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=-0.26) 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= 1.38 K(o=1.4,f=-1.7) USER MOD Single : A 20 SER OG : rot 180:sc= 0.0812 USER MOD Single : A 25 SER OG : rot 180:sc= 0.62 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 MET CE :methyl -125:sc= -0.34 (180deg=-1.44) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 99:sc= 1.22 USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 CYS SG : rot 56:sc= -0.178 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= -0.161 X(o=-0.16,f=-0.06) USER MOD Single : A 60 ASN : amide:sc= 0.569 K(o=0.57,f=-1.6!) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 170:sc= 0.859 (180deg=0.645) USER MOD ----------------------------------------------------------------- ATOM 59 N TYR A 5 13.137 1.915 0.156 1.00 25.00 N ATOM 60 CA TYR A 5 13.829 0.678 0.522 1.00 25.00 C ATOM 61 C TYR A 5 13.319 -0.582 -0.207 1.00 25.00 C ATOM 62 O TYR A 5 12.316 -0.557 -0.907 1.00 25.00 O ATOM 63 CB TYR A 5 13.786 0.491 2.040 1.00 25.00 C ATOM 64 CG TYR A 5 14.696 1.434 2.803 1.00 25.00 C ATOM 65 CD1 TYR A 5 16.077 1.496 2.516 1.00 25.00 C ATOM 66 CD2 TYR A 5 14.192 2.249 3.837 1.00 25.00 C ATOM 67 CE1 TYR A 5 16.936 2.353 3.248 1.00 25.00 C ATOM 68 CE2 TYR A 5 15.058 3.108 4.574 1.00 25.00 C ATOM 69 CZ TYR A 5 16.423 3.144 4.270 1.00 25.00 C ATOM 70 OH TYR A 5 17.269 3.957 4.978 1.00 25.00 O ATOM 0 HA TYR A 5 14.860 0.795 0.188 1.00 25.00 H new ATOM 0 HB2 TYR A 5 12.762 0.633 2.384 1.00 25.00 H new ATOM 0 HB3 TYR A 5 14.063 -0.536 2.277 1.00 25.00 H new ATOM 0 HD1 TYR A 5 16.485 0.881 1.727 1.00 25.00 H new ATOM 0 HD2 TYR A 5 13.138 2.222 4.073 1.00 25.00 H new ATOM 0 HE1 TYR A 5 17.989 2.392 3.012 1.00 25.00 H new ATOM 0 HE2 TYR A 5 14.662 3.729 5.364 1.00 25.00 H new ATOM 0 HH TYR A 5 16.760 4.447 5.657 1.00 25.00 H new ATOM 80 N LEU A 6 14.078 -1.662 -0.085 1.00 25.00 N ATOM 81 CA LEU A 6 13.782 -2.922 -0.771 1.00 25.00 C ATOM 82 C LEU A 6 12.553 -3.616 -0.174 1.00 25.00 C ATOM 83 O LEU A 6 11.731 -4.155 -0.903 1.00 25.00 O ATOM 84 CB LEU A 6 14.988 -3.869 -0.656 1.00 25.00 C ATOM 85 CG LEU A 6 16.353 -3.423 -1.205 1.00 25.00 C ATOM 86 CD1 LEU A 6 17.414 -4.479 -0.847 1.00 25.00 C ATOM 87 CD2 LEU A 6 16.325 -3.214 -2.715 1.00 25.00 C ATOM 0 H LEU A 6 14.918 -1.694 0.492 1.00 25.00 H new ATOM 0 HA LEU A 6 13.576 -2.688 -1.815 1.00 25.00 H new ATOM 0 HB2 LEU A 6 15.121 -4.103 0.400 1.00 25.00 H new ATOM 0 HB3 LEU A 6 14.722 -4.800 -1.157 1.00 25.00 H new ATOM 0 HG LEU A 6 16.601 -2.465 -0.748 1.00 25.00 H new ATOM 0 HD11 LEU A 6 18.384 -4.166 -1.235 1.00 25.00 H new ATOM 0 HD12 LEU A 6 17.473 -4.583 0.236 1.00 25.00 H new ATOM 0 HD13 LEU A 6 17.138 -5.436 -1.289 1.00 25.00 H new ATOM 0 HD21 LEU A 6 17.311 -2.900 -3.057 1.00 25.00 H new ATOM 0 HD22 LEU A 6 16.051 -4.147 -3.206 1.00 25.00 H new ATOM 0 HD23 LEU A 6 15.593 -2.445 -2.962 1.00 25.00 H new ATOM 99 N ASN A 7 12.465 -3.609 1.153 1.00 25.00 N ATOM 100 CA ASN A 7 11.372 -4.246 1.916 1.00 25.00 C ATOM 101 C ASN A 7 11.084 -5.696 1.492 1.00 25.00 C ATOM 102 O ASN A 7 9.960 -6.062 1.158 1.00 25.00 O ATOM 103 CB ASN A 7 10.107 -3.383 1.873 1.00 25.00 C ATOM 104 CG ASN A 7 10.180 -2.236 2.832 1.00 25.00 C ATOM 105 OD1 ASN A 7 10.027 -2.407 4.030 1.00 25.00 O ATOM 106 ND2 ASN A 7 10.446 -1.075 2.329 1.00 25.00 N ATOM 0 H ASN A 7 13.158 -3.155 1.748 1.00 25.00 H new ATOM 0 HA ASN A 7 11.716 -4.311 2.948 1.00 25.00 H new ATOM 0 HB2 ASN A 7 9.962 -3.002 0.862 1.00 25.00 H new ATOM 0 HB3 ASN A 7 9.239 -3.999 2.109 1.00 25.00 H new ATOM 0 HD21 ASN A 7 10.535 -0.263 2.940 1.00 25.00 H new ATOM 0 HD22 ASN A 7 10.567 -0.971 1.322 1.00 25.00 H new ATOM 113 N VAL A 8 12.117 -6.523 1.546 1.00 25.00 N ATOM 114 CA VAL A 8 12.007 -7.946 1.211 1.00 25.00 C ATOM 115 C VAL A 8 12.129 -8.705 2.526 1.00 25.00 C ATOM 116 O VAL A 8 12.583 -8.139 3.503 1.00 25.00 O ATOM 117 CB VAL A 8 13.124 -8.381 0.188 1.00 25.00 C ATOM 118 CG1 VAL A 8 13.624 -7.178 -0.599 1.00 25.00 C ATOM 119 CG2 VAL A 8 14.316 -9.035 0.875 1.00 25.00 C ATOM 0 H VAL A 8 13.055 -6.234 1.822 1.00 25.00 H new ATOM 0 HA VAL A 8 11.056 -8.162 0.724 1.00 25.00 H new ATOM 0 HB VAL A 8 12.664 -9.110 -0.479 1.00 25.00 H new ATOM 0 HG11 VAL A 8 14.395 -7.497 -1.301 1.00 25.00 H new ATOM 0 HG12 VAL A 8 12.795 -6.733 -1.149 1.00 25.00 H new ATOM 0 HG13 VAL A 8 14.041 -6.442 0.088 1.00 25.00 H new ATOM 0 HG21 VAL A 8 15.057 -9.316 0.127 1.00 25.00 H new ATOM 0 HG22 VAL A 8 14.760 -8.332 1.580 1.00 25.00 H new ATOM 0 HG23 VAL A 8 13.984 -9.925 1.410 1.00 25.00 H new ATOM 129 N LEU A 9 11.759 -9.973 2.569 1.00 25.00 N ATOM 130 CA LEU A 9 11.919 -10.757 3.797 1.00 25.00 C ATOM 131 C LEU A 9 13.169 -11.624 3.694 1.00 25.00 C ATOM 132 O LEU A 9 13.508 -12.104 2.616 1.00 25.00 O ATOM 133 CB LEU A 9 10.688 -11.635 4.039 1.00 25.00 C ATOM 134 CG LEU A 9 9.358 -10.883 4.234 1.00 25.00 C ATOM 135 CD1 LEU A 9 8.229 -11.896 4.417 1.00 25.00 C ATOM 136 CD2 LEU A 9 9.405 -9.939 5.439 1.00 25.00 C ATOM 0 H LEU A 9 11.351 -10.482 1.785 1.00 25.00 H new ATOM 0 HA LEU A 9 12.024 -10.073 4.639 1.00 25.00 H new ATOM 0 HB2 LEU A 9 10.579 -12.316 3.195 1.00 25.00 H new ATOM 0 HB3 LEU A 9 10.870 -12.248 4.922 1.00 25.00 H new ATOM 0 HG LEU A 9 9.181 -10.275 3.347 1.00 25.00 H new ATOM 0 HD11 LEU A 9 7.285 -11.368 4.555 1.00 25.00 H new ATOM 0 HD12 LEU A 9 8.163 -12.531 3.534 1.00 25.00 H new ATOM 0 HD13 LEU A 9 8.432 -12.512 5.293 1.00 25.00 H new ATOM 0 HD21 LEU A 9 8.447 -9.429 5.539 1.00 25.00 H new ATOM 0 HD22 LEU A 9 9.607 -10.513 6.343 1.00 25.00 H new ATOM 0 HD23 LEU A 9 10.195 -9.202 5.293 1.00 25.00 H new ATOM 148 N ALA A 10 13.847 -11.834 4.810 1.00 25.00 N ATOM 149 CA ALA A 10 15.040 -12.680 4.847 1.00 25.00 C ATOM 150 C ALA A 10 15.025 -13.563 6.098 1.00 25.00 C ATOM 151 O ALA A 10 14.573 -13.127 7.149 1.00 25.00 O ATOM 152 CB ALA A 10 16.284 -11.813 4.829 1.00 25.00 C ATOM 0 H ALA A 10 13.593 -11.429 5.711 1.00 25.00 H new ATOM 0 HA ALA A 10 15.046 -13.326 3.969 1.00 25.00 H new ATOM 0 HB1 ALA A 10 17.170 -12.447 4.857 1.00 25.00 H new ATOM 0 HB2 ALA A 10 16.296 -11.213 3.919 1.00 25.00 H new ATOM 0 HB3 ALA A 10 16.282 -11.155 5.698 1.00 25.00 H new ATOM 158 N LYS A 11 15.525 -14.791 5.976 1.00 25.00 N ATOM 159 CA LYS A 11 15.592 -15.734 7.097 1.00 25.00 C ATOM 160 C LYS A 11 17.017 -15.870 7.611 1.00 25.00 C ATOM 161 O LYS A 11 17.959 -15.977 6.824 1.00 25.00 O ATOM 162 CB LYS A 11 15.093 -17.121 6.668 1.00 25.00 C ATOM 163 CG LYS A 11 15.235 -18.198 7.763 1.00 25.00 C ATOM 164 CD LYS A 11 14.406 -19.456 7.503 1.00 25.00 C ATOM 165 CE LYS A 11 12.933 -19.219 7.829 1.00 25.00 C ATOM 166 NZ LYS A 11 12.122 -20.484 7.874 1.00 25.00 N ATOM 0 H LYS A 11 15.895 -15.162 5.101 1.00 25.00 H new ATOM 0 HA LYS A 11 14.956 -15.341 7.890 1.00 25.00 H new ATOM 0 HB2 LYS A 11 14.045 -17.046 6.378 1.00 25.00 H new ATOM 0 HB3 LYS A 11 15.646 -17.439 5.784 1.00 25.00 H new ATOM 0 HG2 LYS A 11 16.285 -18.478 7.850 1.00 25.00 H new ATOM 0 HG3 LYS A 11 14.938 -17.770 8.721 1.00 25.00 H new ATOM 0 HD2 LYS A 11 14.508 -19.753 6.459 1.00 25.00 H new ATOM 0 HD3 LYS A 11 14.788 -20.279 8.107 1.00 25.00 H new ATOM 0 HE2 LYS A 11 12.858 -18.713 8.792 1.00 25.00 H new ATOM 0 HE3 LYS A 11 12.506 -18.549 7.083 1.00 25.00 H new ATOM 0 HZ1 LYS A 11 11.133 -20.255 8.100 1.00 25.00 H new ATOM 0 HZ2 LYS A 11 12.165 -20.957 6.949 1.00 25.00 H new ATOM 0 HZ3 LYS A 11 12.506 -21.117 8.605 1.00 25.00 H new ATOM 180 N ALA A 12 17.161 -15.935 8.921 1.00 25.00 N ATOM 181 CA ALA A 12 18.448 -16.170 9.554 1.00 25.00 C ATOM 182 C ALA A 12 18.848 -17.642 9.425 1.00 25.00 C ATOM 183 O ALA A 12 18.068 -18.527 9.761 1.00 25.00 O ATOM 184 CB ALA A 12 18.343 -15.787 11.010 1.00 25.00 C ATOM 0 H ALA A 12 16.389 -15.826 9.579 1.00 25.00 H new ATOM 0 HA ALA A 12 19.213 -15.568 9.063 1.00 25.00 H new ATOM 0 HB1 ALA A 12 19.301 -15.957 11.501 1.00 25.00 H new ATOM 0 HB2 ALA A 12 18.076 -14.733 11.091 1.00 25.00 H new ATOM 0 HB3 ALA A 12 17.576 -16.394 11.491 1.00 25.00 H new ATOM 190 N LEU A 13 20.071 -17.906 8.988 1.00 25.00 N ATOM 191 CA LEU A 13 20.587 -19.280 8.942 1.00 25.00 C ATOM 192 C LEU A 13 21.287 -19.592 10.236 1.00 25.00 C ATOM 193 O LEU A 13 21.531 -20.749 10.550 1.00 25.00 O ATOM 194 CB LEU A 13 21.607 -19.459 7.817 1.00 25.00 C ATOM 195 CG LEU A 13 21.203 -19.278 6.352 1.00 25.00 C ATOM 196 CD1 LEU A 13 19.752 -19.686 6.073 1.00 25.00 C ATOM 197 CD2 LEU A 13 21.449 -17.856 5.907 1.00 25.00 C ATOM 0 H LEU A 13 20.726 -17.196 8.661 1.00 25.00 H new ATOM 0 HA LEU A 13 19.739 -19.944 8.773 1.00 25.00 H new ATOM 0 HB2 LEU A 13 22.423 -18.763 8.012 1.00 25.00 H new ATOM 0 HB3 LEU A 13 22.016 -20.465 7.914 1.00 25.00 H new ATOM 0 HG LEU A 13 21.832 -19.952 5.771 1.00 25.00 H new ATOM 0 HD11 LEU A 13 19.528 -19.534 5.017 1.00 25.00 H new ATOM 0 HD12 LEU A 13 19.615 -20.737 6.325 1.00 25.00 H new ATOM 0 HD13 LEU A 13 19.080 -19.077 6.678 1.00 25.00 H new ATOM 0 HD21 LEU A 13 21.156 -17.746 4.863 1.00 25.00 H new ATOM 0 HD22 LEU A 13 20.861 -17.175 6.523 1.00 25.00 H new ATOM 0 HD23 LEU A 13 22.508 -17.619 6.014 1.00 25.00 H new ATOM 209 N TYR A 14 21.625 -18.544 10.966 1.00 25.00 N ATOM 210 CA TYR A 14 22.351 -18.660 12.218 1.00 25.00 C ATOM 211 C TYR A 14 21.881 -17.569 13.148 1.00 25.00 C ATOM 212 O TYR A 14 21.419 -16.527 12.694 1.00 25.00 O ATOM 213 CB TYR A 14 23.847 -18.498 11.979 1.00 25.00 C ATOM 214 CG TYR A 14 24.400 -19.506 11.001 1.00 25.00 C ATOM 215 CD1 TYR A 14 24.543 -19.180 9.637 1.00 25.00 C ATOM 216 CD2 TYR A 14 24.767 -20.800 11.425 1.00 25.00 C ATOM 217 CE1 TYR A 14 25.031 -20.134 8.710 1.00 25.00 C ATOM 218 CE2 TYR A 14 25.272 -21.750 10.501 1.00 25.00 C ATOM 219 CZ TYR A 14 25.394 -21.409 9.151 1.00 25.00 C ATOM 220 OH TYR A 14 25.865 -22.316 8.238 1.00 25.00 O ATOM 0 H TYR A 14 21.402 -17.583 10.705 1.00 25.00 H new ATOM 0 HA TYR A 14 22.167 -19.642 12.653 1.00 25.00 H new ATOM 0 HB2 TYR A 14 24.043 -17.493 11.606 1.00 25.00 H new ATOM 0 HB3 TYR A 14 24.374 -18.594 12.928 1.00 25.00 H new ATOM 0 HD1 TYR A 14 24.277 -18.191 9.294 1.00 25.00 H new ATOM 0 HD2 TYR A 14 24.662 -21.071 12.465 1.00 25.00 H new ATOM 0 HE1 TYR A 14 25.122 -19.876 7.665 1.00 25.00 H new ATOM 0 HE2 TYR A 14 25.561 -22.734 10.839 1.00 25.00 H new ATOM 0 HH TYR A 14 26.077 -23.158 8.693 1.00 25.00 H new ATOM 230 N ASP A 15 22.019 -17.805 14.440 1.00 25.00 N ATOM 231 CA ASP A 15 21.701 -16.815 15.446 1.00 25.00 C ATOM 232 C ASP A 15 22.668 -15.647 15.337 1.00 25.00 C ATOM 233 O ASP A 15 23.809 -15.804 14.882 1.00 25.00 O ATOM 234 CB ASP A 15 21.840 -17.453 16.827 1.00 25.00 C ATOM 235 CG ASP A 15 20.945 -18.654 16.991 1.00 25.00 C ATOM 236 OD1 ASP A 15 19.758 -18.467 17.307 1.00 25.00 O ATOM 237 OD2 ASP A 15 21.388 -19.786 16.723 1.00 25.00 O ATOM 0 H ASP A 15 22.355 -18.690 14.819 1.00 25.00 H new ATOM 0 HA ASP A 15 20.682 -16.456 15.299 1.00 25.00 H new ATOM 0 HB2 ASP A 15 22.877 -17.750 16.986 1.00 25.00 H new ATOM 0 HB3 ASP A 15 21.599 -16.715 17.592 1.00 25.00 H new ATOM 242 N ASN A 16 22.237 -14.486 15.794 1.00 25.00 N ATOM 243 CA ASN A 16 23.103 -13.319 15.831 1.00 25.00 C ATOM 244 C ASN A 16 22.898 -12.564 17.123 1.00 25.00 C ATOM 245 O ASN A 16 21.768 -12.343 17.547 1.00 25.00 O ATOM 246 CB ASN A 16 22.831 -12.379 14.659 1.00 25.00 C ATOM 247 CG ASN A 16 23.958 -11.404 14.449 1.00 25.00 C ATOM 248 OD1 ASN A 16 25.105 -11.812 14.287 1.00 25.00 O ATOM 249 ND2 ASN A 16 23.666 -10.138 14.489 1.00 25.00 N ATOM 0 H ASN A 16 21.293 -14.324 16.145 1.00 25.00 H new ATOM 0 HA ASN A 16 24.132 -13.673 15.761 1.00 25.00 H new ATOM 0 HB2 ASN A 16 22.683 -12.964 13.751 1.00 25.00 H new ATOM 0 HB3 ASN A 16 21.906 -11.831 14.840 1.00 25.00 H new ATOM 0 HD21 ASN A 16 24.403 -9.441 14.384 1.00 25.00 H new ATOM 0 HD22 ASN A 16 22.700 -9.842 14.626 1.00 25.00 H new ATOM 256 N VAL A 17 23.996 -12.136 17.717 1.00 25.00 N ATOM 257 CA VAL A 17 23.957 -11.309 18.909 1.00 25.00 C ATOM 258 C VAL A 17 24.555 -9.995 18.464 1.00 25.00 C ATOM 259 O VAL A 17 25.625 -9.970 17.852 1.00 25.00 O ATOM 260 CB VAL A 17 24.772 -11.927 20.076 1.00 25.00 C ATOM 261 CG1 VAL A 17 24.752 -11.002 21.306 1.00 25.00 C ATOM 262 CG2 VAL A 17 24.191 -13.305 20.453 1.00 25.00 C ATOM 0 H VAL A 17 24.937 -12.351 17.388 1.00 25.00 H new ATOM 0 HA VAL A 17 22.944 -11.204 19.298 1.00 25.00 H new ATOM 0 HB VAL A 17 25.804 -12.046 19.747 1.00 25.00 H new ATOM 0 HG11 VAL A 17 25.330 -11.455 22.112 1.00 25.00 H new ATOM 0 HG12 VAL A 17 25.189 -10.039 21.044 1.00 25.00 H new ATOM 0 HG13 VAL A 17 23.723 -10.856 21.635 1.00 25.00 H new ATOM 0 HG21 VAL A 17 24.769 -13.732 21.273 1.00 25.00 H new ATOM 0 HG22 VAL A 17 23.152 -13.190 20.763 1.00 25.00 H new ATOM 0 HG23 VAL A 17 24.240 -13.969 19.590 1.00 25.00 H new ATOM 272 N ALA A 18 23.819 -8.926 18.694 1.00 25.00 N ATOM 273 CA ALA A 18 24.233 -7.604 18.286 1.00 25.00 C ATOM 274 C ALA A 18 25.378 -7.133 19.185 1.00 25.00 C ATOM 275 O ALA A 18 25.269 -7.167 20.409 1.00 25.00 O ATOM 276 CB ALA A 18 23.046 -6.673 18.387 1.00 25.00 C ATOM 0 H ALA A 18 22.917 -8.952 19.169 1.00 25.00 H new ATOM 0 HA ALA A 18 24.589 -7.613 17.256 1.00 25.00 H new ATOM 0 HB1 ALA A 18 23.343 -5.670 18.082 1.00 25.00 H new ATOM 0 HB2 ALA A 18 22.248 -7.029 17.735 1.00 25.00 H new ATOM 0 HB3 ALA A 18 22.690 -6.648 19.417 1.00 25.00 H new ATOM 282 N GLU A 19 26.467 -6.713 18.563 1.00 25.00 N ATOM 283 CA GLU A 19 27.643 -6.219 19.287 1.00 25.00 C ATOM 284 C GLU A 19 27.743 -4.712 19.094 1.00 25.00 C ATOM 285 O GLU A 19 28.355 -4.000 19.883 1.00 25.00 O ATOM 286 CB GLU A 19 28.902 -6.914 18.763 1.00 25.00 C ATOM 287 CG GLU A 19 28.895 -8.408 19.048 1.00 25.00 C ATOM 288 CD GLU A 19 30.111 -9.125 18.484 1.00 25.00 C ATOM 289 OE1 GLU A 19 29.917 -10.009 17.613 1.00 25.00 O ATOM 290 OE2 GLU A 19 31.247 -8.817 18.886 1.00 25.00 O ATOM 0 H GLU A 19 26.568 -6.702 17.548 1.00 25.00 H new ATOM 0 HA GLU A 19 27.548 -6.439 20.350 1.00 25.00 H new ATOM 0 HB2 GLU A 19 28.984 -6.751 17.688 1.00 25.00 H new ATOM 0 HB3 GLU A 19 29.782 -6.463 19.222 1.00 25.00 H new ATOM 0 HG2 GLU A 19 28.854 -8.567 20.126 1.00 25.00 H new ATOM 0 HG3 GLU A 19 27.992 -8.849 18.626 1.00 25.00 H new ATOM 297 N SER A 20 27.084 -4.237 18.051 1.00 25.00 N ATOM 298 CA SER A 20 26.988 -2.810 17.764 1.00 25.00 C ATOM 299 C SER A 20 25.603 -2.349 18.201 1.00 25.00 C ATOM 300 O SER A 20 24.632 -3.102 18.084 1.00 25.00 O ATOM 301 CB SER A 20 27.174 -2.573 16.261 1.00 25.00 C ATOM 302 OG SER A 20 26.809 -1.254 15.890 1.00 25.00 O ATOM 0 H SER A 20 26.599 -4.828 17.376 1.00 25.00 H new ATOM 0 HA SER A 20 27.760 -2.253 18.295 1.00 25.00 H new ATOM 0 HB2 SER A 20 28.214 -2.753 15.990 1.00 25.00 H new ATOM 0 HB3 SER A 20 26.571 -3.289 15.702 1.00 25.00 H new ATOM 0 HG SER A 20 26.941 -1.137 14.926 1.00 25.00 H new ATOM 308 N PRO A 21 25.475 -1.094 18.669 1.00 25.00 N ATOM 309 CA PRO A 21 24.153 -0.580 19.048 1.00 25.00 C ATOM 310 C PRO A 21 23.232 -0.370 17.845 1.00 25.00 C ATOM 311 O PRO A 21 22.038 -0.103 18.001 1.00 25.00 O ATOM 312 CB PRO A 21 24.492 0.753 19.720 1.00 25.00 C ATOM 313 CG PRO A 21 25.740 1.187 19.038 1.00 25.00 C ATOM 314 CD PRO A 21 26.521 -0.068 18.867 1.00 25.00 C ATOM 0 HA PRO A 21 23.605 -1.273 19.686 1.00 25.00 H new ATOM 0 HB2 PRO A 21 23.691 1.481 19.590 1.00 25.00 H new ATOM 0 HB3 PRO A 21 24.643 0.633 20.793 1.00 25.00 H new ATOM 0 HG2 PRO A 21 25.526 1.656 18.078 1.00 25.00 H new ATOM 0 HG3 PRO A 21 26.286 1.917 19.635 1.00 25.00 H new ATOM 0 HD2 PRO A 21 27.194 -0.010 18.012 1.00 25.00 H new ATOM 0 HD3 PRO A 21 27.135 -0.283 19.742 1.00 25.00 H new ATOM 322 N ASP A 22 23.786 -0.515 16.648 1.00 25.00 N ATOM 323 CA ASP A 22 23.042 -0.355 15.413 1.00 25.00 C ATOM 324 C ASP A 22 22.788 -1.700 14.766 1.00 25.00 C ATOM 325 O ASP A 22 22.258 -1.762 13.679 1.00 25.00 O ATOM 326 CB ASP A 22 23.841 0.531 14.463 1.00 25.00 C ATOM 327 CG ASP A 22 23.821 1.978 14.889 1.00 25.00 C ATOM 328 OD1 ASP A 22 22.711 2.516 15.110 1.00 25.00 O ATOM 329 OD2 ASP A 22 24.907 2.561 15.064 1.00 25.00 O ATOM 0 H ASP A 22 24.769 -0.748 16.510 1.00 25.00 H new ATOM 0 HA ASP A 22 22.080 0.107 15.633 1.00 25.00 H new ATOM 0 HB2 ASP A 22 24.872 0.180 14.420 1.00 25.00 H new ATOM 0 HB3 ASP A 22 23.433 0.444 13.456 1.00 25.00 H new ATOM 334 N GLU A 23 23.176 -2.778 15.430 1.00 25.00 N ATOM 335 CA GLU A 23 23.007 -4.132 14.898 1.00 25.00 C ATOM 336 C GLU A 23 21.783 -4.806 15.536 1.00 25.00 C ATOM 337 O GLU A 23 21.389 -4.471 16.653 1.00 25.00 O ATOM 338 CB GLU A 23 24.287 -4.941 15.169 1.00 25.00 C ATOM 339 CG GLU A 23 24.327 -6.322 14.527 1.00 25.00 C ATOM 340 CD GLU A 23 25.596 -7.091 14.845 1.00 25.00 C ATOM 341 OE1 GLU A 23 26.393 -6.660 15.712 1.00 25.00 O ATOM 342 OE2 GLU A 23 25.773 -8.181 14.261 1.00 25.00 O ATOM 0 H GLU A 23 23.616 -2.745 16.350 1.00 25.00 H new ATOM 0 HA GLU A 23 22.837 -4.087 13.822 1.00 25.00 H new ATOM 0 HB2 GLU A 23 25.143 -4.367 14.814 1.00 25.00 H new ATOM 0 HB3 GLU A 23 24.405 -5.055 16.247 1.00 25.00 H new ATOM 0 HG2 GLU A 23 23.466 -6.898 14.865 1.00 25.00 H new ATOM 0 HG3 GLU A 23 24.235 -6.216 13.446 1.00 25.00 H new ATOM 349 N LEU A 24 21.175 -5.749 14.826 1.00 25.00 N ATOM 350 CA LEU A 24 20.033 -6.498 15.354 1.00 25.00 C ATOM 351 C LEU A 24 20.436 -7.862 15.899 1.00 25.00 C ATOM 352 O LEU A 24 21.292 -8.555 15.347 1.00 25.00 O ATOM 353 CB LEU A 24 18.976 -6.705 14.270 1.00 25.00 C ATOM 354 CG LEU A 24 18.217 -5.443 13.845 1.00 25.00 C ATOM 355 CD1 LEU A 24 17.344 -5.764 12.647 1.00 25.00 C ATOM 356 CD2 LEU A 24 17.358 -4.893 14.989 1.00 25.00 C ATOM 0 H LEU A 24 21.452 -6.016 13.881 1.00 25.00 H new ATOM 0 HA LEU A 24 19.628 -5.902 16.172 1.00 25.00 H new ATOM 0 HB2 LEU A 24 19.460 -7.131 13.391 1.00 25.00 H new ATOM 0 HB3 LEU A 24 18.254 -7.441 14.625 1.00 25.00 H new ATOM 0 HG LEU A 24 18.944 -4.676 13.580 1.00 25.00 H new ATOM 0 HD11 LEU A 24 16.802 -4.869 12.341 1.00 25.00 H new ATOM 0 HD12 LEU A 24 17.969 -6.109 11.823 1.00 25.00 H new ATOM 0 HD13 LEU A 24 16.632 -6.545 12.914 1.00 25.00 H new ATOM 0 HD21 LEU A 24 16.834 -3.998 14.653 1.00 25.00 H new ATOM 0 HD22 LEU A 24 16.631 -5.646 15.293 1.00 25.00 H new ATOM 0 HD23 LEU A 24 17.997 -4.642 15.836 1.00 25.00 H new ATOM 368 N SER A 25 19.753 -8.261 16.960 1.00 25.00 N ATOM 369 CA SER A 25 19.940 -9.567 17.569 1.00 25.00 C ATOM 370 C SER A 25 18.749 -10.406 17.164 1.00 25.00 C ATOM 371 O SER A 25 17.609 -9.974 17.308 1.00 25.00 O ATOM 372 CB SER A 25 19.969 -9.471 19.096 1.00 25.00 C ATOM 373 OG SER A 25 21.040 -8.675 19.554 1.00 25.00 O ATOM 0 H SER A 25 19.051 -7.685 17.424 1.00 25.00 H new ATOM 0 HA SER A 25 20.887 -9.996 17.241 1.00 25.00 H new ATOM 0 HB2 SER A 25 19.028 -9.052 19.451 1.00 25.00 H new ATOM 0 HB3 SER A 25 20.053 -10.471 19.521 1.00 25.00 H new ATOM 0 HG SER A 25 21.024 -8.637 20.533 1.00 25.00 H new ATOM 379 N PHE A 26 19.015 -11.600 16.673 1.00 25.00 N ATOM 380 CA PHE A 26 17.954 -12.527 16.267 1.00 25.00 C ATOM 381 C PHE A 26 18.360 -13.989 16.352 1.00 25.00 C ATOM 382 O PHE A 26 19.528 -14.326 16.509 1.00 25.00 O ATOM 383 CB PHE A 26 17.481 -12.223 14.848 1.00 25.00 C ATOM 384 CG PHE A 26 18.575 -12.181 13.829 1.00 25.00 C ATOM 385 CD1 PHE A 26 19.169 -13.361 13.340 1.00 25.00 C ATOM 386 CD2 PHE A 26 18.985 -10.948 13.308 1.00 25.00 C ATOM 387 CE1 PHE A 26 20.147 -13.304 12.315 1.00 25.00 C ATOM 388 CE2 PHE A 26 19.941 -10.885 12.297 1.00 25.00 C ATOM 389 CZ PHE A 26 20.516 -12.071 11.779 1.00 25.00 C ATOM 0 H PHE A 26 19.960 -11.961 16.541 1.00 25.00 H new ATOM 0 HA PHE A 26 17.143 -12.371 16.978 1.00 25.00 H new ATOM 0 HB2 PHE A 26 16.753 -12.978 14.551 1.00 25.00 H new ATOM 0 HB3 PHE A 26 16.964 -11.264 14.848 1.00 25.00 H new ATOM 0 HD1 PHE A 26 18.877 -14.317 13.749 1.00 25.00 H new ATOM 0 HD2 PHE A 26 18.555 -10.036 13.694 1.00 25.00 H new ATOM 0 HE1 PHE A 26 20.604 -14.212 11.951 1.00 25.00 H new ATOM 0 HE2 PHE A 26 20.246 -9.926 11.906 1.00 25.00 H new ATOM 0 HZ PHE A 26 21.235 -12.021 10.975 1.00 25.00 H new ATOM 399 N ARG A 27 17.364 -14.856 16.258 1.00 25.00 N ATOM 400 CA ARG A 27 17.555 -16.297 16.347 1.00 25.00 C ATOM 401 C ARG A 27 17.725 -16.896 14.959 1.00 25.00 C ATOM 402 O ARG A 27 17.228 -16.377 13.976 1.00 25.00 O ATOM 403 CB ARG A 27 16.293 -16.887 17.018 1.00 25.00 C ATOM 404 CG ARG A 27 16.349 -18.355 17.491 1.00 25.00 C ATOM 405 CD ARG A 27 16.948 -18.491 18.893 1.00 25.00 C ATOM 406 NE ARG A 27 16.800 -19.864 19.422 1.00 25.00 N ATOM 407 CZ ARG A 27 17.691 -20.847 19.302 1.00 25.00 C ATOM 408 NH1 ARG A 27 18.826 -20.708 18.672 1.00 25.00 N ATOM 409 NH2 ARG A 27 17.425 -22.007 19.839 1.00 25.00 N ATOM 0 H ARG A 27 16.393 -14.578 16.117 1.00 25.00 H new ATOM 0 HA ARG A 27 18.450 -16.526 16.925 1.00 25.00 H new ATOM 0 HB2 ARG A 27 16.051 -16.266 17.881 1.00 25.00 H new ATOM 0 HB3 ARG A 27 15.465 -16.793 16.315 1.00 25.00 H new ATOM 0 HG2 ARG A 27 15.343 -18.775 17.486 1.00 25.00 H new ATOM 0 HG3 ARG A 27 16.942 -18.939 16.787 1.00 25.00 H new ATOM 0 HD2 ARG A 27 18.004 -18.224 18.864 1.00 25.00 H new ATOM 0 HD3 ARG A 27 16.460 -17.787 19.567 1.00 25.00 H new ATOM 0 HE ARG A 27 15.938 -20.078 19.924 1.00 25.00 H new ATOM 0 HH11 ARG A 27 19.065 -19.814 18.243 1.00 25.00 H new ATOM 0 HH12 ARG A 27 19.474 -21.493 18.609 1.00 25.00 H new ATOM 0 HH21 ARG A 27 16.548 -22.148 20.340 1.00 25.00 H new ATOM 0 HH22 ARG A 27 18.095 -22.772 19.758 1.00 25.00 H new ATOM 423 N LYS A 28 18.358 -18.046 14.903 1.00 25.00 N ATOM 424 CA LYS A 28 18.401 -18.855 13.695 1.00 25.00 C ATOM 425 C LYS A 28 16.960 -19.210 13.338 1.00 25.00 C ATOM 426 O LYS A 28 16.213 -19.690 14.180 1.00 25.00 O ATOM 427 CB LYS A 28 19.219 -20.106 14.010 1.00 25.00 C ATOM 428 CG LYS A 28 19.325 -21.133 12.919 1.00 25.00 C ATOM 429 CD LYS A 28 20.506 -22.049 13.269 1.00 25.00 C ATOM 430 CE LYS A 28 20.605 -23.305 12.424 1.00 25.00 C ATOM 431 NZ LYS A 28 21.843 -24.080 12.825 1.00 25.00 N ATOM 0 H LYS A 28 18.860 -18.452 15.693 1.00 25.00 H new ATOM 0 HA LYS A 28 18.860 -18.336 12.854 1.00 25.00 H new ATOM 0 HB2 LYS A 28 20.227 -19.794 14.283 1.00 25.00 H new ATOM 0 HB3 LYS A 28 18.785 -20.585 14.888 1.00 25.00 H new ATOM 0 HG2 LYS A 28 18.402 -21.708 12.841 1.00 25.00 H new ATOM 0 HG3 LYS A 28 19.484 -20.653 11.953 1.00 25.00 H new ATOM 0 HD2 LYS A 28 21.431 -21.483 13.164 1.00 25.00 H new ATOM 0 HD3 LYS A 28 20.426 -22.338 14.317 1.00 25.00 H new ATOM 0 HE2 LYS A 28 19.716 -23.921 12.561 1.00 25.00 H new ATOM 0 HE3 LYS A 28 20.652 -23.044 11.367 1.00 25.00 H new ATOM 0 HZ1 LYS A 28 21.915 -24.942 12.248 1.00 25.00 H new ATOM 0 HZ2 LYS A 28 22.686 -23.490 12.673 1.00 25.00 H new ATOM 0 HZ3 LYS A 28 21.779 -24.340 13.830 1.00 25.00 H new ATOM 445 N GLY A 29 16.573 -18.940 12.101 1.00 25.00 N ATOM 446 CA GLY A 29 15.215 -19.192 11.651 1.00 25.00 C ATOM 447 C GLY A 29 14.306 -17.979 11.687 1.00 25.00 C ATOM 448 O GLY A 29 13.207 -18.032 11.137 1.00 25.00 O ATOM 0 H GLY A 29 17.185 -18.544 11.388 1.00 25.00 H new ATOM 0 HA2 GLY A 29 15.249 -19.575 10.631 1.00 25.00 H new ATOM 0 HA3 GLY A 29 14.779 -19.975 12.271 1.00 25.00 H new ATOM 452 N ASP A 30 14.757 -16.898 12.310 1.00 25.00 N ATOM 453 CA ASP A 30 13.948 -15.677 12.444 1.00 25.00 C ATOM 454 C ASP A 30 13.808 -14.979 11.094 1.00 25.00 C ATOM 455 O ASP A 30 14.607 -15.226 10.181 1.00 25.00 O ATOM 456 CB ASP A 30 14.607 -14.727 13.447 1.00 25.00 C ATOM 457 CG ASP A 30 13.612 -13.888 14.202 1.00 25.00 C ATOM 458 OD1 ASP A 30 12.447 -13.773 13.766 1.00 25.00 O ATOM 459 OD2 ASP A 30 13.997 -13.380 15.278 1.00 25.00 O ATOM 0 H ASP A 30 15.682 -16.835 12.735 1.00 25.00 H new ATOM 0 HA ASP A 30 12.956 -15.954 12.801 1.00 25.00 H new ATOM 0 HB2 ASP A 30 15.197 -15.308 14.156 1.00 25.00 H new ATOM 0 HB3 ASP A 30 15.299 -14.072 12.918 1.00 25.00 H new ATOM 464 N ILE A 31 12.803 -14.119 10.968 1.00 25.00 N ATOM 465 CA ILE A 31 12.520 -13.403 9.720 1.00 25.00 C ATOM 466 C ILE A 31 12.573 -11.899 9.954 1.00 25.00 C ATOM 467 O ILE A 31 11.860 -11.377 10.802 1.00 25.00 O ATOM 468 CB ILE A 31 11.101 -13.732 9.162 1.00 25.00 C ATOM 469 CG1 ILE A 31 10.947 -15.239 8.880 1.00 25.00 C ATOM 470 CG2 ILE A 31 10.827 -12.926 7.857 1.00 25.00 C ATOM 471 CD1 ILE A 31 11.957 -15.827 7.898 1.00 25.00 C ATOM 0 H ILE A 31 12.159 -13.895 11.726 1.00 25.00 H new ATOM 0 HA ILE A 31 13.276 -13.723 9.003 1.00 25.00 H new ATOM 0 HB ILE A 31 10.374 -13.446 9.922 1.00 25.00 H new ATOM 0 HG12 ILE A 31 11.027 -15.778 9.824 1.00 25.00 H new ATOM 0 HG13 ILE A 31 9.943 -15.419 8.494 1.00 25.00 H new ATOM 0 HG21 ILE A 31 9.833 -13.168 7.482 1.00 25.00 H new ATOM 0 HG22 ILE A 31 10.885 -11.859 8.070 1.00 25.00 H new ATOM 0 HG23 ILE A 31 11.572 -13.187 7.105 1.00 25.00 H new ATOM 0 HD11 ILE A 31 11.762 -16.892 7.769 1.00 25.00 H new ATOM 0 HD12 ILE A 31 11.866 -15.322 6.936 1.00 25.00 H new ATOM 0 HD13 ILE A 31 12.966 -15.687 8.286 1.00 25.00 H new ATOM 483 N MET A 32 13.376 -11.204 9.163 1.00 25.00 N ATOM 484 CA MET A 32 13.470 -9.748 9.235 1.00 25.00 C ATOM 485 C MET A 32 13.236 -9.135 7.869 1.00 25.00 C ATOM 486 O MET A 32 13.446 -9.777 6.835 1.00 25.00 O ATOM 487 CB MET A 32 14.840 -9.330 9.765 1.00 25.00 C ATOM 488 CG MET A 32 16.007 -9.919 9.004 1.00 25.00 C ATOM 489 SD MET A 32 17.261 -10.467 10.157 1.00 25.00 S ATOM 490 CE MET A 32 16.466 -11.967 10.856 1.00 25.00 C ATOM 0 H MET A 32 13.978 -11.627 8.457 1.00 25.00 H new ATOM 0 HA MET A 32 12.702 -9.387 9.919 1.00 25.00 H new ATOM 0 HB2 MET A 32 14.912 -8.243 9.734 1.00 25.00 H new ATOM 0 HB3 MET A 32 14.917 -9.625 10.811 1.00 25.00 H new ATOM 0 HG2 MET A 32 15.670 -10.756 8.393 1.00 25.00 H new ATOM 0 HG3 MET A 32 16.424 -9.175 8.325 1.00 25.00 H new ATOM 0 HE1 MET A 32 16.428 -11.886 11.942 1.00 25.00 H new ATOM 0 HE2 MET A 32 15.453 -12.059 10.463 1.00 25.00 H new ATOM 0 HE3 MET A 32 17.044 -12.848 10.578 1.00 25.00 H new ATOM 500 N THR A 33 12.791 -7.891 7.878 1.00 25.00 N ATOM 501 CA THR A 33 12.514 -7.150 6.651 1.00 25.00 C ATOM 502 C THR A 33 13.770 -6.419 6.203 1.00 25.00 C ATOM 503 O THR A 33 14.210 -5.508 6.877 1.00 25.00 O ATOM 504 CB THR A 33 11.403 -6.110 6.890 1.00 25.00 C ATOM 505 OG1 THR A 33 10.211 -6.783 7.301 1.00 25.00 O ATOM 506 CG2 THR A 33 11.104 -5.324 5.636 1.00 25.00 C ATOM 0 H THR A 33 12.610 -7.363 8.732 1.00 25.00 H new ATOM 0 HA THR A 33 12.193 -7.857 5.886 1.00 25.00 H new ATOM 0 HB THR A 33 11.746 -5.420 7.661 1.00 25.00 H new ATOM 0 HG1 THR A 33 9.501 -6.126 7.456 1.00 25.00 H new ATOM 0 HG21 THR A 33 10.316 -4.599 5.840 1.00 25.00 H new ATOM 0 HG22 THR A 33 12.003 -4.800 5.312 1.00 25.00 H new ATOM 0 HG23 THR A 33 10.777 -6.004 4.850 1.00 25.00 H new ATOM 514 N VAL A 34 14.353 -6.816 5.084 1.00 25.00 N ATOM 515 CA VAL A 34 15.564 -6.178 4.569 1.00 25.00 C ATOM 516 C VAL A 34 15.200 -4.909 3.842 1.00 25.00 C ATOM 517 O VAL A 34 14.397 -4.916 2.911 1.00 25.00 O ATOM 518 CB VAL A 34 16.336 -7.090 3.609 1.00 25.00 C ATOM 519 CG1 VAL A 34 17.676 -6.461 3.198 1.00 25.00 C ATOM 520 CG2 VAL A 34 16.557 -8.432 4.262 1.00 25.00 C ATOM 0 H VAL A 34 14.007 -7.583 4.507 1.00 25.00 H new ATOM 0 HA VAL A 34 16.204 -5.964 5.425 1.00 25.00 H new ATOM 0 HB VAL A 34 15.746 -7.222 2.702 1.00 25.00 H new ATOM 0 HG11 VAL A 34 18.199 -7.132 2.517 1.00 25.00 H new ATOM 0 HG12 VAL A 34 17.493 -5.509 2.700 1.00 25.00 H new ATOM 0 HG13 VAL A 34 18.287 -6.295 4.085 1.00 25.00 H new ATOM 0 HG21 VAL A 34 17.106 -9.082 3.581 1.00 25.00 H new ATOM 0 HG22 VAL A 34 17.131 -8.300 5.179 1.00 25.00 H new ATOM 0 HG23 VAL A 34 15.594 -8.885 4.498 1.00 25.00 H new ATOM 530 N LEU A 35 15.788 -3.817 4.287 1.00 25.00 N ATOM 531 CA LEU A 35 15.524 -2.506 3.743 1.00 25.00 C ATOM 532 C LEU A 35 16.573 -2.141 2.714 1.00 25.00 C ATOM 533 O LEU A 35 16.241 -1.683 1.636 1.00 25.00 O ATOM 534 CB LEU A 35 15.524 -1.497 4.878 1.00 25.00 C ATOM 535 CG LEU A 35 14.471 -1.776 5.958 1.00 25.00 C ATOM 536 CD1 LEU A 35 14.721 -0.860 7.098 1.00 25.00 C ATOM 537 CD2 LEU A 35 13.053 -1.591 5.440 1.00 25.00 C ATOM 0 H LEU A 35 16.470 -3.818 5.045 1.00 25.00 H new ATOM 0 HA LEU A 35 14.552 -2.503 3.250 1.00 25.00 H new ATOM 0 HB2 LEU A 35 16.511 -1.486 5.341 1.00 25.00 H new ATOM 0 HB3 LEU A 35 15.353 -0.502 4.467 1.00 25.00 H new ATOM 0 HG LEU A 35 14.558 -2.817 6.270 1.00 25.00 H new ATOM 0 HD11 LEU A 35 13.983 -1.041 7.879 1.00 25.00 H new ATOM 0 HD12 LEU A 35 15.720 -1.038 7.495 1.00 25.00 H new ATOM 0 HD13 LEU A 35 14.644 0.173 6.758 1.00 25.00 H new ATOM 0 HD21 LEU A 35 12.343 -1.800 6.240 1.00 25.00 H new ATOM 0 HD22 LEU A 35 12.922 -0.565 5.097 1.00 25.00 H new ATOM 0 HD23 LEU A 35 12.876 -2.276 4.611 1.00 25.00 H new ATOM 549 N GLU A 36 17.835 -2.396 3.011 1.00 25.00 N ATOM 550 CA GLU A 36 18.888 -2.202 2.013 1.00 25.00 C ATOM 551 C GLU A 36 20.059 -3.111 2.328 1.00 25.00 C ATOM 552 O GLU A 36 20.063 -3.781 3.356 1.00 25.00 O ATOM 553 CB GLU A 36 19.314 -0.730 1.914 1.00 25.00 C ATOM 554 CG GLU A 36 20.255 -0.230 2.931 1.00 25.00 C ATOM 555 CD GLU A 36 20.347 1.286 2.926 1.00 25.00 C ATOM 556 OE1 GLU A 36 20.127 1.901 1.864 1.00 25.00 O ATOM 557 OE2 GLU A 36 20.591 1.865 4.005 1.00 25.00 O ATOM 0 H GLU A 36 18.159 -2.733 3.918 1.00 25.00 H new ATOM 0 HA GLU A 36 18.495 -2.471 1.032 1.00 25.00 H new ATOM 0 HB2 GLU A 36 19.763 -0.574 0.933 1.00 25.00 H new ATOM 0 HB3 GLU A 36 18.415 -0.115 1.955 1.00 25.00 H new ATOM 0 HG2 GLU A 36 19.938 -0.571 3.917 1.00 25.00 H new ATOM 0 HG3 GLU A 36 21.243 -0.654 2.750 1.00 25.00 H new ATOM 564 N ARG A 37 21.039 -3.160 1.443 1.00 25.00 N ATOM 565 CA ARG A 37 22.210 -4.003 1.633 1.00 25.00 C ATOM 566 C ARG A 37 23.410 -3.118 1.454 1.00 25.00 C ATOM 567 O ARG A 37 23.323 -2.146 0.713 1.00 25.00 O ATOM 568 CB ARG A 37 22.245 -5.118 0.595 1.00 25.00 C ATOM 569 CG ARG A 37 21.013 -6.017 0.612 1.00 25.00 C ATOM 570 CD ARG A 37 21.241 -7.258 -0.227 1.00 25.00 C ATOM 571 NE ARG A 37 21.787 -6.919 -1.552 1.00 25.00 N ATOM 572 CZ ARG A 37 22.163 -7.795 -2.475 1.00 25.00 C ATOM 573 NH1 ARG A 37 22.059 -9.089 -2.293 1.00 25.00 N ATOM 574 NH2 ARG A 37 22.660 -7.357 -3.596 1.00 25.00 N ATOM 0 H ARG A 37 21.048 -2.621 0.577 1.00 25.00 H new ATOM 0 HA ARG A 37 22.192 -4.466 2.620 1.00 25.00 H new ATOM 0 HB2 ARG A 37 22.346 -4.675 -0.396 1.00 25.00 H new ATOM 0 HB3 ARG A 37 23.131 -5.730 0.763 1.00 25.00 H new ATOM 0 HG2 ARG A 37 20.780 -6.304 1.638 1.00 25.00 H new ATOM 0 HG3 ARG A 37 20.152 -5.468 0.231 1.00 25.00 H new ATOM 0 HD2 ARG A 37 21.928 -7.928 0.291 1.00 25.00 H new ATOM 0 HD3 ARG A 37 20.301 -7.796 -0.346 1.00 25.00 H new ATOM 0 HE ARG A 37 21.884 -5.929 -1.779 1.00 25.00 H new ATOM 0 HH11 ARG A 37 21.679 -9.452 -1.419 1.00 25.00 H new ATOM 0 HH12 ARG A 37 22.358 -9.733 -3.025 1.00 25.00 H new ATOM 0 HH21 ARG A 37 22.755 -6.354 -3.754 1.00 25.00 H new ATOM 0 HH22 ARG A 37 22.954 -8.017 -4.316 1.00 25.00 H new ATOM 588 N ASP A 38 24.490 -3.456 2.144 1.00 25.00 N ATOM 589 CA ASP A 38 25.760 -2.728 2.071 1.00 25.00 C ATOM 590 C ASP A 38 25.500 -1.278 2.506 1.00 25.00 C ATOM 591 O ASP A 38 26.042 -0.301 1.985 1.00 25.00 O ATOM 592 CB ASP A 38 26.362 -2.916 0.676 1.00 25.00 C ATOM 593 CG ASP A 38 26.339 -4.391 0.248 1.00 25.00 C ATOM 594 OD1 ASP A 38 25.692 -4.711 -0.783 1.00 25.00 O ATOM 595 OD2 ASP A 38 26.802 -5.255 1.045 1.00 25.00 O ATOM 0 H ASP A 38 24.515 -4.253 2.780 1.00 25.00 H new ATOM 0 HA ASP A 38 26.519 -3.111 2.754 1.00 25.00 H new ATOM 0 HB2 ASP A 38 25.805 -2.318 -0.045 1.00 25.00 H new ATOM 0 HB3 ASP A 38 27.389 -2.550 0.669 1.00 25.00 H new ATOM 600 N THR A 39 24.600 -1.193 3.477 1.00 25.00 N ATOM 601 CA THR A 39 24.105 0.063 4.032 1.00 25.00 C ATOM 602 C THR A 39 25.209 0.841 4.724 1.00 25.00 C ATOM 603 O THR A 39 26.096 0.259 5.309 1.00 25.00 O ATOM 604 CB THR A 39 22.971 -0.227 5.053 1.00 25.00 C ATOM 605 OG1 THR A 39 22.508 0.985 5.650 1.00 25.00 O ATOM 606 CG2 THR A 39 23.399 -1.171 6.133 1.00 25.00 C ATOM 0 H THR A 39 24.183 -2.016 3.912 1.00 25.00 H new ATOM 0 HA THR A 39 23.726 0.665 3.206 1.00 25.00 H new ATOM 0 HB THR A 39 22.165 -0.699 4.491 1.00 25.00 H new ATOM 0 HG1 THR A 39 21.688 1.279 5.201 1.00 25.00 H new ATOM 0 HG21 THR A 39 22.569 -1.339 6.819 1.00 25.00 H new ATOM 0 HG22 THR A 39 23.701 -2.120 5.689 1.00 25.00 H new ATOM 0 HG23 THR A 39 24.240 -0.742 6.679 1.00 25.00 H new ATOM 614 N GLN A 40 25.143 2.164 4.637 1.00 25.00 N ATOM 615 CA GLN A 40 26.125 3.080 5.245 1.00 25.00 C ATOM 616 C GLN A 40 27.562 2.834 4.759 1.00 25.00 C ATOM 617 O GLN A 40 28.515 3.288 5.375 1.00 25.00 O ATOM 618 CB GLN A 40 26.063 3.019 6.782 1.00 25.00 C ATOM 619 CG GLN A 40 24.652 2.893 7.340 1.00 25.00 C ATOM 620 CD GLN A 40 24.579 3.195 8.817 1.00 25.00 C ATOM 621 OE1 GLN A 40 24.592 4.340 9.222 1.00 25.00 O ATOM 622 NE2 GLN A 40 24.479 2.172 9.624 1.00 25.00 N ATOM 0 H GLN A 40 24.397 2.647 4.136 1.00 25.00 H new ATOM 0 HA GLN A 40 25.846 4.081 4.916 1.00 25.00 H new ATOM 0 HB2 GLN A 40 26.656 2.171 7.126 1.00 25.00 H new ATOM 0 HB3 GLN A 40 26.525 3.918 7.190 1.00 25.00 H new ATOM 0 HG2 GLN A 40 23.991 3.572 6.802 1.00 25.00 H new ATOM 0 HG3 GLN A 40 24.284 1.883 7.162 1.00 25.00 H new ATOM 0 HE21 GLN A 40 24.471 1.224 9.247 1.00 25.00 H new ATOM 0 HE22 GLN A 40 24.409 2.321 10.631 1.00 25.00 H new ATOM 631 N GLY A 41 27.703 2.107 3.656 1.00 25.00 N ATOM 632 CA GLY A 41 29.020 1.769 3.138 1.00 25.00 C ATOM 633 C GLY A 41 29.623 0.590 3.878 1.00 25.00 C ATOM 634 O GLY A 41 30.810 0.308 3.758 1.00 25.00 O ATOM 0 H GLY A 41 26.924 1.743 3.107 1.00 25.00 H new ATOM 0 HA2 GLY A 41 28.945 1.534 2.076 1.00 25.00 H new ATOM 0 HA3 GLY A 41 29.680 2.632 3.227 1.00 25.00 H new ATOM 638 N LEU A 42 28.805 -0.090 4.669 1.00 25.00 N ATOM 639 CA LEU A 42 29.246 -1.230 5.443 1.00 25.00 C ATOM 640 C LEU A 42 29.037 -2.472 4.591 1.00 25.00 C ATOM 641 O LEU A 42 27.970 -3.079 4.602 1.00 25.00 O ATOM 642 CB LEU A 42 28.435 -1.315 6.736 1.00 25.00 C ATOM 643 CG LEU A 42 28.460 -0.083 7.646 1.00 25.00 C ATOM 644 CD1 LEU A 42 27.361 -0.209 8.683 1.00 25.00 C ATOM 645 CD2 LEU A 42 29.792 0.055 8.337 1.00 25.00 C ATOM 0 H LEU A 42 27.818 0.137 4.789 1.00 25.00 H new ATOM 0 HA LEU A 42 30.298 -1.139 5.713 1.00 25.00 H new ATOM 0 HB2 LEU A 42 27.398 -1.523 6.474 1.00 25.00 H new ATOM 0 HB3 LEU A 42 28.797 -2.169 7.309 1.00 25.00 H new ATOM 0 HG LEU A 42 28.301 0.805 7.034 1.00 25.00 H new ATOM 0 HD11 LEU A 42 27.373 0.665 9.334 1.00 25.00 H new ATOM 0 HD12 LEU A 42 26.395 -0.275 8.183 1.00 25.00 H new ATOM 0 HD13 LEU A 42 27.524 -1.107 9.278 1.00 25.00 H new ATOM 0 HD21 LEU A 42 29.781 0.938 8.976 1.00 25.00 H new ATOM 0 HD22 LEU A 42 29.980 -0.830 8.944 1.00 25.00 H new ATOM 0 HD23 LEU A 42 30.580 0.157 7.591 1.00 25.00 H new ATOM 657 N ASP A 43 30.045 -2.821 3.815 1.00 25.00 N ATOM 658 CA ASP A 43 29.955 -3.974 2.917 1.00 25.00 C ATOM 659 C ASP A 43 29.610 -5.238 3.699 1.00 25.00 C ATOM 660 O ASP A 43 30.217 -5.545 4.728 1.00 25.00 O ATOM 661 CB ASP A 43 31.277 -4.190 2.179 1.00 25.00 C ATOM 662 CG ASP A 43 31.304 -3.512 0.823 1.00 25.00 C ATOM 663 OD1 ASP A 43 32.105 -2.575 0.635 1.00 25.00 O ATOM 664 OD2 ASP A 43 30.551 -3.953 -0.073 1.00 25.00 O ATOM 0 H ASP A 43 30.938 -2.328 3.783 1.00 25.00 H new ATOM 0 HA ASP A 43 29.167 -3.769 2.193 1.00 25.00 H new ATOM 0 HB2 ASP A 43 32.096 -3.808 2.789 1.00 25.00 H new ATOM 0 HB3 ASP A 43 31.447 -5.259 2.050 1.00 25.00 H new ATOM 669 N GLY A 44 28.608 -5.962 3.218 1.00 25.00 N ATOM 670 CA GLY A 44 28.186 -7.187 3.874 1.00 25.00 C ATOM 671 C GLY A 44 27.160 -6.984 4.974 1.00 25.00 C ATOM 672 O GLY A 44 26.516 -7.950 5.394 1.00 25.00 O ATOM 0 H GLY A 44 28.077 -5.722 2.381 1.00 25.00 H new ATOM 0 HA2 GLY A 44 27.771 -7.862 3.126 1.00 25.00 H new ATOM 0 HA3 GLY A 44 29.062 -7.680 4.296 1.00 25.00 H new ATOM 676 N TRP A 45 26.974 -5.756 5.437 1.00 25.00 N ATOM 677 CA TRP A 45 25.976 -5.457 6.442 1.00 25.00 C ATOM 678 C TRP A 45 24.696 -5.049 5.738 1.00 25.00 C ATOM 679 O TRP A 45 24.707 -4.223 4.837 1.00 25.00 O ATOM 680 CB TRP A 45 26.488 -4.320 7.309 1.00 25.00 C ATOM 681 CG TRP A 45 27.535 -4.779 8.266 1.00 25.00 C ATOM 682 CD1 TRP A 45 28.876 -4.591 8.185 1.00 25.00 C ATOM 683 CD2 TRP A 45 27.327 -5.521 9.474 1.00 25.00 C ATOM 684 NE1 TRP A 45 29.524 -5.133 9.252 1.00 25.00 N ATOM 685 CE2 TRP A 45 28.602 -5.729 10.071 1.00 25.00 C ATOM 686 CE3 TRP A 45 26.187 -6.018 10.124 1.00 25.00 C ATOM 687 CZ2 TRP A 45 28.756 -6.427 11.284 1.00 25.00 C ATOM 688 CZ3 TRP A 45 26.334 -6.703 11.339 1.00 25.00 C ATOM 689 CH2 TRP A 45 27.616 -6.907 11.906 1.00 25.00 C ATOM 0 H TRP A 45 27.510 -4.946 5.126 1.00 25.00 H new ATOM 0 HA TRP A 45 25.780 -6.325 7.071 1.00 25.00 H new ATOM 0 HB2 TRP A 45 26.896 -3.534 6.673 1.00 25.00 H new ATOM 0 HB3 TRP A 45 25.657 -3.883 7.862 1.00 25.00 H new ATOM 0 HD1 TRP A 45 29.368 -4.075 7.374 1.00 25.00 H new ATOM 0 HE1 TRP A 45 30.530 -5.101 9.415 1.00 25.00 H new ATOM 0 HE3 TRP A 45 25.207 -5.875 9.693 1.00 25.00 H new ATOM 0 HZ2 TRP A 45 29.733 -6.583 11.716 1.00 25.00 H new ATOM 0 HZ3 TRP A 45 25.459 -7.079 11.848 1.00 25.00 H new ATOM 0 HH2 TRP A 45 27.706 -7.445 12.838 1.00 25.00 H new ATOM 700 N TRP A 46 23.586 -5.652 6.121 1.00 25.00 N ATOM 701 CA TRP A 46 22.309 -5.385 5.473 1.00 25.00 C ATOM 702 C TRP A 46 21.374 -4.730 6.472 1.00 25.00 C ATOM 703 O TRP A 46 21.198 -5.230 7.573 1.00 25.00 O ATOM 704 CB TRP A 46 21.704 -6.693 4.951 1.00 25.00 C ATOM 705 CG TRP A 46 22.544 -7.377 3.875 1.00 25.00 C ATOM 706 CD1 TRP A 46 23.678 -6.913 3.276 1.00 25.00 C ATOM 707 CD2 TRP A 46 22.304 -8.663 3.271 1.00 25.00 C ATOM 708 NE1 TRP A 46 24.155 -7.786 2.348 1.00 25.00 N ATOM 709 CE2 TRP A 46 23.340 -8.882 2.313 1.00 25.00 C ATOM 710 CE3 TRP A 46 21.320 -9.656 3.440 1.00 25.00 C ATOM 711 CZ2 TRP A 46 23.403 -10.052 1.523 1.00 25.00 C ATOM 712 CZ3 TRP A 46 21.394 -10.839 2.668 1.00 25.00 C ATOM 713 CH2 TRP A 46 22.426 -11.017 1.708 1.00 25.00 C ATOM 0 H TRP A 46 23.540 -6.332 6.879 1.00 25.00 H new ATOM 0 HA TRP A 46 22.458 -4.714 4.627 1.00 25.00 H new ATOM 0 HB2 TRP A 46 21.573 -7.380 5.787 1.00 25.00 H new ATOM 0 HB3 TRP A 46 20.712 -6.488 4.548 1.00 25.00 H new ATOM 0 HD1 TRP A 46 24.142 -5.966 3.510 1.00 25.00 H new ATOM 0 HE1 TRP A 46 24.985 -7.645 1.772 1.00 25.00 H new ATOM 0 HE3 TRP A 46 20.519 -9.516 4.150 1.00 25.00 H new ATOM 0 HZ2 TRP A 46 24.190 -10.190 0.796 1.00 25.00 H new ATOM 0 HZ3 TRP A 46 20.657 -11.616 2.810 1.00 25.00 H new ATOM 0 HH2 TRP A 46 22.449 -11.918 1.113 1.00 25.00 H new ATOM 724 N LEU A 47 20.792 -3.604 6.099 1.00 25.00 N ATOM 725 CA LEU A 47 19.862 -2.896 6.968 1.00 25.00 C ATOM 726 C LEU A 47 18.571 -3.667 6.959 1.00 25.00 C ATOM 727 O LEU A 47 17.985 -3.865 5.904 1.00 25.00 O ATOM 728 CB LEU A 47 19.604 -1.483 6.446 1.00 25.00 C ATOM 729 CG LEU A 47 18.632 -0.621 7.258 1.00 25.00 C ATOM 730 CD1 LEU A 47 19.078 -0.470 8.699 1.00 25.00 C ATOM 731 CD2 LEU A 47 18.492 0.746 6.609 1.00 25.00 C ATOM 0 H LEU A 47 20.947 -3.156 5.196 1.00 25.00 H new ATOM 0 HA LEU A 47 20.276 -2.817 7.973 1.00 25.00 H new ATOM 0 HB2 LEU A 47 20.559 -0.960 6.390 1.00 25.00 H new ATOM 0 HB3 LEU A 47 19.223 -1.560 5.428 1.00 25.00 H new ATOM 0 HG LEU A 47 17.666 -1.125 7.266 1.00 25.00 H new ATOM 0 HD11 LEU A 47 18.361 0.148 9.239 1.00 25.00 H new ATOM 0 HD12 LEU A 47 19.135 -1.453 9.167 1.00 25.00 H new ATOM 0 HD13 LEU A 47 20.059 0.003 8.728 1.00 25.00 H new ATOM 0 HD21 LEU A 47 17.800 1.355 7.190 1.00 25.00 H new ATOM 0 HD22 LEU A 47 19.466 1.235 6.576 1.00 25.00 H new ATOM 0 HD23 LEU A 47 18.110 0.630 5.595 1.00 25.00 H new ATOM 743 N CYS A 48 18.124 -4.100 8.121 1.00 25.00 N ATOM 744 CA CYS A 48 16.874 -4.824 8.231 1.00 25.00 C ATOM 745 C CYS A 48 16.070 -4.290 9.392 1.00 25.00 C ATOM 746 O CYS A 48 16.554 -3.479 10.173 1.00 25.00 O ATOM 747 CB CYS A 48 17.138 -6.324 8.419 1.00 25.00 C ATOM 748 SG CYS A 48 18.370 -7.005 7.275 1.00 25.00 S ATOM 0 H CYS A 48 18.611 -3.962 9.007 1.00 25.00 H new ATOM 0 HA CYS A 48 16.307 -4.684 7.311 1.00 25.00 H new ATOM 0 HB2 CYS A 48 17.472 -6.498 9.442 1.00 25.00 H new ATOM 0 HB3 CYS A 48 16.201 -6.866 8.292 1.00 25.00 H new ATOM 0 HG CYS A 48 19.482 -6.341 7.389 1.00 25.00 H new ATOM 754 N SER A 49 14.843 -4.761 9.506 1.00 25.00 N ATOM 755 CA SER A 49 13.970 -4.398 10.601 1.00 25.00 C ATOM 756 C SER A 49 13.405 -5.680 11.195 1.00 25.00 C ATOM 757 O SER A 49 12.965 -6.578 10.469 1.00 25.00 O ATOM 758 CB SER A 49 12.882 -3.450 10.099 1.00 25.00 C ATOM 759 OG SER A 49 11.600 -4.053 10.088 1.00 25.00 O ATOM 0 H SER A 49 14.424 -5.408 8.838 1.00 25.00 H new ATOM 0 HA SER A 49 14.510 -3.866 11.384 1.00 25.00 H new ATOM 0 HB2 SER A 49 12.857 -2.563 10.732 1.00 25.00 H new ATOM 0 HB3 SER A 49 13.132 -3.116 9.092 1.00 25.00 H new ATOM 0 HG SER A 49 10.938 -3.408 9.761 1.00 25.00 H new ATOM 765 N LEU A 50 13.494 -5.792 12.512 1.00 25.00 N ATOM 766 CA LEU A 50 13.047 -6.973 13.241 1.00 25.00 C ATOM 767 C LEU A 50 12.450 -6.485 14.547 1.00 25.00 C ATOM 768 O LEU A 50 13.019 -5.604 15.183 1.00 25.00 O ATOM 769 CB LEU A 50 14.231 -7.896 13.536 1.00 25.00 C ATOM 770 CG LEU A 50 13.858 -9.209 14.238 1.00 25.00 C ATOM 771 CD1 LEU A 50 13.834 -10.336 13.265 1.00 25.00 C ATOM 772 CD2 LEU A 50 14.824 -9.502 15.363 1.00 25.00 C ATOM 0 H LEU A 50 13.881 -5.062 13.110 1.00 25.00 H new ATOM 0 HA LEU A 50 12.319 -7.533 12.654 1.00 25.00 H new ATOM 0 HB2 LEU A 50 14.734 -8.131 12.598 1.00 25.00 H new ATOM 0 HB3 LEU A 50 14.948 -7.358 14.156 1.00 25.00 H new ATOM 0 HG LEU A 50 12.859 -9.099 14.661 1.00 25.00 H new ATOM 0 HD11 LEU A 50 13.568 -11.258 13.782 1.00 25.00 H new ATOM 0 HD12 LEU A 50 13.098 -10.130 12.488 1.00 25.00 H new ATOM 0 HD13 LEU A 50 14.819 -10.446 12.812 1.00 25.00 H new ATOM 0 HD21 LEU A 50 14.544 -10.437 15.849 1.00 25.00 H new ATOM 0 HD22 LEU A 50 15.834 -9.590 14.962 1.00 25.00 H new ATOM 0 HD23 LEU A 50 14.792 -8.691 16.090 1.00 25.00 H new ATOM 784 N HIS A 51 11.284 -7.010 14.904 1.00 25.00 N ATOM 785 CA HIS A 51 10.560 -6.617 16.126 1.00 25.00 C ATOM 786 C HIS A 51 10.312 -5.098 16.175 1.00 25.00 C ATOM 787 O HIS A 51 10.231 -4.507 17.244 1.00 25.00 O ATOM 788 CB HIS A 51 11.336 -7.055 17.385 1.00 25.00 C ATOM 789 CG HIS A 51 11.607 -8.528 17.452 1.00 25.00 C ATOM 790 ND1 HIS A 51 12.618 -9.092 18.188 1.00 25.00 N ATOM 791 CD2 HIS A 51 10.976 -9.579 16.858 1.00 25.00 C ATOM 792 CE1 HIS A 51 12.566 -10.410 18.024 1.00 25.00 C ATOM 793 NE2 HIS A 51 11.578 -10.762 17.229 1.00 25.00 N ATOM 0 H HIS A 51 10.804 -7.725 14.357 1.00 25.00 H new ATOM 0 HA HIS A 51 9.594 -7.122 16.104 1.00 25.00 H new ATOM 0 HB2 HIS A 51 12.285 -6.519 17.419 1.00 25.00 H new ATOM 0 HB3 HIS A 51 10.771 -6.759 18.269 1.00 25.00 H new ATOM 0 HD2 HIS A 51 10.128 -9.497 16.194 1.00 25.00 H new ATOM 0 HE1 HIS A 51 13.250 -11.106 18.486 1.00 25.00 H new ATOM 0 HE2 HIS A 51 11.315 -11.707 16.948 1.00 25.00 H new ATOM 801 N GLY A 52 10.198 -4.474 15.008 1.00 25.00 N ATOM 802 CA GLY A 52 9.957 -3.038 14.941 1.00 25.00 C ATOM 803 C GLY A 52 11.188 -2.166 15.146 1.00 25.00 C ATOM 804 O GLY A 52 11.070 -0.946 15.193 1.00 25.00 O ATOM 0 H GLY A 52 10.268 -4.936 14.101 1.00 25.00 H new ATOM 0 HA2 GLY A 52 9.522 -2.803 13.969 1.00 25.00 H new ATOM 0 HA3 GLY A 52 9.215 -2.774 15.694 1.00 25.00 H new ATOM 808 N ARG A 53 12.368 -2.766 15.249 1.00 25.00 N ATOM 809 CA ARG A 53 13.611 -2.018 15.438 1.00 25.00 C ATOM 810 C ARG A 53 14.424 -2.222 14.181 1.00 25.00 C ATOM 811 O ARG A 53 14.489 -3.325 13.656 1.00 25.00 O ATOM 812 CB ARG A 53 14.369 -2.555 16.664 1.00 25.00 C ATOM 813 CG ARG A 53 15.148 -1.496 17.480 1.00 25.00 C ATOM 814 CD ARG A 53 16.475 -1.092 16.825 1.00 25.00 C ATOM 815 NE ARG A 53 17.348 -0.348 17.754 1.00 25.00 N ATOM 816 CZ ARG A 53 18.599 0.033 17.496 1.00 25.00 C ATOM 817 NH1 ARG A 53 19.189 -0.185 16.351 1.00 25.00 N ATOM 818 NH2 ARG A 53 19.275 0.643 18.424 1.00 25.00 N ATOM 0 H ARG A 53 12.493 -3.777 15.205 1.00 25.00 H new ATOM 0 HA ARG A 53 13.418 -0.959 15.613 1.00 25.00 H new ATOM 0 HB2 ARG A 53 13.655 -3.045 17.325 1.00 25.00 H new ATOM 0 HB3 ARG A 53 15.070 -3.320 16.330 1.00 25.00 H new ATOM 0 HG2 ARG A 53 14.525 -0.610 17.603 1.00 25.00 H new ATOM 0 HG3 ARG A 53 15.346 -1.888 18.478 1.00 25.00 H new ATOM 0 HD2 ARG A 53 16.994 -1.985 16.477 1.00 25.00 H new ATOM 0 HD3 ARG A 53 16.274 -0.478 15.947 1.00 25.00 H new ATOM 0 HE ARG A 53 16.963 -0.106 18.667 1.00 25.00 H new ATOM 0 HH11 ARG A 53 18.690 -0.667 15.604 1.00 25.00 H new ATOM 0 HH12 ARG A 53 20.149 0.127 16.204 1.00 25.00 H new ATOM 0 HH21 ARG A 53 18.847 0.823 19.332 1.00 25.00 H new ATOM 0 HH22 ARG A 53 20.234 0.942 18.244 1.00 25.00 H new ATOM 832 N GLN A 54 15.024 -1.158 13.691 1.00 25.00 N ATOM 833 CA GLN A 54 15.865 -1.222 12.505 1.00 25.00 C ATOM 834 C GLN A 54 17.320 -1.359 12.919 1.00 25.00 C ATOM 835 O GLN A 54 17.719 -0.822 13.944 1.00 25.00 O ATOM 836 CB GLN A 54 15.693 0.051 11.685 1.00 25.00 C ATOM 837 CG GLN A 54 14.799 -0.126 10.492 1.00 25.00 C ATOM 838 CD GLN A 54 14.571 1.172 9.733 1.00 25.00 C ATOM 839 OE1 GLN A 54 13.444 1.545 9.460 1.00 25.00 O ATOM 840 NE2 GLN A 54 15.636 1.849 9.383 1.00 25.00 N ATOM 0 H GLN A 54 14.946 -0.226 14.098 1.00 25.00 H new ATOM 0 HA GLN A 54 15.573 -2.084 11.905 1.00 25.00 H new ATOM 0 HB2 GLN A 54 15.284 0.834 12.324 1.00 25.00 H new ATOM 0 HB3 GLN A 54 16.672 0.393 11.349 1.00 25.00 H new ATOM 0 HG2 GLN A 54 15.238 -0.863 9.820 1.00 25.00 H new ATOM 0 HG3 GLN A 54 13.839 -0.525 10.819 1.00 25.00 H new ATOM 0 HE21 GLN A 54 16.564 1.504 9.630 1.00 25.00 H new ATOM 0 HE22 GLN A 54 15.538 2.721 8.863 1.00 25.00 H new ATOM 849 N GLY A 55 18.111 -2.052 12.119 1.00 25.00 N ATOM 850 CA GLY A 55 19.525 -2.191 12.405 1.00 25.00 C ATOM 851 C GLY A 55 20.225 -3.023 11.354 1.00 25.00 C ATOM 852 O GLY A 55 19.571 -3.641 10.515 1.00 25.00 O ATOM 0 H GLY A 55 17.799 -2.525 11.271 1.00 25.00 H new ATOM 0 HA2 GLY A 55 19.986 -1.204 12.455 1.00 25.00 H new ATOM 0 HA3 GLY A 55 19.655 -2.654 13.383 1.00 25.00 H new ATOM 856 N ILE A 56 21.547 -3.027 11.375 1.00 25.00 N ATOM 857 CA ILE A 56 22.331 -3.781 10.407 1.00 25.00 C ATOM 858 C ILE A 56 22.403 -5.242 10.833 1.00 25.00 C ATOM 859 O ILE A 56 22.194 -5.587 12.000 1.00 25.00 O ATOM 860 CB ILE A 56 23.759 -3.179 10.231 1.00 25.00 C ATOM 861 CG1 ILE A 56 24.561 -3.308 11.543 1.00 25.00 C ATOM 862 CG2 ILE A 56 23.637 -1.699 9.821 1.00 25.00 C ATOM 863 CD1 ILE A 56 25.967 -2.752 11.488 1.00 25.00 C ATOM 0 H ILE A 56 22.105 -2.513 12.057 1.00 25.00 H new ATOM 0 HA ILE A 56 21.836 -3.717 9.438 1.00 25.00 H new ATOM 0 HB ILE A 56 24.290 -3.727 9.453 1.00 25.00 H new ATOM 0 HG12 ILE A 56 24.015 -2.798 12.337 1.00 25.00 H new ATOM 0 HG13 ILE A 56 24.613 -4.362 11.818 1.00 25.00 H new ATOM 0 HG21 ILE A 56 24.632 -1.273 9.696 1.00 25.00 H new ATOM 0 HG22 ILE A 56 23.091 -1.626 8.881 1.00 25.00 H new ATOM 0 HG23 ILE A 56 23.101 -1.150 10.595 1.00 25.00 H new ATOM 0 HD11 ILE A 56 26.450 -2.888 12.455 1.00 25.00 H new ATOM 0 HD12 ILE A 56 26.536 -3.277 10.721 1.00 25.00 H new ATOM 0 HD13 ILE A 56 25.929 -1.689 11.248 1.00 25.00 H new ATOM 875 N VAL A 57 22.647 -6.097 9.858 1.00 25.00 N ATOM 876 CA VAL A 57 22.696 -7.542 10.054 1.00 25.00 C ATOM 877 C VAL A 57 23.805 -8.098 9.173 1.00 25.00 C ATOM 878 O VAL A 57 23.942 -7.679 8.026 1.00 25.00 O ATOM 879 CB VAL A 57 21.362 -8.180 9.588 1.00 25.00 C ATOM 880 CG1 VAL A 57 21.417 -9.681 9.589 1.00 25.00 C ATOM 881 CG2 VAL A 57 20.195 -7.664 10.443 1.00 25.00 C ATOM 0 H VAL A 57 22.819 -5.809 8.895 1.00 25.00 H new ATOM 0 HA VAL A 57 22.868 -7.764 11.107 1.00 25.00 H new ATOM 0 HB VAL A 57 21.197 -7.876 8.554 1.00 25.00 H new ATOM 0 HG11 VAL A 57 20.459 -10.080 9.255 1.00 25.00 H new ATOM 0 HG12 VAL A 57 22.205 -10.017 8.915 1.00 25.00 H new ATOM 0 HG13 VAL A 57 21.627 -10.037 10.598 1.00 25.00 H new ATOM 0 HG21 VAL A 57 19.265 -8.121 10.104 1.00 25.00 H new ATOM 0 HG22 VAL A 57 20.367 -7.924 11.488 1.00 25.00 H new ATOM 0 HG23 VAL A 57 20.124 -6.581 10.345 1.00 25.00 H new ATOM 891 N PRO A 58 24.588 -9.065 9.668 1.00 25.00 N ATOM 892 CA PRO A 58 25.583 -9.669 8.784 1.00 25.00 C ATOM 893 C PRO A 58 24.910 -10.535 7.712 1.00 25.00 C ATOM 894 O PRO A 58 24.325 -11.582 8.008 1.00 25.00 O ATOM 895 CB PRO A 58 26.429 -10.501 9.747 1.00 25.00 C ATOM 896 CG PRO A 58 25.495 -10.874 10.849 1.00 25.00 C ATOM 897 CD PRO A 58 24.575 -9.695 11.000 1.00 25.00 C ATOM 0 HA PRO A 58 26.173 -8.943 8.225 1.00 25.00 H new ATOM 0 HB2 PRO A 58 26.834 -11.385 9.255 1.00 25.00 H new ATOM 0 HB3 PRO A 58 27.277 -9.929 10.124 1.00 25.00 H new ATOM 0 HG2 PRO A 58 24.939 -11.779 10.605 1.00 25.00 H new ATOM 0 HG3 PRO A 58 26.036 -11.072 11.774 1.00 25.00 H new ATOM 0 HD2 PRO A 58 23.570 -10.006 11.285 1.00 25.00 H new ATOM 0 HD3 PRO A 58 24.927 -9.009 11.770 1.00 25.00 H new ATOM 905 N GLY A 59 25.006 -10.109 6.460 1.00 25.00 N ATOM 906 CA GLY A 59 24.402 -10.842 5.355 1.00 25.00 C ATOM 907 C GLY A 59 24.959 -12.243 5.218 1.00 25.00 C ATOM 908 O GLY A 59 24.308 -13.136 4.700 1.00 25.00 O ATOM 0 H GLY A 59 25.497 -9.259 6.184 1.00 25.00 H new ATOM 0 HA2 GLY A 59 23.324 -10.896 5.505 1.00 25.00 H new ATOM 0 HA3 GLY A 59 24.568 -10.296 4.427 1.00 25.00 H new ATOM 912 N ASN A 60 26.151 -12.449 5.761 1.00 25.00 N ATOM 913 CA ASN A 60 26.807 -13.760 5.759 1.00 25.00 C ATOM 914 C ASN A 60 26.031 -14.813 6.574 1.00 25.00 C ATOM 915 O ASN A 60 26.267 -16.007 6.447 1.00 25.00 O ATOM 916 CB ASN A 60 28.226 -13.606 6.323 1.00 25.00 C ATOM 917 CG ASN A 60 29.155 -14.709 5.874 1.00 25.00 C ATOM 918 OD1 ASN A 60 28.940 -15.344 4.859 1.00 25.00 O ATOM 919 ND2 ASN A 60 30.212 -14.911 6.607 1.00 25.00 N ATOM 0 H ASN A 60 26.695 -11.716 6.216 1.00 25.00 H new ATOM 0 HA ASN A 60 26.837 -14.117 4.730 1.00 25.00 H new ATOM 0 HB2 ASN A 60 28.634 -12.644 6.012 1.00 25.00 H new ATOM 0 HB3 ASN A 60 28.181 -13.596 7.412 1.00 25.00 H new ATOM 0 HD21 ASN A 60 30.892 -15.621 6.336 1.00 25.00 H new ATOM 0 HD22 ASN A 60 30.360 -14.359 7.452 1.00 25.00 H new ATOM 926 N ARG A 61 25.094 -14.364 7.405 1.00 25.00 N ATOM 927 CA ARG A 61 24.258 -15.266 8.209 1.00 25.00 C ATOM 928 C ARG A 61 22.791 -15.149 7.811 1.00 25.00 C ATOM 929 O ARG A 61 21.911 -15.675 8.506 1.00 25.00 O ATOM 930 CB ARG A 61 24.397 -14.922 9.697 1.00 25.00 C ATOM 931 CG ARG A 61 25.800 -15.110 10.247 1.00 25.00 C ATOM 932 CD ARG A 61 25.826 -14.822 11.737 1.00 25.00 C ATOM 933 NE ARG A 61 27.162 -15.068 12.302 1.00 25.00 N ATOM 934 CZ ARG A 61 27.490 -14.951 13.582 1.00 25.00 C ATOM 935 NH1 ARG A 61 26.632 -14.593 14.502 1.00 25.00 N ATOM 936 NH2 ARG A 61 28.713 -15.216 13.937 1.00 25.00 N ATOM 0 H ARG A 61 24.890 -13.374 7.543 1.00 25.00 H new ATOM 0 HA ARG A 61 24.596 -16.287 8.028 1.00 25.00 H new ATOM 0 HB2 ARG A 61 24.094 -13.886 9.850 1.00 25.00 H new ATOM 0 HB3 ARG A 61 23.708 -15.543 10.269 1.00 25.00 H new ATOM 0 HG2 ARG A 61 26.137 -16.130 10.061 1.00 25.00 H new ATOM 0 HG3 ARG A 61 26.493 -14.446 9.729 1.00 25.00 H new ATOM 0 HD2 ARG A 61 25.538 -13.786 11.915 1.00 25.00 H new ATOM 0 HD3 ARG A 61 25.092 -15.449 12.244 1.00 25.00 H new ATOM 0 HE ARG A 61 27.898 -15.352 11.655 1.00 25.00 H new ATOM 0 HH11 ARG A 61 25.665 -14.391 14.247 1.00 25.00 H new ATOM 0 HH12 ARG A 61 26.930 -14.516 15.475 1.00 25.00 H new ATOM 0 HH21 ARG A 61 29.396 -15.506 13.237 1.00 25.00 H new ATOM 0 HH22 ARG A 61 28.989 -15.133 14.915 1.00 25.00 H new ATOM 950 N LEU A 62 22.516 -14.451 6.718 1.00 25.00 N ATOM 951 CA LEU A 62 21.141 -14.169 6.313 1.00 25.00 C ATOM 952 C LEU A 62 20.827 -14.610 4.893 1.00 25.00 C ATOM 953 O LEU A 62 21.641 -14.488 3.989 1.00 25.00 O ATOM 954 CB LEU A 62 20.879 -12.668 6.437 1.00 25.00 C ATOM 955 CG LEU A 62 19.440 -12.270 6.756 1.00 25.00 C ATOM 956 CD1 LEU A 62 18.993 -12.727 8.101 1.00 25.00 C ATOM 957 CD2 LEU A 62 19.285 -10.770 6.631 1.00 25.00 C ATOM 0 H LEU A 62 23.226 -14.068 6.094 1.00 25.00 H new ATOM 0 HA LEU A 62 20.493 -14.743 6.976 1.00 25.00 H new ATOM 0 HB2 LEU A 62 21.528 -12.268 7.216 1.00 25.00 H new ATOM 0 HB3 LEU A 62 21.170 -12.189 5.502 1.00 25.00 H new ATOM 0 HG LEU A 62 18.800 -12.772 6.031 1.00 25.00 H new ATOM 0 HD11 LEU A 62 17.963 -12.413 8.268 1.00 25.00 H new ATOM 0 HD12 LEU A 62 19.055 -13.814 8.155 1.00 25.00 H new ATOM 0 HD13 LEU A 62 19.634 -12.289 8.866 1.00 25.00 H new ATOM 0 HD21 LEU A 62 18.257 -10.490 6.859 1.00 25.00 H new ATOM 0 HD22 LEU A 62 19.959 -10.275 7.330 1.00 25.00 H new ATOM 0 HD23 LEU A 62 19.527 -10.463 5.614 1.00 25.00 H new ATOM 969 N LYS A 63 19.617 -15.111 4.699 1.00 25.00 N ATOM 970 CA LYS A 63 19.168 -15.544 3.379 1.00 25.00 C ATOM 971 C LYS A 63 17.974 -14.761 2.931 1.00 25.00 C ATOM 972 O LYS A 63 16.919 -14.829 3.538 1.00 25.00 O ATOM 973 CB LYS A 63 18.800 -17.027 3.399 1.00 25.00 C ATOM 974 CG LYS A 63 18.240 -17.545 2.065 1.00 25.00 C ATOM 975 CD LYS A 63 18.070 -19.061 2.067 1.00 25.00 C ATOM 976 CE LYS A 63 19.427 -19.742 1.984 1.00 25.00 C ATOM 977 NZ LYS A 63 19.341 -21.240 1.927 1.00 25.00 N ATOM 0 H LYS A 63 18.925 -15.229 5.439 1.00 25.00 H new ATOM 0 HA LYS A 63 19.990 -15.375 2.684 1.00 25.00 H new ATOM 0 HB2 LYS A 63 19.684 -17.608 3.661 1.00 25.00 H new ATOM 0 HB3 LYS A 63 18.062 -17.198 4.183 1.00 25.00 H new ATOM 0 HG2 LYS A 63 17.278 -17.073 1.868 1.00 25.00 H new ATOM 0 HG3 LYS A 63 18.909 -17.256 1.254 1.00 25.00 H new ATOM 0 HD2 LYS A 63 17.552 -19.375 2.973 1.00 25.00 H new ATOM 0 HD3 LYS A 63 17.450 -19.366 1.224 1.00 25.00 H new ATOM 0 HE2 LYS A 63 19.952 -19.382 1.099 1.00 25.00 H new ATOM 0 HE3 LYS A 63 20.024 -19.453 2.849 1.00 25.00 H new ATOM 0 HZ1 LYS A 63 20.299 -21.641 1.872 1.00 25.00 H new ATOM 0 HZ2 LYS A 63 18.867 -21.593 2.782 1.00 25.00 H new ATOM 0 HZ3 LYS A 63 18.798 -21.525 1.087 1.00 25.00 H new ATOM 991 N ILE A 64 18.127 -14.078 1.816 1.00 25.00 N ATOM 992 CA ILE A 64 17.037 -13.325 1.224 1.00 25.00 C ATOM 993 C ILE A 64 16.015 -14.305 0.674 1.00 25.00 C ATOM 994 O ILE A 64 16.352 -15.197 -0.110 1.00 25.00 O ATOM 995 CB ILE A 64 17.557 -12.428 0.078 1.00 25.00 C ATOM 996 CG1 ILE A 64 18.667 -11.489 0.588 1.00 25.00 C ATOM 997 CG2 ILE A 64 16.428 -11.618 -0.526 1.00 25.00 C ATOM 998 CD1 ILE A 64 18.252 -10.520 1.718 1.00 25.00 C ATOM 0 H ILE A 64 19.003 -14.028 1.296 1.00 25.00 H new ATOM 0 HA ILE A 64 16.584 -12.688 1.984 1.00 25.00 H new ATOM 0 HB ILE A 64 17.971 -13.075 -0.695 1.00 25.00 H new ATOM 0 HG12 ILE A 64 19.499 -12.097 0.942 1.00 25.00 H new ATOM 0 HG13 ILE A 64 19.037 -10.902 -0.253 1.00 25.00 H new ATOM 0 HG21 ILE A 64 16.818 -10.994 -1.330 1.00 25.00 H new ATOM 0 HG22 ILE A 64 15.669 -12.292 -0.924 1.00 25.00 H new ATOM 0 HG23 ILE A 64 15.984 -10.984 0.242 1.00 25.00 H new ATOM 0 HD11 ILE A 64 19.106 -9.906 2.002 1.00 25.00 H new ATOM 0 HD12 ILE A 64 17.444 -9.878 1.368 1.00 25.00 H new ATOM 0 HD13 ILE A 64 17.913 -11.092 2.582 1.00 25.00 H new ATOM 1010 N LEU A 65 14.770 -14.151 1.090 1.00 25.00 N ATOM 1011 CA LEU A 65 13.695 -15.008 0.618 1.00 25.00 C ATOM 1012 C LEU A 65 13.035 -14.300 -0.561 1.00 25.00 C ATOM 1013 O LEU A 65 12.140 -13.475 -0.400 1.00 25.00 O ATOM 1014 CB LEU A 65 12.698 -15.280 1.748 1.00 25.00 C ATOM 1015 CG LEU A 65 13.321 -15.850 3.039 1.00 25.00 C ATOM 1016 CD1 LEU A 65 12.221 -15.995 4.088 1.00 25.00 C ATOM 1017 CD2 LEU A 65 14.049 -17.204 2.812 1.00 25.00 C ATOM 0 H LEU A 65 14.477 -13.437 1.757 1.00 25.00 H new ATOM 0 HA LEU A 65 14.076 -15.978 0.297 1.00 25.00 H new ATOM 0 HB2 LEU A 65 12.183 -14.351 1.990 1.00 25.00 H new ATOM 0 HB3 LEU A 65 11.943 -15.978 1.387 1.00 25.00 H new ATOM 0 HG LEU A 65 14.086 -15.154 3.384 1.00 25.00 H new ATOM 0 HD11 LEU A 65 12.646 -16.397 5.008 1.00 25.00 H new ATOM 0 HD12 LEU A 65 11.779 -15.019 4.289 1.00 25.00 H new ATOM 0 HD13 LEU A 65 11.452 -16.672 3.717 1.00 25.00 H new ATOM 0 HD21 LEU A 65 14.467 -17.555 3.756 1.00 25.00 H new ATOM 0 HD22 LEU A 65 13.339 -17.940 2.433 1.00 25.00 H new ATOM 0 HD23 LEU A 65 14.852 -17.068 2.088 1.00 25.00 H new ATOM 1327 N PRO A 89 29.122 -18.641 10.557 1.00 25.00 N ATOM 1328 CA PRO A 89 30.310 -18.008 9.983 1.00 25.00 C ATOM 1329 C PRO A 89 30.534 -16.617 10.584 1.00 25.00 C ATOM 1330 O PRO A 89 29.643 -16.066 11.248 1.00 25.00 O ATOM 1331 CB PRO A 89 29.969 -17.946 8.495 1.00 25.00 C ATOM 1332 CG PRO A 89 28.503 -17.778 8.468 1.00 25.00 C ATOM 1333 CD PRO A 89 27.996 -18.627 9.603 1.00 25.00 C ATOM 0 HA PRO A 89 31.237 -18.546 10.180 1.00 25.00 H new ATOM 0 HB2 PRO A 89 30.475 -17.114 8.005 1.00 25.00 H new ATOM 0 HB3 PRO A 89 30.276 -18.855 7.978 1.00 25.00 H new ATOM 0 HG2 PRO A 89 28.222 -16.733 8.600 1.00 25.00 H new ATOM 0 HG3 PRO A 89 28.085 -18.102 7.515 1.00 25.00 H new ATOM 0 HD2 PRO A 89 27.097 -18.203 10.050 1.00 25.00 H new ATOM 0 HD3 PRO A 89 27.742 -19.633 9.269 1.00 25.00 H new ATOM 1341 N PRO A 90 31.725 -16.031 10.381 1.00 25.00 N ATOM 1342 CA PRO A 90 31.957 -14.727 11.014 1.00 25.00 C ATOM 1343 C PRO A 90 31.164 -13.584 10.380 1.00 25.00 C ATOM 1344 O PRO A 90 30.756 -13.654 9.218 1.00 25.00 O ATOM 1345 CB PRO A 90 33.464 -14.524 10.823 1.00 25.00 C ATOM 1346 CG PRO A 90 33.772 -15.249 9.568 1.00 25.00 C ATOM 1347 CD PRO A 90 32.907 -16.484 9.622 1.00 25.00 C ATOM 0 HA PRO A 90 31.629 -14.718 12.053 1.00 25.00 H new ATOM 0 HB2 PRO A 90 33.717 -13.467 10.744 1.00 25.00 H new ATOM 0 HB3 PRO A 90 34.030 -14.925 11.664 1.00 25.00 H new ATOM 0 HG2 PRO A 90 33.542 -14.642 8.692 1.00 25.00 H new ATOM 0 HG3 PRO A 90 34.829 -15.507 9.508 1.00 25.00 H new ATOM 0 HD2 PRO A 90 32.637 -16.831 8.625 1.00 25.00 H new ATOM 0 HD3 PRO A 90 33.414 -17.310 10.121 1.00 25.00 H new ATOM 1355 N LYS A 91 30.961 -12.525 11.151 1.00 25.00 N ATOM 1356 CA LYS A 91 30.309 -11.313 10.654 1.00 25.00 C ATOM 1357 C LYS A 91 31.411 -10.425 10.064 1.00 25.00 C ATOM 1358 O LYS A 91 32.562 -10.504 10.501 1.00 25.00 O ATOM 1359 CB LYS A 91 29.564 -10.584 11.794 1.00 25.00 C ATOM 1360 CG LYS A 91 30.407 -10.306 13.053 1.00 25.00 C ATOM 1361 CD LYS A 91 29.656 -9.459 14.102 1.00 25.00 C ATOM 1362 CE LYS A 91 28.431 -10.177 14.697 1.00 25.00 C ATOM 1363 NZ LYS A 91 27.829 -9.371 15.811 1.00 25.00 N ATOM 0 H LYS A 91 31.239 -12.477 12.131 1.00 25.00 H new ATOM 0 HA LYS A 91 29.564 -11.556 9.897 1.00 25.00 H new ATOM 0 HB2 LYS A 91 29.186 -9.636 11.412 1.00 25.00 H new ATOM 0 HB3 LYS A 91 28.698 -11.180 12.080 1.00 25.00 H new ATOM 0 HG2 LYS A 91 30.703 -11.254 13.503 1.00 25.00 H new ATOM 0 HG3 LYS A 91 31.323 -9.790 12.765 1.00 25.00 H new ATOM 0 HD2 LYS A 91 30.342 -9.198 14.907 1.00 25.00 H new ATOM 0 HD3 LYS A 91 29.334 -8.525 13.642 1.00 25.00 H new ATOM 0 HE2 LYS A 91 27.687 -10.342 13.918 1.00 25.00 H new ATOM 0 HE3 LYS A 91 28.725 -11.158 15.070 1.00 25.00 H new ATOM 0 HZ1 LYS A 91 26.914 -9.784 16.083 1.00 25.00 H new ATOM 0 HZ2 LYS A 91 28.470 -9.378 16.630 1.00 25.00 H new ATOM 0 HZ3 LYS A 91 27.685 -8.392 15.492 1.00 25.00 H new ATOM 1377 N PRO A 92 31.086 -9.602 9.051 1.00 25.00 N ATOM 1378 CA PRO A 92 32.135 -8.724 8.517 1.00 25.00 C ATOM 1379 C PRO A 92 32.499 -7.609 9.513 1.00 25.00 C ATOM 1380 O PRO A 92 31.724 -7.320 10.426 1.00 25.00 O ATOM 1381 CB PRO A 92 31.495 -8.166 7.240 1.00 25.00 C ATOM 1382 CG PRO A 92 30.048 -8.194 7.501 1.00 25.00 C ATOM 1383 CD PRO A 92 29.801 -9.402 8.355 1.00 25.00 C ATOM 0 HA PRO A 92 33.077 -9.240 8.330 1.00 25.00 H new ATOM 0 HB2 PRO A 92 31.840 -7.153 7.035 1.00 25.00 H new ATOM 0 HB3 PRO A 92 31.752 -8.772 6.371 1.00 25.00 H new ATOM 0 HG2 PRO A 92 29.726 -7.285 8.010 1.00 25.00 H new ATOM 0 HG3 PRO A 92 29.485 -8.254 6.569 1.00 25.00 H new ATOM 0 HD2 PRO A 92 28.985 -9.236 9.059 1.00 25.00 H new ATOM 0 HD3 PRO A 92 29.531 -10.270 7.754 1.00 25.00 H new