USER MOD reduce.3.24.130724 H: found=0, std=0, add=520, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 520 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 7 ASN : amide:sc= 0 X(o=0,f=-0.079) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= 1.4 K(o=1.4,f=-0.61) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0.0197 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 MET CE :methyl -131:sc= -0.581 (180deg=-1.14) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 91:sc= 1.13 USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 48 CYS SG : rot 57:sc= -0.0489 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 54 GLN : amide:sc= -0.0923 X(o=-0.092,f=-0.016) USER MOD Single : A 60 ASN : amide:sc= 0.669 K(o=0.67,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ -177:sc= 1.56 (180deg=1.5) USER MOD ----------------------------------------------------------------- ATOM 59 N TYR A 5 12.764 1.770 0.060 1.00 25.00 N ATOM 60 CA TYR A 5 13.460 0.557 0.499 1.00 25.00 C ATOM 61 C TYR A 5 13.016 -0.742 -0.194 1.00 25.00 C ATOM 62 O TYR A 5 11.975 -0.815 -0.825 1.00 25.00 O ATOM 63 CB TYR A 5 13.378 0.407 2.013 1.00 25.00 C ATOM 64 CG TYR A 5 14.155 1.445 2.782 1.00 25.00 C ATOM 65 CD1 TYR A 5 13.493 2.317 3.670 1.00 25.00 C ATOM 66 CD2 TYR A 5 15.554 1.559 2.650 1.00 25.00 C ATOM 67 CE1 TYR A 5 14.216 3.286 4.410 1.00 25.00 C ATOM 68 CE2 TYR A 5 16.278 2.526 3.380 1.00 25.00 C ATOM 69 CZ TYR A 5 15.605 3.384 4.256 1.00 25.00 C ATOM 70 OH TYR A 5 16.309 4.319 4.966 1.00 25.00 O ATOM 0 HA TYR A 5 14.495 0.703 0.191 1.00 25.00 H new ATOM 0 HB2 TYR A 5 12.332 0.456 2.315 1.00 25.00 H new ATOM 0 HB3 TYR A 5 13.744 -0.582 2.289 1.00 25.00 H new ATOM 0 HD1 TYR A 5 12.422 2.246 3.788 1.00 25.00 H new ATOM 0 HD2 TYR A 5 16.080 0.896 1.979 1.00 25.00 H new ATOM 0 HE1 TYR A 5 13.698 3.946 5.090 1.00 25.00 H new ATOM 0 HE2 TYR A 5 17.349 2.603 3.263 1.00 25.00 H new ATOM 0 HH TYR A 5 17.261 4.251 4.742 1.00 25.00 H new ATOM 80 N LEU A 6 13.872 -1.752 -0.104 1.00 25.00 N ATOM 81 CA LEU A 6 13.650 -3.036 -0.777 1.00 25.00 C ATOM 82 C LEU A 6 12.462 -3.802 -0.188 1.00 25.00 C ATOM 83 O LEU A 6 11.680 -4.392 -0.923 1.00 25.00 O ATOM 84 CB LEU A 6 14.908 -3.913 -0.656 1.00 25.00 C ATOM 85 CG LEU A 6 16.256 -3.414 -1.211 1.00 25.00 C ATOM 86 CD1 LEU A 6 17.357 -4.431 -0.845 1.00 25.00 C ATOM 87 CD2 LEU A 6 16.214 -3.213 -2.726 1.00 25.00 C ATOM 0 H LEU A 6 14.738 -1.710 0.434 1.00 25.00 H new ATOM 0 HA LEU A 6 13.431 -2.815 -1.822 1.00 25.00 H new ATOM 0 HB2 LEU A 6 15.053 -4.126 0.403 1.00 25.00 H new ATOM 0 HB3 LEU A 6 14.689 -4.862 -1.145 1.00 25.00 H new ATOM 0 HG LEU A 6 16.471 -2.444 -0.763 1.00 25.00 H new ATOM 0 HD11 LEU A 6 18.315 -4.086 -1.234 1.00 25.00 H new ATOM 0 HD12 LEU A 6 17.419 -4.526 0.239 1.00 25.00 H new ATOM 0 HD13 LEU A 6 17.116 -5.400 -1.281 1.00 25.00 H new ATOM 0 HD21 LEU A 6 17.185 -2.861 -3.073 1.00 25.00 H new ATOM 0 HD22 LEU A 6 15.976 -4.159 -3.212 1.00 25.00 H new ATOM 0 HD23 LEU A 6 15.451 -2.475 -2.974 1.00 25.00 H new ATOM 99 N ASN A 7 12.368 -3.796 1.135 1.00 25.00 N ATOM 100 CA ASN A 7 11.305 -4.492 1.889 1.00 25.00 C ATOM 101 C ASN A 7 11.113 -5.960 1.482 1.00 25.00 C ATOM 102 O ASN A 7 9.998 -6.413 1.223 1.00 25.00 O ATOM 103 CB ASN A 7 9.982 -3.729 1.786 1.00 25.00 C ATOM 104 CG ASN A 7 10.026 -2.420 2.510 1.00 25.00 C ATOM 105 OD1 ASN A 7 10.088 -2.379 3.728 1.00 25.00 O ATOM 106 ND2 ASN A 7 10.034 -1.352 1.775 1.00 25.00 N ATOM 0 H ASN A 7 13.032 -3.304 1.733 1.00 25.00 H new ATOM 0 HA ASN A 7 11.637 -4.509 2.927 1.00 25.00 H new ATOM 0 HB2 ASN A 7 9.746 -3.554 0.736 1.00 25.00 H new ATOM 0 HB3 ASN A 7 9.179 -4.342 2.195 1.00 25.00 H new ATOM 0 HD21 ASN A 7 10.094 -0.432 2.212 1.00 25.00 H new ATOM 0 HD22 ASN A 7 9.980 -1.431 0.760 1.00 25.00 H new ATOM 113 N VAL A 8 12.213 -6.701 1.458 1.00 25.00 N ATOM 114 CA VAL A 8 12.173 -8.129 1.140 1.00 25.00 C ATOM 115 C VAL A 8 12.283 -8.863 2.465 1.00 25.00 C ATOM 116 O VAL A 8 12.764 -8.301 3.436 1.00 25.00 O ATOM 117 CB VAL A 8 13.317 -8.543 0.133 1.00 25.00 C ATOM 118 CG1 VAL A 8 13.809 -7.342 -0.651 1.00 25.00 C ATOM 119 CG2 VAL A 8 14.496 -9.182 0.843 1.00 25.00 C ATOM 0 H VAL A 8 13.146 -6.340 1.655 1.00 25.00 H new ATOM 0 HA VAL A 8 11.245 -8.388 0.631 1.00 25.00 H new ATOM 0 HB VAL A 8 12.881 -9.275 -0.547 1.00 25.00 H new ATOM 0 HG11 VAL A 8 14.596 -7.653 -1.337 1.00 25.00 H new ATOM 0 HG12 VAL A 8 12.982 -6.914 -1.218 1.00 25.00 H new ATOM 0 HG13 VAL A 8 14.203 -6.594 0.038 1.00 25.00 H new ATOM 0 HG21 VAL A 8 15.259 -9.451 0.112 1.00 25.00 H new ATOM 0 HG22 VAL A 8 14.914 -8.477 1.561 1.00 25.00 H new ATOM 0 HG23 VAL A 8 14.163 -10.078 1.366 1.00 25.00 H new ATOM 129 N LEU A 9 11.855 -10.107 2.516 1.00 25.00 N ATOM 130 CA LEU A 9 11.988 -10.879 3.741 1.00 25.00 C ATOM 131 C LEU A 9 13.254 -11.719 3.662 1.00 25.00 C ATOM 132 O LEU A 9 13.590 -12.251 2.602 1.00 25.00 O ATOM 133 CB LEU A 9 10.772 -11.781 3.942 1.00 25.00 C ATOM 134 CG LEU A 9 9.416 -11.064 4.073 1.00 25.00 C ATOM 135 CD1 LEU A 9 8.319 -12.110 4.247 1.00 25.00 C ATOM 136 CD2 LEU A 9 9.389 -10.096 5.253 1.00 25.00 C ATOM 0 H LEU A 9 11.418 -10.602 1.739 1.00 25.00 H new ATOM 0 HA LEU A 9 12.050 -10.198 4.590 1.00 25.00 H new ATOM 0 HB2 LEU A 9 10.715 -12.474 3.102 1.00 25.00 H new ATOM 0 HB3 LEU A 9 10.932 -12.380 4.839 1.00 25.00 H new ATOM 0 HG LEU A 9 9.253 -10.480 3.167 1.00 25.00 H new ATOM 0 HD11 LEU A 9 7.354 -11.613 4.341 1.00 25.00 H new ATOM 0 HD12 LEU A 9 8.304 -12.770 3.379 1.00 25.00 H new ATOM 0 HD13 LEU A 9 8.514 -12.696 5.145 1.00 25.00 H new ATOM 0 HD21 LEU A 9 8.413 -9.614 5.306 1.00 25.00 H new ATOM 0 HD22 LEU A 9 9.573 -10.644 6.177 1.00 25.00 H new ATOM 0 HD23 LEU A 9 10.161 -9.338 5.120 1.00 25.00 H new ATOM 148 N ALA A 10 13.954 -11.860 4.777 1.00 25.00 N ATOM 149 CA ALA A 10 15.149 -12.687 4.834 1.00 25.00 C ATOM 150 C ALA A 10 15.094 -13.551 6.093 1.00 25.00 C ATOM 151 O ALA A 10 14.665 -13.084 7.146 1.00 25.00 O ATOM 152 CB ALA A 10 16.383 -11.807 4.826 1.00 25.00 C ATOM 0 H ALA A 10 13.713 -11.409 5.660 1.00 25.00 H new ATOM 0 HA ALA A 10 15.198 -13.340 3.962 1.00 25.00 H new ATOM 0 HB1 ALA A 10 17.275 -12.431 4.869 1.00 25.00 H new ATOM 0 HB2 ALA A 10 16.400 -11.212 3.913 1.00 25.00 H new ATOM 0 HB3 ALA A 10 16.362 -11.144 5.691 1.00 25.00 H new ATOM 158 N LYS A 11 15.524 -14.805 5.970 1.00 25.00 N ATOM 159 CA LYS A 11 15.553 -15.733 7.102 1.00 25.00 C ATOM 160 C LYS A 11 16.966 -15.893 7.627 1.00 25.00 C ATOM 161 O LYS A 11 17.902 -16.077 6.849 1.00 25.00 O ATOM 162 CB LYS A 11 15.028 -17.112 6.698 1.00 25.00 C ATOM 163 CG LYS A 11 15.156 -18.160 7.819 1.00 25.00 C ATOM 164 CD LYS A 11 14.272 -19.379 7.618 1.00 25.00 C ATOM 165 CE LYS A 11 12.816 -19.055 7.972 1.00 25.00 C ATOM 166 NZ LYS A 11 11.969 -20.272 8.168 1.00 25.00 N ATOM 0 H LYS A 11 15.859 -15.205 5.093 1.00 25.00 H new ATOM 0 HA LYS A 11 14.913 -15.314 7.879 1.00 25.00 H new ATOM 0 HB2 LYS A 11 13.981 -17.025 6.408 1.00 25.00 H new ATOM 0 HB3 LYS A 11 15.574 -17.459 5.821 1.00 25.00 H new ATOM 0 HG2 LYS A 11 16.195 -18.483 7.886 1.00 25.00 H new ATOM 0 HG3 LYS A 11 14.905 -17.693 8.771 1.00 25.00 H new ATOM 0 HD2 LYS A 11 14.334 -19.713 6.582 1.00 25.00 H new ATOM 0 HD3 LYS A 11 14.629 -20.200 8.240 1.00 25.00 H new ATOM 0 HE2 LYS A 11 12.796 -18.456 8.883 1.00 25.00 H new ATOM 0 HE3 LYS A 11 12.384 -18.444 7.179 1.00 25.00 H new ATOM 0 HZ1 LYS A 11 10.998 -19.985 8.405 1.00 25.00 H new ATOM 0 HZ2 LYS A 11 11.960 -20.834 7.293 1.00 25.00 H new ATOM 0 HZ3 LYS A 11 12.359 -20.845 8.943 1.00 25.00 H new ATOM 180 N ALA A 12 17.105 -15.877 8.939 1.00 25.00 N ATOM 181 CA ALA A 12 18.383 -16.109 9.587 1.00 25.00 C ATOM 182 C ALA A 12 18.768 -17.584 9.482 1.00 25.00 C ATOM 183 O ALA A 12 17.968 -18.456 9.812 1.00 25.00 O ATOM 184 CB ALA A 12 18.273 -15.699 11.048 1.00 25.00 C ATOM 0 H ALA A 12 16.336 -15.703 9.586 1.00 25.00 H new ATOM 0 HA ALA A 12 19.156 -15.518 9.096 1.00 25.00 H new ATOM 0 HB1 ALA A 12 19.227 -15.869 11.546 1.00 25.00 H new ATOM 0 HB2 ALA A 12 18.014 -14.642 11.111 1.00 25.00 H new ATOM 0 HB3 ALA A 12 17.499 -16.292 11.535 1.00 25.00 H new ATOM 190 N LEU A 13 19.987 -17.871 9.054 1.00 25.00 N ATOM 191 CA LEU A 13 20.470 -19.255 9.013 1.00 25.00 C ATOM 192 C LEU A 13 21.146 -19.593 10.331 1.00 25.00 C ATOM 193 O LEU A 13 21.359 -20.752 10.640 1.00 25.00 O ATOM 194 CB LEU A 13 21.514 -19.453 7.917 1.00 25.00 C ATOM 195 CG LEU A 13 21.164 -19.307 6.437 1.00 25.00 C ATOM 196 CD1 LEU A 13 19.711 -19.696 6.104 1.00 25.00 C ATOM 197 CD2 LEU A 13 21.467 -17.909 5.983 1.00 25.00 C ATOM 0 H LEU A 13 20.660 -17.176 8.731 1.00 25.00 H new ATOM 0 HA LEU A 13 19.607 -19.893 8.822 1.00 25.00 H new ATOM 0 HB2 LEU A 13 22.322 -18.751 8.121 1.00 25.00 H new ATOM 0 HB3 LEU A 13 21.922 -20.455 8.047 1.00 25.00 H new ATOM 0 HG LEU A 13 21.786 -20.016 5.890 1.00 25.00 H new ATOM 0 HD11 LEU A 13 19.535 -19.567 5.036 1.00 25.00 H new ATOM 0 HD12 LEU A 13 19.542 -20.738 6.376 1.00 25.00 H new ATOM 0 HD13 LEU A 13 19.026 -19.059 6.664 1.00 25.00 H new ATOM 0 HD21 LEU A 13 21.217 -17.807 4.927 1.00 25.00 H new ATOM 0 HD22 LEU A 13 20.877 -17.201 6.566 1.00 25.00 H new ATOM 0 HD23 LEU A 13 22.528 -17.702 6.126 1.00 25.00 H new ATOM 209 N TYR A 14 21.525 -18.564 11.068 1.00 25.00 N ATOM 210 CA TYR A 14 22.273 -18.717 12.306 1.00 25.00 C ATOM 211 C TYR A 14 21.797 -17.672 13.296 1.00 25.00 C ATOM 212 O TYR A 14 21.178 -16.686 12.897 1.00 25.00 O ATOM 213 CB TYR A 14 23.768 -18.502 12.049 1.00 25.00 C ATOM 214 CG TYR A 14 24.326 -19.398 10.966 1.00 25.00 C ATOM 215 CD1 TYR A 14 24.717 -20.723 11.247 1.00 25.00 C ATOM 216 CD2 TYR A 14 24.449 -18.934 9.639 1.00 25.00 C ATOM 217 CE1 TYR A 14 25.218 -21.565 10.222 1.00 25.00 C ATOM 218 CE2 TYR A 14 24.939 -19.782 8.612 1.00 25.00 C ATOM 219 CZ TYR A 14 25.314 -21.089 8.918 1.00 25.00 C ATOM 220 OH TYR A 14 25.791 -21.903 7.931 1.00 25.00 O ATOM 0 H TYR A 14 21.322 -17.594 10.825 1.00 25.00 H new ATOM 0 HA TYR A 14 22.114 -19.721 12.699 1.00 25.00 H new ATOM 0 HB2 TYR A 14 23.935 -17.461 11.771 1.00 25.00 H new ATOM 0 HB3 TYR A 14 24.317 -18.677 12.974 1.00 25.00 H new ATOM 0 HD1 TYR A 14 24.634 -21.101 12.255 1.00 25.00 H new ATOM 0 HD2 TYR A 14 24.166 -17.919 9.402 1.00 25.00 H new ATOM 0 HE1 TYR A 14 25.525 -22.574 10.453 1.00 25.00 H new ATOM 0 HE2 TYR A 14 25.021 -19.417 7.599 1.00 25.00 H new ATOM 0 HH TYR A 14 25.793 -21.418 7.079 1.00 25.00 H new ATOM 230 N ASP A 15 22.123 -17.859 14.561 1.00 25.00 N ATOM 231 CA ASP A 15 21.827 -16.861 15.586 1.00 25.00 C ATOM 232 C ASP A 15 22.732 -15.660 15.367 1.00 25.00 C ATOM 233 O ASP A 15 23.837 -15.787 14.820 1.00 25.00 O ATOM 234 CB ASP A 15 22.121 -17.413 16.989 1.00 25.00 C ATOM 235 CG ASP A 15 21.016 -18.302 17.520 1.00 25.00 C ATOM 236 OD1 ASP A 15 20.232 -18.867 16.723 1.00 25.00 O ATOM 237 OD2 ASP A 15 20.912 -18.434 18.749 1.00 25.00 O ATOM 0 H ASP A 15 22.594 -18.694 14.910 1.00 25.00 H new ATOM 0 HA ASP A 15 20.773 -16.592 15.514 1.00 25.00 H new ATOM 0 HB2 ASP A 15 23.053 -17.978 16.963 1.00 25.00 H new ATOM 0 HB3 ASP A 15 22.272 -16.581 17.676 1.00 25.00 H new ATOM 242 N ASN A 16 22.314 -14.506 15.859 1.00 25.00 N ATOM 243 CA ASN A 16 23.179 -13.336 15.882 1.00 25.00 C ATOM 244 C ASN A 16 22.991 -12.612 17.194 1.00 25.00 C ATOM 245 O ASN A 16 21.871 -12.327 17.593 1.00 25.00 O ATOM 246 CB ASN A 16 22.885 -12.380 14.732 1.00 25.00 C ATOM 247 CG ASN A 16 24.020 -11.413 14.500 1.00 25.00 C ATOM 248 OD1 ASN A 16 25.153 -11.828 14.282 1.00 25.00 O ATOM 249 ND2 ASN A 16 23.746 -10.141 14.586 1.00 25.00 N ATOM 0 H ASN A 16 21.383 -14.353 16.247 1.00 25.00 H new ATOM 0 HA ASN A 16 24.208 -13.678 15.771 1.00 25.00 H new ATOM 0 HB2 ASN A 16 22.703 -12.952 13.822 1.00 25.00 H new ATOM 0 HB3 ASN A 16 21.972 -11.824 14.946 1.00 25.00 H new ATOM 0 HD21 ASN A 16 24.488 -9.451 14.471 1.00 25.00 H new ATOM 0 HD22 ASN A 16 22.790 -9.836 14.769 1.00 25.00 H new ATOM 256 N VAL A 17 24.096 -12.282 17.834 1.00 25.00 N ATOM 257 CA VAL A 17 24.078 -11.489 19.046 1.00 25.00 C ATOM 258 C VAL A 17 24.617 -10.152 18.598 1.00 25.00 C ATOM 259 O VAL A 17 25.663 -10.083 17.958 1.00 25.00 O ATOM 260 CB VAL A 17 24.965 -12.103 20.160 1.00 25.00 C ATOM 261 CG1 VAL A 17 24.974 -11.203 21.410 1.00 25.00 C ATOM 262 CG2 VAL A 17 24.449 -13.504 20.530 1.00 25.00 C ATOM 0 H VAL A 17 25.030 -12.556 17.528 1.00 25.00 H new ATOM 0 HA VAL A 17 23.082 -11.428 19.485 1.00 25.00 H new ATOM 0 HB VAL A 17 25.985 -12.181 19.783 1.00 25.00 H new ATOM 0 HG11 VAL A 17 25.602 -11.654 22.178 1.00 25.00 H new ATOM 0 HG12 VAL A 17 25.368 -10.221 21.148 1.00 25.00 H new ATOM 0 HG13 VAL A 17 23.958 -11.097 21.789 1.00 25.00 H new ATOM 0 HG21 VAL A 17 25.078 -13.928 21.313 1.00 25.00 H new ATOM 0 HG22 VAL A 17 23.422 -13.431 20.889 1.00 25.00 H new ATOM 0 HG23 VAL A 17 24.481 -14.147 19.651 1.00 25.00 H new ATOM 272 N ALA A 18 23.849 -9.113 18.857 1.00 25.00 N ATOM 273 CA ALA A 18 24.220 -7.777 18.454 1.00 25.00 C ATOM 274 C ALA A 18 25.365 -7.301 19.344 1.00 25.00 C ATOM 275 O ALA A 18 25.260 -7.328 20.571 1.00 25.00 O ATOM 276 CB ALA A 18 23.017 -6.847 18.575 1.00 25.00 C ATOM 0 H ALA A 18 22.957 -9.172 19.349 1.00 25.00 H new ATOM 0 HA ALA A 18 24.546 -7.773 17.414 1.00 25.00 H new ATOM 0 HB1 ALA A 18 23.303 -5.841 18.270 1.00 25.00 H new ATOM 0 HB2 ALA A 18 22.213 -7.206 17.933 1.00 25.00 H new ATOM 0 HB3 ALA A 18 22.674 -6.829 19.609 1.00 25.00 H new ATOM 282 N GLU A 19 26.453 -6.893 18.713 1.00 25.00 N ATOM 283 CA GLU A 19 27.638 -6.407 19.432 1.00 25.00 C ATOM 284 C GLU A 19 27.725 -4.899 19.269 1.00 25.00 C ATOM 285 O GLU A 19 28.368 -4.203 20.049 1.00 25.00 O ATOM 286 CB GLU A 19 28.892 -7.059 18.846 1.00 25.00 C ATOM 287 CG GLU A 19 28.914 -8.575 19.012 1.00 25.00 C ATOM 288 CD GLU A 19 30.143 -9.222 18.383 1.00 25.00 C ATOM 289 OE1 GLU A 19 31.271 -8.911 18.803 1.00 25.00 O ATOM 290 OE2 GLU A 19 29.967 -10.057 17.465 1.00 25.00 O ATOM 0 H GLU A 19 26.549 -6.886 17.698 1.00 25.00 H new ATOM 0 HA GLU A 19 27.562 -6.661 20.489 1.00 25.00 H new ATOM 0 HB2 GLU A 19 28.959 -6.815 17.786 1.00 25.00 H new ATOM 0 HB3 GLU A 19 29.773 -6.634 19.327 1.00 25.00 H new ATOM 0 HG2 GLU A 19 28.884 -8.820 20.074 1.00 25.00 H new ATOM 0 HG3 GLU A 19 28.016 -8.998 18.562 1.00 25.00 H new ATOM 297 N SER A 20 27.042 -4.406 18.249 1.00 25.00 N ATOM 298 CA SER A 20 27.035 -2.982 17.933 1.00 25.00 C ATOM 299 C SER A 20 25.679 -2.381 18.272 1.00 25.00 C ATOM 300 O SER A 20 24.661 -3.075 18.223 1.00 25.00 O ATOM 301 CB SER A 20 27.330 -2.813 16.445 1.00 25.00 C ATOM 302 OG SER A 20 28.352 -3.705 16.054 1.00 25.00 O ATOM 0 H SER A 20 26.479 -4.976 17.618 1.00 25.00 H new ATOM 0 HA SER A 20 27.795 -2.466 18.520 1.00 25.00 H new ATOM 0 HB2 SER A 20 26.428 -3.002 15.863 1.00 25.00 H new ATOM 0 HB3 SER A 20 27.633 -1.786 16.240 1.00 25.00 H new ATOM 0 HG SER A 20 28.536 -3.593 15.098 1.00 25.00 H new ATOM 308 N PRO A 21 25.634 -1.076 18.590 1.00 25.00 N ATOM 309 CA PRO A 21 24.343 -0.461 18.920 1.00 25.00 C ATOM 310 C PRO A 21 23.428 -0.329 17.701 1.00 25.00 C ATOM 311 O PRO A 21 22.225 -0.104 17.831 1.00 25.00 O ATOM 312 CB PRO A 21 24.751 0.912 19.467 1.00 25.00 C ATOM 313 CG PRO A 21 26.037 1.206 18.775 1.00 25.00 C ATOM 314 CD PRO A 21 26.738 -0.102 18.677 1.00 25.00 C ATOM 0 HA PRO A 21 23.763 -1.057 19.624 1.00 25.00 H new ATOM 0 HB2 PRO A 21 23.998 1.669 19.249 1.00 25.00 H new ATOM 0 HB3 PRO A 21 24.876 0.890 20.550 1.00 25.00 H new ATOM 0 HG2 PRO A 21 25.863 1.634 17.788 1.00 25.00 H new ATOM 0 HG3 PRO A 21 26.629 1.929 19.336 1.00 25.00 H new ATOM 0 HD2 PRO A 21 27.384 -0.147 17.800 1.00 25.00 H new ATOM 0 HD3 PRO A 21 27.369 -0.286 19.547 1.00 25.00 H new ATOM 322 N ASP A 22 23.999 -0.506 16.519 1.00 25.00 N ATOM 323 CA ASP A 22 23.252 -0.424 15.275 1.00 25.00 C ATOM 324 C ASP A 22 22.844 -1.800 14.795 1.00 25.00 C ATOM 325 O ASP A 22 22.223 -1.917 13.768 1.00 25.00 O ATOM 326 CB ASP A 22 24.127 0.208 14.190 1.00 25.00 C ATOM 327 CG ASP A 22 24.377 1.673 14.433 1.00 25.00 C ATOM 328 OD1 ASP A 22 23.644 2.494 13.847 1.00 25.00 O ATOM 329 OD2 ASP A 22 25.270 2.003 15.239 1.00 25.00 O ATOM 0 H ASP A 22 24.991 -0.710 16.396 1.00 25.00 H new ATOM 0 HA ASP A 22 22.363 0.178 15.460 1.00 25.00 H new ATOM 0 HB2 ASP A 22 25.081 -0.318 14.145 1.00 25.00 H new ATOM 0 HB3 ASP A 22 23.646 0.081 13.220 1.00 25.00 H new ATOM 334 N GLU A 23 23.250 -2.846 15.495 1.00 25.00 N ATOM 335 CA GLU A 23 23.065 -4.219 15.014 1.00 25.00 C ATOM 336 C GLU A 23 21.823 -4.882 15.619 1.00 25.00 C ATOM 337 O GLU A 23 21.439 -4.599 16.752 1.00 25.00 O ATOM 338 CB GLU A 23 24.326 -5.032 15.350 1.00 25.00 C ATOM 339 CG GLU A 23 24.409 -6.387 14.669 1.00 25.00 C ATOM 340 CD GLU A 23 25.687 -7.137 14.994 1.00 25.00 C ATOM 341 OE1 GLU A 23 25.912 -8.200 14.375 1.00 25.00 O ATOM 342 OE2 GLU A 23 26.448 -6.707 15.891 1.00 25.00 O ATOM 0 H GLU A 23 23.712 -2.778 16.402 1.00 25.00 H new ATOM 0 HA GLU A 23 22.909 -4.190 13.936 1.00 25.00 H new ATOM 0 HB2 GLU A 23 25.203 -4.447 15.073 1.00 25.00 H new ATOM 0 HB3 GLU A 23 24.369 -5.180 16.429 1.00 25.00 H new ATOM 0 HG2 GLU A 23 23.553 -6.991 14.970 1.00 25.00 H new ATOM 0 HG3 GLU A 23 24.339 -6.250 13.590 1.00 25.00 H new ATOM 349 N LEU A 24 21.210 -5.785 14.863 1.00 25.00 N ATOM 350 CA LEU A 24 20.072 -6.551 15.355 1.00 25.00 C ATOM 351 C LEU A 24 20.490 -7.903 15.906 1.00 25.00 C ATOM 352 O LEU A 24 21.370 -8.577 15.370 1.00 25.00 O ATOM 353 CB LEU A 24 19.059 -6.797 14.237 1.00 25.00 C ATOM 354 CG LEU A 24 18.286 -5.560 13.757 1.00 25.00 C ATOM 355 CD1 LEU A 24 17.397 -5.941 12.588 1.00 25.00 C ATOM 356 CD2 LEU A 24 17.445 -4.959 14.881 1.00 25.00 C ATOM 0 H LEU A 24 21.483 -6.005 13.905 1.00 25.00 H new ATOM 0 HA LEU A 24 19.627 -5.957 16.153 1.00 25.00 H new ATOM 0 HB2 LEU A 24 19.584 -7.229 13.385 1.00 25.00 H new ATOM 0 HB3 LEU A 24 18.341 -7.542 14.580 1.00 25.00 H new ATOM 0 HG LEU A 24 19.006 -4.806 13.441 1.00 25.00 H new ATOM 0 HD11 LEU A 24 16.848 -5.063 12.247 1.00 25.00 H new ATOM 0 HD12 LEU A 24 18.012 -6.324 11.773 1.00 25.00 H new ATOM 0 HD13 LEU A 24 16.692 -6.710 12.903 1.00 25.00 H new ATOM 0 HD21 LEU A 24 16.911 -4.085 14.508 1.00 25.00 H new ATOM 0 HD22 LEU A 24 16.728 -5.700 15.235 1.00 25.00 H new ATOM 0 HD23 LEU A 24 18.096 -4.663 15.704 1.00 25.00 H new ATOM 368 N SER A 25 19.793 -8.324 16.944 1.00 25.00 N ATOM 369 CA SER A 25 19.997 -9.624 17.550 1.00 25.00 C ATOM 370 C SER A 25 18.777 -10.469 17.230 1.00 25.00 C ATOM 371 O SER A 25 17.646 -10.012 17.355 1.00 25.00 O ATOM 372 CB SER A 25 20.152 -9.473 19.058 1.00 25.00 C ATOM 373 OG SER A 25 19.306 -8.443 19.547 1.00 25.00 O ATOM 0 H SER A 25 19.064 -7.769 17.393 1.00 25.00 H new ATOM 0 HA SER A 25 20.900 -10.096 17.163 1.00 25.00 H new ATOM 0 HB2 SER A 25 19.909 -10.415 19.550 1.00 25.00 H new ATOM 0 HB3 SER A 25 21.190 -9.245 19.301 1.00 25.00 H new ATOM 0 HG SER A 25 19.417 -8.361 20.517 1.00 25.00 H new ATOM 379 N PHE A 26 19.029 -11.689 16.793 1.00 25.00 N ATOM 380 CA PHE A 26 17.965 -12.627 16.424 1.00 25.00 C ATOM 381 C PHE A 26 18.417 -14.087 16.503 1.00 25.00 C ATOM 382 O PHE A 26 19.597 -14.384 16.699 1.00 25.00 O ATOM 383 CB PHE A 26 17.478 -12.327 15.006 1.00 25.00 C ATOM 384 CG PHE A 26 18.575 -12.246 13.998 1.00 25.00 C ATOM 385 CD1 PHE A 26 19.001 -10.996 13.520 1.00 25.00 C ATOM 386 CD2 PHE A 26 19.188 -13.416 13.499 1.00 25.00 C ATOM 387 CE1 PHE A 26 20.012 -10.910 12.557 1.00 25.00 C ATOM 388 CE2 PHE A 26 20.210 -13.335 12.533 1.00 25.00 C ATOM 389 CZ PHE A 26 20.617 -12.091 12.057 1.00 25.00 C ATOM 0 H PHE A 26 19.971 -12.064 16.681 1.00 25.00 H new ATOM 0 HA PHE A 26 17.156 -12.491 17.142 1.00 25.00 H new ATOM 0 HB2 PHE A 26 16.774 -13.102 14.702 1.00 25.00 H new ATOM 0 HB3 PHE A 26 16.931 -11.384 15.011 1.00 25.00 H new ATOM 0 HD1 PHE A 26 18.544 -10.094 13.899 1.00 25.00 H new ATOM 0 HD2 PHE A 26 18.870 -14.382 13.861 1.00 25.00 H new ATOM 0 HE1 PHE A 26 20.332 -9.944 12.194 1.00 25.00 H new ATOM 0 HE2 PHE A 26 20.677 -14.236 12.162 1.00 25.00 H new ATOM 0 HZ PHE A 26 21.392 -12.026 11.308 1.00 25.00 H new ATOM 399 N ARG A 27 17.462 -14.989 16.337 1.00 25.00 N ATOM 400 CA ARG A 27 17.685 -16.433 16.410 1.00 25.00 C ATOM 401 C ARG A 27 17.701 -17.016 14.998 1.00 25.00 C ATOM 402 O ARG A 27 17.091 -16.469 14.087 1.00 25.00 O ATOM 403 CB ARG A 27 16.510 -17.034 17.205 1.00 25.00 C ATOM 404 CG ARG A 27 16.638 -18.495 17.660 1.00 25.00 C ATOM 405 CD ARG A 27 17.516 -18.635 18.902 1.00 25.00 C ATOM 406 NE ARG A 27 17.403 -19.989 19.487 1.00 25.00 N ATOM 407 CZ ARG A 27 18.246 -21.001 19.288 1.00 25.00 C ATOM 408 NH1 ARG A 27 19.311 -20.910 18.543 1.00 25.00 N ATOM 409 NH2 ARG A 27 17.996 -22.141 19.863 1.00 25.00 N ATOM 0 H ARG A 27 16.492 -14.738 16.144 1.00 25.00 H new ATOM 0 HA ARG A 27 18.636 -16.659 16.892 1.00 25.00 H new ATOM 0 HB2 ARG A 27 16.353 -16.418 18.090 1.00 25.00 H new ATOM 0 HB3 ARG A 27 15.611 -16.949 16.594 1.00 25.00 H new ATOM 0 HG2 ARG A 27 15.647 -18.897 17.870 1.00 25.00 H new ATOM 0 HG3 ARG A 27 17.059 -19.091 16.850 1.00 25.00 H new ATOM 0 HD2 ARG A 27 18.555 -18.434 18.641 1.00 25.00 H new ATOM 0 HD3 ARG A 27 17.224 -17.890 19.643 1.00 25.00 H new ATOM 0 HE ARG A 27 16.606 -20.164 20.099 1.00 25.00 H new ATOM 0 HH11 ARG A 27 19.534 -20.030 18.077 1.00 25.00 H new ATOM 0 HH12 ARG A 27 19.922 -21.718 18.426 1.00 25.00 H new ATOM 0 HH21 ARG A 27 17.169 -22.245 20.451 1.00 25.00 H new ATOM 0 HH22 ARG A 27 18.627 -22.931 19.726 1.00 25.00 H new ATOM 423 N LYS A 28 18.328 -18.168 14.836 1.00 25.00 N ATOM 424 CA LYS A 28 18.238 -18.936 13.601 1.00 25.00 C ATOM 425 C LYS A 28 16.765 -19.191 13.302 1.00 25.00 C ATOM 426 O LYS A 28 16.004 -19.604 14.175 1.00 25.00 O ATOM 427 CB LYS A 28 18.978 -20.266 13.780 1.00 25.00 C ATOM 428 CG LYS A 28 18.839 -21.215 12.606 1.00 25.00 C ATOM 429 CD LYS A 28 19.698 -22.453 12.804 1.00 25.00 C ATOM 430 CE LYS A 28 19.612 -23.360 11.588 1.00 25.00 C ATOM 431 NZ LYS A 28 20.556 -24.477 11.738 1.00 25.00 N ATOM 0 H LYS A 28 18.913 -18.598 15.553 1.00 25.00 H new ATOM 0 HA LYS A 28 18.692 -18.389 12.774 1.00 25.00 H new ATOM 0 HB2 LYS A 28 20.036 -20.061 13.945 1.00 25.00 H new ATOM 0 HB3 LYS A 28 18.605 -20.759 14.678 1.00 25.00 H new ATOM 0 HG2 LYS A 28 17.795 -21.507 12.491 1.00 25.00 H new ATOM 0 HG3 LYS A 28 19.132 -20.708 11.687 1.00 25.00 H new ATOM 0 HD2 LYS A 28 20.734 -22.161 12.974 1.00 25.00 H new ATOM 0 HD3 LYS A 28 19.369 -22.993 13.692 1.00 25.00 H new ATOM 0 HE2 LYS A 28 18.597 -23.741 11.477 1.00 25.00 H new ATOM 0 HE3 LYS A 28 19.841 -22.796 10.684 1.00 25.00 H new ATOM 0 HZ1 LYS A 28 20.496 -25.097 10.905 1.00 25.00 H new ATOM 0 HZ2 LYS A 28 21.523 -24.105 11.824 1.00 25.00 H new ATOM 0 HZ3 LYS A 28 20.318 -25.021 12.592 1.00 25.00 H new ATOM 445 N GLY A 29 16.376 -18.938 12.063 1.00 25.00 N ATOM 446 CA GLY A 29 15.010 -19.157 11.630 1.00 25.00 C ATOM 447 C GLY A 29 14.138 -17.921 11.695 1.00 25.00 C ATOM 448 O GLY A 29 13.022 -17.947 11.183 1.00 25.00 O ATOM 0 H GLY A 29 16.994 -18.578 11.336 1.00 25.00 H new ATOM 0 HA2 GLY A 29 15.020 -19.529 10.605 1.00 25.00 H new ATOM 0 HA3 GLY A 29 14.564 -19.937 12.248 1.00 25.00 H new ATOM 452 N ASP A 30 14.631 -16.843 12.293 1.00 25.00 N ATOM 453 CA ASP A 30 13.853 -15.611 12.431 1.00 25.00 C ATOM 454 C ASP A 30 13.736 -14.916 11.074 1.00 25.00 C ATOM 455 O ASP A 30 14.536 -15.183 10.170 1.00 25.00 O ATOM 456 CB ASP A 30 14.531 -14.674 13.435 1.00 25.00 C ATOM 457 CG ASP A 30 13.551 -13.799 14.170 1.00 25.00 C ATOM 458 OD1 ASP A 30 12.387 -13.677 13.732 1.00 25.00 O ATOM 459 OD2 ASP A 30 13.945 -13.268 15.225 1.00 25.00 O ATOM 0 H ASP A 30 15.568 -16.794 12.692 1.00 25.00 H new ATOM 0 HA ASP A 30 12.856 -15.860 12.793 1.00 25.00 H new ATOM 0 HB2 ASP A 30 15.093 -15.267 14.156 1.00 25.00 H new ATOM 0 HB3 ASP A 30 15.250 -14.045 12.910 1.00 25.00 H new ATOM 464 N ILE A 31 12.758 -14.030 10.939 1.00 25.00 N ATOM 465 CA ILE A 31 12.508 -13.308 9.691 1.00 25.00 C ATOM 466 C ILE A 31 12.590 -11.810 9.921 1.00 25.00 C ATOM 467 O ILE A 31 11.847 -11.254 10.720 1.00 25.00 O ATOM 468 CB ILE A 31 11.083 -13.601 9.124 1.00 25.00 C ATOM 469 CG1 ILE A 31 10.891 -15.097 8.847 1.00 25.00 C ATOM 470 CG2 ILE A 31 10.839 -12.789 7.816 1.00 25.00 C ATOM 471 CD1 ILE A 31 11.873 -15.707 7.869 1.00 25.00 C ATOM 0 H ILE A 31 12.113 -13.789 11.691 1.00 25.00 H new ATOM 0 HA ILE A 31 13.266 -13.645 8.984 1.00 25.00 H new ATOM 0 HB ILE A 31 10.358 -13.294 9.878 1.00 25.00 H new ATOM 0 HG12 ILE A 31 10.962 -15.636 9.792 1.00 25.00 H new ATOM 0 HG13 ILE A 31 9.881 -15.252 8.467 1.00 25.00 H new ATOM 0 HG21 ILE A 31 9.841 -13.005 7.434 1.00 25.00 H new ATOM 0 HG22 ILE A 31 10.923 -11.723 8.028 1.00 25.00 H new ATOM 0 HG23 ILE A 31 11.582 -13.070 7.069 1.00 25.00 H new ATOM 0 HD11 ILE A 31 11.651 -16.767 7.743 1.00 25.00 H new ATOM 0 HD12 ILE A 31 11.789 -15.202 6.907 1.00 25.00 H new ATOM 0 HD13 ILE A 31 12.887 -15.592 8.252 1.00 25.00 H new ATOM 483 N MET A 32 13.449 -11.154 9.165 1.00 25.00 N ATOM 484 CA MET A 32 13.568 -9.704 9.216 1.00 25.00 C ATOM 485 C MET A 32 13.335 -9.121 7.838 1.00 25.00 C ATOM 486 O MET A 32 13.577 -9.770 6.810 1.00 25.00 O ATOM 487 CB MET A 32 14.938 -9.298 9.751 1.00 25.00 C ATOM 488 CG MET A 32 16.102 -9.904 9.002 1.00 25.00 C ATOM 489 SD MET A 32 17.369 -10.436 10.154 1.00 25.00 S ATOM 490 CE MET A 32 16.596 -11.918 10.896 1.00 25.00 C ATOM 0 H MET A 32 14.081 -11.604 8.502 1.00 25.00 H new ATOM 0 HA MET A 32 12.812 -9.310 9.895 1.00 25.00 H new ATOM 0 HB2 MET A 32 15.023 -8.212 9.713 1.00 25.00 H new ATOM 0 HB3 MET A 32 15.006 -9.587 10.800 1.00 25.00 H new ATOM 0 HG2 MET A 32 15.760 -10.752 8.409 1.00 25.00 H new ATOM 0 HG3 MET A 32 16.516 -9.174 8.306 1.00 25.00 H new ATOM 0 HE1 MET A 32 16.670 -11.862 11.982 1.00 25.00 H new ATOM 0 HE2 MET A 32 15.546 -11.965 10.606 1.00 25.00 H new ATOM 0 HE3 MET A 32 17.110 -12.812 10.543 1.00 25.00 H new ATOM 500 N THR A 33 12.852 -7.894 7.829 1.00 25.00 N ATOM 501 CA THR A 33 12.574 -7.169 6.591 1.00 25.00 C ATOM 502 C THR A 33 13.817 -6.424 6.151 1.00 25.00 C ATOM 503 O THR A 33 14.243 -5.508 6.832 1.00 25.00 O ATOM 504 CB THR A 33 11.444 -6.142 6.816 1.00 25.00 C ATOM 505 OG1 THR A 33 10.259 -6.824 7.232 1.00 25.00 O ATOM 506 CG2 THR A 33 11.141 -5.371 5.559 1.00 25.00 C ATOM 0 H THR A 33 12.639 -7.366 8.676 1.00 25.00 H new ATOM 0 HA THR A 33 12.271 -7.887 5.829 1.00 25.00 H new ATOM 0 HB THR A 33 11.776 -5.441 7.582 1.00 25.00 H new ATOM 0 HG1 THR A 33 9.541 -6.173 7.377 1.00 25.00 H new ATOM 0 HG21 THR A 33 10.341 -4.657 5.754 1.00 25.00 H new ATOM 0 HG22 THR A 33 12.034 -4.836 5.236 1.00 25.00 H new ATOM 0 HG23 THR A 33 10.829 -6.061 4.775 1.00 25.00 H new ATOM 514 N VAL A 34 14.413 -6.817 5.038 1.00 25.00 N ATOM 515 CA VAL A 34 15.618 -6.158 4.534 1.00 25.00 C ATOM 516 C VAL A 34 15.213 -4.889 3.827 1.00 25.00 C ATOM 517 O VAL A 34 14.421 -4.916 2.892 1.00 25.00 O ATOM 518 CB VAL A 34 16.401 -7.051 3.558 1.00 25.00 C ATOM 519 CG1 VAL A 34 17.729 -6.397 3.140 1.00 25.00 C ATOM 520 CG2 VAL A 34 16.672 -8.398 4.192 1.00 25.00 C ATOM 0 H VAL A 34 14.085 -7.591 4.461 1.00 25.00 H new ATOM 0 HA VAL A 34 16.269 -5.946 5.382 1.00 25.00 H new ATOM 0 HB VAL A 34 15.792 -7.184 2.664 1.00 25.00 H new ATOM 0 HG11 VAL A 34 18.257 -7.055 2.450 1.00 25.00 H new ATOM 0 HG12 VAL A 34 17.527 -5.444 2.650 1.00 25.00 H new ATOM 0 HG13 VAL A 34 18.345 -6.228 4.023 1.00 25.00 H new ATOM 0 HG21 VAL A 34 17.227 -9.024 3.493 1.00 25.00 H new ATOM 0 HG22 VAL A 34 17.258 -8.261 5.101 1.00 25.00 H new ATOM 0 HG23 VAL A 34 15.726 -8.881 4.439 1.00 25.00 H new ATOM 530 N LEU A 35 15.736 -3.776 4.299 1.00 25.00 N ATOM 531 CA LEU A 35 15.410 -2.467 3.766 1.00 25.00 C ATOM 532 C LEU A 35 16.427 -2.074 2.705 1.00 25.00 C ATOM 533 O LEU A 35 16.056 -1.597 1.643 1.00 25.00 O ATOM 534 CB LEU A 35 15.415 -1.455 4.900 1.00 25.00 C ATOM 535 CG LEU A 35 14.380 -1.742 5.994 1.00 25.00 C ATOM 536 CD1 LEU A 35 14.658 -0.839 7.151 1.00 25.00 C ATOM 537 CD2 LEU A 35 12.961 -1.545 5.489 1.00 25.00 C ATOM 0 H LEU A 35 16.404 -3.753 5.069 1.00 25.00 H new ATOM 0 HA LEU A 35 14.422 -2.491 3.307 1.00 25.00 H new ATOM 0 HB2 LEU A 35 16.408 -1.433 5.350 1.00 25.00 H new ATOM 0 HB3 LEU A 35 15.229 -0.463 4.489 1.00 25.00 H new ATOM 0 HG LEU A 35 14.463 -2.785 6.301 1.00 25.00 H new ATOM 0 HD11 LEU A 35 13.932 -1.027 7.942 1.00 25.00 H new ATOM 0 HD12 LEU A 35 15.663 -1.030 7.528 1.00 25.00 H new ATOM 0 HD13 LEU A 35 14.582 0.199 6.828 1.00 25.00 H new ATOM 0 HD21 LEU A 35 12.256 -1.758 6.293 1.00 25.00 H new ATOM 0 HD22 LEU A 35 12.833 -0.515 5.157 1.00 25.00 H new ATOM 0 HD23 LEU A 35 12.775 -2.221 4.654 1.00 25.00 H new ATOM 549 N GLU A 36 17.696 -2.331 2.969 1.00 25.00 N ATOM 550 CA GLU A 36 18.742 -2.125 1.968 1.00 25.00 C ATOM 551 C GLU A 36 19.900 -3.052 2.314 1.00 25.00 C ATOM 552 O GLU A 36 19.906 -3.660 3.381 1.00 25.00 O ATOM 553 CB GLU A 36 19.211 -0.663 1.909 1.00 25.00 C ATOM 554 CG GLU A 36 20.044 -0.227 3.039 1.00 25.00 C ATOM 555 CD GLU A 36 20.485 1.218 2.927 1.00 25.00 C ATOM 556 OE1 GLU A 36 20.404 1.940 3.942 1.00 25.00 O ATOM 557 OE2 GLU A 36 20.953 1.618 1.849 1.00 25.00 O ATOM 0 H GLU A 36 18.032 -2.683 3.865 1.00 25.00 H new ATOM 0 HA GLU A 36 18.345 -2.354 0.979 1.00 25.00 H new ATOM 0 HB2 GLU A 36 19.772 -0.515 0.986 1.00 25.00 H new ATOM 0 HB3 GLU A 36 18.334 -0.019 1.855 1.00 25.00 H new ATOM 0 HG2 GLU A 36 19.487 -0.360 3.966 1.00 25.00 H new ATOM 0 HG3 GLU A 36 20.925 -0.866 3.102 1.00 25.00 H new ATOM 564 N ARG A 37 20.880 -3.157 1.428 1.00 25.00 N ATOM 565 CA ARG A 37 22.065 -3.976 1.673 1.00 25.00 C ATOM 566 C ARG A 37 23.268 -3.081 1.510 1.00 25.00 C ATOM 567 O ARG A 37 23.197 -2.119 0.762 1.00 25.00 O ATOM 568 CB ARG A 37 22.164 -5.104 0.659 1.00 25.00 C ATOM 569 CG ARG A 37 20.985 -6.058 0.641 1.00 25.00 C ATOM 570 CD ARG A 37 21.274 -7.273 -0.259 1.00 25.00 C ATOM 571 NE ARG A 37 21.619 -6.867 -1.641 1.00 25.00 N ATOM 572 CZ ARG A 37 22.857 -6.709 -2.116 1.00 25.00 C ATOM 573 NH1 ARG A 37 23.925 -6.943 -1.399 1.00 25.00 N ATOM 574 NH2 ARG A 37 23.017 -6.292 -3.337 1.00 25.00 N ATOM 0 H ARG A 37 20.880 -2.682 0.525 1.00 25.00 H new ATOM 0 HA ARG A 37 22.010 -4.412 2.671 1.00 25.00 H new ATOM 0 HB2 ARG A 37 22.275 -4.670 -0.335 1.00 25.00 H new ATOM 0 HB3 ARG A 37 23.070 -5.675 0.861 1.00 25.00 H new ATOM 0 HG2 ARG A 37 20.769 -6.395 1.655 1.00 25.00 H new ATOM 0 HG3 ARG A 37 20.097 -5.538 0.282 1.00 25.00 H new ATOM 0 HD2 ARG A 37 22.095 -7.852 0.165 1.00 25.00 H new ATOM 0 HD3 ARG A 37 20.401 -7.925 -0.279 1.00 25.00 H new ATOM 0 HE ARG A 37 20.846 -6.694 -2.284 1.00 25.00 H new ATOM 0 HH11 ARG A 37 23.832 -7.260 -0.434 1.00 25.00 H new ATOM 0 HH12 ARG A 37 24.851 -6.808 -1.805 1.00 25.00 H new ATOM 0 HH21 ARG A 37 22.203 -6.090 -3.918 1.00 25.00 H new ATOM 0 HH22 ARG A 37 23.956 -6.166 -3.714 1.00 25.00 H new ATOM 588 N ASP A 38 24.349 -3.431 2.198 1.00 25.00 N ATOM 589 CA ASP A 38 25.632 -2.726 2.119 1.00 25.00 C ATOM 590 C ASP A 38 25.406 -1.260 2.523 1.00 25.00 C ATOM 591 O ASP A 38 25.962 -0.308 1.970 1.00 25.00 O ATOM 592 CB ASP A 38 26.247 -2.938 0.732 1.00 25.00 C ATOM 593 CG ASP A 38 26.202 -4.416 0.307 1.00 25.00 C ATOM 594 OD1 ASP A 38 25.748 -4.698 -0.829 1.00 25.00 O ATOM 595 OD2 ASP A 38 26.498 -5.304 1.150 1.00 25.00 O ATOM 0 H ASP A 38 24.363 -4.225 2.838 1.00 25.00 H new ATOM 0 HA ASP A 38 26.369 -3.123 2.818 1.00 25.00 H new ATOM 0 HB2 ASP A 38 25.711 -2.333 0.001 1.00 25.00 H new ATOM 0 HB3 ASP A 38 27.281 -2.592 0.736 1.00 25.00 H new ATOM 600 N THR A 39 24.514 -1.129 3.497 1.00 25.00 N ATOM 601 CA THR A 39 24.045 0.155 4.015 1.00 25.00 C ATOM 602 C THR A 39 25.173 0.926 4.669 1.00 25.00 C ATOM 603 O THR A 39 26.071 0.336 5.235 1.00 25.00 O ATOM 604 CB THR A 39 22.926 -0.076 5.047 1.00 25.00 C ATOM 605 OG1 THR A 39 22.479 1.171 5.588 1.00 25.00 O ATOM 606 CG2 THR A 39 23.359 -0.976 6.166 1.00 25.00 C ATOM 0 H THR A 39 24.085 -1.930 3.961 1.00 25.00 H new ATOM 0 HA THR A 39 23.665 0.738 3.176 1.00 25.00 H new ATOM 0 HB THR A 39 22.108 -0.566 4.519 1.00 25.00 H new ATOM 0 HG1 THR A 39 21.735 1.513 5.050 1.00 25.00 H new ATOM 0 HG21 THR A 39 22.535 -1.107 6.867 1.00 25.00 H new ATOM 0 HG22 THR A 39 23.650 -1.946 5.761 1.00 25.00 H new ATOM 0 HG23 THR A 39 24.208 -0.530 6.684 1.00 25.00 H new ATOM 614 N GLN A 40 25.120 2.251 4.582 1.00 25.00 N ATOM 615 CA GLN A 40 26.148 3.143 5.146 1.00 25.00 C ATOM 616 C GLN A 40 27.554 2.815 4.619 1.00 25.00 C ATOM 617 O GLN A 40 28.553 3.126 5.255 1.00 25.00 O ATOM 618 CB GLN A 40 26.147 3.097 6.684 1.00 25.00 C ATOM 619 CG GLN A 40 24.762 3.076 7.309 1.00 25.00 C ATOM 620 CD GLN A 40 24.785 3.444 8.783 1.00 25.00 C ATOM 621 OE1 GLN A 40 25.124 4.551 9.143 1.00 25.00 O ATOM 622 NE2 GLN A 40 24.428 2.510 9.627 1.00 25.00 N ATOM 0 H GLN A 40 24.360 2.748 4.116 1.00 25.00 H new ATOM 0 HA GLN A 40 25.891 4.151 4.821 1.00 25.00 H new ATOM 0 HB2 GLN A 40 26.693 2.212 7.010 1.00 25.00 H new ATOM 0 HB3 GLN A 40 26.690 3.963 7.062 1.00 25.00 H new ATOM 0 HG2 GLN A 40 24.115 3.771 6.774 1.00 25.00 H new ATOM 0 HG3 GLN A 40 24.329 2.083 7.192 1.00 25.00 H new ATOM 0 HE21 GLN A 40 24.149 1.591 9.283 1.00 25.00 H new ATOM 0 HE22 GLN A 40 24.428 2.701 10.629 1.00 25.00 H new ATOM 631 N GLY A 41 27.622 2.149 3.473 1.00 25.00 N ATOM 632 CA GLY A 41 28.903 1.737 2.916 1.00 25.00 C ATOM 633 C GLY A 41 29.543 0.604 3.701 1.00 25.00 C ATOM 634 O GLY A 41 30.729 0.312 3.532 1.00 25.00 O ATOM 0 H GLY A 41 26.810 1.884 2.915 1.00 25.00 H new ATOM 0 HA2 GLY A 41 28.761 1.423 1.882 1.00 25.00 H new ATOM 0 HA3 GLY A 41 29.580 2.591 2.900 1.00 25.00 H new ATOM 638 N LEU A 42 28.766 -0.032 4.565 1.00 25.00 N ATOM 639 CA LEU A 42 29.247 -1.136 5.368 1.00 25.00 C ATOM 640 C LEU A 42 29.057 -2.385 4.540 1.00 25.00 C ATOM 641 O LEU A 42 27.982 -2.976 4.532 1.00 25.00 O ATOM 642 CB LEU A 42 28.451 -1.219 6.666 1.00 25.00 C ATOM 643 CG LEU A 42 28.485 0.030 7.550 1.00 25.00 C ATOM 644 CD1 LEU A 42 27.425 -0.089 8.620 1.00 25.00 C ATOM 645 CD2 LEU A 42 29.825 0.207 8.182 1.00 25.00 C ATOM 0 H LEU A 42 27.787 0.205 4.726 1.00 25.00 H new ATOM 0 HA LEU A 42 30.296 -1.009 5.637 1.00 25.00 H new ATOM 0 HB2 LEU A 42 27.412 -1.438 6.419 1.00 25.00 H new ATOM 0 HB3 LEU A 42 28.826 -2.062 7.246 1.00 25.00 H new ATOM 0 HG LEU A 42 28.289 0.903 6.927 1.00 25.00 H new ATOM 0 HD11 LEU A 42 27.445 0.798 9.252 1.00 25.00 H new ATOM 0 HD12 LEU A 42 26.445 -0.179 8.152 1.00 25.00 H new ATOM 0 HD13 LEU A 42 27.619 -0.972 9.228 1.00 25.00 H new ATOM 0 HD21 LEU A 42 29.819 1.102 8.804 1.00 25.00 H new ATOM 0 HD22 LEU A 42 30.054 -0.662 8.799 1.00 25.00 H new ATOM 0 HD23 LEU A 42 30.583 0.310 7.405 1.00 25.00 H new ATOM 657 N ASP A 43 30.082 -2.749 3.790 1.00 25.00 N ATOM 658 CA ASP A 43 29.980 -3.893 2.890 1.00 25.00 C ATOM 659 C ASP A 43 29.643 -5.135 3.689 1.00 25.00 C ATOM 660 O ASP A 43 30.210 -5.383 4.759 1.00 25.00 O ATOM 661 CB ASP A 43 31.292 -4.127 2.158 1.00 25.00 C ATOM 662 CG ASP A 43 31.089 -4.631 0.740 1.00 25.00 C ATOM 663 OD1 ASP A 43 31.759 -4.115 -0.180 1.00 25.00 O ATOM 664 OD2 ASP A 43 30.278 -5.560 0.550 1.00 25.00 O ATOM 0 H ASP A 43 30.987 -2.278 3.783 1.00 25.00 H new ATOM 0 HA ASP A 43 29.198 -3.684 2.160 1.00 25.00 H new ATOM 0 HB2 ASP A 43 31.859 -3.197 2.131 1.00 25.00 H new ATOM 0 HB3 ASP A 43 31.890 -4.849 2.714 1.00 25.00 H new ATOM 669 N GLY A 44 28.697 -5.904 3.185 1.00 25.00 N ATOM 670 CA GLY A 44 28.295 -7.122 3.849 1.00 25.00 C ATOM 671 C GLY A 44 27.243 -6.929 4.932 1.00 25.00 C ATOM 672 O GLY A 44 26.630 -7.916 5.355 1.00 25.00 O ATOM 0 H GLY A 44 28.195 -5.705 2.320 1.00 25.00 H new ATOM 0 HA2 GLY A 44 27.909 -7.817 3.104 1.00 25.00 H new ATOM 0 HA3 GLY A 44 29.175 -7.587 4.293 1.00 25.00 H new ATOM 676 N TRP A 45 27.015 -5.703 5.385 1.00 25.00 N ATOM 677 CA TRP A 45 26.017 -5.427 6.409 1.00 25.00 C ATOM 678 C TRP A 45 24.707 -5.010 5.751 1.00 25.00 C ATOM 679 O TRP A 45 24.682 -4.152 4.885 1.00 25.00 O ATOM 680 CB TRP A 45 26.533 -4.295 7.284 1.00 25.00 C ATOM 681 CG TRP A 45 27.598 -4.743 8.232 1.00 25.00 C ATOM 682 CD1 TRP A 45 28.936 -4.548 8.131 1.00 25.00 C ATOM 683 CD2 TRP A 45 27.415 -5.474 9.458 1.00 25.00 C ATOM 684 NE1 TRP A 45 29.603 -5.076 9.194 1.00 25.00 N ATOM 685 CE2 TRP A 45 28.704 -5.670 10.033 1.00 25.00 C ATOM 686 CE3 TRP A 45 26.288 -5.976 10.135 1.00 25.00 C ATOM 687 CZ2 TRP A 45 28.886 -6.349 11.252 1.00 25.00 C ATOM 688 CZ3 TRP A 45 26.466 -6.642 11.365 1.00 25.00 C ATOM 689 CH2 TRP A 45 27.765 -6.828 11.906 1.00 25.00 C ATOM 0 H TRP A 45 27.514 -4.877 5.055 1.00 25.00 H new ATOM 0 HA TRP A 45 25.839 -6.318 7.011 1.00 25.00 H new ATOM 0 HB2 TRP A 45 26.927 -3.501 6.650 1.00 25.00 H new ATOM 0 HB3 TRP A 45 25.703 -3.870 7.849 1.00 25.00 H new ATOM 0 HD1 TRP A 45 29.414 -4.037 7.308 1.00 25.00 H new ATOM 0 HE1 TRP A 45 30.612 -5.035 9.340 1.00 25.00 H new ATOM 0 HE3 TRP A 45 25.299 -5.853 9.718 1.00 25.00 H new ATOM 0 HZ2 TRP A 45 29.873 -6.492 11.666 1.00 25.00 H new ATOM 0 HZ3 TRP A 45 25.605 -7.014 11.901 1.00 25.00 H new ATOM 0 HH2 TRP A 45 27.880 -7.352 12.843 1.00 25.00 H new ATOM 700 N TRP A 46 23.609 -5.632 6.144 1.00 25.00 N ATOM 701 CA TRP A 46 22.313 -5.361 5.524 1.00 25.00 C ATOM 702 C TRP A 46 21.379 -4.703 6.522 1.00 25.00 C ATOM 703 O TRP A 46 21.201 -5.204 7.622 1.00 25.00 O ATOM 704 CB TRP A 46 21.694 -6.667 4.999 1.00 25.00 C ATOM 705 CG TRP A 46 22.521 -7.358 3.919 1.00 25.00 C ATOM 706 CD1 TRP A 46 23.658 -6.898 3.326 1.00 25.00 C ATOM 707 CD2 TRP A 46 22.279 -8.651 3.316 1.00 25.00 C ATOM 708 NE1 TRP A 46 24.141 -7.776 2.407 1.00 25.00 N ATOM 709 CE2 TRP A 46 23.331 -8.880 2.373 1.00 25.00 C ATOM 710 CE3 TRP A 46 21.282 -9.635 3.475 1.00 25.00 C ATOM 711 CZ2 TRP A 46 23.402 -10.052 1.594 1.00 25.00 C ATOM 712 CZ3 TRP A 46 21.370 -10.829 2.703 1.00 25.00 C ATOM 713 CH2 TRP A 46 22.423 -11.016 1.765 1.00 25.00 C ATOM 0 H TRP A 46 23.584 -6.329 6.889 1.00 25.00 H new ATOM 0 HA TRP A 46 22.462 -4.681 4.686 1.00 25.00 H new ATOM 0 HB2 TRP A 46 21.560 -7.354 5.834 1.00 25.00 H new ATOM 0 HB3 TRP A 46 20.702 -6.452 4.601 1.00 25.00 H new ATOM 0 HD1 TRP A 46 24.120 -5.950 3.558 1.00 25.00 H new ATOM 0 HE1 TRP A 46 24.973 -7.635 1.835 1.00 25.00 H new ATOM 0 HE3 TRP A 46 20.467 -9.487 4.168 1.00 25.00 H new ATOM 0 HZ2 TRP A 46 24.201 -10.195 0.881 1.00 25.00 H new ATOM 0 HZ3 TRP A 46 20.627 -11.603 2.832 1.00 25.00 H new ATOM 0 HH2 TRP A 46 22.459 -11.922 1.178 1.00 25.00 H new ATOM 724 N LEU A 47 20.787 -3.579 6.136 1.00 25.00 N ATOM 725 CA LEU A 47 19.848 -2.871 7.001 1.00 25.00 C ATOM 726 C LEU A 47 18.549 -3.627 6.984 1.00 25.00 C ATOM 727 O LEU A 47 17.947 -3.806 5.933 1.00 25.00 O ATOM 728 CB LEU A 47 19.584 -1.455 6.477 1.00 25.00 C ATOM 729 CG LEU A 47 18.578 -0.591 7.252 1.00 25.00 C ATOM 730 CD1 LEU A 47 18.968 -0.442 8.708 1.00 25.00 C ATOM 731 CD2 LEU A 47 18.453 0.782 6.608 1.00 25.00 C ATOM 0 H LEU A 47 20.940 -3.137 5.229 1.00 25.00 H new ATOM 0 HA LEU A 47 20.266 -2.803 8.005 1.00 25.00 H new ATOM 0 HB2 LEU A 47 20.535 -0.923 6.450 1.00 25.00 H new ATOM 0 HB3 LEU A 47 19.235 -1.536 5.447 1.00 25.00 H new ATOM 0 HG LEU A 47 17.615 -1.099 7.213 1.00 25.00 H new ATOM 0 HD11 LEU A 47 18.231 0.176 9.221 1.00 25.00 H new ATOM 0 HD12 LEU A 47 19.006 -1.425 9.177 1.00 25.00 H new ATOM 0 HD13 LEU A 47 19.948 0.031 8.776 1.00 25.00 H new ATOM 0 HD21 LEU A 47 17.737 1.383 7.168 1.00 25.00 H new ATOM 0 HD22 LEU A 47 19.424 1.276 6.614 1.00 25.00 H new ATOM 0 HD23 LEU A 47 18.108 0.672 5.580 1.00 25.00 H new ATOM 743 N CYS A 48 18.106 -4.063 8.148 1.00 25.00 N ATOM 744 CA CYS A 48 16.861 -4.788 8.262 1.00 25.00 C ATOM 745 C CYS A 48 16.043 -4.269 9.421 1.00 25.00 C ATOM 746 O CYS A 48 16.523 -3.478 10.229 1.00 25.00 O ATOM 747 CB CYS A 48 17.134 -6.285 8.443 1.00 25.00 C ATOM 748 SG CYS A 48 18.372 -6.952 7.296 1.00 25.00 S ATOM 0 H CYS A 48 18.596 -3.925 9.032 1.00 25.00 H new ATOM 0 HA CYS A 48 16.294 -4.638 7.343 1.00 25.00 H new ATOM 0 HB2 CYS A 48 17.468 -6.462 9.465 1.00 25.00 H new ATOM 0 HB3 CYS A 48 16.201 -6.833 8.313 1.00 25.00 H new ATOM 0 HG CYS A 48 19.485 -6.292 7.427 1.00 25.00 H new ATOM 754 N SER A 49 14.808 -4.728 9.495 1.00 25.00 N ATOM 755 CA SER A 49 13.904 -4.374 10.571 1.00 25.00 C ATOM 756 C SER A 49 13.349 -5.658 11.159 1.00 25.00 C ATOM 757 O SER A 49 12.881 -6.532 10.423 1.00 25.00 O ATOM 758 CB SER A 49 12.796 -3.464 10.041 1.00 25.00 C ATOM 759 OG SER A 49 11.538 -4.123 9.989 1.00 25.00 O ATOM 0 H SER A 49 14.402 -5.361 8.806 1.00 25.00 H new ATOM 0 HA SER A 49 14.425 -3.822 11.353 1.00 25.00 H new ATOM 0 HB2 SER A 49 12.716 -2.583 10.678 1.00 25.00 H new ATOM 0 HB3 SER A 49 13.062 -3.114 9.044 1.00 25.00 H new ATOM 0 HG SER A 49 10.859 -3.505 9.646 1.00 25.00 H new ATOM 765 N LEU A 50 13.434 -5.778 12.474 1.00 25.00 N ATOM 766 CA LEU A 50 12.966 -6.957 13.198 1.00 25.00 C ATOM 767 C LEU A 50 12.305 -6.467 14.481 1.00 25.00 C ATOM 768 O LEU A 50 12.880 -5.638 15.173 1.00 25.00 O ATOM 769 CB LEU A 50 14.155 -7.858 13.549 1.00 25.00 C ATOM 770 CG LEU A 50 13.814 -9.180 14.240 1.00 25.00 C ATOM 771 CD1 LEU A 50 13.838 -10.287 13.238 1.00 25.00 C ATOM 772 CD2 LEU A 50 14.799 -9.454 15.368 1.00 25.00 C ATOM 0 H LEU A 50 13.832 -5.057 13.076 1.00 25.00 H new ATOM 0 HA LEU A 50 12.265 -7.529 12.590 1.00 25.00 H new ATOM 0 HB2 LEU A 50 14.700 -8.080 12.632 1.00 25.00 H new ATOM 0 HB3 LEU A 50 14.832 -7.298 14.194 1.00 25.00 H new ATOM 0 HG LEU A 50 12.815 -9.115 14.670 1.00 25.00 H new ATOM 0 HD11 LEU A 50 13.595 -11.229 13.730 1.00 25.00 H new ATOM 0 HD12 LEU A 50 13.105 -10.086 12.457 1.00 25.00 H new ATOM 0 HD13 LEU A 50 14.831 -10.355 12.795 1.00 25.00 H new ATOM 0 HD21 LEU A 50 14.545 -10.397 15.851 1.00 25.00 H new ATOM 0 HD22 LEU A 50 15.809 -9.514 14.963 1.00 25.00 H new ATOM 0 HD23 LEU A 50 14.749 -8.647 16.099 1.00 25.00 H new ATOM 784 N HIS A 51 11.087 -6.923 14.763 1.00 25.00 N ATOM 785 CA HIS A 51 10.317 -6.480 15.949 1.00 25.00 C ATOM 786 C HIS A 51 10.194 -4.948 16.050 1.00 25.00 C ATOM 787 O HIS A 51 10.121 -4.390 17.136 1.00 25.00 O ATOM 788 CB HIS A 51 10.918 -7.052 17.247 1.00 25.00 C ATOM 789 CG HIS A 51 10.734 -8.532 17.385 1.00 25.00 C ATOM 790 ND1 HIS A 51 9.537 -9.137 17.686 1.00 25.00 N ATOM 791 CD2 HIS A 51 11.628 -9.554 17.281 1.00 25.00 C ATOM 792 CE1 HIS A 51 9.735 -10.447 17.753 1.00 25.00 C ATOM 793 NE2 HIS A 51 10.991 -10.761 17.514 1.00 25.00 N ATOM 0 H HIS A 51 10.598 -7.607 14.186 1.00 25.00 H new ATOM 0 HA HIS A 51 9.309 -6.874 15.818 1.00 25.00 H new ATOM 0 HB2 HIS A 51 11.983 -6.821 17.278 1.00 25.00 H new ATOM 0 HB3 HIS A 51 10.459 -6.555 18.101 1.00 25.00 H new ATOM 0 HD2 HIS A 51 12.677 -9.440 17.051 1.00 25.00 H new ATOM 0 HE1 HIS A 51 8.961 -11.167 17.976 1.00 25.00 H new ATOM 0 HE2 HIS A 51 11.406 -11.693 17.503 1.00 25.00 H new ATOM 801 N GLY A 52 10.159 -4.272 14.908 1.00 25.00 N ATOM 802 CA GLY A 52 10.020 -2.825 14.902 1.00 25.00 C ATOM 803 C GLY A 52 11.304 -2.076 15.217 1.00 25.00 C ATOM 804 O GLY A 52 11.296 -0.858 15.348 1.00 25.00 O ATOM 0 H GLY A 52 10.224 -4.699 13.984 1.00 25.00 H new ATOM 0 HA2 GLY A 52 9.659 -2.510 13.923 1.00 25.00 H new ATOM 0 HA3 GLY A 52 9.259 -2.541 15.629 1.00 25.00 H new ATOM 808 N ARG A 53 12.413 -2.793 15.325 1.00 25.00 N ATOM 809 CA ARG A 53 13.710 -2.188 15.589 1.00 25.00 C ATOM 810 C ARG A 53 14.468 -2.321 14.296 1.00 25.00 C ATOM 811 O ARG A 53 14.411 -3.361 13.654 1.00 25.00 O ATOM 812 CB ARG A 53 14.415 -2.952 16.715 1.00 25.00 C ATOM 813 CG ARG A 53 15.323 -2.100 17.616 1.00 25.00 C ATOM 814 CD ARG A 53 16.653 -1.706 16.957 1.00 25.00 C ATOM 815 NE ARG A 53 17.598 -1.195 17.962 1.00 25.00 N ATOM 816 CZ ARG A 53 18.848 -0.805 17.724 1.00 25.00 C ATOM 817 NH1 ARG A 53 19.389 -0.802 16.537 1.00 25.00 N ATOM 818 NH2 ARG A 53 19.576 -0.405 18.728 1.00 25.00 N ATOM 0 H ARG A 53 12.439 -3.808 15.232 1.00 25.00 H new ATOM 0 HA ARG A 53 13.635 -1.148 15.906 1.00 25.00 H new ATOM 0 HB2 ARG A 53 13.658 -3.430 17.337 1.00 25.00 H new ATOM 0 HB3 ARG A 53 15.013 -3.748 16.273 1.00 25.00 H new ATOM 0 HG2 ARG A 53 14.788 -1.195 17.904 1.00 25.00 H new ATOM 0 HG3 ARG A 53 15.531 -2.652 18.533 1.00 25.00 H new ATOM 0 HD2 ARG A 53 17.084 -2.570 16.451 1.00 25.00 H new ATOM 0 HD3 ARG A 53 16.477 -0.946 16.196 1.00 25.00 H new ATOM 0 HE ARG A 53 17.266 -1.134 18.925 1.00 25.00 H new ATOM 0 HH11 ARG A 53 18.848 -1.110 15.729 1.00 25.00 H new ATOM 0 HH12 ARG A 53 20.353 -0.491 16.417 1.00 25.00 H new ATOM 0 HH21 ARG A 53 19.185 -0.396 19.670 1.00 25.00 H new ATOM 0 HH22 ARG A 53 20.537 -0.101 18.572 1.00 25.00 H new ATOM 832 N GLN A 54 15.155 -1.269 13.902 1.00 25.00 N ATOM 833 CA GLN A 54 15.923 -1.280 12.662 1.00 25.00 C ATOM 834 C GLN A 54 17.394 -1.399 13.005 1.00 25.00 C ATOM 835 O GLN A 54 17.828 -0.882 14.032 1.00 25.00 O ATOM 836 CB GLN A 54 15.673 0.008 11.884 1.00 25.00 C ATOM 837 CG GLN A 54 14.921 -0.205 10.599 1.00 25.00 C ATOM 838 CD GLN A 54 14.576 1.094 9.906 1.00 25.00 C ATOM 839 OE1 GLN A 54 13.428 1.337 9.567 1.00 25.00 O ATOM 840 NE2 GLN A 54 15.557 1.937 9.699 1.00 25.00 N ATOM 0 H GLN A 54 15.201 -0.391 14.419 1.00 25.00 H new ATOM 0 HA GLN A 54 15.617 -2.124 12.044 1.00 25.00 H new ATOM 0 HB2 GLN A 54 15.113 0.700 12.513 1.00 25.00 H new ATOM 0 HB3 GLN A 54 16.630 0.481 11.662 1.00 25.00 H new ATOM 0 HG2 GLN A 54 15.520 -0.822 9.929 1.00 25.00 H new ATOM 0 HG3 GLN A 54 14.004 -0.757 10.806 1.00 25.00 H new ATOM 0 HE21 GLN A 54 16.504 1.701 9.996 1.00 25.00 H new ATOM 0 HE22 GLN A 54 15.374 2.830 9.241 1.00 25.00 H new ATOM 849 N GLY A 55 18.155 -2.074 12.163 1.00 25.00 N ATOM 850 CA GLY A 55 19.577 -2.219 12.402 1.00 25.00 C ATOM 851 C GLY A 55 20.276 -3.043 11.343 1.00 25.00 C ATOM 852 O GLY A 55 19.629 -3.644 10.486 1.00 25.00 O ATOM 0 H GLY A 55 17.815 -2.527 11.315 1.00 25.00 H new ATOM 0 HA2 GLY A 55 20.035 -1.231 12.446 1.00 25.00 H new ATOM 0 HA3 GLY A 55 19.730 -2.684 13.376 1.00 25.00 H new ATOM 856 N ILE A 56 21.598 -3.056 11.386 1.00 25.00 N ATOM 857 CA ILE A 56 22.397 -3.800 10.424 1.00 25.00 C ATOM 858 C ILE A 56 22.490 -5.265 10.853 1.00 25.00 C ATOM 859 O ILE A 56 22.314 -5.600 12.030 1.00 25.00 O ATOM 860 CB ILE A 56 23.822 -3.178 10.254 1.00 25.00 C ATOM 861 CG1 ILE A 56 24.625 -3.290 11.569 1.00 25.00 C ATOM 862 CG2 ILE A 56 23.678 -1.708 9.834 1.00 25.00 C ATOM 863 CD1 ILE A 56 26.033 -2.724 11.520 1.00 25.00 C ATOM 0 H ILE A 56 22.146 -2.554 12.085 1.00 25.00 H new ATOM 0 HA ILE A 56 21.904 -3.743 9.453 1.00 25.00 H new ATOM 0 HB ILE A 56 24.366 -3.725 9.484 1.00 25.00 H new ATOM 0 HG12 ILE A 56 24.073 -2.778 12.357 1.00 25.00 H new ATOM 0 HG13 ILE A 56 24.683 -4.341 11.851 1.00 25.00 H new ATOM 0 HG21 ILE A 56 24.667 -1.266 9.713 1.00 25.00 H new ATOM 0 HG22 ILE A 56 23.137 -1.651 8.890 1.00 25.00 H new ATOM 0 HG23 ILE A 56 23.128 -1.163 10.601 1.00 25.00 H new ATOM 0 HD11 ILE A 56 26.511 -2.852 12.491 1.00 25.00 H new ATOM 0 HD12 ILE A 56 26.610 -3.250 10.760 1.00 25.00 H new ATOM 0 HD13 ILE A 56 25.990 -1.663 11.274 1.00 25.00 H new ATOM 875 N VAL A 57 22.707 -6.128 9.881 1.00 25.00 N ATOM 876 CA VAL A 57 22.794 -7.568 10.096 1.00 25.00 C ATOM 877 C VAL A 57 23.887 -8.114 9.185 1.00 25.00 C ATOM 878 O VAL A 57 23.983 -7.695 8.034 1.00 25.00 O ATOM 879 CB VAL A 57 21.457 -8.260 9.700 1.00 25.00 C ATOM 880 CG1 VAL A 57 21.539 -9.744 9.850 1.00 25.00 C ATOM 881 CG2 VAL A 57 20.295 -7.696 10.505 1.00 25.00 C ATOM 0 H VAL A 57 22.830 -5.851 8.907 1.00 25.00 H new ATOM 0 HA VAL A 57 23.006 -7.762 11.147 1.00 25.00 H new ATOM 0 HB VAL A 57 21.278 -8.047 8.646 1.00 25.00 H new ATOM 0 HG11 VAL A 57 20.587 -10.192 9.564 1.00 25.00 H new ATOM 0 HG12 VAL A 57 22.330 -10.132 9.207 1.00 25.00 H new ATOM 0 HG13 VAL A 57 21.760 -9.993 10.888 1.00 25.00 H new ATOM 0 HG21 VAL A 57 19.372 -8.195 10.210 1.00 25.00 H new ATOM 0 HG22 VAL A 57 20.474 -7.862 11.567 1.00 25.00 H new ATOM 0 HG23 VAL A 57 20.206 -6.626 10.315 1.00 25.00 H new ATOM 891 N PRO A 58 24.714 -9.058 9.663 1.00 25.00 N ATOM 892 CA PRO A 58 25.708 -9.610 8.737 1.00 25.00 C ATOM 893 C PRO A 58 25.057 -10.489 7.661 1.00 25.00 C ATOM 894 O PRO A 58 24.400 -11.487 7.964 1.00 25.00 O ATOM 895 CB PRO A 58 26.616 -10.415 9.663 1.00 25.00 C ATOM 896 CG PRO A 58 25.726 -10.848 10.788 1.00 25.00 C ATOM 897 CD PRO A 58 24.784 -9.695 10.994 1.00 25.00 C ATOM 0 HA PRO A 58 26.243 -8.847 8.171 1.00 25.00 H new ATOM 0 HB2 PRO A 58 27.047 -11.273 9.147 1.00 25.00 H new ATOM 0 HB3 PRO A 58 27.447 -9.810 10.026 1.00 25.00 H new ATOM 0 HG2 PRO A 58 25.186 -11.761 10.537 1.00 25.00 H new ATOM 0 HG3 PRO A 58 26.301 -11.056 11.690 1.00 25.00 H new ATOM 0 HD2 PRO A 58 23.803 -10.034 11.328 1.00 25.00 H new ATOM 0 HD3 PRO A 58 25.157 -9.004 11.750 1.00 25.00 H new ATOM 905 N GLY A 59 25.244 -10.121 6.401 1.00 25.00 N ATOM 906 CA GLY A 59 24.637 -10.854 5.293 1.00 25.00 C ATOM 907 C GLY A 59 25.083 -12.300 5.224 1.00 25.00 C ATOM 908 O GLY A 59 24.354 -13.163 4.751 1.00 25.00 O ATOM 0 H GLY A 59 25.810 -9.321 6.118 1.00 25.00 H new ATOM 0 HA2 GLY A 59 23.552 -10.819 5.392 1.00 25.00 H new ATOM 0 HA3 GLY A 59 24.887 -10.357 4.356 1.00 25.00 H new ATOM 912 N ASN A 60 26.268 -12.576 5.757 1.00 25.00 N ATOM 913 CA ASN A 60 26.812 -13.936 5.786 1.00 25.00 C ATOM 914 C ASN A 60 25.963 -14.908 6.623 1.00 25.00 C ATOM 915 O ASN A 60 26.122 -16.121 6.515 1.00 25.00 O ATOM 916 CB ASN A 60 28.245 -13.899 6.342 1.00 25.00 C ATOM 917 CG ASN A 60 29.186 -14.836 5.605 1.00 25.00 C ATOM 918 OD1 ASN A 60 30.211 -14.417 5.106 1.00 25.00 O ATOM 919 ND2 ASN A 60 28.835 -16.092 5.523 1.00 25.00 N ATOM 0 H ASN A 60 26.876 -11.874 6.178 1.00 25.00 H new ATOM 0 HA ASN A 60 26.802 -14.307 4.761 1.00 25.00 H new ATOM 0 HB2 ASN A 60 28.629 -12.881 6.277 1.00 25.00 H new ATOM 0 HB3 ASN A 60 28.227 -14.166 7.399 1.00 25.00 H new ATOM 0 HD21 ASN A 60 29.429 -16.756 5.027 1.00 25.00 H new ATOM 0 HD22 ASN A 60 27.967 -16.408 5.955 1.00 25.00 H new ATOM 926 N ARG A 61 25.064 -14.388 7.453 1.00 25.00 N ATOM 927 CA ARG A 61 24.195 -15.232 8.279 1.00 25.00 C ATOM 928 C ARG A 61 22.728 -15.095 7.878 1.00 25.00 C ATOM 929 O ARG A 61 21.839 -15.615 8.563 1.00 25.00 O ATOM 930 CB ARG A 61 24.369 -14.872 9.761 1.00 25.00 C ATOM 931 CG ARG A 61 25.771 -15.136 10.285 1.00 25.00 C ATOM 932 CD ARG A 61 25.857 -14.869 11.772 1.00 25.00 C ATOM 933 NE ARG A 61 27.183 -15.219 12.307 1.00 25.00 N ATOM 934 CZ ARG A 61 27.534 -15.166 13.592 1.00 25.00 C ATOM 935 NH1 ARG A 61 26.703 -14.804 14.531 1.00 25.00 N ATOM 936 NH2 ARG A 61 28.748 -15.490 13.923 1.00 25.00 N ATOM 0 H ARG A 61 24.915 -13.386 7.574 1.00 25.00 H new ATOM 0 HA ARG A 61 24.489 -16.269 8.118 1.00 25.00 H new ATOM 0 HB2 ARG A 61 24.129 -13.818 9.902 1.00 25.00 H new ATOM 0 HB3 ARG A 61 23.654 -15.444 10.353 1.00 25.00 H new ATOM 0 HG2 ARG A 61 26.050 -16.170 10.081 1.00 25.00 H new ATOM 0 HG3 ARG A 61 26.485 -14.504 9.757 1.00 25.00 H new ATOM 0 HD2 ARG A 61 25.651 -13.816 11.966 1.00 25.00 H new ATOM 0 HD3 ARG A 61 25.091 -15.445 12.291 1.00 25.00 H new ATOM 0 HE ARG A 61 27.891 -15.527 11.640 1.00 25.00 H new ATOM 0 HH11 ARG A 61 25.745 -14.548 14.293 1.00 25.00 H new ATOM 0 HH12 ARG A 61 27.012 -14.777 15.503 1.00 25.00 H new ATOM 0 HH21 ARG A 61 29.413 -15.778 13.205 1.00 25.00 H new ATOM 0 HH22 ARG A 61 29.036 -15.456 14.901 1.00 25.00 H new ATOM 950 N LEU A 62 22.473 -14.426 6.762 1.00 25.00 N ATOM 951 CA LEU A 62 21.107 -14.233 6.267 1.00 25.00 C ATOM 952 C LEU A 62 20.886 -14.844 4.909 1.00 25.00 C ATOM 953 O LEU A 62 21.775 -14.905 4.072 1.00 25.00 O ATOM 954 CB LEU A 62 20.783 -12.751 6.147 1.00 25.00 C ATOM 955 CG LEU A 62 20.013 -12.131 7.314 1.00 25.00 C ATOM 956 CD1 LEU A 62 19.756 -10.674 6.977 1.00 25.00 C ATOM 957 CD2 LEU A 62 18.693 -12.833 7.603 1.00 25.00 C ATOM 0 H LEU A 62 23.194 -14.004 6.177 1.00 25.00 H new ATOM 0 HA LEU A 62 20.461 -14.726 6.993 1.00 25.00 H new ATOM 0 HB2 LEU A 62 21.718 -12.205 6.025 1.00 25.00 H new ATOM 0 HB3 LEU A 62 20.204 -12.600 5.236 1.00 25.00 H new ATOM 0 HG LEU A 62 20.617 -12.237 8.215 1.00 25.00 H new ATOM 0 HD11 LEU A 62 19.207 -10.203 7.793 1.00 25.00 H new ATOM 0 HD12 LEU A 62 20.707 -10.160 6.836 1.00 25.00 H new ATOM 0 HD13 LEU A 62 19.169 -10.611 6.061 1.00 25.00 H new ATOM 0 HD21 LEU A 62 18.197 -12.344 8.442 1.00 25.00 H new ATOM 0 HD22 LEU A 62 18.053 -12.781 6.722 1.00 25.00 H new ATOM 0 HD23 LEU A 62 18.883 -13.877 7.852 1.00 25.00 H new ATOM 969 N LYS A 63 19.647 -15.234 4.672 1.00 25.00 N ATOM 970 CA LYS A 63 19.232 -15.711 3.359 1.00 25.00 C ATOM 971 C LYS A 63 18.043 -14.923 2.904 1.00 25.00 C ATOM 972 O LYS A 63 16.990 -14.969 3.523 1.00 25.00 O ATOM 973 CB LYS A 63 18.869 -17.195 3.397 1.00 25.00 C ATOM 974 CG LYS A 63 18.300 -17.707 2.074 1.00 25.00 C ATOM 975 CD LYS A 63 18.261 -19.227 2.004 1.00 25.00 C ATOM 976 CE LYS A 63 17.268 -19.840 2.982 1.00 25.00 C ATOM 977 NZ LYS A 63 17.364 -21.342 2.928 1.00 25.00 N ATOM 0 H LYS A 63 18.906 -15.231 5.372 1.00 25.00 H new ATOM 0 HA LYS A 63 20.064 -15.580 2.667 1.00 25.00 H new ATOM 0 HB2 LYS A 63 19.757 -17.774 3.652 1.00 25.00 H new ATOM 0 HB3 LYS A 63 18.140 -17.364 4.189 1.00 25.00 H new ATOM 0 HG2 LYS A 63 17.292 -17.315 1.940 1.00 25.00 H new ATOM 0 HG3 LYS A 63 18.903 -17.324 1.251 1.00 25.00 H new ATOM 0 HD2 LYS A 63 18.001 -19.532 0.991 1.00 25.00 H new ATOM 0 HD3 LYS A 63 19.256 -19.621 2.210 1.00 25.00 H new ATOM 0 HE2 LYS A 63 17.475 -19.489 3.993 1.00 25.00 H new ATOM 0 HE3 LYS A 63 16.255 -19.522 2.735 1.00 25.00 H new ATOM 0 HZ1 LYS A 63 16.685 -21.758 3.597 1.00 25.00 H new ATOM 0 HZ2 LYS A 63 17.146 -21.669 1.965 1.00 25.00 H new ATOM 0 HZ3 LYS A 63 18.327 -21.638 3.185 1.00 25.00 H new ATOM 991 N ILE A 64 18.202 -14.243 1.787 1.00 25.00 N ATOM 992 CA ILE A 64 17.115 -13.492 1.191 1.00 25.00 C ATOM 993 C ILE A 64 16.092 -14.503 0.684 1.00 25.00 C ATOM 994 O ILE A 64 16.440 -15.447 -0.031 1.00 25.00 O ATOM 995 CB ILE A 64 17.627 -12.636 0.006 1.00 25.00 C ATOM 996 CG1 ILE A 64 18.724 -11.650 0.458 1.00 25.00 C ATOM 997 CG2 ILE A 64 16.482 -11.863 -0.630 1.00 25.00 C ATOM 998 CD1 ILE A 64 18.278 -10.591 1.491 1.00 25.00 C ATOM 0 H ILE A 64 19.080 -14.195 1.270 1.00 25.00 H new ATOM 0 HA ILE A 64 16.676 -12.818 1.927 1.00 25.00 H new ATOM 0 HB ILE A 64 18.054 -13.319 -0.728 1.00 25.00 H new ATOM 0 HG12 ILE A 64 19.550 -12.221 0.882 1.00 25.00 H new ATOM 0 HG13 ILE A 64 19.111 -11.135 -0.421 1.00 25.00 H new ATOM 0 HG21 ILE A 64 16.862 -11.268 -1.460 1.00 25.00 H new ATOM 0 HG22 ILE A 64 15.731 -12.562 -0.998 1.00 25.00 H new ATOM 0 HG23 ILE A 64 16.031 -11.204 0.112 1.00 25.00 H new ATOM 0 HD11 ILE A 64 19.122 -9.949 1.742 1.00 25.00 H new ATOM 0 HD12 ILE A 64 17.475 -9.987 1.069 1.00 25.00 H new ATOM 0 HD13 ILE A 64 17.921 -11.090 2.392 1.00 25.00 H new ATOM 1010 N LEU A 65 14.843 -14.328 1.065 1.00 25.00 N ATOM 1011 CA LEU A 65 13.786 -15.219 0.619 1.00 25.00 C ATOM 1012 C LEU A 65 13.208 -14.652 -0.667 1.00 25.00 C ATOM 1013 O LEU A 65 12.283 -13.839 -0.656 1.00 25.00 O ATOM 1014 CB LEU A 65 12.711 -15.365 1.707 1.00 25.00 C ATOM 1015 CG LEU A 65 13.242 -15.877 3.059 1.00 25.00 C ATOM 1016 CD1 LEU A 65 12.107 -15.904 4.079 1.00 25.00 C ATOM 1017 CD2 LEU A 65 13.873 -17.272 2.926 1.00 25.00 C ATOM 0 H LEU A 65 14.533 -13.578 1.682 1.00 25.00 H new ATOM 0 HA LEU A 65 14.181 -16.217 0.430 1.00 25.00 H new ATOM 0 HB2 LEU A 65 12.233 -14.398 1.861 1.00 25.00 H new ATOM 0 HB3 LEU A 65 11.940 -16.048 1.350 1.00 25.00 H new ATOM 0 HG LEU A 65 14.021 -15.195 3.399 1.00 25.00 H new ATOM 0 HD11 LEU A 65 12.485 -16.267 5.035 1.00 25.00 H new ATOM 0 HD12 LEU A 65 11.707 -14.898 4.205 1.00 25.00 H new ATOM 0 HD13 LEU A 65 11.317 -16.567 3.727 1.00 25.00 H new ATOM 0 HD21 LEU A 65 14.237 -17.601 3.899 1.00 25.00 H new ATOM 0 HD22 LEU A 65 13.125 -17.976 2.561 1.00 25.00 H new ATOM 0 HD23 LEU A 65 14.705 -17.229 2.223 1.00 25.00 H new ATOM 1327 N PRO A 89 29.139 -18.934 10.638 1.00 25.00 N ATOM 1328 CA PRO A 89 30.258 -18.271 9.962 1.00 25.00 C ATOM 1329 C PRO A 89 30.561 -16.888 10.560 1.00 25.00 C ATOM 1330 O PRO A 89 29.757 -16.343 11.331 1.00 25.00 O ATOM 1331 CB PRO A 89 29.747 -18.148 8.523 1.00 25.00 C ATOM 1332 CG PRO A 89 28.305 -17.976 8.670 1.00 25.00 C ATOM 1333 CD PRO A 89 27.930 -18.902 9.791 1.00 25.00 C ATOM 0 HA PRO A 89 31.195 -18.821 10.055 1.00 25.00 H new ATOM 0 HB2 PRO A 89 30.199 -17.299 8.011 1.00 25.00 H new ATOM 0 HB3 PRO A 89 29.985 -19.037 7.938 1.00 25.00 H new ATOM 0 HG2 PRO A 89 28.050 -16.943 8.906 1.00 25.00 H new ATOM 0 HG3 PRO A 89 27.779 -18.232 7.750 1.00 25.00 H new ATOM 0 HD2 PRO A 89 27.065 -18.534 10.342 1.00 25.00 H new ATOM 0 HD3 PRO A 89 27.674 -19.895 9.421 1.00 25.00 H new ATOM 1341 N PRO A 90 31.718 -16.297 10.211 1.00 25.00 N ATOM 1342 CA PRO A 90 32.039 -14.980 10.773 1.00 25.00 C ATOM 1343 C PRO A 90 31.178 -13.848 10.199 1.00 25.00 C ATOM 1344 O PRO A 90 30.463 -14.032 9.204 1.00 25.00 O ATOM 1345 CB PRO A 90 33.513 -14.797 10.383 1.00 25.00 C ATOM 1346 CG PRO A 90 33.640 -15.534 9.115 1.00 25.00 C ATOM 1347 CD PRO A 90 32.787 -16.769 9.309 1.00 25.00 C ATOM 0 HA PRO A 90 31.848 -14.937 11.845 1.00 25.00 H new ATOM 0 HB2 PRO A 90 33.765 -13.744 10.260 1.00 25.00 H new ATOM 0 HB3 PRO A 90 34.180 -15.197 11.146 1.00 25.00 H new ATOM 0 HG2 PRO A 90 33.290 -14.938 8.272 1.00 25.00 H new ATOM 0 HG3 PRO A 90 34.678 -15.796 8.910 1.00 25.00 H new ATOM 0 HD2 PRO A 90 32.385 -17.134 8.364 1.00 25.00 H new ATOM 0 HD3 PRO A 90 33.356 -17.587 9.751 1.00 25.00 H new ATOM 1355 N LYS A 91 31.264 -12.678 10.826 1.00 25.00 N ATOM 1356 CA LYS A 91 30.561 -11.475 10.362 1.00 25.00 C ATOM 1357 C LYS A 91 31.618 -10.508 9.803 1.00 25.00 C ATOM 1358 O LYS A 91 32.780 -10.572 10.217 1.00 25.00 O ATOM 1359 CB LYS A 91 29.765 -10.825 11.519 1.00 25.00 C ATOM 1360 CG LYS A 91 30.591 -10.519 12.781 1.00 25.00 C ATOM 1361 CD LYS A 91 29.801 -9.693 13.816 1.00 25.00 C ATOM 1362 CE LYS A 91 28.631 -10.467 14.448 1.00 25.00 C ATOM 1363 NZ LYS A 91 27.972 -9.676 15.547 1.00 25.00 N ATOM 0 H LYS A 91 31.820 -12.532 11.668 1.00 25.00 H new ATOM 0 HA LYS A 91 29.839 -11.730 9.586 1.00 25.00 H new ATOM 0 HB2 LYS A 91 29.321 -9.897 11.159 1.00 25.00 H new ATOM 0 HB3 LYS A 91 28.943 -11.487 11.792 1.00 25.00 H new ATOM 0 HG2 LYS A 91 30.913 -11.455 13.237 1.00 25.00 H new ATOM 0 HG3 LYS A 91 31.493 -9.976 12.499 1.00 25.00 H new ATOM 0 HD2 LYS A 91 30.479 -9.367 14.604 1.00 25.00 H new ATOM 0 HD3 LYS A 91 29.415 -8.794 13.335 1.00 25.00 H new ATOM 0 HE2 LYS A 91 27.895 -10.706 13.680 1.00 25.00 H new ATOM 0 HE3 LYS A 91 28.994 -11.414 14.848 1.00 25.00 H new ATOM 0 HZ1 LYS A 91 27.221 -10.248 15.984 1.00 25.00 H new ATOM 0 HZ2 LYS A 91 28.680 -9.425 16.267 1.00 25.00 H new ATOM 0 HZ3 LYS A 91 27.559 -8.808 15.150 1.00 25.00 H new ATOM 1377 N PRO A 92 31.245 -9.632 8.846 1.00 25.00 N ATOM 1378 CA PRO A 92 32.237 -8.673 8.336 1.00 25.00 C ATOM 1379 C PRO A 92 32.590 -7.606 9.403 1.00 25.00 C ATOM 1380 O PRO A 92 31.860 -7.444 10.381 1.00 25.00 O ATOM 1381 CB PRO A 92 31.514 -8.060 7.129 1.00 25.00 C ATOM 1382 CG PRO A 92 30.087 -8.155 7.463 1.00 25.00 C ATOM 1383 CD PRO A 92 29.935 -9.448 8.188 1.00 25.00 C ATOM 0 HA PRO A 92 33.193 -9.127 8.077 1.00 25.00 H new ATOM 0 HB2 PRO A 92 31.816 -7.025 6.970 1.00 25.00 H new ATOM 0 HB3 PRO A 92 31.743 -8.603 6.212 1.00 25.00 H new ATOM 0 HG2 PRO A 92 29.772 -7.317 8.085 1.00 25.00 H new ATOM 0 HG3 PRO A 92 29.471 -8.134 6.564 1.00 25.00 H new ATOM 0 HD2 PRO A 92 29.123 -9.408 8.914 1.00 25.00 H new ATOM 0 HD3 PRO A 92 29.711 -10.267 7.505 1.00 25.00 H new