USER MOD reduce.3.24.130724 H: found=0, std=0, add=386, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 386 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 34 SER OG : rot 158:sc= 2.49 USER MOD Set 1.2: A 54 TYR OH : rot 27:sc= 0.544 USER MOD Set 2.1: A 44 ASN : amide:sc= -8.63! C(o=-16!,f=-10!) USER MOD Set 2.2: A 46 GLN : amide:sc= -7.01! C(o=-16!,f=-5.9!) USER MOD Single : A 5 LYS NZ :NH3+ 162:sc= -0.213 (180deg=-0.984) USER MOD Single : A 6 LYS NZ :NH3+ 149:sc= -1.01 (180deg=-1.82) USER MOD Single : A 8 TYR OH : rot 53:sc= -3.58! USER MOD Single : A 10 ASN : amide:sc= -1.82! C(o=-1.8!,f=-6.3!) USER MOD Single : A 11 TYR OH : rot 95:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= -0.0284 USER MOD Single : A 15 LYS NZ :NH3+ -146:sc= -2.28! (180deg=-3.09) USER MOD Single : A 17 GLN : amide:sc= -2.28! C(o=-2.3!,f=-3.8!) USER MOD Single : A 20 ASN : amide:sc= -0.0665 K(o=-0.067,f=-1.9!) USER MOD Single : A 21 GLN : amide:sc= -0.269 X(o=-0.27,f=-0.27) USER MOD Single : A 23 ASN : amide:sc= -10.3! C(o=-10!,f=-29!) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00777) USER MOD Single : A 31 HIS : no HD1:sc= -0.991 K(o=-0.99,f=-0.22) USER MOD Single : A 39 TYR OH : rot 180:sc= -0.289 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 TYR OH : rot -173:sc= -0.409 USER MOD ----------------------------------------------------------------- ATOM 35 N CYS A 4 70.463 -77.282 61.975 1.00 0.00 N ATOM 36 CA CYS A 4 69.668 -77.328 60.753 1.00 0.00 C ATOM 37 C CYS A 4 68.507 -76.351 60.797 1.00 0.00 C ATOM 38 O CYS A 4 67.416 -76.745 60.386 1.00 0.00 O ATOM 39 CB CYS A 4 69.051 -78.718 60.582 1.00 0.00 C ATOM 40 SG CYS A 4 70.329 -79.977 60.815 1.00 0.00 S ATOM 0 HA CYS A 4 70.343 -77.075 59.935 1.00 0.00 H new ATOM 0 HB2 CYS A 4 68.247 -78.862 61.304 1.00 0.00 H new ATOM 0 HB3 CYS A 4 68.609 -78.812 59.590 1.00 0.00 H new ATOM 45 N LYS A 5 68.692 -75.139 61.310 1.00 0.00 N ATOM 46 CA LYS A 5 67.596 -74.181 61.396 1.00 0.00 C ATOM 47 C LYS A 5 68.063 -72.793 60.968 1.00 0.00 C ATOM 48 O LYS A 5 69.156 -72.357 61.329 1.00 0.00 O ATOM 49 CB LYS A 5 67.061 -74.125 62.828 1.00 0.00 C ATOM 50 CG LYS A 5 66.580 -75.515 63.248 1.00 0.00 C ATOM 51 CD LYS A 5 66.165 -75.488 64.720 1.00 0.00 C ATOM 52 CE LYS A 5 65.632 -76.864 65.126 1.00 0.00 C ATOM 53 NZ LYS A 5 66.525 -77.923 64.580 1.00 0.00 N ATOM 0 H LYS A 5 69.584 -74.799 61.670 1.00 0.00 H new ATOM 0 HA LYS A 5 66.800 -74.506 60.726 1.00 0.00 H new ATOM 0 HB2 LYS A 5 67.841 -73.778 63.506 1.00 0.00 H new ATOM 0 HB3 LYS A 5 66.241 -73.410 62.893 1.00 0.00 H new ATOM 0 HG2 LYS A 5 65.738 -75.823 62.628 1.00 0.00 H new ATOM 0 HG3 LYS A 5 67.373 -76.247 63.096 1.00 0.00 H new ATOM 0 HD2 LYS A 5 67.017 -75.218 65.344 1.00 0.00 H new ATOM 0 HD3 LYS A 5 65.400 -74.728 64.879 1.00 0.00 H new ATOM 0 HE2 LYS A 5 65.582 -76.940 66.212 1.00 0.00 H new ATOM 0 HE3 LYS A 5 64.618 -76.999 64.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 66.358 -78.815 65.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 66.325 -78.059 63.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 67.517 -77.637 64.701 1.00 0.00 H new ATOM 67 N LYS A 6 67.227 -72.104 60.199 1.00 0.00 N ATOM 68 CA LYS A 6 67.548 -70.750 59.762 1.00 0.00 C ATOM 69 C LYS A 6 66.329 -69.842 59.890 1.00 0.00 C ATOM 70 O LYS A 6 65.307 -70.063 59.240 1.00 0.00 O ATOM 71 CB LYS A 6 68.020 -70.769 58.306 1.00 0.00 C ATOM 72 CG LYS A 6 69.488 -71.195 58.250 1.00 0.00 C ATOM 73 CD LYS A 6 69.786 -71.828 56.891 1.00 0.00 C ATOM 74 CE LYS A 6 69.378 -70.862 55.777 1.00 0.00 C ATOM 75 NZ LYS A 6 69.827 -69.484 56.126 1.00 0.00 N ATOM 0 H LYS A 6 66.329 -72.457 59.868 1.00 0.00 H new ATOM 0 HA LYS A 6 68.344 -70.363 60.398 1.00 0.00 H new ATOM 0 HB2 LYS A 6 67.408 -71.458 57.723 1.00 0.00 H new ATOM 0 HB3 LYS A 6 67.900 -69.781 57.861 1.00 0.00 H new ATOM 0 HG2 LYS A 6 70.134 -70.332 58.410 1.00 0.00 H new ATOM 0 HG3 LYS A 6 69.702 -71.906 59.048 1.00 0.00 H new ATOM 0 HD2 LYS A 6 70.847 -72.063 56.812 1.00 0.00 H new ATOM 0 HD3 LYS A 6 69.243 -72.768 56.789 1.00 0.00 H new ATOM 0 HE2 LYS A 6 69.822 -71.172 54.831 1.00 0.00 H new ATOM 0 HE3 LYS A 6 68.296 -70.881 55.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 70.044 -68.959 55.255 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 69.072 -68.994 56.647 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 70.679 -69.537 56.720 1.00 0.00 H new ATOM 89 N VAL A 7 66.444 -68.819 60.730 1.00 0.00 N ATOM 90 CA VAL A 7 65.326 -67.917 60.977 1.00 0.00 C ATOM 91 C VAL A 7 65.137 -66.964 59.801 1.00 0.00 C ATOM 92 O VAL A 7 66.107 -66.438 59.254 1.00 0.00 O ATOM 93 CB VAL A 7 65.574 -67.112 62.254 1.00 0.00 C ATOM 94 CG1 VAL A 7 64.353 -66.243 62.556 1.00 0.00 C ATOM 95 CG2 VAL A 7 65.817 -68.072 63.420 1.00 0.00 C ATOM 0 H VAL A 7 67.294 -68.595 61.248 1.00 0.00 H new ATOM 0 HA VAL A 7 64.422 -68.514 61.096 1.00 0.00 H new ATOM 0 HB VAL A 7 66.448 -66.474 62.118 1.00 0.00 H new ATOM 0 HG11 VAL A 7 64.530 -65.670 63.466 1.00 0.00 H new ATOM 0 HG12 VAL A 7 64.178 -65.560 61.725 1.00 0.00 H new ATOM 0 HG13 VAL A 7 63.479 -66.879 62.693 1.00 0.00 H new ATOM 0 HG21 VAL A 7 65.994 -67.500 64.331 1.00 0.00 H new ATOM 0 HG22 VAL A 7 64.943 -68.709 63.555 1.00 0.00 H new ATOM 0 HG23 VAL A 7 66.688 -68.692 63.206 1.00 0.00 H new ATOM 105 N TYR A 8 63.884 -66.747 59.415 1.00 0.00 N ATOM 106 CA TYR A 8 63.579 -65.821 58.331 1.00 0.00 C ATOM 107 C TYR A 8 63.447 -64.397 58.862 1.00 0.00 C ATOM 108 O TYR A 8 62.631 -64.127 59.743 1.00 0.00 O ATOM 109 CB TYR A 8 62.277 -66.235 57.642 1.00 0.00 C ATOM 110 CG TYR A 8 62.594 -67.088 56.438 1.00 0.00 C ATOM 111 CD1 TYR A 8 63.479 -68.166 56.555 1.00 0.00 C ATOM 112 CD2 TYR A 8 62.001 -66.802 55.202 1.00 0.00 C ATOM 113 CE1 TYR A 8 63.773 -68.956 55.439 1.00 0.00 C ATOM 114 CE2 TYR A 8 62.294 -67.593 54.085 1.00 0.00 C ATOM 115 CZ TYR A 8 63.180 -68.670 54.203 1.00 0.00 C ATOM 116 OH TYR A 8 63.469 -69.450 53.102 1.00 0.00 O ATOM 0 H TYR A 8 63.069 -67.196 59.833 1.00 0.00 H new ATOM 0 HA TYR A 8 64.397 -65.852 57.611 1.00 0.00 H new ATOM 0 HB2 TYR A 8 61.645 -66.788 58.337 1.00 0.00 H new ATOM 0 HB3 TYR A 8 61.717 -65.351 57.337 1.00 0.00 H new ATOM 0 HD1 TYR A 8 63.935 -68.388 57.508 1.00 0.00 H new ATOM 0 HD2 TYR A 8 61.317 -65.971 55.111 1.00 0.00 H new ATOM 0 HE1 TYR A 8 64.457 -69.787 55.530 1.00 0.00 H new ATOM 0 HE2 TYR A 8 61.836 -67.372 53.132 1.00 0.00 H new ATOM 0 HH TYR A 8 63.316 -70.393 53.320 1.00 0.00 H new ATOM 126 N GLU A 9 64.254 -63.492 58.320 1.00 0.00 N ATOM 127 CA GLU A 9 64.214 -62.096 58.743 1.00 0.00 C ATOM 128 C GLU A 9 63.491 -61.242 57.705 1.00 0.00 C ATOM 129 O GLU A 9 63.725 -61.375 56.504 1.00 0.00 O ATOM 130 CB GLU A 9 65.636 -61.568 58.938 1.00 0.00 C ATOM 131 CG GLU A 9 66.325 -62.355 60.055 1.00 0.00 C ATOM 132 CD GLU A 9 66.735 -63.732 59.545 1.00 0.00 C ATOM 133 OE1 GLU A 9 66.726 -63.923 58.340 1.00 0.00 O ATOM 134 OE2 GLU A 9 67.053 -64.575 60.367 1.00 0.00 O ATOM 0 H GLU A 9 64.939 -63.697 57.592 1.00 0.00 H new ATOM 0 HA GLU A 9 63.672 -62.038 59.687 1.00 0.00 H new ATOM 0 HB2 GLU A 9 66.201 -61.663 58.010 1.00 0.00 H new ATOM 0 HB3 GLU A 9 65.610 -60.508 59.189 1.00 0.00 H new ATOM 0 HG2 GLU A 9 67.202 -61.812 60.406 1.00 0.00 H new ATOM 0 HG3 GLU A 9 65.652 -62.459 60.906 1.00 0.00 H new ATOM 141 N ASN A 10 62.611 -60.366 58.179 1.00 0.00 N ATOM 142 CA ASN A 10 61.870 -59.482 57.284 1.00 0.00 C ATOM 143 C ASN A 10 60.902 -60.283 56.419 1.00 0.00 C ATOM 144 O ASN A 10 60.958 -60.225 55.191 1.00 0.00 O ATOM 145 CB ASN A 10 62.843 -58.714 56.388 1.00 0.00 C ATOM 146 CG ASN A 10 64.065 -58.283 57.193 1.00 0.00 C ATOM 147 OD1 ASN A 10 64.105 -58.472 58.408 1.00 0.00 O ATOM 148 ND2 ASN A 10 65.066 -57.711 56.584 1.00 0.00 N ATOM 0 H ASN A 10 62.394 -60.249 59.169 1.00 0.00 H new ATOM 0 HA ASN A 10 61.299 -58.778 57.889 1.00 0.00 H new ATOM 0 HB2 ASN A 10 63.151 -59.341 55.551 1.00 0.00 H new ATOM 0 HB3 ASN A 10 62.348 -57.839 55.966 1.00 0.00 H new ATOM 0 HD21 ASN A 10 65.886 -57.418 57.115 1.00 0.00 H new ATOM 0 HD22 ASN A 10 65.029 -57.556 55.577 1.00 0.00 H new ATOM 155 N TYR A 11 60.015 -61.029 57.069 1.00 0.00 N ATOM 156 CA TYR A 11 59.020 -61.816 56.351 1.00 0.00 C ATOM 157 C TYR A 11 57.628 -61.572 56.925 1.00 0.00 C ATOM 158 O TYR A 11 57.426 -61.626 58.138 1.00 0.00 O ATOM 159 CB TYR A 11 59.360 -63.305 56.447 1.00 0.00 C ATOM 160 CG TYR A 11 60.195 -63.709 55.255 1.00 0.00 C ATOM 161 CD1 TYR A 11 61.566 -63.425 55.233 1.00 0.00 C ATOM 162 CD2 TYR A 11 59.598 -64.367 54.174 1.00 0.00 C ATOM 163 CE1 TYR A 11 62.340 -63.799 54.127 1.00 0.00 C ATOM 164 CE2 TYR A 11 60.372 -64.741 53.069 1.00 0.00 C ATOM 165 CZ TYR A 11 61.743 -64.457 53.045 1.00 0.00 C ATOM 166 OH TYR A 11 62.505 -64.826 51.956 1.00 0.00 O ATOM 0 H TYR A 11 59.965 -61.105 58.085 1.00 0.00 H new ATOM 0 HA TYR A 11 59.029 -61.509 55.305 1.00 0.00 H new ATOM 0 HB2 TYR A 11 59.904 -63.506 57.370 1.00 0.00 H new ATOM 0 HB3 TYR A 11 58.445 -63.896 56.481 1.00 0.00 H new ATOM 0 HD1 TYR A 11 62.026 -62.918 56.068 1.00 0.00 H new ATOM 0 HD2 TYR A 11 58.541 -64.586 54.192 1.00 0.00 H new ATOM 0 HE1 TYR A 11 63.397 -63.580 54.109 1.00 0.00 H new ATOM 0 HE2 TYR A 11 59.911 -65.249 52.235 1.00 0.00 H new ATOM 0 HH TYR A 11 62.790 -65.758 52.057 1.00 0.00 H new ATOM 176 N PRO A 12 56.675 -61.303 56.074 1.00 0.00 N ATOM 177 CA PRO A 12 55.269 -61.043 56.492 1.00 0.00 C ATOM 178 C PRO A 12 54.774 -62.061 57.516 1.00 0.00 C ATOM 179 O PRO A 12 54.803 -63.266 57.272 1.00 0.00 O ATOM 180 CB PRO A 12 54.478 -61.162 55.185 1.00 0.00 C ATOM 181 CG PRO A 12 55.452 -60.823 54.104 1.00 0.00 C ATOM 182 CD PRO A 12 56.839 -61.221 54.615 1.00 0.00 C ATOM 0 HA PRO A 12 55.160 -60.074 56.980 1.00 0.00 H new ATOM 0 HB2 PRO A 12 54.081 -62.169 55.056 1.00 0.00 H new ATOM 0 HB3 PRO A 12 53.627 -60.480 55.176 1.00 0.00 H new ATOM 0 HG2 PRO A 12 55.211 -61.358 53.185 1.00 0.00 H new ATOM 0 HG3 PRO A 12 55.417 -59.759 53.872 1.00 0.00 H new ATOM 0 HD2 PRO A 12 57.159 -62.175 54.196 1.00 0.00 H new ATOM 0 HD3 PRO A 12 57.592 -60.483 54.340 1.00 0.00 H new ATOM 190 N VAL A 13 54.322 -61.564 58.664 1.00 0.00 N ATOM 191 CA VAL A 13 53.816 -62.440 59.717 1.00 0.00 C ATOM 192 C VAL A 13 52.421 -62.945 59.368 1.00 0.00 C ATOM 193 O VAL A 13 52.114 -64.123 59.550 1.00 0.00 O ATOM 194 CB VAL A 13 53.770 -61.684 61.045 1.00 0.00 C ATOM 195 CG1 VAL A 13 55.167 -61.163 61.387 1.00 0.00 C ATOM 196 CG2 VAL A 13 52.802 -60.505 60.926 1.00 0.00 C ATOM 0 H VAL A 13 54.295 -60.569 58.888 1.00 0.00 H new ATOM 0 HA VAL A 13 54.487 -63.294 59.808 1.00 0.00 H new ATOM 0 HB VAL A 13 53.431 -62.356 61.833 1.00 0.00 H new ATOM 0 HG11 VAL A 13 55.133 -60.624 62.334 1.00 0.00 H new ATOM 0 HG12 VAL A 13 55.858 -62.002 61.472 1.00 0.00 H new ATOM 0 HG13 VAL A 13 55.508 -60.491 60.599 1.00 0.00 H new ATOM 0 HG21 VAL A 13 52.768 -59.965 61.872 1.00 0.00 H new ATOM 0 HG22 VAL A 13 53.141 -59.834 60.137 1.00 0.00 H new ATOM 0 HG23 VAL A 13 51.806 -60.875 60.684 1.00 0.00 H new ATOM 206 N SER A 14 51.579 -62.047 58.866 1.00 0.00 N ATOM 207 CA SER A 14 50.212 -62.411 58.509 1.00 0.00 C ATOM 208 C SER A 14 50.204 -63.647 57.615 1.00 0.00 C ATOM 209 O SER A 14 49.327 -64.503 57.731 1.00 0.00 O ATOM 210 CB SER A 14 49.537 -61.248 57.782 1.00 0.00 C ATOM 211 OG SER A 14 50.157 -61.061 56.517 1.00 0.00 O ATOM 0 H SER A 14 51.816 -61.069 58.698 1.00 0.00 H new ATOM 0 HA SER A 14 49.663 -62.635 59.424 1.00 0.00 H new ATOM 0 HB2 SER A 14 48.474 -61.453 57.652 1.00 0.00 H new ATOM 0 HB3 SER A 14 49.616 -60.338 58.376 1.00 0.00 H new ATOM 0 HG SER A 14 49.725 -60.317 56.048 1.00 0.00 H new ATOM 217 N LYS A 15 51.185 -63.733 56.723 1.00 0.00 N ATOM 218 CA LYS A 15 51.286 -64.874 55.822 1.00 0.00 C ATOM 219 C LYS A 15 51.702 -66.126 56.586 1.00 0.00 C ATOM 220 O LYS A 15 51.296 -67.237 56.247 1.00 0.00 O ATOM 221 CB LYS A 15 52.309 -64.582 54.721 1.00 0.00 C ATOM 222 CG LYS A 15 51.810 -63.425 53.853 1.00 0.00 C ATOM 223 CD LYS A 15 52.715 -63.278 52.629 1.00 0.00 C ATOM 224 CE LYS A 15 52.319 -62.024 51.847 1.00 0.00 C ATOM 225 NZ LYS A 15 52.411 -60.834 52.740 1.00 0.00 N ATOM 0 H LYS A 15 51.916 -63.032 56.605 1.00 0.00 H new ATOM 0 HA LYS A 15 50.308 -65.045 55.373 1.00 0.00 H new ATOM 0 HB2 LYS A 15 53.273 -64.329 55.163 1.00 0.00 H new ATOM 0 HB3 LYS A 15 52.463 -65.470 54.108 1.00 0.00 H new ATOM 0 HG2 LYS A 15 50.783 -63.609 53.539 1.00 0.00 H new ATOM 0 HG3 LYS A 15 51.806 -62.500 54.429 1.00 0.00 H new ATOM 0 HD2 LYS A 15 53.757 -63.211 52.941 1.00 0.00 H new ATOM 0 HD3 LYS A 15 52.629 -64.159 51.992 1.00 0.00 H new ATOM 0 HE2 LYS A 15 52.974 -61.897 50.985 1.00 0.00 H new ATOM 0 HE3 LYS A 15 51.304 -62.127 51.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 51.669 -60.151 52.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 52.284 -61.131 53.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 53.344 -60.389 52.630 1.00 0.00 H new ATOM 239 N CYS A 16 52.516 -65.938 57.620 1.00 0.00 N ATOM 240 CA CYS A 16 52.981 -67.059 58.429 1.00 0.00 C ATOM 241 C CYS A 16 51.817 -67.695 59.183 1.00 0.00 C ATOM 242 O CYS A 16 51.971 -68.742 59.812 1.00 0.00 O ATOM 243 CB CYS A 16 54.038 -66.582 59.425 1.00 0.00 C ATOM 244 SG CYS A 16 55.392 -67.782 59.487 1.00 0.00 S ATOM 0 H CYS A 16 52.865 -65.027 57.916 1.00 0.00 H new ATOM 0 HA CYS A 16 53.419 -67.804 57.765 1.00 0.00 H new ATOM 0 HB2 CYS A 16 54.418 -65.604 59.129 1.00 0.00 H new ATOM 0 HB3 CYS A 16 53.595 -66.466 60.414 1.00 0.00 H new ATOM 249 N GLN A 17 50.654 -67.056 59.114 1.00 0.00 N ATOM 250 CA GLN A 17 49.470 -67.571 59.791 1.00 0.00 C ATOM 251 C GLN A 17 49.037 -68.898 59.178 1.00 0.00 C ATOM 252 O GLN A 17 48.139 -69.567 59.691 1.00 0.00 O ATOM 253 CB GLN A 17 48.326 -66.559 59.686 1.00 0.00 C ATOM 254 CG GLN A 17 47.739 -66.599 58.274 1.00 0.00 C ATOM 255 CD GLN A 17 46.890 -65.357 58.028 1.00 0.00 C ATOM 256 OE1 GLN A 17 46.677 -64.558 58.940 1.00 0.00 O ATOM 257 NE2 GLN A 17 46.390 -65.143 56.841 1.00 0.00 N ATOM 0 H GLN A 17 50.506 -66.187 58.600 1.00 0.00 H new ATOM 0 HA GLN A 17 49.716 -67.732 60.841 1.00 0.00 H new ATOM 0 HB2 GLN A 17 47.553 -66.790 60.419 1.00 0.00 H new ATOM 0 HB3 GLN A 17 48.691 -65.557 59.912 1.00 0.00 H new ATOM 0 HG2 GLN A 17 48.542 -66.652 57.539 1.00 0.00 H new ATOM 0 HG3 GLN A 17 47.132 -67.496 58.149 1.00 0.00 H new ATOM 0 HE21 GLN A 17 46.567 -65.806 56.086 1.00 0.00 H new ATOM 0 HE22 GLN A 17 45.822 -64.313 56.669 1.00 0.00 H new ATOM 266 N LEU A 18 49.681 -69.273 58.079 1.00 0.00 N ATOM 267 CA LEU A 18 49.366 -70.531 57.411 1.00 0.00 C ATOM 268 C LEU A 18 50.604 -71.417 57.325 1.00 0.00 C ATOM 269 O LEU A 18 51.447 -71.239 56.446 1.00 0.00 O ATOM 270 CB LEU A 18 48.834 -70.256 56.003 1.00 0.00 C ATOM 271 CG LEU A 18 47.334 -69.964 56.073 1.00 0.00 C ATOM 272 CD1 LEU A 18 46.933 -69.067 54.901 1.00 0.00 C ATOM 273 CD2 LEU A 18 46.556 -71.279 55.996 1.00 0.00 C ATOM 0 H LEU A 18 50.420 -68.729 57.634 1.00 0.00 H new ATOM 0 HA LEU A 18 48.603 -71.048 57.993 1.00 0.00 H new ATOM 0 HB2 LEU A 18 49.360 -69.409 55.563 1.00 0.00 H new ATOM 0 HB3 LEU A 18 49.018 -71.116 55.359 1.00 0.00 H new ATOM 0 HG LEU A 18 47.106 -69.459 57.012 1.00 0.00 H new ATOM 0 HD11 LEU A 18 45.864 -68.859 54.951 1.00 0.00 H new ATOM 0 HD12 LEU A 18 47.488 -68.130 54.953 1.00 0.00 H new ATOM 0 HD13 LEU A 18 47.161 -69.572 53.962 1.00 0.00 H new ATOM 0 HD21 LEU A 18 45.487 -71.073 56.046 1.00 0.00 H new ATOM 0 HD22 LEU A 18 46.785 -71.783 55.057 1.00 0.00 H new ATOM 0 HD23 LEU A 18 46.841 -71.920 56.830 1.00 0.00 H new ATOM 285 N ALA A 19 50.708 -72.371 58.244 1.00 0.00 N ATOM 286 CA ALA A 19 51.850 -73.278 58.265 1.00 0.00 C ATOM 287 C ALA A 19 52.146 -73.800 56.862 1.00 0.00 C ATOM 288 O ALA A 19 53.193 -74.401 56.621 1.00 0.00 O ATOM 289 CB ALA A 19 51.565 -74.455 59.200 1.00 0.00 C ATOM 0 H ALA A 19 50.021 -72.536 58.979 1.00 0.00 H new ATOM 0 HA ALA A 19 52.719 -72.729 58.627 1.00 0.00 H new ATOM 0 HB1 ALA A 19 52.423 -75.128 59.210 1.00 0.00 H new ATOM 0 HB2 ALA A 19 51.384 -74.083 60.208 1.00 0.00 H new ATOM 0 HB3 ALA A 19 50.685 -74.994 58.849 1.00 0.00 H new ATOM 295 N ASN A 20 51.216 -73.567 55.941 1.00 0.00 N ATOM 296 CA ASN A 20 51.391 -74.015 54.564 1.00 0.00 C ATOM 297 C ASN A 20 52.200 -72.995 53.768 1.00 0.00 C ATOM 298 O ASN A 20 53.087 -73.359 52.994 1.00 0.00 O ATOM 299 CB ASN A 20 50.027 -74.215 53.901 1.00 0.00 C ATOM 300 CG ASN A 20 49.356 -75.464 54.460 1.00 0.00 C ATOM 301 OD1 ASN A 20 50.023 -76.329 55.027 1.00 0.00 O ATOM 302 ND2 ASN A 20 48.064 -75.612 54.334 1.00 0.00 N ATOM 0 H ASN A 20 50.341 -73.075 56.121 1.00 0.00 H new ATOM 0 HA ASN A 20 51.931 -74.962 54.576 1.00 0.00 H new ATOM 0 HB2 ASN A 20 49.396 -73.343 54.077 1.00 0.00 H new ATOM 0 HB3 ASN A 20 50.148 -74.309 52.822 1.00 0.00 H new ATOM 0 HD21 ASN A 20 47.607 -76.445 54.706 1.00 0.00 H new ATOM 0 HD22 ASN A 20 47.512 -74.895 53.864 1.00 0.00 H new ATOM 309 N GLN A 21 51.889 -71.717 53.961 1.00 0.00 N ATOM 310 CA GLN A 21 52.603 -70.653 53.266 1.00 0.00 C ATOM 311 C GLN A 21 54.009 -70.491 53.834 1.00 0.00 C ATOM 312 O GLN A 21 54.977 -70.341 53.087 1.00 0.00 O ATOM 313 CB GLN A 21 51.840 -69.335 53.406 1.00 0.00 C ATOM 314 CG GLN A 21 50.619 -69.349 52.484 1.00 0.00 C ATOM 315 CD GLN A 21 51.066 -69.249 51.029 1.00 0.00 C ATOM 316 OE1 GLN A 21 51.697 -68.268 50.638 1.00 0.00 O ATOM 317 NE2 GLN A 21 50.774 -70.213 50.199 1.00 0.00 N ATOM 0 H GLN A 21 51.152 -71.395 54.589 1.00 0.00 H new ATOM 0 HA GLN A 21 52.678 -70.920 52.212 1.00 0.00 H new ATOM 0 HB2 GLN A 21 51.526 -69.193 54.440 1.00 0.00 H new ATOM 0 HB3 GLN A 21 52.490 -68.498 53.152 1.00 0.00 H new ATOM 0 HG2 GLN A 21 50.048 -70.265 52.636 1.00 0.00 H new ATOM 0 HG3 GLN A 21 49.958 -68.517 52.729 1.00 0.00 H new ATOM 0 HE21 GLN A 21 50.251 -71.026 50.525 1.00 0.00 H new ATOM 0 HE22 GLN A 21 51.069 -70.154 49.224 1.00 0.00 H new ATOM 326 N CYS A 22 54.115 -70.520 55.158 1.00 0.00 N ATOM 327 CA CYS A 22 55.406 -70.361 55.816 1.00 0.00 C ATOM 328 C CYS A 22 56.409 -71.384 55.291 1.00 0.00 C ATOM 329 O CYS A 22 57.456 -71.022 54.756 1.00 0.00 O ATOM 330 CB CYS A 22 55.245 -70.530 57.328 1.00 0.00 C ATOM 331 SG CYS A 22 56.872 -70.472 58.119 1.00 0.00 S ATOM 0 H CYS A 22 53.328 -70.651 55.793 1.00 0.00 H new ATOM 0 HA CYS A 22 55.781 -69.361 55.599 1.00 0.00 H new ATOM 0 HB2 CYS A 22 54.607 -69.742 57.727 1.00 0.00 H new ATOM 0 HB3 CYS A 22 54.755 -71.479 57.548 1.00 0.00 H new ATOM 336 N ASN A 23 56.082 -72.662 55.452 1.00 0.00 N ATOM 337 CA ASN A 23 56.976 -73.730 55.020 1.00 0.00 C ATOM 338 C ASN A 23 57.251 -73.630 53.522 1.00 0.00 C ATOM 339 O ASN A 23 58.398 -73.724 53.084 1.00 0.00 O ATOM 340 CB ASN A 23 56.355 -75.092 55.336 1.00 0.00 C ATOM 341 CG ASN A 23 54.941 -75.162 54.768 1.00 0.00 C ATOM 342 OD1 ASN A 23 54.275 -74.138 54.627 1.00 0.00 O ATOM 343 ND2 ASN A 23 54.440 -76.320 54.434 1.00 0.00 N ATOM 0 H ASN A 23 55.211 -72.982 55.875 1.00 0.00 H new ATOM 0 HA ASN A 23 57.918 -73.626 55.558 1.00 0.00 H new ATOM 0 HB2 ASN A 23 56.967 -75.888 54.911 1.00 0.00 H new ATOM 0 HB3 ASN A 23 56.331 -75.249 56.414 1.00 0.00 H new ATOM 0 HD21 ASN A 23 53.495 -76.377 54.055 1.00 0.00 H new ATOM 0 HD22 ASN A 23 54.994 -77.168 54.552 1.00 0.00 H new ATOM 350 N TYR A 24 56.193 -73.440 52.742 1.00 0.00 N ATOM 351 CA TYR A 24 56.333 -73.323 51.295 1.00 0.00 C ATOM 352 C TYR A 24 57.254 -72.161 50.937 1.00 0.00 C ATOM 353 O TYR A 24 58.256 -72.341 50.243 1.00 0.00 O ATOM 354 CB TYR A 24 54.962 -73.104 50.654 1.00 0.00 C ATOM 355 CG TYR A 24 54.377 -74.437 50.250 1.00 0.00 C ATOM 356 CD1 TYR A 24 54.198 -75.442 51.208 1.00 0.00 C ATOM 357 CD2 TYR A 24 54.012 -74.666 48.917 1.00 0.00 C ATOM 358 CE1 TYR A 24 53.655 -76.677 50.833 1.00 0.00 C ATOM 359 CE2 TYR A 24 53.469 -75.901 48.543 1.00 0.00 C ATOM 360 CZ TYR A 24 53.291 -76.907 49.501 1.00 0.00 C ATOM 361 OH TYR A 24 52.756 -78.124 49.132 1.00 0.00 O ATOM 0 H TYR A 24 55.235 -73.364 53.084 1.00 0.00 H new ATOM 0 HA TYR A 24 56.769 -74.247 50.916 1.00 0.00 H new ATOM 0 HB2 TYR A 24 54.297 -72.600 51.355 1.00 0.00 H new ATOM 0 HB3 TYR A 24 55.055 -72.456 49.782 1.00 0.00 H new ATOM 0 HD1 TYR A 24 54.479 -75.265 52.236 1.00 0.00 H new ATOM 0 HD2 TYR A 24 54.149 -73.890 48.178 1.00 0.00 H new ATOM 0 HE1 TYR A 24 53.517 -77.453 51.572 1.00 0.00 H new ATOM 0 HE2 TYR A 24 53.187 -76.078 47.516 1.00 0.00 H new ATOM 0 HH TYR A 24 52.558 -78.117 48.172 1.00 0.00 H new ATOM 371 N ASP A 25 56.908 -70.969 51.412 1.00 0.00 N ATOM 372 CA ASP A 25 57.714 -69.784 51.139 1.00 0.00 C ATOM 373 C ASP A 25 59.171 -70.021 51.524 1.00 0.00 C ATOM 374 O ASP A 25 60.086 -69.609 50.811 1.00 0.00 O ATOM 375 CB ASP A 25 57.166 -68.588 51.921 1.00 0.00 C ATOM 376 CG ASP A 25 55.794 -68.197 51.382 1.00 0.00 C ATOM 377 OD1 ASP A 25 55.441 -68.673 50.316 1.00 0.00 O ATOM 378 OD2 ASP A 25 55.118 -67.428 52.044 1.00 0.00 O ATOM 0 H ASP A 25 56.081 -70.798 51.984 1.00 0.00 H new ATOM 0 HA ASP A 25 57.664 -69.575 50.070 1.00 0.00 H new ATOM 0 HB2 ASP A 25 57.092 -68.838 52.979 1.00 0.00 H new ATOM 0 HB3 ASP A 25 57.852 -67.745 51.840 1.00 0.00 H new ATOM 383 N CYS A 26 59.378 -70.685 52.656 1.00 0.00 N ATOM 384 CA CYS A 26 60.729 -70.976 53.123 1.00 0.00 C ATOM 385 C CYS A 26 61.511 -71.747 52.063 1.00 0.00 C ATOM 386 O CYS A 26 62.637 -71.384 51.722 1.00 0.00 O ATOM 387 CB CYS A 26 60.670 -71.797 54.413 1.00 0.00 C ATOM 388 SG CYS A 26 62.002 -71.272 55.521 1.00 0.00 S ATOM 0 H CYS A 26 58.634 -71.030 53.263 1.00 0.00 H new ATOM 0 HA CYS A 26 61.237 -70.031 53.316 1.00 0.00 H new ATOM 0 HB2 CYS A 26 59.704 -71.662 54.899 1.00 0.00 H new ATOM 0 HB3 CYS A 26 60.768 -72.859 54.186 1.00 0.00 H new ATOM 393 N LYS A 27 60.906 -72.812 51.547 1.00 0.00 N ATOM 394 CA LYS A 27 61.557 -73.630 50.530 1.00 0.00 C ATOM 395 C LYS A 27 61.796 -72.819 49.260 1.00 0.00 C ATOM 396 O LYS A 27 62.913 -72.769 48.744 1.00 0.00 O ATOM 397 CB LYS A 27 60.690 -74.848 50.205 1.00 0.00 C ATOM 398 CG LYS A 27 60.498 -75.689 51.468 1.00 0.00 C ATOM 399 CD LYS A 27 59.935 -77.060 51.088 1.00 0.00 C ATOM 400 CE LYS A 27 58.547 -76.887 50.467 1.00 0.00 C ATOM 401 NZ LYS A 27 57.842 -78.200 50.455 1.00 0.00 N ATOM 0 H LYS A 27 59.973 -73.127 51.814 1.00 0.00 H new ATOM 0 HA LYS A 27 62.519 -73.963 50.920 1.00 0.00 H new ATOM 0 HB2 LYS A 27 59.723 -74.527 49.819 1.00 0.00 H new ATOM 0 HB3 LYS A 27 61.162 -75.446 49.425 1.00 0.00 H new ATOM 0 HG2 LYS A 27 61.449 -75.806 51.988 1.00 0.00 H new ATOM 0 HG3 LYS A 27 59.819 -75.183 52.155 1.00 0.00 H new ATOM 0 HD2 LYS A 27 60.602 -77.556 50.382 1.00 0.00 H new ATOM 0 HD3 LYS A 27 59.874 -77.697 51.970 1.00 0.00 H new ATOM 0 HE2 LYS A 27 57.970 -76.158 51.036 1.00 0.00 H new ATOM 0 HE3 LYS A 27 58.636 -76.501 49.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 56.899 -78.084 50.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 58.390 -78.883 49.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 57.745 -78.551 51.429 1.00 0.00 H new ATOM 415 N LEU A 28 60.739 -72.189 48.758 1.00 0.00 N ATOM 416 CA LEU A 28 60.839 -71.411 47.528 1.00 0.00 C ATOM 417 C LEU A 28 61.935 -70.357 47.645 1.00 0.00 C ATOM 418 O LEU A 28 62.546 -69.971 46.648 1.00 0.00 O ATOM 419 CB LEU A 28 59.503 -70.728 47.231 1.00 0.00 C ATOM 420 CG LEU A 28 58.413 -71.789 47.070 1.00 0.00 C ATOM 421 CD1 LEU A 28 57.047 -71.108 46.969 1.00 0.00 C ATOM 422 CD2 LEU A 28 58.674 -72.596 45.796 1.00 0.00 C ATOM 0 H LEU A 28 59.810 -72.201 49.180 1.00 0.00 H new ATOM 0 HA LEU A 28 61.090 -72.090 46.713 1.00 0.00 H new ATOM 0 HB2 LEU A 28 59.244 -70.045 48.040 1.00 0.00 H new ATOM 0 HB3 LEU A 28 59.582 -70.131 46.322 1.00 0.00 H new ATOM 0 HG LEU A 28 58.424 -72.455 47.933 1.00 0.00 H new ATOM 0 HD11 LEU A 28 56.271 -71.865 46.854 1.00 0.00 H new ATOM 0 HD12 LEU A 28 56.860 -70.531 47.875 1.00 0.00 H new ATOM 0 HD13 LEU A 28 57.035 -70.442 46.106 1.00 0.00 H new ATOM 0 HD21 LEU A 28 57.898 -73.353 45.679 1.00 0.00 H new ATOM 0 HD22 LEU A 28 58.663 -71.929 44.934 1.00 0.00 H new ATOM 0 HD23 LEU A 28 59.647 -73.082 45.866 1.00 0.00 H new ATOM 434 N ASP A 29 62.179 -69.896 48.867 1.00 0.00 N ATOM 435 CA ASP A 29 63.172 -68.853 49.095 1.00 0.00 C ATOM 436 C ASP A 29 64.539 -69.466 49.382 1.00 0.00 C ATOM 437 O ASP A 29 65.530 -69.129 48.734 1.00 0.00 O ATOM 438 CB ASP A 29 62.747 -67.974 50.272 1.00 0.00 C ATOM 439 CG ASP A 29 61.461 -67.229 49.929 1.00 0.00 C ATOM 440 OD1 ASP A 29 61.253 -66.956 48.757 1.00 0.00 O ATOM 441 OD2 ASP A 29 60.704 -66.941 50.841 1.00 0.00 O ATOM 0 H ASP A 29 61.707 -70.225 49.709 1.00 0.00 H new ATOM 0 HA ASP A 29 63.243 -68.243 48.194 1.00 0.00 H new ATOM 0 HB2 ASP A 29 62.595 -68.589 51.159 1.00 0.00 H new ATOM 0 HB3 ASP A 29 63.537 -67.262 50.509 1.00 0.00 H new ATOM 446 N LYS A 30 64.584 -70.367 50.358 1.00 0.00 N ATOM 447 CA LYS A 30 65.849 -70.954 50.783 1.00 0.00 C ATOM 448 C LYS A 30 65.923 -72.423 50.374 1.00 0.00 C ATOM 449 O LYS A 30 66.997 -73.024 50.377 1.00 0.00 O ATOM 450 CB LYS A 30 65.995 -70.837 52.301 1.00 0.00 C ATOM 451 CG LYS A 30 66.023 -69.360 52.699 1.00 0.00 C ATOM 452 CD LYS A 30 67.457 -68.833 52.607 1.00 0.00 C ATOM 453 CE LYS A 30 67.506 -67.393 53.119 1.00 0.00 C ATOM 454 NZ LYS A 30 66.954 -66.478 52.080 1.00 0.00 N ATOM 0 H LYS A 30 63.766 -70.704 50.866 1.00 0.00 H new ATOM 0 HA LYS A 30 66.661 -70.412 50.297 1.00 0.00 H new ATOM 0 HB2 LYS A 30 65.166 -71.342 52.797 1.00 0.00 H new ATOM 0 HB3 LYS A 30 66.910 -71.330 52.628 1.00 0.00 H new ATOM 0 HG2 LYS A 30 65.370 -68.784 52.044 1.00 0.00 H new ATOM 0 HG3 LYS A 30 65.644 -69.239 53.714 1.00 0.00 H new ATOM 0 HD2 LYS A 30 68.125 -69.462 53.195 1.00 0.00 H new ATOM 0 HD3 LYS A 30 67.806 -68.875 51.575 1.00 0.00 H new ATOM 0 HE2 LYS A 30 66.931 -67.303 54.041 1.00 0.00 H new ATOM 0 HE3 LYS A 30 68.533 -67.115 53.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 67.018 -65.495 52.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 67.500 -66.582 51.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 65.958 -66.718 51.900 1.00 0.00 H new ATOM 468 N HIS A 31 64.775 -72.993 50.025 1.00 0.00 N ATOM 469 CA HIS A 31 64.723 -74.388 49.603 1.00 0.00 C ATOM 470 C HIS A 31 65.083 -75.312 50.763 1.00 0.00 C ATOM 471 O HIS A 31 65.997 -76.129 50.656 1.00 0.00 O ATOM 472 CB HIS A 31 65.694 -74.620 48.445 1.00 0.00 C ATOM 473 CG HIS A 31 65.401 -73.640 47.341 1.00 0.00 C ATOM 474 ND1 HIS A 31 64.718 -74.003 46.191 1.00 0.00 N ATOM 475 CD2 HIS A 31 65.691 -72.305 47.199 1.00 0.00 C ATOM 476 CE1 HIS A 31 64.622 -72.909 45.414 1.00 0.00 C ATOM 477 NE2 HIS A 31 65.199 -71.847 45.981 1.00 0.00 N ATOM 0 H HIS A 31 63.874 -72.515 50.026 1.00 0.00 H new ATOM 0 HA HIS A 31 63.708 -74.611 49.276 1.00 0.00 H new ATOM 0 HB2 HIS A 31 66.722 -74.501 48.788 1.00 0.00 H new ATOM 0 HB3 HIS A 31 65.598 -75.641 48.075 1.00 0.00 H new ATOM 0 HD2 HIS A 31 66.220 -71.703 47.923 1.00 0.00 H new ATOM 0 HE1 HIS A 31 64.137 -72.892 44.449 1.00 0.00 H new ATOM 0 HE2 HIS A 31 65.265 -70.902 45.602 1.00 0.00 H new ATOM 485 N ALA A 32 64.357 -75.178 51.867 1.00 0.00 N ATOM 486 CA ALA A 32 64.588 -76.030 53.028 1.00 0.00 C ATOM 487 C ALA A 32 63.649 -77.232 53.003 1.00 0.00 C ATOM 488 O ALA A 32 62.996 -77.502 51.995 1.00 0.00 O ATOM 489 CB ALA A 32 64.364 -75.232 54.314 1.00 0.00 C ATOM 0 H ALA A 32 63.610 -74.494 51.983 1.00 0.00 H new ATOM 0 HA ALA A 32 65.618 -76.386 52.997 1.00 0.00 H new ATOM 0 HB1 ALA A 32 64.538 -75.875 55.176 1.00 0.00 H new ATOM 0 HB2 ALA A 32 65.055 -74.389 54.344 1.00 0.00 H new ATOM 0 HB3 ALA A 32 63.339 -74.862 54.339 1.00 0.00 H new ATOM 495 N ARG A 33 63.587 -77.952 54.118 1.00 0.00 N ATOM 496 CA ARG A 33 62.712 -79.114 54.218 1.00 0.00 C ATOM 497 C ARG A 33 61.271 -78.681 54.471 1.00 0.00 C ATOM 498 O ARG A 33 60.356 -79.082 53.752 1.00 0.00 O ATOM 499 CB ARG A 33 63.180 -80.025 55.354 1.00 0.00 C ATOM 500 CG ARG A 33 64.693 -80.228 55.256 1.00 0.00 C ATOM 501 CD ARG A 33 64.993 -81.387 54.305 1.00 0.00 C ATOM 502 NE ARG A 33 66.366 -81.299 53.819 1.00 0.00 N ATOM 503 CZ ARG A 33 66.738 -80.334 52.985 1.00 0.00 C ATOM 504 NH1 ARG A 33 65.870 -79.445 52.586 1.00 0.00 N ATOM 505 NH2 ARG A 33 67.971 -80.275 52.564 1.00 0.00 N ATOM 0 H ARG A 33 64.128 -77.753 54.960 1.00 0.00 H new ATOM 0 HA ARG A 33 62.755 -79.659 53.275 1.00 0.00 H new ATOM 0 HB2 ARG A 33 62.923 -79.584 56.317 1.00 0.00 H new ATOM 0 HB3 ARG A 33 62.669 -80.986 55.297 1.00 0.00 H new ATOM 0 HG2 ARG A 33 65.170 -79.316 54.897 1.00 0.00 H new ATOM 0 HG3 ARG A 33 65.107 -80.437 56.242 1.00 0.00 H new ATOM 0 HD2 ARG A 33 64.842 -82.337 54.818 1.00 0.00 H new ATOM 0 HD3 ARG A 33 64.300 -81.365 53.464 1.00 0.00 H new ATOM 0 HE ARG A 33 67.051 -81.990 54.125 1.00 0.00 H new ATOM 0 HH11 ARG A 33 64.905 -79.491 52.914 1.00 0.00 H new ATOM 0 HH12 ARG A 33 66.156 -78.704 51.946 1.00 0.00 H new ATOM 0 HH21 ARG A 33 68.650 -80.970 52.875 1.00 0.00 H new ATOM 0 HH22 ARG A 33 68.256 -79.534 51.924 1.00 0.00 H new ATOM 519 N SER A 34 61.076 -77.860 55.498 1.00 0.00 N ATOM 520 CA SER A 34 59.745 -77.361 55.823 1.00 0.00 C ATOM 521 C SER A 34 59.761 -75.842 55.967 1.00 0.00 C ATOM 522 O SER A 34 59.344 -75.119 55.062 1.00 0.00 O ATOM 523 CB SER A 34 59.253 -77.993 57.124 1.00 0.00 C ATOM 524 OG SER A 34 58.914 -79.353 56.887 1.00 0.00 O ATOM 0 H SER A 34 61.817 -77.528 56.115 1.00 0.00 H new ATOM 0 HA SER A 34 59.070 -77.630 55.011 1.00 0.00 H new ATOM 0 HB2 SER A 34 60.027 -77.927 57.889 1.00 0.00 H new ATOM 0 HB3 SER A 34 58.386 -77.450 57.500 1.00 0.00 H new ATOM 0 HG SER A 34 58.939 -79.848 57.732 1.00 0.00 H new ATOM 530 N GLY A 35 60.244 -75.366 57.109 1.00 0.00 N ATOM 531 CA GLY A 35 60.330 -73.931 57.351 1.00 0.00 C ATOM 532 C GLY A 35 59.027 -73.398 57.939 1.00 0.00 C ATOM 533 O GLY A 35 58.425 -72.469 57.399 1.00 0.00 O ATOM 0 H GLY A 35 60.580 -75.948 57.877 1.00 0.00 H new ATOM 0 HA2 GLY A 35 61.154 -73.722 58.034 1.00 0.00 H new ATOM 0 HA3 GLY A 35 60.551 -73.413 56.417 1.00 0.00 H new ATOM 537 N GLU A 36 58.596 -73.994 59.046 1.00 0.00 N ATOM 538 CA GLU A 36 57.355 -73.582 59.690 1.00 0.00 C ATOM 539 C GLU A 36 57.553 -72.274 60.450 1.00 0.00 C ATOM 540 O GLU A 36 58.674 -71.778 60.571 1.00 0.00 O ATOM 541 CB GLU A 36 56.884 -74.669 60.657 1.00 0.00 C ATOM 542 CG GLU A 36 56.626 -75.964 59.884 1.00 0.00 C ATOM 543 CD GLU A 36 55.450 -75.777 58.931 1.00 0.00 C ATOM 544 OE1 GLU A 36 54.712 -74.822 59.112 1.00 0.00 O ATOM 545 OE2 GLU A 36 55.305 -76.591 58.033 1.00 0.00 O ATOM 0 H GLU A 36 59.084 -74.758 59.513 1.00 0.00 H new ATOM 0 HA GLU A 36 56.601 -73.429 58.918 1.00 0.00 H new ATOM 0 HB2 GLU A 36 57.637 -74.837 61.427 1.00 0.00 H new ATOM 0 HB3 GLU A 36 55.974 -74.349 61.165 1.00 0.00 H new ATOM 0 HG2 GLU A 36 57.517 -76.247 59.324 1.00 0.00 H new ATOM 0 HG3 GLU A 36 56.416 -76.777 60.579 1.00 0.00 H new ATOM 552 N CYS A 37 56.458 -71.720 60.960 1.00 0.00 N ATOM 553 CA CYS A 37 56.519 -70.456 61.685 1.00 0.00 C ATOM 554 C CYS A 37 56.964 -70.686 63.126 1.00 0.00 C ATOM 555 O CYS A 37 56.700 -71.740 63.706 1.00 0.00 O ATOM 556 CB CYS A 37 55.165 -69.762 61.762 1.00 0.00 C ATOM 557 SG CYS A 37 54.510 -69.494 60.097 1.00 0.00 S ATOM 0 H CYS A 37 55.524 -72.123 60.886 1.00 0.00 H new ATOM 0 HA CYS A 37 57.225 -69.835 61.134 1.00 0.00 H new ATOM 0 HB2 CYS A 37 54.469 -70.368 62.342 1.00 0.00 H new ATOM 0 HB3 CYS A 37 55.265 -68.808 62.280 1.00 0.00 H new ATOM 562 N PHE A 38 57.639 -69.695 63.698 1.00 0.00 N ATOM 563 CA PHE A 38 58.083 -69.787 65.084 1.00 0.00 C ATOM 564 C PHE A 38 58.034 -68.419 65.755 1.00 0.00 C ATOM 565 O PHE A 38 58.183 -67.388 65.098 1.00 0.00 O ATOM 566 CB PHE A 38 59.511 -70.335 65.141 1.00 0.00 C ATOM 567 CG PHE A 38 59.504 -71.795 64.757 1.00 0.00 C ATOM 568 CD1 PHE A 38 59.598 -72.166 63.409 1.00 0.00 C ATOM 569 CD2 PHE A 38 59.405 -72.779 65.748 1.00 0.00 C ATOM 570 CE1 PHE A 38 59.593 -73.519 63.054 1.00 0.00 C ATOM 571 CE2 PHE A 38 59.400 -74.133 65.392 1.00 0.00 C ATOM 572 CZ PHE A 38 59.494 -74.503 64.045 1.00 0.00 C ATOM 0 H PHE A 38 57.889 -68.825 63.228 1.00 0.00 H new ATOM 0 HA PHE A 38 57.413 -70.463 65.615 1.00 0.00 H new ATOM 0 HB2 PHE A 38 60.155 -69.773 64.465 1.00 0.00 H new ATOM 0 HB3 PHE A 38 59.919 -70.214 66.144 1.00 0.00 H new ATOM 0 HD1 PHE A 38 59.674 -71.407 62.644 1.00 0.00 H new ATOM 0 HD2 PHE A 38 59.332 -72.494 66.787 1.00 0.00 H new ATOM 0 HE1 PHE A 38 59.666 -73.805 62.015 1.00 0.00 H new ATOM 0 HE2 PHE A 38 59.324 -74.892 66.156 1.00 0.00 H new ATOM 0 HZ PHE A 38 59.490 -75.547 63.770 1.00 0.00 H new ATOM 582 N TYR A 39 57.825 -68.416 67.068 1.00 0.00 N ATOM 583 CA TYR A 39 57.752 -67.168 67.818 1.00 0.00 C ATOM 584 C TYR A 39 59.142 -66.733 68.270 1.00 0.00 C ATOM 585 O TYR A 39 59.746 -67.359 69.142 1.00 0.00 O ATOM 586 CB TYR A 39 56.847 -67.345 69.039 1.00 0.00 C ATOM 587 CG TYR A 39 55.401 -67.263 68.611 1.00 0.00 C ATOM 588 CD1 TYR A 39 54.885 -68.196 67.704 1.00 0.00 C ATOM 589 CD2 TYR A 39 54.576 -66.254 69.123 1.00 0.00 C ATOM 590 CE1 TYR A 39 53.545 -68.120 67.308 1.00 0.00 C ATOM 591 CE2 TYR A 39 53.235 -66.178 68.727 1.00 0.00 C ATOM 592 CZ TYR A 39 52.720 -67.111 67.819 1.00 0.00 C ATOM 593 OH TYR A 39 51.398 -67.036 67.429 1.00 0.00 O ATOM 0 H TYR A 39 57.704 -69.258 67.631 1.00 0.00 H new ATOM 0 HA TYR A 39 57.337 -66.398 67.168 1.00 0.00 H new ATOM 0 HB2 TYR A 39 57.043 -68.307 69.514 1.00 0.00 H new ATOM 0 HB3 TYR A 39 57.062 -66.574 69.779 1.00 0.00 H new ATOM 0 HD1 TYR A 39 55.521 -68.975 67.310 1.00 0.00 H new ATOM 0 HD2 TYR A 39 54.974 -65.534 69.823 1.00 0.00 H new ATOM 0 HE1 TYR A 39 53.147 -68.840 66.608 1.00 0.00 H new ATOM 0 HE2 TYR A 39 52.598 -65.400 69.122 1.00 0.00 H new ATOM 0 HH TYR A 39 50.967 -66.279 67.878 1.00 0.00 H new ATOM 603 N ASP A 40 59.644 -65.657 67.673 1.00 0.00 N ATOM 604 CA ASP A 40 60.956 -65.136 68.035 1.00 0.00 C ATOM 605 C ASP A 40 60.867 -64.287 69.299 1.00 0.00 C ATOM 606 O ASP A 40 59.921 -64.414 70.078 1.00 0.00 O ATOM 607 CB ASP A 40 61.519 -64.291 66.891 1.00 0.00 C ATOM 608 CG ASP A 40 61.844 -65.181 65.696 1.00 0.00 C ATOM 609 OD1 ASP A 40 61.683 -66.385 65.818 1.00 0.00 O ATOM 610 OD2 ASP A 40 62.248 -64.648 64.676 1.00 0.00 O ATOM 0 H ASP A 40 59.165 -65.132 66.941 1.00 0.00 H new ATOM 0 HA ASP A 40 61.619 -65.980 68.223 1.00 0.00 H new ATOM 0 HB2 ASP A 40 60.796 -63.529 66.601 1.00 0.00 H new ATOM 0 HB3 ASP A 40 62.417 -63.769 67.221 1.00 0.00 H new ATOM 615 N GLU A 41 61.855 -63.421 69.496 1.00 0.00 N ATOM 616 CA GLU A 41 61.875 -62.553 70.669 1.00 0.00 C ATOM 617 C GLU A 41 60.763 -61.512 70.583 1.00 0.00 C ATOM 618 O GLU A 41 60.086 -61.231 71.573 1.00 0.00 O ATOM 619 CB GLU A 41 63.229 -61.848 70.773 1.00 0.00 C ATOM 620 CG GLU A 41 64.333 -62.889 70.967 1.00 0.00 C ATOM 621 CD GLU A 41 64.164 -63.585 72.312 1.00 0.00 C ATOM 622 OE1 GLU A 41 63.455 -63.050 73.148 1.00 0.00 O ATOM 623 OE2 GLU A 41 64.746 -64.643 72.487 1.00 0.00 O ATOM 0 H GLU A 41 62.647 -63.301 68.864 1.00 0.00 H new ATOM 0 HA GLU A 41 61.716 -63.167 71.556 1.00 0.00 H new ATOM 0 HB2 GLU A 41 63.418 -61.266 69.871 1.00 0.00 H new ATOM 0 HB3 GLU A 41 63.223 -61.148 71.609 1.00 0.00 H new ATOM 0 HG2 GLU A 41 64.298 -63.623 70.162 1.00 0.00 H new ATOM 0 HG3 GLU A 41 65.310 -62.408 70.917 1.00 0.00 H new ATOM 630 N LYS A 42 60.581 -60.943 69.396 1.00 0.00 N ATOM 631 CA LYS A 42 59.543 -59.939 69.192 1.00 0.00 C ATOM 632 C LYS A 42 58.169 -60.597 69.119 1.00 0.00 C ATOM 633 O LYS A 42 57.163 -59.929 68.875 1.00 0.00 O ATOM 634 CB LYS A 42 59.811 -59.166 67.900 1.00 0.00 C ATOM 635 CG LYS A 42 61.156 -58.445 68.006 1.00 0.00 C ATOM 636 CD LYS A 42 61.386 -57.604 66.749 1.00 0.00 C ATOM 637 CE LYS A 42 62.792 -57.004 66.785 1.00 0.00 C ATOM 638 NZ LYS A 42 63.079 -56.331 65.486 1.00 0.00 N ATOM 0 H LYS A 42 61.134 -61.158 68.566 1.00 0.00 H new ATOM 0 HA LYS A 42 59.559 -59.250 70.036 1.00 0.00 H new ATOM 0 HB2 LYS A 42 59.818 -59.849 67.050 1.00 0.00 H new ATOM 0 HB3 LYS A 42 59.013 -58.445 67.723 1.00 0.00 H new ATOM 0 HG2 LYS A 42 61.170 -57.808 68.890 1.00 0.00 H new ATOM 0 HG3 LYS A 42 61.961 -59.170 68.123 1.00 0.00 H new ATOM 0 HD2 LYS A 42 61.266 -58.221 65.859 1.00 0.00 H new ATOM 0 HD3 LYS A 42 60.642 -56.810 66.689 1.00 0.00 H new ATOM 0 HE2 LYS A 42 62.873 -56.288 67.603 1.00 0.00 H new ATOM 0 HE3 LYS A 42 63.528 -57.786 66.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 64.035 -55.923 65.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 63.019 -57.026 64.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 62.384 -55.574 65.326 1.00 0.00 H new ATOM 652 N ARG A 43 58.132 -61.908 69.330 1.00 0.00 N ATOM 653 CA ARG A 43 56.875 -62.646 69.284 1.00 0.00 C ATOM 654 C ARG A 43 56.217 -62.495 67.916 1.00 0.00 C ATOM 655 O ARG A 43 54.996 -62.363 67.816 1.00 0.00 O ATOM 656 CB ARG A 43 55.928 -62.131 70.369 1.00 0.00 C ATOM 657 CG ARG A 43 56.706 -61.924 71.669 1.00 0.00 C ATOM 658 CD ARG A 43 57.423 -63.221 72.048 1.00 0.00 C ATOM 659 NE ARG A 43 56.573 -64.370 71.760 1.00 0.00 N ATOM 660 CZ ARG A 43 55.583 -64.713 72.578 1.00 0.00 C ATOM 661 NH1 ARG A 43 55.358 -64.017 73.658 1.00 0.00 N ATOM 662 NH2 ARG A 43 54.836 -65.746 72.299 1.00 0.00 N ATOM 0 H ARG A 43 58.952 -62.479 69.533 1.00 0.00 H new ATOM 0 HA ARG A 43 57.086 -63.701 69.459 1.00 0.00 H new ATOM 0 HB2 ARG A 43 55.471 -61.193 70.053 1.00 0.00 H new ATOM 0 HB3 ARG A 43 55.118 -62.843 70.527 1.00 0.00 H new ATOM 0 HG2 ARG A 43 57.430 -61.118 71.547 1.00 0.00 H new ATOM 0 HG3 ARG A 43 56.027 -61.625 72.468 1.00 0.00 H new ATOM 0 HD2 ARG A 43 58.358 -63.303 71.494 1.00 0.00 H new ATOM 0 HD3 ARG A 43 57.680 -63.206 73.107 1.00 0.00 H new ATOM 0 HE ARG A 43 56.741 -64.920 70.917 1.00 0.00 H new ATOM 0 HH11 ARG A 43 55.942 -63.209 73.875 1.00 0.00 H new ATOM 0 HH12 ARG A 43 54.598 -64.280 74.285 1.00 0.00 H new ATOM 0 HH21 ARG A 43 55.012 -66.289 71.454 1.00 0.00 H new ATOM 0 HH22 ARG A 43 54.076 -66.010 72.926 1.00 0.00 H new ATOM 676 N ASN A 44 57.031 -62.515 66.866 1.00 0.00 N ATOM 677 CA ASN A 44 56.515 -62.384 65.509 1.00 0.00 C ATOM 678 C ASN A 44 56.703 -63.685 64.736 1.00 0.00 C ATOM 679 O ASN A 44 57.827 -64.155 64.559 1.00 0.00 O ATOM 680 CB ASN A 44 57.236 -61.247 64.783 1.00 0.00 C ATOM 681 CG ASN A 44 58.653 -61.678 64.419 1.00 0.00 C ATOM 682 OD1 ASN A 44 59.329 -62.329 65.215 1.00 0.00 O ATOM 683 ND2 ASN A 44 59.145 -61.352 63.254 1.00 0.00 N ATOM 0 H ASN A 44 58.044 -62.620 66.928 1.00 0.00 H new ATOM 0 HA ASN A 44 55.450 -62.160 65.566 1.00 0.00 H new ATOM 0 HB2 ASN A 44 56.687 -60.974 63.882 1.00 0.00 H new ATOM 0 HB3 ASN A 44 57.268 -60.361 65.418 1.00 0.00 H new ATOM 0 HD21 ASN A 44 60.091 -61.637 63.002 1.00 0.00 H new ATOM 0 HD22 ASN A 44 58.583 -60.812 62.596 1.00 0.00 H new ATOM 690 N LEU A 45 55.596 -64.260 64.277 1.00 0.00 N ATOM 691 CA LEU A 45 55.653 -65.505 63.520 1.00 0.00 C ATOM 692 C LEU A 45 56.751 -65.442 62.464 1.00 0.00 C ATOM 693 O LEU A 45 56.643 -64.701 61.485 1.00 0.00 O ATOM 694 CB LEU A 45 54.306 -65.767 62.842 1.00 0.00 C ATOM 695 CG LEU A 45 53.193 -65.745 63.892 1.00 0.00 C ATOM 696 CD1 LEU A 45 51.884 -65.297 63.239 1.00 0.00 C ATOM 697 CD2 LEU A 45 53.018 -67.148 64.476 1.00 0.00 C ATOM 0 H LEU A 45 54.656 -63.888 64.414 1.00 0.00 H new ATOM 0 HA LEU A 45 55.876 -66.317 64.212 1.00 0.00 H new ATOM 0 HB2 LEU A 45 54.117 -65.010 62.080 1.00 0.00 H new ATOM 0 HB3 LEU A 45 54.323 -66.732 62.335 1.00 0.00 H new ATOM 0 HG LEU A 45 53.457 -65.049 64.688 1.00 0.00 H new ATOM 0 HD11 LEU A 45 51.091 -65.281 63.987 1.00 0.00 H new ATOM 0 HD12 LEU A 45 52.009 -64.298 62.822 1.00 0.00 H new ATOM 0 HD13 LEU A 45 51.618 -65.992 62.443 1.00 0.00 H new ATOM 0 HD21 LEU A 45 52.226 -67.134 65.224 1.00 0.00 H new ATOM 0 HD22 LEU A 45 52.753 -67.843 63.679 1.00 0.00 H new ATOM 0 HD23 LEU A 45 53.951 -67.467 64.941 1.00 0.00 H new ATOM 709 N GLN A 46 57.807 -66.222 62.667 1.00 0.00 N ATOM 710 CA GLN A 46 58.921 -66.245 61.726 1.00 0.00 C ATOM 711 C GLN A 46 59.140 -67.656 61.190 1.00 0.00 C ATOM 712 O GLN A 46 59.029 -68.635 61.929 1.00 0.00 O ATOM 713 CB GLN A 46 60.196 -65.753 62.413 1.00 0.00 C ATOM 714 CG GLN A 46 60.002 -64.309 62.877 1.00 0.00 C ATOM 715 CD GLN A 46 61.092 -63.421 62.286 1.00 0.00 C ATOM 716 OE1 GLN A 46 62.277 -63.637 62.541 1.00 0.00 O ATOM 717 NE2 GLN A 46 60.761 -62.427 61.507 1.00 0.00 N ATOM 0 H GLN A 46 57.915 -66.843 63.469 1.00 0.00 H new ATOM 0 HA GLN A 46 58.682 -65.585 60.892 1.00 0.00 H new ATOM 0 HB2 GLN A 46 60.432 -66.391 63.265 1.00 0.00 H new ATOM 0 HB3 GLN A 46 61.039 -65.815 61.725 1.00 0.00 H new ATOM 0 HG2 GLN A 46 59.021 -63.948 62.569 1.00 0.00 H new ATOM 0 HG3 GLN A 46 60.032 -64.261 63.966 1.00 0.00 H new ATOM 0 HE21 GLN A 46 59.779 -62.249 61.297 1.00 0.00 H new ATOM 0 HE22 GLN A 46 61.484 -61.828 61.109 1.00 0.00 H new ATOM 726 N CYS A 47 59.452 -67.752 59.902 1.00 0.00 N ATOM 727 CA CYS A 47 59.695 -69.049 59.280 1.00 0.00 C ATOM 728 C CYS A 47 61.126 -69.510 59.540 1.00 0.00 C ATOM 729 O CYS A 47 62.083 -68.816 59.195 1.00 0.00 O ATOM 730 CB CYS A 47 59.471 -68.968 57.767 1.00 0.00 C ATOM 731 SG CYS A 47 57.709 -68.778 57.404 1.00 0.00 S ATOM 0 H CYS A 47 59.542 -66.954 59.273 1.00 0.00 H new ATOM 0 HA CYS A 47 58.997 -69.763 59.717 1.00 0.00 H new ATOM 0 HB2 CYS A 47 60.027 -68.126 57.354 1.00 0.00 H new ATOM 0 HB3 CYS A 47 59.853 -69.869 57.287 1.00 0.00 H new ATOM 736 N ILE A 48 61.263 -70.683 60.150 1.00 0.00 N ATOM 737 CA ILE A 48 62.583 -71.230 60.444 1.00 0.00 C ATOM 738 C ILE A 48 62.919 -72.365 59.484 1.00 0.00 C ATOM 739 O ILE A 48 62.569 -73.520 59.726 1.00 0.00 O ATOM 740 CB ILE A 48 62.625 -71.746 61.883 1.00 0.00 C ATOM 741 CG1 ILE A 48 62.532 -70.565 62.852 1.00 0.00 C ATOM 742 CG2 ILE A 48 63.939 -72.494 62.118 1.00 0.00 C ATOM 743 CD1 ILE A 48 62.636 -71.076 64.290 1.00 0.00 C ATOM 0 H ILE A 48 60.483 -71.269 60.448 1.00 0.00 H new ATOM 0 HA ILE A 48 63.320 -70.437 60.321 1.00 0.00 H new ATOM 0 HB ILE A 48 61.786 -72.421 62.051 1.00 0.00 H new ATOM 0 HG12 ILE A 48 63.330 -69.851 62.650 1.00 0.00 H new ATOM 0 HG13 ILE A 48 61.589 -70.037 62.710 1.00 0.00 H new ATOM 0 HG21 ILE A 48 63.970 -72.862 63.144 1.00 0.00 H new ATOM 0 HG22 ILE A 48 64.007 -73.335 61.428 1.00 0.00 H new ATOM 0 HG23 ILE A 48 64.777 -71.818 61.950 1.00 0.00 H new ATOM 0 HD11 ILE A 48 62.570 -70.235 64.981 1.00 0.00 H new ATOM 0 HD12 ILE A 48 61.822 -71.773 64.488 1.00 0.00 H new ATOM 0 HD13 ILE A 48 63.590 -71.584 64.427 1.00 0.00 H new ATOM 755 N CYS A 49 63.601 -72.030 58.393 1.00 0.00 N ATOM 756 CA CYS A 49 63.988 -73.033 57.407 1.00 0.00 C ATOM 757 C CYS A 49 64.925 -74.063 58.031 1.00 0.00 C ATOM 758 O CYS A 49 66.040 -73.735 58.440 1.00 0.00 O ATOM 759 CB CYS A 49 64.726 -72.368 56.245 1.00 0.00 C ATOM 760 SG CYS A 49 63.641 -72.209 54.805 1.00 0.00 S ATOM 0 H CYS A 49 63.895 -71.079 58.170 1.00 0.00 H new ATOM 0 HA CYS A 49 63.080 -73.521 57.052 1.00 0.00 H new ATOM 0 HB2 CYS A 49 65.081 -71.383 56.549 1.00 0.00 H new ATOM 0 HB3 CYS A 49 65.605 -72.957 55.981 1.00 0.00 H new ATOM 765 N ASP A 50 64.468 -75.308 58.100 1.00 0.00 N ATOM 766 CA ASP A 50 65.280 -76.380 58.663 1.00 0.00 C ATOM 767 C ASP A 50 65.855 -77.255 57.554 1.00 0.00 C ATOM 768 O ASP A 50 65.142 -77.659 56.635 1.00 0.00 O ATOM 769 CB ASP A 50 64.433 -77.238 59.605 1.00 0.00 C ATOM 770 CG ASP A 50 63.364 -77.983 58.812 1.00 0.00 C ATOM 771 OD1 ASP A 50 63.653 -78.381 57.696 1.00 0.00 O ATOM 772 OD2 ASP A 50 62.272 -78.144 59.334 1.00 0.00 O ATOM 0 H ASP A 50 63.546 -75.599 57.775 1.00 0.00 H new ATOM 0 HA ASP A 50 66.102 -75.932 59.221 1.00 0.00 H new ATOM 0 HB2 ASP A 50 65.068 -77.950 60.132 1.00 0.00 H new ATOM 0 HB3 ASP A 50 63.964 -76.608 60.361 1.00 0.00 H new ATOM 777 N TYR A 51 67.149 -77.543 57.647 1.00 0.00 N ATOM 778 CA TYR A 51 67.804 -78.393 56.659 1.00 0.00 C ATOM 779 C TYR A 51 68.185 -79.736 57.274 1.00 0.00 C ATOM 780 O TYR A 51 69.365 -80.073 57.370 1.00 0.00 O ATOM 781 CB TYR A 51 69.060 -77.700 56.126 1.00 0.00 C ATOM 782 CG TYR A 51 68.660 -76.589 55.183 1.00 0.00 C ATOM 783 CD1 TYR A 51 68.327 -75.328 55.691 1.00 0.00 C ATOM 784 CD2 TYR A 51 68.622 -76.822 53.804 1.00 0.00 C ATOM 785 CE1 TYR A 51 67.956 -74.298 54.816 1.00 0.00 C ATOM 786 CE2 TYR A 51 68.251 -75.793 52.930 1.00 0.00 C ATOM 787 CZ TYR A 51 67.918 -74.530 53.437 1.00 0.00 C ATOM 788 OH TYR A 51 67.553 -73.516 52.575 1.00 0.00 O ATOM 0 H TYR A 51 67.761 -77.204 58.390 1.00 0.00 H new ATOM 0 HA TYR A 51 67.108 -78.567 55.839 1.00 0.00 H new ATOM 0 HB2 TYR A 51 69.645 -77.297 56.953 1.00 0.00 H new ATOM 0 HB3 TYR A 51 69.694 -78.420 55.609 1.00 0.00 H new ATOM 0 HD1 TYR A 51 68.356 -75.149 56.756 1.00 0.00 H new ATOM 0 HD2 TYR A 51 68.879 -77.796 53.414 1.00 0.00 H new ATOM 0 HE1 TYR A 51 67.699 -73.324 55.207 1.00 0.00 H new ATOM 0 HE2 TYR A 51 68.222 -75.973 51.865 1.00 0.00 H new ATOM 0 HH TYR A 51 67.471 -73.873 51.666 1.00 0.00 H new ATOM 798 N CYS A 52 67.178 -80.498 57.689 1.00 0.00 N ATOM 799 CA CYS A 52 67.420 -81.801 58.297 1.00 0.00 C ATOM 800 C CYS A 52 66.116 -82.579 58.438 1.00 0.00 C ATOM 801 O CYS A 52 65.075 -82.160 57.931 1.00 0.00 O ATOM 802 CB CYS A 52 68.062 -81.623 59.675 1.00 0.00 C ATOM 803 SG CYS A 52 69.851 -81.421 59.486 1.00 0.00 S ATOM 0 H CYS A 52 66.194 -80.238 57.616 1.00 0.00 H new ATOM 0 HA CYS A 52 68.095 -82.362 57.651 1.00 0.00 H new ATOM 0 HB2 CYS A 52 67.638 -80.753 60.176 1.00 0.00 H new ATOM 0 HB3 CYS A 52 67.847 -82.488 60.303 1.00 0.00 H new ATOM 808 N GLU A 53 66.180 -83.711 59.130 1.00 0.00 N ATOM 809 CA GLU A 53 64.996 -84.539 59.334 1.00 0.00 C ATOM 810 C GLU A 53 64.385 -84.272 60.706 1.00 0.00 C ATOM 811 O GLU A 53 64.598 -85.034 61.649 1.00 0.00 O ATOM 812 CB GLU A 53 65.366 -86.018 59.216 1.00 0.00 C ATOM 813 CG GLU A 53 65.928 -86.295 57.820 1.00 0.00 C ATOM 814 CD GLU A 53 64.845 -86.076 56.770 1.00 0.00 C ATOM 815 OE1 GLU A 53 63.682 -86.070 57.139 1.00 0.00 O ATOM 816 OE2 GLU A 53 65.194 -85.919 55.612 1.00 0.00 O ATOM 0 H GLU A 53 67.032 -84.075 59.557 1.00 0.00 H new ATOM 0 HA GLU A 53 64.263 -84.287 58.568 1.00 0.00 H new ATOM 0 HB2 GLU A 53 66.103 -86.281 59.975 1.00 0.00 H new ATOM 0 HB3 GLU A 53 64.488 -86.639 59.396 1.00 0.00 H new ATOM 0 HG2 GLU A 53 66.775 -85.638 57.623 1.00 0.00 H new ATOM 0 HG3 GLU A 53 66.298 -87.319 57.764 1.00 0.00 H new ATOM 823 N TYR A 54 63.627 -83.187 60.809 1.00 0.00 N ATOM 824 CA TYR A 54 62.984 -82.833 62.070 1.00 0.00 C ATOM 825 C TYR A 54 61.864 -83.817 62.395 1.00 0.00 C ATOM 826 CB TYR A 54 62.413 -81.416 61.987 1.00 0.00 C ATOM 827 CG TYR A 54 61.258 -81.395 61.014 1.00 0.00 C ATOM 828 CD1 TYR A 54 61.490 -81.131 59.659 1.00 0.00 C ATOM 829 CD2 TYR A 54 59.957 -81.639 61.467 1.00 0.00 C ATOM 830 CE1 TYR A 54 60.420 -81.111 58.756 1.00 0.00 C ATOM 831 CE2 TYR A 54 58.886 -81.619 60.565 1.00 0.00 C ATOM 832 CZ TYR A 54 59.118 -81.355 59.210 1.00 0.00 C ATOM 833 OH TYR A 54 58.062 -81.335 58.320 1.00 0.00 O ATOM 0 H TYR A 54 63.443 -82.541 60.041 1.00 0.00 H new ATOM 0 HA TYR A 54 63.732 -82.876 62.862 1.00 0.00 H new ATOM 0 HB2 TYR A 54 62.079 -81.089 62.972 1.00 0.00 H new ATOM 0 HB3 TYR A 54 63.187 -80.719 61.665 1.00 0.00 H new ATOM 0 HD1 TYR A 54 62.495 -80.943 59.310 1.00 0.00 H new ATOM 0 HD2 TYR A 54 59.779 -81.843 62.512 1.00 0.00 H new ATOM 0 HE1 TYR A 54 60.599 -80.908 57.710 1.00 0.00 H new ATOM 0 HE2 TYR A 54 57.882 -81.807 60.915 1.00 0.00 H new ATOM 0 HH TYR A 54 58.385 -81.567 57.424 1.00 0.00 H new