1.00 0.00 O ATOM 469 CB ASP A 503 7.175 25.508 12.863 1.00 0.00 C ATOM 470 CG ASP A 503 8.619 25.574 12.345 1.00 0.00 C ATOM 471 OD1 ASP A 503 8.811 25.815 11.130 1.00 0.00 O ATOM 472 OD2 ASP A 503 9.554 25.441 13.169 1.00 0.00 O ATOM 0 H ASP A 503 4.769 24.590 13.377 1.00 0.00 H new ATOM 0 HA ASP A 503 6.269 25.345 10.921 1.00 0.00 H new ATOM 0 HB2 ASP A 503 6.827 26.519 13.074 1.00 0.00 H new ATOM 0 HB3 ASP A 503 7.161 24.963 13.807 1.00 0.00 H new ATOM 477 N VAL A 504 7.241 23.110 10.501 1.00 0.00 N ATOM 478 CA VAL A 504 7.677 21.783 10.039 1.00 0.00 C ATOM 479 C VAL A 504 9.204 21.768 9.938 1.00 0.00 C ATOM 480 O VAL A 504 9.815 22.728 9.456 1.00 0.00 O ATOM 481 CB VAL A 504 6.993 21.410 8.701 1.00 0.00 C ATOM 482 CG1 VAL A 504 7.466 22.238 7.497 1.00 0.00 C ATOM 483 CG2 VAL A 504 7.131 19.912 8.390 1.00 0.00 C ATOM 0 H VAL A 504 7.523 23.856 9.865 1.00 0.00 H new ATOM 0 HA VAL A 504 7.374 21.022 10.759 1.00 0.00 H new ATOM 0 HB VAL A 504 5.942 21.654 8.854 1.00 0.00 H new ATOM 0 HG11 VAL A 504 6.937 21.912 6.601 1.00 0.00 H new ATOM 0 HG12 VAL A 504 7.259 23.293 7.677 1.00 0.00 H new ATOM 0 HG13 VAL A 504 8.538 22.097 7.357 1.00 0.00 H new ATOM 0 HG21 VAL A 504 6.638 19.690 7.443 1.00 0.00 H new ATOM 0 HG22 VAL A 504 8.187 19.651 8.319 1.00 0.00 H new ATOM 0 HG23 VAL A 504 6.666 19.331 9.186 1.00 0.00 H new ATOM 493 N LEU A 505 9.831 20.690 10.419 1.00 0.00 N ATOM 494 CA LEU A 505 11.286 20.586 10.532 1.00 0.00 C ATOM 495 C LEU A 505 11.790 19.235 10.009 1.00 0.00 C ATOM 496 O LEU A 505 11.075 18.226 10.022 1.00 0.00 O ATOM 497 CB LEU A 505 11.751 20.832 11.983 1.00 0.00 C ATOM 498 CG LEU A 505 11.185 22.093 12.674 1.00 0.00 C ATOM 499 CD1 LEU A 505 9.922 21.781 13.488 1.00 0.00 C ATOM 500 CD2 LEU A 505 12.214 22.684 13.639 1.00 0.00 C ATOM 0 H LEU A 505 9.337 19.859 10.743 1.00 0.00 H new ATOM 0 HA LEU A 505 11.723 21.365 9.907 1.00 0.00 H new ATOM 0 HB2 LEU A 505 11.481 19.962 12.582 1.00 0.00 H new ATOM 0 HB3 LEU A 505 12.839 20.897 11.988 1.00 0.00 H new ATOM 0 HG LEU A 505 10.944 22.798 11.878 1.00 0.00 H new ATOM 0 HD11 LEU A 505 9.557 22.694 13.957 1.00 0.00 H new ATOM 0 HD12 LEU A 505 9.153 21.380 12.827 1.00 0.00 H new ATOM 0 HD13 LEU A 505 10.158 21.047 14.258 1.00 0.00 H new ATOM 0 HD21 LEU A 505 11.798 23.571 14.116 1.00 0.00 H new ATOM 0 HD22 LEU A 505 12.464 21.946 14.401 1.00 0.00 H new ATOM 0 HD23 LEU A 505 13.114 22.957 13.089 1.00 0.00 H new ATOM 512 N GLU A 506 13.038 19.219 9.544 1.00 0.00 N ATOM 513 CA GLU A 506 13.680 18.029 8.981 1.00 0.00 C ATOM 514 C GLU A 506 14.522 17.348 10.064 1.00 0.00 C ATOM 515 O GLU A 506 15.468 17.949 10.575 1.00 0.00 O ATOM 516 CB GLU A 506 14.523 18.423 7.756 1.00 0.00 C ATOM 517 CG GLU A 506 15.090 17.197 7.029 1.00 0.00 C ATOM 518 CD GLU A 506 15.972 17.606 5.832 1.00 0.00 C ATOM 519 OE1 GLU A 506 15.432 18.050 4.789 1.00 0.00 O ATOM 520 OE2 GLU A 506 17.217 17.464 5.912 1.00 0.00 O ATOM 0 H GLU A 506 13.641 20.042 9.547 1.00 0.00 H new ATOM 0 HA GLU A 506 12.927 17.317 8.644 1.00 0.00 H new ATOM 0 HB2 GLU A 506 13.910 19.002 7.066 1.00 0.00 H new ATOM 0 HB3 GLU A 506 15.343 19.068 8.073 1.00 0.00 H new ATOM 0 HG2 GLU A 506 15.676 16.598 7.726 1.00 0.00 H new ATOM 0 HG3 GLU A 506 14.271 16.569 6.680 1.00 0.00 H new ATOM 527 N VAL A 507 14.167 16.113 10.439 1.00 0.00 N ATOM 528 CA VAL A 507 14.953 15.295 11.380 1.00 0.00 C ATOM 529 C VAL A 507 16.322 14.926 10.797 1.00 0.00 C ATOM 530 O VAL A 507 16.449 14.571 9.622 1.00 0.00 O ATOM 531 CB VAL A 507 14.160 14.059 11.857 1.00 0.00 C ATOM 532 CG1 VAL A 507 13.843 13.050 10.748 1.00 0.00 C ATOM 533 CG2 VAL A 507 14.881 13.325 12.994 1.00 0.00 C ATOM 0 H VAL A 507 13.325 15.649 10.099 1.00 0.00 H new ATOM 0 HA VAL A 507 15.145 15.901 12.265 1.00 0.00 H new ATOM 0 HB VAL A 507 13.214 14.469 12.211 1.00 0.00 H new ATOM 0 HG11 VAL A 507 13.285 12.213 11.167 1.00 0.00 H new ATOM 0 HG12 VAL A 507 13.246 13.534 9.975 1.00 0.00 H new ATOM 0 HG13 VAL A 507 14.773 12.684 10.312 1.00 0.00 H new ATOM 0 HG21 VAL A 507 14.291 12.462 13.301 1.00 0.00 H new ATOM 0 HG22 VAL A 507 15.860 12.991 12.649 1.00 0.00 H new ATOM 0 HG23 VAL A 507 15.006 14.000 13.841 1.00 0.00 H new ATOM 543 N LEU A 508 17.347 15.000 11.649 1.00 0.00 N ATOM 544 CA LEU A 508 18.755 14.762 11.314 1.00 0.00 C ATOM 545 C LEU A 508 19.384 13.682 12.210 1.00 0.00 C ATOM 546 O LEU A 508 20.250 12.930 11.757 1.00 0.00 O ATOM 547 CB LEU A 508 19.528 16.082 11.486 1.00 0.00 C ATOM 548 CG LEU A 508 19.039 17.268 10.636 1.00 0.00 C ATOM 549 CD1 LEU A 508 19.793 18.521 11.071 1.00 0.00 C ATOM 550 CD2 LEU A 508 19.262 17.051 9.139 1.00 0.00 C ATOM 0 H LEU A 508 17.214 15.237 12.632 1.00 0.00 H new ATOM 0 HA LEU A 508 18.809 14.408 10.285 1.00 0.00 H new ATOM 0 HB2 LEU A 508 19.484 16.371 12.536 1.00 0.00 H new ATOM 0 HB3 LEU A 508 20.576 15.899 11.249 1.00 0.00 H new ATOM 0 HG LEU A 508 17.965 17.370 10.795 1.00 0.00 H new ATOM 0 HD11 LEU A 508 19.458 19.372 10.478 1.00 0.00 H new ATOM 0 HD12 LEU A 508 19.598 18.715 12.126 1.00 0.00 H new ATOM 0 HD13 LEU A 508 20.862 18.373 10.921 1.00 0.00 H new ATOM 0 HD21 LEU A 508 18.899 17.918 8.588 1.00 0.00 H new ATOM 0 HD22 LEU A 508 20.326 16.918 8.945 1.00 0.00 H new ATOM 0 HD23 LEU A 508 18.720 16.162 8.815 1.00 0.00 H new ATOM 562 N ASP A 509 18.934 13.583 13.464 1.00 0.00 N ATOM 563 CA ASP A 509 19.333 12.551 14.426 1.00 0.00 C ATOM 564 C ASP A 509 18.200 12.280 15.433 1.00 0.00 C ATOM 565 O ASP A 509 17.524 13.204 15.893 1.00 0.00 O ATOM 566 CB ASP A 509 20.614 12.998 15.151 1.00 0.00 C ATOM 567 CG ASP A 509 21.160 11.928 16.111 1.00 0.00 C ATOM 568 OD1 ASP A 509 21.122 10.720 15.772 1.00 0.00 O ATOM 569 OD2 ASP A 509 21.645 12.291 17.209 1.00 0.00 O ATOM 0 H ASP A 509 18.258 14.242 13.851 1.00 0.00 H new ATOM 0 HA ASP A 509 19.532 11.621 13.893 1.00 0.00 H new ATOM 0 HB2 ASP A 509 21.378 13.241 14.412 1.00 0.00 H new ATOM 0 HB3 ASP A 509 20.410 13.911 15.710 1.00 0.00 H new ATOM 574 N ASP A 510 18.008 11.007 15.783 1.00 0.00 N ATOM 575 CA ASP A 510 16.893 10.485 16.593 1.00 0.00 C ATOM 576 C ASP A 510 17.348 9.442 17.647 1.00 0.00 C ATOM 577 O ASP A 510 16.541 8.670 18.176 1.00 0.00 O ATOM 578 CB ASP A 510 15.797 9.948 15.649 1.00 0.00 C ATOM 579 CG ASP A 510 16.244 8.836 14.677 1.00 0.00 C ATOM 580 OD1 ASP A 510 17.233 8.109 14.943 1.00 0.00 O ATOM 581 OD2 ASP A 510 15.583 8.670 13.622 1.00 0.00 O ATOM 0 H ASP A 510 18.655 10.272 15.498 1.00 0.00 H new ATOM 0 HA ASP A 510 16.477 11.301 17.183 1.00 0.00 H new ATOM 0 HB2 ASP A 510 14.974 9.568 16.255 1.00 0.00 H new ATOM 0 HB3 ASP A 510 15.405 10.781 15.065 1.00 0.00 H new ATOM 586 N SER A 511 18.653 9.417 17.956 1.00 0.00 N ATOM 587 CA SER A 511 19.311 8.460 18.865 1.00 0.00 C ATOM 588 C SER A 511 18.799 8.494 20.322 1.00 0.00 C ATOM 589 O SER A 511 18.812 7.467 21.010 1.00 0.00 O ATOM 590 CB SER A 511 20.822 8.737 18.836 1.00 0.00 C ATOM 591 OG SER A 511 21.565 7.740 19.519 1.00 0.00 O ATOM 0 H SER A 511 19.309 10.092 17.563 1.00 0.00 H new ATOM 0 HA SER A 511 19.069 7.461 18.503 1.00 0.00 H new ATOM 0 HB2 SER A 511 21.159 8.793 17.801 1.00 0.00 H new ATOM 0 HB3 SER A 511 21.020 9.709 19.289 1.00 0.00 H new ATOM 0 HG SER A 511 22.520 7.955 19.474 1.00 0.00 H new ATOM 597 N ARG A 512 18.313 9.655 20.789 1.00 0.00 N ATOM 598 CA ARG A 512 17.781 9.913 22.146 1.00 0.00 C ATOM 599 C ARG A 512 16.447 10.673 22.087 1.00 0.00 C ATOM 600 O ARG A 512 16.013 11.060 21.003 1.00 0.00 O ATOM 601 CB ARG A 512 18.830 10.698 22.963 1.00 0.00 C ATOM 602 CG ARG A 512 20.133 9.910 23.174 1.00 0.00 C ATOM 603 CD ARG A 512 21.093 10.602 24.158 1.00 0.00 C ATOM 604 NE ARG A 512 20.523 10.739 25.517 1.00 0.00 N ATOM 605 CZ ARG A 512 20.413 9.802 26.445 1.00 0.00 C ATOM 606 NH1 ARG A 512 20.832 8.580 26.262 1.00 0.00 N ATOM 607 NH2 ARG A 512 19.865 10.080 27.593 1.00 0.00 N ATOM 0 H ARG A 512 18.277 10.488 20.201 1.00 0.00 H new ATOM 0 HA ARG A 512 17.585 8.959 22.636 1.00 0.00 H new ATOM 0 HB2 ARG A 512 19.056 11.634 22.452 1.00 0.00 H new ATOM 0 HB3 ARG A 512 18.407 10.959 23.933 1.00 0.00 H new ATOM 0 HG2 ARG A 512 19.894 8.914 23.546 1.00 0.00 H new ATOM 0 HG3 ARG A 512 20.634 9.780 22.215 1.00 0.00 H new ATOM 0 HD2 ARG A 512 22.021 10.033 24.214 1.00 0.00 H new ATOM 0 HD3 ARG A 512 21.348 11.590 23.775 1.00 0.00 H new ATOM 0 HE ARG A 512 20.174 11.664 25.768 1.00 0.00 H new ATOM 0 HH11 ARG A 512 21.264 8.316 25.376 1.00 0.00 H new ATOM 0 HH12 ARG A 512 20.728 7.888 27.004 1.00 0.00 H new ATOM 0 HH21 ARG A 512 19.519 11.022 27.778 1.00 0.00 H new ATOM 0 HH22 ARG A 512 19.781 9.356 28.307 1.00 0.00 H new ATOM 621 N LYS A 513 15.805 10.923 23.240 1.00 0.00 N ATOM 622 CA LYS A 513 14.548 11.704 23.358 1.00 0.00 C ATOM 623 C LYS A 513 14.627 13.074 22.670 1.00 0.00 C ATOM 624 O LYS A 513 13.686 13.496 21.997 1.00 0.00 O ATOM 625 CB LYS A 513 14.187 11.867 24.849 1.00 0.00 C ATOM 626 CG LYS A 513 12.957 12.766 25.095 1.00 0.00 C ATOM 627 CD LYS A 513 12.558 12.919 26.571 1.00 0.00 C ATOM 628 CE LYS A 513 13.589 13.697 27.407 1.00 0.00 C ATOM 629 NZ LYS A 513 14.527 12.802 28.144 1.00 0.00 N ATOM 0 H LYS A 513 16.147 10.584 24.139 1.00 0.00 H new ATOM 0 HA LYS A 513 13.766 11.148 22.841 1.00 0.00 H new ATOM 0 HB2 LYS A 513 13.998 10.883 25.278 1.00 0.00 H new ATOM 0 HB3 LYS A 513 15.043 12.286 25.377 1.00 0.00 H new ATOM 0 HG2 LYS A 513 13.159 13.755 24.683 1.00 0.00 H new ATOM 0 HG3 LYS A 513 12.110 12.358 24.544 1.00 0.00 H new ATOM 0 HD2 LYS A 513 11.596 13.429 26.628 1.00 0.00 H new ATOM 0 HD3 LYS A 513 12.421 11.929 27.007 1.00 0.00 H new ATOM 0 HE2 LYS A 513 14.160 14.354 26.752 1.00 0.00 H new ATOM 0 HE3 LYS A 513 13.066 14.334 28.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 513 15.350 13.350 28.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 513 14.041 12.393 28.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 513 14.844 12.037 27.514 1.00 0.00 H new ATOM 643 N TRP A 514 15.749 13.763 22.854 1.00 0.00 N ATOM 644 CA TRP A 514 16.049 15.027 22.189 1.00 0.00 C ATOM 645 C TRP A 514 16.488 14.758 20.740 1.00 0.00 C ATOM 646 O TRP A 514 17.625 14.352 20.486 1.00 0.00 O ATOM 647 CB TRP A 514 17.095 15.791 23.007 1.00 0.00 C ATOM 648 CG TRP A 514 16.603 16.271 24.342 1.00 0.00 C ATOM 649 CD1 TRP A 514 16.683 15.595 25.512 1.00 0.00 C ATOM 650 CD2 TRP A 514 15.927 17.529 24.660 1.00 0.00 C ATOM 651 NE1 TRP A 514 16.088 16.335 26.520 1.00 0.00 N ATOM 652 CE2 TRP A 514 15.583 17.526 26.044 1.00 0.00 C ATOM 653 CE3 TRP A 514 15.577 18.676 23.916 1.00 0.00 C ATOM 654 CZ2 TRP A 514 14.894 18.589 26.650 1.00 0.00 C ATOM 655 CZ3 TRP A 514 14.904 19.758 24.515 1.00 0.00 C ATOM 656 CH2 TRP A 514 14.549 19.710 25.875 1.00 0.00 C ATOM 0 H TRP A 514 16.490 13.452 23.482 1.00 0.00 H new ATOM 0 HA TRP A 514 15.162 15.658 22.134 1.00 0.00 H new ATOM 0 HB2 TRP A 514 17.960 15.146 23.162 1.00 0.00 H new ATOM 0 HB3 TRP A 514 17.436 16.649 22.428 1.00 0.00 H new ATOM 0 HD1 TRP A 514 17.141 14.626 25.640 1.00 0.00 H new ATOM 0 HE1 TRP A 514 16.031 16.036 27.493 1.00 0.00 H new ATOM 0 HE3 TRP A 514 15.830 18.725 22.867 1.00 0.00 H new ATOM 0 HZ2 TRP A 514 14.633 18.546 27.697 1.00 0.00 H new ATOM 0 HZ3 TRP A 514 14.659 20.630 23.927 1.00 0.00 H new ATOM 0 HH2 TRP A 514 14.012 20.533 26.323 1.00 0.00 H new ATOM 667 N TRP A 515 15.568 14.944 19.791 1.00 0.00 N ATOM 668 CA TRP A 515 15.824 14.814 18.352 1.00 0.00 C ATOM 669 C TRP A 515 16.491 16.084 17.818 1.00 0.00 C ATOM 670 O TRP A 515 16.094 17.196 18.183 1.00 0.00 O ATOM 671 CB TRP A 515 14.507 14.548 17.597 1.00 0.00 C ATOM 672 CG TRP A 515 13.949 13.156 17.702 1.00 0.00 C ATOM 673 CD1 TRP A 515 14.189 12.285 18.706 1.00 0.00 C ATOM 674 CD2 TRP A 515 13.083 12.436 16.767 1.00 0.00 C ATOM 675 NE1 TRP A 515 13.557 11.084 18.463 1.00 0.00 N ATOM 676 CE2 TRP A 515 12.857 11.119 17.279 1.00 0.00 C ATOM 677 CE3 TRP A 515 12.475 12.750 15.532 1.00 0.00 C ATOM 678 CZ2 TRP A 515 12.082 10.166 16.602 1.00 0.00 C ATOM 679 CZ3 TRP A 515 11.709 11.794 14.834 1.00 0.00 C ATOM 680 CH2 TRP A 515 11.509 10.506 15.366 1.00 0.00 C ATOM 0 H TRP A 515 14.603 15.195 20.005 1.00 0.00 H new ATOM 0 HA TRP A 515 16.495 13.970 18.191 1.00 0.00 H new ATOM 0 HB2 TRP A 515 13.755 15.247 17.964 1.00 0.00 H new ATOM 0 HB3 TRP A 515 14.665 14.775 16.543 1.00 0.00 H new ATOM 0 HD1 TRP A 515 14.791 12.499 19.577 1.00 0.00 H new ATOM 0 HE1 TRP A 515 13.603 10.274 19.081 1.00 0.00 H new ATOM 0 HE3 TRP A 515 12.599 13.739 15.115 1.00 0.00 H new ATOM 0 HZ2 TRP A 515 11.928 9.184 17.025 1.00 0.00 H new ATOM 0 HZ3 TRP A 515 11.271 12.052 13.881 1.00 0.00 H new ATOM 0 HH2 TRP A 515 10.917 9.782 14.826 1.00 0.00 H new ATOM 691 N LYS A 516 17.482 15.922 16.934 1.00 0.00 N ATOM 692 CA LYS A 516 18.111 17.041 16.216 1.00 0.00 C ATOM 693 C LYS A 516 17.333 17.331 14.935 1.00 0.00 C ATOM 694 O LYS A 516 17.061 16.419 14.149 1.00 0.00 O ATOM 695 CB LYS A 516 19.592 16.745 15.911 1.00 0.00 C ATOM 696 CG LYS A 516 20.382 18.061 15.796 1.00 0.00 C ATOM 697 CD LYS A 516 21.833 17.866 15.333 1.00 0.00 C ATOM 698 CE LYS A 516 21.905 17.635 13.818 1.00 0.00 C ATOM 699 NZ LYS A 516 23.308 17.599 13.325 1.00 0.00 N ATOM 0 H LYS A 516 17.872 15.011 16.695 1.00 0.00 H new ATOM 0 HA LYS A 516 18.083 17.925 16.852 1.00 0.00 H new ATOM 0 HB2 LYS A 516 20.017 16.125 16.700 1.00 0.00 H new ATOM 0 HB3 LYS A 516 19.674 16.180 14.982 1.00 0.00 H new ATOM 0 HG2 LYS A 516 19.871 18.722 15.096 1.00 0.00 H new ATOM 0 HG3 LYS A 516 20.382 18.561 16.764 1.00 0.00 H new ATOM 0 HD2 LYS A 516 22.423 18.743 15.598 1.00 0.00 H new ATOM 0 HD3 LYS A 516 22.273 17.016 15.855 1.00 0.00 H new ATOM 0 HE2 LYS A 516 21.410 16.696 13.571 1.00 0.00 H new ATOM 0 HE3 LYS A 516 21.361 18.427 13.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 516 23.509 18.466 12.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 516 23.959 17.535 14.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 516 23.439 16.771 12.710 1.00 0.00 H new ATOM 713 N VAL A 517 17.004 18.599 14.713 1.00 0.00 N ATOM 714 CA VAL A 517 16.191 19.081 13.583 1.00 0.00 C ATOM 715 C VAL A 517 16.725 20.410 13.036 1.00 0.00 C ATOM 716 O VAL A 517 17.415 21.153 13.742 1.00 0.00 O ATOM 717 CB VAL A 517 14.704 19.238 13.976 1.00 0.00 C ATOM 718 CG1 VAL A 517 13.981 17.899 14.167 1.00 0.00 C ATOM 719 CG2 VAL A 517 14.498 20.078 15.241 1.00 0.00 C ATOM 0 H VAL A 517 17.303 19.352 15.332 1.00 0.00 H new ATOM 0 HA VAL A 517 16.264 18.326 12.800 1.00 0.00 H new ATOM 0 HB VAL A 517 14.268 19.760 13.124 1.00 0.00 H new ATOM 0 HG11 VAL A 517 12.942 18.082 14.442 1.00 0.00 H new ATOM 0 HG12 VAL A 517 14.016 17.331 13.237 1.00 0.00 H new ATOM 0 HG13 VAL A 517 14.470 17.331 14.958 1.00 0.00 H new ATOM 0 HG21 VAL A 517 13.433 20.149 15.461 1.00 0.00 H new ATOM 0 HG22 VAL A 517 15.011 19.606 16.079 1.00 0.00 H new ATOM 0 HG23 VAL A 517 14.903 21.078 15.084 1.00 0.00 H new ATOM 729 N ARG A 518 16.371 20.722 11.783 1.00 0.00 N ATOM 730 CA ARG A 518 16.701 21.983 11.098 1.00 0.00 C ATOM 731 C ARG A 518 15.432 22.814 10.888 1.00 0.00 C ATOM 732 O ARG A 518 14.491 22.381 10.218 1.00 0.00 O ATOM 733 CB ARG A 518 17.382 21.674 9.755 1.00 0.00 C ATOM 734 CG ARG A 518 18.161 22.883 9.210 1.00 0.00 C ATOM 735 CD ARG A 518 18.685 22.644 7.791 1.00 0.00 C ATOM 736 NE ARG A 518 19.603 21.487 7.724 1.00 0.00 N ATOM 737 CZ ARG A 518 19.894 20.771 6.650 1.00 0.00 C ATOM 738 NH1 ARG A 518 19.433 21.071 5.468 1.00 0.00 N ATOM 739 NH2 ARG A 518 20.667 19.727 6.745 1.00 0.00 N ATOM 0 H ARG A 518 15.830 20.085 11.198 1.00 0.00 H new ATOM 0 HA ARG A 518 17.389 22.563 11.713 1.00 0.00 H new ATOM 0 HB2 ARG A 518 18.062 20.831 9.879 1.00 0.00 H new ATOM 0 HB3 ARG A 518 16.628 21.371 9.028 1.00 0.00 H new ATOM 0 HG2 ARG A 518 17.515 23.761 9.213 1.00 0.00 H new ATOM 0 HG3 ARG A 518 18.999 23.102 9.872 1.00 0.00 H new ATOM 0 HD2 ARG A 518 17.844 22.478 7.118 1.00 0.00 H new ATOM 0 HD3 ARG A 518 19.202 23.537 7.441 1.00 0.00 H new ATOM 0 HE ARG A 518 20.058 21.213 8.594 1.00 0.00 H new ATOM 0 HH11 ARG A 518 18.826 21.882 5.348 1.00 0.00 H new ATOM 0 HH12 ARG A 518 19.679 20.495 4.663 1.00 0.00 H new ATOM 0 HH21 ARG A 518 21.051 19.458 7.651 1.00 0.00 H new ATOM 0 HH22 ARG A 518 20.888 19.179 5.914 1.00 0.00 H new ATOM 753 N ASP A 519 15.405 23.996 11.485 1.00 0.00 N ATOM 754 CA ASP A 519 14.365 25.022 11.317 1.00 0.00 C ATOM 755 C ASP A 519 14.474 25.782 9.971 1.00 0.00 C ATOM 756 O ASP A 519 15.534 25.771 9.332 1.00 0.00 O ATOM 757 CB ASP A 519 14.484 25.999 12.495 1.00 0.00 C ATOM 758 CG ASP A 519 15.913 26.533 12.628 1.00 0.00 C ATOM 759 OD1 ASP A 519 16.253 27.521 11.929 1.00 0.00 O ATOM 760 OD2 ASP A 519 16.683 25.935 13.404 1.00 0.00 O ATOM 0 H ASP A 519 16.138 24.288 12.132 1.00 0.00 H new ATOM 0 HA ASP A 519 13.391 24.533 11.302 1.00 0.00 H new ATOM 0 HB2 ASP A 519 13.794 26.831 12.353 1.00 0.00 H new ATOM 0 HB3 ASP A 519 14.193 25.497 13.418 1.00 0.00 H new ATOM 765 N PRO A 520 13.406 26.481 9.529 1.00 0.00 N ATOM 766 CA PRO A 520 13.405 27.242 8.275 1.00 0.00 C ATOM 767 C PRO A 520 14.263 28.523 8.288 1.00 0.00 C ATOM 768 O PRO A 520 14.521 29.085 7.220 1.00 0.00 O ATOM 769 CB PRO A 520 11.933 27.565 8.002 1.00 0.00 C ATOM 770 CG PRO A 520 11.312 27.603 9.394 1.00 0.00 C ATOM 771 CD PRO A 520 12.070 26.492 10.116 1.00 0.00 C ATOM 0 HA PRO A 520 13.868 26.643 7.490 1.00 0.00 H new ATOM 0 HB2 PRO A 520 11.820 28.519 7.486 1.00 0.00 H new ATOM 0 HB3 PRO A 520 11.465 26.806 7.375 1.00 0.00 H new ATOM 0 HG2 PRO A 520 11.452 28.571 9.876 1.00 0.00 H new ATOM 0 HG3 PRO A 520 10.239 27.413 9.366 1.00 0.00 H new ATOM 0 HD2 PRO A 520 12.115 26.681 11.188 1.00 0.00 H new ATOM 0 HD3 PRO A 520 11.576 25.530 9.983 1.00 0.00 H new ATOM 779 N ALA A 521 14.723 28.996 9.456 1.00 0.00 N ATOM 780 CA ALA A 521 15.645 30.136 9.555 1.00 0.00 C ATOM 781 C ALA A 521 17.091 29.769 9.155 1.00 0.00 C ATOM 782 O ALA A 521 17.888 30.655 8.829 1.00 0.00 O ATOM 783 CB ALA A 521 15.604 30.716 10.977 1.00 0.00 C ATOM 0 H ALA A 521 14.466 28.598 10.359 1.00 0.00 H new ATOM 0 HA ALA A 521 15.310 30.891 8.844 1.00 0.00 H new ATOM 0 HB1 ALA A 521 16.289 31.561 11.045 1.00 0.00 H new ATOM 0 HB2 ALA A 521 14.592 31.050 11.204 1.00 0.00 H new ATOM 0 HB3 ALA A 521 15.902 29.949 11.692 1.00 0.00 H new ATOM 789 N GLY A 522 17.428 28.473 9.162 1.00 0.00 N ATOM 790 CA GLY A 522 18.728 27.935 8.754 1.00 0.00 C ATOM 791 C GLY A 522 19.638 27.538 9.923 1.00 0.00 C ATOM 792 O GLY A 522 20.831 27.300 9.708 1.00 0.00 O ATOM 0 H GLY A 522 16.779 27.746 9.463 1.00 0.00 H new ATOM 0 HA2 GLY A 522 18.565 27.062 8.122 1.00 0.00 H new ATOM 0 HA3 GLY A 522 19.242 28.679 8.145 1.00 0.00 H new ATOM 796 N GLN A 523 19.109 27.484 11.149 1.00 0.00 N ATOM 797 CA GLN A 523 19.835 27.038 12.344 1.00 0.00 C ATOM 798 C GLN A 523 19.639 25.520 12.575 1.00 0.00 C ATOM 799 O GLN A 523 18.970 24.828 11.799 1.00 0.00 O ATOM 800 CB GLN A 523 19.425 27.887 13.571 1.00 0.00 C ATOM 801 CG GLN A 523 19.334 29.400 13.298 1.00 0.00 C ATOM 802 CD GLN A 523 19.225 30.208 14.590 1.00 0.00 C ATOM 803 OE1 GLN A 523 18.144 30.531 15.070 1.00 0.00 O ATOM 804 NE2 GLN A 523 20.332 30.571 15.207 1.00 0.00 N ATOM 0 H GLN A 523 18.145 27.754 11.343 1.00 0.00 H new ATOM 0 HA GLN A 523 20.903 27.192 12.190 1.00 0.00 H new ATOM 0 HB2 GLN A 523 18.458 27.537 13.933 1.00 0.00 H new ATOM 0 HB3 GLN A 523 20.145 27.718 14.371 1.00 0.00 H new ATOM 0 HG2 GLN A 523 20.215 29.722 12.742 1.00 0.00 H new ATOM 0 HG3 GLN A 523 18.468 29.604 12.669 1.00 0.00 H new ATOM 0 HE21 GLN A 523 21.240 30.311 14.821 1.00 0.00 H new ATOM 0 HE22 GLN A 523 20.281 31.112 16.070 1.00 0.00 H new ATOM 813 N GLU A 524 20.249 24.982 13.634 1.00 0.00 N ATOM 814 CA GLU A 524 20.075 23.594 14.089 1.00 0.00 C ATOM 815 C GLU A 524 20.093 23.537 15.623 1.00 0.00 C ATOM 816 O GLU A 524 20.824 24.286 16.283 1.00 0.00 O ATOM 817 CB GLU A 524 21.208 22.693 13.566 1.00 0.00 C ATOM 818 CG GLU A 524 21.173 22.379 12.067 1.00 0.00 C ATOM 819 CD GLU A 524 22.452 21.623 11.651 1.00 0.00 C ATOM 820 OE1 GLU A 524 22.624 20.439 12.032 1.00 0.00 O ATOM 821 OE2 GLU A 524 23.307 22.215 10.946 1.00 0.00 O ATOM 0 H GLU A 524 20.896 25.512 14.217 1.00 0.00 H new ATOM 0 HA GLU A 524 19.119 23.240 13.703 1.00 0.00 H new ATOM 0 HB2 GLU A 524 22.161 23.170 13.796 1.00 0.00 H new ATOM 0 HB3 GLU A 524 21.181 21.752 14.116 1.00 0.00 H new ATOM 0 HG2 GLU A 524 20.294 21.777 11.834 1.00 0.00 H new ATOM 0 HG3 GLU A 524 21.086 23.304 11.496 1.00 0.00 H new ATOM 828 N GLY A 525 19.323 22.612 16.198 1.00 0.00 N ATOM 829 CA GLY A 525 19.279 22.374 17.636 1.00 0.00 C ATOM 830 C GLY A 525 18.383 21.186 17.995 1.00 0.00 C ATOM 831 O GLY A 525 17.977 20.413 17.120 1.00 0.00 O ATOM 0 H GLY A 525 18.704 21.999 15.667 1.00 0.00 H new ATOM 0 HA2 GLY A 525 20.289 22.191 18.004 1.00 0.00 H new ATOM 0 HA3 GLY A 525 18.914 23.269 18.140 1.00 0.00 H new ATOM 835 N TYR A 526 18.069 21.050 19.285 1.00 0.00 N ATOM 836 CA TYR A 526 17.414 19.865 19.846 1.00 0.00 C ATOM 837 C TYR A 526 16.038 20.161 20.470 1.00 0.00 C ATOM 838 O TYR A 526 15.836 21.211 21.088 1.00 0.00 O ATOM 839 CB TYR A 526 18.366 19.243 20.875 1.00 0.00 C ATOM 840 CG TYR A 526 19.587 18.566 20.270 1.00 0.00 C ATOM 841 CD1 TYR A 526 19.529 17.203 19.922 1.00 0.00 C ATOM 842 CD2 TYR A 526 20.780 19.284 20.057 1.00 0.00 C ATOM 843 CE1 TYR A 526 20.659 16.555 19.389 1.00 0.00 C ATOM 844 CE2 TYR A 526 21.912 18.646 19.514 1.00 0.00 C ATOM 845 CZ TYR A 526 21.855 17.274 19.182 1.00 0.00 C ATOM 846 OH TYR A 526 22.946 16.646 18.665 1.00 0.00 O ATOM 0 H TYR A 526 18.265 21.770 19.980 1.00 0.00 H new ATOM 0 HA TYR A 526 17.210 19.168 19.033 1.00 0.00 H new ATOM 0 HB2 TYR A 526 18.700 20.022 21.561 1.00 0.00 H new ATOM 0 HB3 TYR A 526 17.815 18.512 21.466 1.00 0.00 H new ATOM 0 HD1 TYR A 526 18.612 16.651 20.065 1.00 0.00 H new ATOM 0 HD2 TYR A 526 20.827 20.332 20.312 1.00 0.00 H new ATOM 0 HE1 TYR A 526 20.610 15.506 19.138 1.00 0.00 H new ATOM 0 HE2 TYR A 526 22.822 19.205 19.352 1.00 0.00 H new ATOM 0 HH TYR A 526 23.685 17.285 18.586 1.00 0.00 H new ATOM 856 N VAL A 527 15.111 19.199 20.349 1.00 0.00 N ATOM 857 CA VAL A 527 13.728 19.246 20.885 1.00 0.00 C ATOM 858 C VAL A 527 13.204 17.856 21.282 1.00 0.00 C ATOM 859 O VAL A 527 13.623 16.860 20.687 1.00 0.00 O ATOM 860 CB VAL A 527 12.720 19.841 19.874 1.00 0.00 C ATOM 861 CG1 VAL A 527 12.708 21.362 19.947 1.00 0.00 C ATOM 862 CG2 VAL A 527 12.968 19.422 18.422 1.00 0.00 C ATOM 0 H VAL A 527 15.305 18.328 19.856 1.00 0.00 H new ATOM 0 HA VAL A 527 13.798 19.886 21.764 1.00 0.00 H new ATOM 0 HB VAL A 527 11.754 19.433 20.170 1.00 0.00 H new ATOM 0 HG11 VAL A 527 11.991 21.755 19.226 1.00 0.00 H new ATOM 0 HG12 VAL A 527 12.422 21.676 20.951 1.00 0.00 H new ATOM 0 HG13 VAL A 527 13.702 21.745 19.716 1.00 0.00 H new ATOM 0 HG21 VAL A 527 12.219 19.882 17.778 1.00 0.00 H new ATOM 0 HG22 VAL A 527 13.961 19.749 18.114 1.00 0.00 H new ATOM 0 HG23 VAL A 527 12.901 18.337 18.340 1.00 0.00 H new ATOM 872 N PRO A 528 12.265 17.756 22.245 1.00 0.00 N ATOM 873 CA PRO A 528 11.669 16.481 22.647 1.00 0.00 C ATOM 874 C PRO A 528 10.762 15.905 21.546 1.00 0.00 C ATOM 875 O PRO A 528 9.888 16.598 21.024 1.00 0.00 O ATOM 876 CB PRO A 528 10.883 16.793 23.929 1.00 0.00 C ATOM 877 CG PRO A 528 10.542 18.282 23.822 1.00 0.00 C ATOM 878 CD PRO A 528 11.708 18.857 23.026 1.00 0.00 C ATOM 0 HA PRO A 528 12.427 15.717 22.817 1.00 0.00 H new ATOM 0 HB2 PRO A 528 9.982 16.184 23.999 1.00 0.00 H new ATOM 0 HB3 PRO A 528 11.478 16.586 24.819 1.00 0.00 H new ATOM 0 HG2 PRO A 528 9.591 18.441 23.313 1.00 0.00 H new ATOM 0 HG3 PRO A 528 10.459 18.746 24.805 1.00 0.00 H new ATOM 0 HD2 PRO A 528 11.372 19.663 22.374 1.00 0.00 H new ATOM 0 HD3 PRO A 528 12.461 19.279 23.692 1.00 0.00 H new ATOM 886 N TYR A 529 10.906 14.613 21.227 1.00 0.00 N ATOM 887 CA TYR A 529 10.046 13.932 20.241 1.00 0.00 C ATOM 888 C TYR A 529 8.550 13.880 20.620 1.00 0.00 C ATOM 889 O TYR A 529 7.711 13.661 19.749 1.00 0.00 O ATOM 890 CB TYR A 529 10.571 12.518 19.949 1.00 0.00 C ATOM 891 CG TYR A 529 10.197 11.454 20.971 1.00 0.00 C ATOM 892 CD1 TYR A 529 10.982 11.280 22.124 1.00 0.00 C ATOM 893 CD2 TYR A 529 9.066 10.635 20.769 1.00 0.00 C ATOM 894 CE1 TYR A 529 10.655 10.292 23.071 1.00 0.00 C ATOM 895 CE2 TYR A 529 8.726 9.650 21.719 1.00 0.00 C ATOM 896 CZ TYR A 529 9.523 9.475 22.872 1.00 0.00 C ATOM 897 OH TYR A 529 9.211 8.525 23.795 1.00 0.00 O ATOM 0 H TYR A 529 11.617 14.010 21.640 1.00 0.00 H new ATOM 0 HA TYR A 529 10.101 14.544 19.341 1.00 0.00 H new ATOM 0 HB2 TYR A 529 10.199 12.206 18.973 1.00 0.00 H new ATOM 0 HB3 TYR A 529 11.658 12.561 19.877 1.00 0.00 H new ATOM 0 HD1 TYR A 529 11.844 11.910 22.284 1.00 0.00 H new ATOM 0 HD2 TYR A 529 8.459 10.763 19.885 1.00 0.00 H new ATOM 0 HE1 TYR A 529 11.270 10.160 23.949 1.00 0.00 H new ATOM 0 HE2 TYR A 529 7.856 9.029 21.565 1.00 0.00 H new ATOM 0 HH TYR A 529 8.403 8.048 23.513 1.00 0.00 H new ATOM 907 N ASN A 530 8.201 14.084 21.898 1.00 0.00 N ATOM 908 CA ASN A 530 6.824 14.008 22.403 1.00 0.00 C ATOM 909 C ASN A 530 5.880 15.089 21.824 1.00 0.00 C ATOM 910 O ASN A 530 4.718 14.793 21.537 1.00 0.00 O ATOM 911 CB ASN A 530 6.885 14.079 23.940 1.00 0.00 C ATOM 912 CG ASN A 530 5.508 13.956 24.577 1.00 0.00 C ATOM 913 OD1 ASN A 530 4.876 14.939 24.941 1.00 0.00 O ATOM 914 ND2 ASN A 530 5.000 12.753 24.730 1.00 0.00 N ATOM 0 H ASN A 530 8.882 14.311 22.623 1.00 0.00 H new ATOM 0 HA ASN A 530 6.389 13.065 22.071 1.00 0.00 H new ATOM 0 HB2 ASN A 530 7.529 13.282 24.313 1.00 0.00 H new ATOM 0 HB3 ASN A 530 7.339 15.023 24.241 1.00 0.00 H new ATOM 0 HD21 ASN A 530 4.079 12.638 25.152 1.00 0.00 H new ATOM 0 HD22 ASN A 530 5.527 11.934 24.426 1.00 0.00 H new ATOM 921 N ILE A 531 6.370 16.324 21.635 1.00 0.00 N ATOM 922 CA ILE A 531 5.602 17.423 21.005 1.00 0.00 C ATOM 923 C ILE A 531 5.669 17.388 19.471 1.00 0.00 C ATOM 924 O ILE A 531 4.842 18.015 18.807 1.00 0.00 O ATOM 925 CB ILE A 531 6.053 18.813 21.515 1.00 0.00 C ATOM 926 CG1 ILE A 531 7.499 19.150 21.079 1.00 0.00 C ATOM 927 CG2 ILE A 531 5.854 18.898 23.038 1.00 0.00 C ATOM 928 CD1 ILE A 531 8.012 20.511 21.550 1.00 0.00 C ATOM 0 H ILE A 531 7.313 16.595 21.914 1.00 0.00 H new ATOM 0 HA ILE A 531 4.566 17.261 21.301 1.00 0.00 H new ATOM 0 HB ILE A 531 5.426 19.576 21.053 1.00 0.00 H new ATOM 0 HG12 ILE A 531 8.167 18.376 21.457 1.00 0.00 H new ATOM 0 HG13 ILE A 531 7.553 19.114 19.991 1.00 0.00 H new ATOM 0 HG21 ILE A 531 6.173 19.878 23.392 1.00 0.00 H new ATOM 0 HG22 ILE A 531 4.801 18.751 23.276 1.00 0.00 H new ATOM 0 HG23 ILE A 531 6.447 18.125 23.526 1.00 0.00 H new ATOM 0 HD11 ILE A 531 9.033 20.657 21.196 1.00 0.00 H new ATOM 0 HD12 ILE A 531 7.373 21.299 21.151 1.00 0.00 H new ATOM 0 HD13 ILE A 531 7.997 20.549 22.639 1.00 0.00 H new ATOM 940 N LEU A 532 6.646 16.676 18.900 1.00 0.00 N ATOM 941 CA LEU A 532 6.712 16.384 17.469 1.00 0.00 C ATOM 942 C LEU A 532 5.740 15.248 17.100 1.00 0.00 C ATOM 943 O LEU A 532 5.324 14.443 17.938 1.00 0.00 O ATOM 944 CB LEU A 532 8.158 16.023 17.065 1.00 0.00 C ATOM 945 CG LEU A 532 9.226 17.090 17.385 1.00 0.00 C ATOM 946 CD1 LEU A 532 10.588 16.610 16.885 1.00 0.00 C ATOM 947 CD2 LEU A 532 8.924 18.442 16.733 1.00 0.00 C ATOM 0 H LEU A 532 7.424 16.282 19.429 1.00 0.00 H new ATOM 0 HA LEU A 532 6.412 17.275 16.918 1.00 0.00 H new ATOM 0 HB2 LEU A 532 8.435 15.096 17.566 1.00 0.00 H new ATOM 0 HB3 LEU A 532 8.178 15.825 15.993 1.00 0.00 H new ATOM 0 HG LEU A 532 9.224 17.228 18.466 1.00 0.00 H new ATOM 0 HD11 LEU A 532 11.344 17.362 17.110 1.00 0.00 H new ATOM 0 HD12 LEU A 532 10.848 15.675 17.380 1.00 0.00 H new ATOM 0 HD13 LEU A 532 10.544 16.450 15.808 1.00 0.00 H new ATOM 0 HD21 LEU A 532 9.708 19.154 16.992 1.00 0.00 H new ATOM 0 HD22 LEU A 532 8.885 18.323 15.650 1.00 0.00 H new ATOM 0 HD23 LEU A 532 7.964 18.813 17.092 1.00 0.00 H new ATOM 959 N THR A 533 5.401 15.169 15.816 1.00 0.00 N ATOM 960 CA THR A 533 4.516 14.155 15.222 1.00 0.00 C ATOM 961 C THR A 533 4.967 13.822 13.796 1.00 0.00 C ATOM 962 O THR A 533 5.648 14.640 13.167 1.00 0.00 O ATOM 963 CB THR A 533 3.041 14.627 15.202 1.00 0.00 C ATOM 964 OG1 THR A 533 2.893 15.999 14.889 1.00 0.00 O ATOM 965 CG2 THR A 533 2.346 14.406 16.546 1.00 0.00 C ATOM 0 H THR A 533 5.747 15.836 15.126 1.00 0.00 H new ATOM 0 HA THR A 533 4.581 13.262 15.843 1.00 0.00 H new ATOM 0 HB THR A 533 2.583 14.021 14.421 1.00 0.00 H new ATOM 0 HG1 THR A 533 3.736 16.345 14.527 1.00 0.00 H new ATOM 0 HG21 THR A 533 1.314 14.752 16.483 1.00 0.00 H new ATOM 0 HG22 THR A 533 2.358 13.344 16.792 1.00 0.00 H new ATOM 0 HG23 THR A 533 2.869 14.964 17.322 1.00 0.00 H new ATOM 973 N PRO A 534 4.600 12.650 13.242 1.00 0.00 N ATOM 974 CA PRO A 534 4.870 12.346 11.839 1.00 0.00 C ATOM 975 C PRO A 534 4.141 13.330 10.910 1.00 0.00 C ATOM 976 O PRO A 534 3.122 13.922 11.282 1.00 0.00 O ATOM 977 CB PRO A 534 4.407 10.895 11.642 1.00 0.00 C ATOM 978 CG PRO A 534 3.332 10.709 12.711 1.00 0.00 C ATOM 979 CD PRO A 534 3.840 11.571 13.865 1.00 0.00 C ATOM 0 HA PRO A 534 5.926 12.452 11.589 1.00 0.00 H new ATOM 0 HB2 PRO A 534 4.008 10.735 10.641 1.00 0.00 H new ATOM 0 HB3 PRO A 534 5.229 10.191 11.774 1.00 0.00 H new ATOM 0 HG2 PRO A 534 2.354 11.039 12.361 1.00 0.00 H new ATOM 0 HG3 PRO A 534 3.230 9.664 13.003 1.00 0.00 H new ATOM 0 HD2 PRO A 534 3.012 11.964 14.455 1.00 0.00 H new ATOM 0 HD3 PRO A 534 4.466 10.990 14.542 1.00 0.00 H new ATOM 987 N TYR A 535 4.635 13.465 9.677 1.00 0.00 N ATOM 988 CA TYR A 535 4.009 14.271 8.620 1.00 0.00 C ATOM 989 C TYR A 535 3.677 13.391 7.396 1.00 0.00 C ATOM 990 O TYR A 535 4.414 13.399 6.403 1.00 0.00 O ATOM 991 CB TYR A 535 4.866 15.508 8.306 1.00 0.00 C ATOM 992 CG TYR A 535 4.195 16.512 7.378 1.00 0.00 C ATOM 993 CD1 TYR A 535 2.910 17.011 7.676 1.00 0.00 C ATOM 994 CD2 TYR A 535 4.858 16.948 6.213 1.00 0.00 C ATOM 995 CE1 TYR A 535 2.282 17.923 6.807 1.00 0.00 C ATOM 996 CE2 TYR A 535 4.237 17.869 5.345 1.00 0.00 C ATOM 997 CZ TYR A 535 2.943 18.354 5.637 1.00 0.00 C ATOM 998 OH TYR A 535 2.329 19.233 4.799 1.00 0.00 O ATOM 0 H TYR A 535 5.497 13.010 9.377 1.00 0.00 H new ATOM 0 HA TYR A 535 3.052 14.662 8.966 1.00 0.00 H new ATOM 0 HB2 TYR A 535 5.120 16.007 9.241 1.00 0.00 H new ATOM 0 HB3 TYR A 535 5.803 15.182 7.854 1.00 0.00 H new ATOM 0 HD1 TYR A 535 2.405 16.692 8.576 1.00 0.00 H new ATOM 0 HD2 TYR A 535 5.845 16.575 5.985 1.00 0.00 H new ATOM 0 HE1 TYR A 535 1.294 18.293 7.036 1.00 0.00 H new ATOM 0 HE2 TYR A 535 4.751 18.204 4.456 1.00 0.00 H new ATOM 0 HH TYR A 535 2.919 19.429 4.041 1.00 0.00 H new ATOM 1008 N PRO A 536 2.610 12.566 7.484 1.00 0.00 N ATOM 1009 CA PRO A 536 2.178 11.644 6.432 1.00 0.00 C ATOM 1010 C PRO A 536 1.519 12.395 5.257 1.00 0.00 C ATOM 1011 O PRO A 536 0.291 12.452 5.128 1.00 0.00 O ATOM 1012 CB PRO A 536 1.249 10.643 7.131 1.00 0.00 C ATOM 1013 CG PRO A 536 0.604 11.481 8.233 1.00 0.00 C ATOM 1014 CD PRO A 536 1.731 12.429 8.643 1.00 0.00 C ATOM 0 HA PRO A 536 3.012 11.119 5.966 1.00 0.00 H new ATOM 0 HB2 PRO A 536 0.505 10.237 6.446 1.00 0.00 H new ATOM 0 HB3 PRO A 536 1.802 9.797 7.539 1.00 0.00 H new ATOM 0 HG2 PRO A 536 -0.269 12.024 7.870 1.00 0.00 H new ATOM 0 HG3 PRO A 536 0.271 10.864 9.068 1.00 0.00 H new ATOM 0 HD2 PRO A 536 1.331 13.398 8.942 1.00 0.00 H new ATOM 0 HD3 PRO A 536 2.278 12.032 9.498 1.00 0.00 H new ATOM 1022 N ALA A 537 2.352 12.988 4.403 1.00 0.00 N ATOM 1023 CA ALA A 537 1.966 13.781 3.236 1.00 0.00 C ATOM 1024 C ALA A 537 2.568 13.207 1.936 1.00 0.00 C ATOM 1025 O ALA A 537 3.539 12.442 1.960 1.00 0.00 O ATOM 1026 CB ALA A 537 2.402 15.233 3.484 1.00 0.00 C ATOM 0 H ALA A 537 3.364 12.926 4.511 1.00 0.00 H new ATOM 0 HA ALA A 537 0.885 13.745 3.101 1.00 0.00 H new ATOM 0 HB1 ALA A 537 2.126 15.847 2.627 1.00 0.00 H new ATOM 0 HB2 ALA A 537 1.908 15.614 4.378 1.00 0.00 H new ATOM 0 HB3 ALA A 537 3.482 15.270 3.623 1.00 0.00 H new ATOM 1032 N ALA A 538 1.989 13.595 0.796 1.00 0.00 N ATOM 1033 CA ALA A 538 2.306 13.065 -0.538 1.00 0.00 C ATOM 1034 C ALA A 538 2.536 14.176 -1.591 1.00 0.00 C ATOM 1035 O ALA A 538 2.496 13.922 -2.800 1.00 0.00 O ATOM 1036 CB ALA A 538 1.189 12.084 -0.927 1.00 0.00 C ATOM 0 H ALA A 538 1.262 14.310 0.773 1.00 0.00 H new ATOM 0 HA ALA A 538 3.259 12.537 -0.507 1.00 0.00 H new ATOM 0 HB1 ALA A 538 1.395 11.672 -1.915 1.00 0.00 H new ATOM 0 HB2 ALA A 538 1.145 11.275 -0.198 1.00 0.00 H new ATOM 0 HB3 ALA A 538 0.234 12.609 -0.945 1.00 0.00 H new ATOM 1042 N ALA A 539 2.781 15.410 -1.137 1.00 0.00 N ATOM 1043 CA ALA A 539 3.117 16.571 -1.966 1.00 0.00 C ATOM 1044 C ALA A 539 4.645 16.815 -2.016 1.00 0.00 C ATOM 1045 O ALA A 539 5.388 16.380 -1.127 1.00 0.00 O ATOM 1046 CB ALA A 539 2.368 17.784 -1.399 1.00 0.00 C ATOM 0 H ALA A 539 2.749 15.635 -0.143 1.00 0.00 H new ATOM 0 HA ALA A 539 2.809 16.393 -2.996 1.00 0.00 H new ATOM 0 HB1 ALA A 539 2.599 18.666 -1.997 1.00 0.00 H new ATOM 0 HB2 ALA A 539 1.295 17.596 -1.429 1.00 0.00 H new ATOM 0 HB3 ALA A 539 2.678 17.953 -0.368 1.00 0.00 H new ATOM 1052 N SER A 540 5.108 17.524 -3.056 1.00 0.00 N ATOM 1053 CA SER A 540 6.527 17.855 -3.302 1.00 0.00 C ATOM 1054 C SER A 540 6.888 19.244 -2.756 1.00 0.00 C ATOM 1055 O SER A 540 6.558 20.263 -3.408 1.00 0.00 O ATOM 1056 CB SER A 540 6.823 17.719 -4.800 1.00 0.00 C ATOM 1057 OG SER A 540 8.217 17.838 -5.025 1.00 0.00 O ATOM 0 H SER A 540 4.488 17.897 -3.775 1.00 0.00 H new ATOM 0 HA SER A 540 7.160 17.151 -2.761 1.00 0.00 H new ATOM 0 HB2 SER A 540 6.467 16.755 -5.165 1.00 0.00 H new ATOM 0 HB3 SER A 540 6.288 18.488 -5.357 1.00 0.00 H new ATOM 0 HG SER A 540 8.402 17.749 -5.983 1.00 0.00 H new TER 1063 SER A 540