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= 0.0201 X(o=0.02,f=0) 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= 1.41 K(o=1.4,f=-0.5) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0.0162 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 MET CE :methyl -129:sc= -0.773 (180deg=-1.68) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 89:sc= 1.27 USER MOD Single : A 40 GLN : amide:sc= 0.0525 X(o=0.052,f=-0.042) USER MOD Single : A 48 CYS SG : rot 58:sc= 0.0672 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 HIS : no HD1:sc= -0.0098 X(o=-0.0098,f=0) USER MOD Single : A 54 GLN : amide:sc= -0.048 X(o=-0.048,f=-0.048) USER MOD Single : A 60 ASN : amide:sc= 0.961 K(o=0.96,f=-2.6) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 170:sc= 1.25 (180deg=1.03) USER MOD ----------------------------------------------------------------- ATOM 59 N TYR A 5 13.025 1.795 0.209 1.00 25.00 N ATOM 60 CA TYR A 5 13.769 0.599 0.569 1.00 25.00 C ATOM 61 C TYR A 5 13.257 -0.642 -0.145 1.00 25.00 C ATOM 62 O TYR A 5 12.166 -0.642 -0.694 1.00 25.00 O ATOM 63 CB TYR A 5 13.686 0.418 2.080 1.00 25.00 C ATOM 64 CG TYR A 5 14.569 1.393 2.833 1.00 25.00 C ATOM 65 CD1 TYR A 5 14.020 2.334 3.726 1.00 25.00 C ATOM 66 CD2 TYR A 5 15.967 1.377 2.655 1.00 25.00 C ATOM 67 CE1 TYR A 5 14.865 3.227 4.451 1.00 25.00 C ATOM 68 CE2 TYR A 5 16.806 2.259 3.374 1.00 25.00 C ATOM 69 CZ TYR A 5 16.252 3.170 4.267 1.00 25.00 C ATOM 70 OH TYR A 5 17.081 4.008 4.965 1.00 25.00 O ATOM 0 HA TYR A 5 14.805 0.728 0.254 1.00 25.00 H new ATOM 0 HB2 TYR A 5 12.652 0.547 2.401 1.00 25.00 H new ATOM 0 HB3 TYR A 5 13.975 -0.601 2.337 1.00 25.00 H new ATOM 0 HD1 TYR A 5 12.950 2.380 3.863 1.00 25.00 H new ATOM 0 HD2 TYR A 5 16.405 0.679 1.957 1.00 25.00 H new ATOM 0 HE1 TYR A 5 14.437 3.943 5.138 1.00 25.00 H new ATOM 0 HE2 TYR A 5 17.876 2.225 3.230 1.00 25.00 H new ATOM 0 HH TYR A 5 18.012 3.831 4.714 1.00 25.00 H new ATOM 80 N LEU A 6 14.072 -1.689 -0.138 1.00 25.00 N ATOM 81 CA LEU A 6 13.779 -2.940 -0.836 1.00 25.00 C ATOM 82 C LEU A 6 12.565 -3.654 -0.239 1.00 25.00 C ATOM 83 O LEU A 6 11.743 -4.192 -0.967 1.00 25.00 O ATOM 84 CB LEU A 6 14.995 -3.877 -0.747 1.00 25.00 C ATOM 85 CG LEU A 6 16.360 -3.381 -1.251 1.00 25.00 C ATOM 86 CD1 LEU A 6 17.441 -4.418 -0.901 1.00 25.00 C ATOM 87 CD2 LEU A 6 16.359 -3.126 -2.751 1.00 25.00 C ATOM 0 H LEU A 6 14.964 -1.696 0.356 1.00 25.00 H new ATOM 0 HA LEU A 6 13.557 -2.693 -1.874 1.00 25.00 H new ATOM 0 HB2 LEU A 6 15.114 -4.162 0.298 1.00 25.00 H new ATOM 0 HB3 LEU A 6 14.751 -4.785 -1.299 1.00 25.00 H new ATOM 0 HG LEU A 6 16.573 -2.432 -0.758 1.00 25.00 H new ATOM 0 HD11 LEU A 6 18.410 -4.068 -1.258 1.00 25.00 H new ATOM 0 HD12 LEU A 6 17.479 -4.553 0.180 1.00 25.00 H new ATOM 0 HD13 LEU A 6 17.201 -5.369 -1.377 1.00 25.00 H new ATOM 0 HD21 LEU A 6 17.344 -2.777 -3.061 1.00 25.00 H new ATOM 0 HD22 LEU A 6 16.119 -4.050 -3.277 1.00 25.00 H new ATOM 0 HD23 LEU A 6 15.613 -2.368 -2.991 1.00 25.00 H new ATOM 99 N ASN A 7 12.487 -3.657 1.089 1.00 25.00 N ATOM 100 CA ASN A 7 11.396 -4.294 1.851 1.00 25.00 C ATOM 101 C ASN A 7 11.151 -5.757 1.458 1.00 25.00 C ATOM 102 O ASN A 7 10.030 -6.154 1.150 1.00 25.00 O ATOM 103 CB ASN A 7 10.102 -3.477 1.728 1.00 25.00 C ATOM 104 CG ASN A 7 10.197 -2.150 2.416 1.00 25.00 C ATOM 105 OD1 ASN A 7 10.164 -2.074 3.631 1.00 25.00 O ATOM 106 ND2 ASN A 7 10.330 -1.104 1.660 1.00 25.00 N ATOM 0 H ASN A 7 13.187 -3.212 1.683 1.00 25.00 H new ATOM 0 HA ASN A 7 11.717 -4.307 2.893 1.00 25.00 H new ATOM 0 HB2 ASN A 7 9.873 -3.321 0.674 1.00 25.00 H new ATOM 0 HB3 ASN A 7 9.275 -4.045 2.153 1.00 25.00 H new ATOM 0 HD21 ASN A 7 10.411 -0.178 2.080 1.00 25.00 H new ATOM 0 HD22 ASN A 7 10.353 -1.208 0.646 1.00 25.00 H new ATOM 113 N VAL A 8 12.203 -6.562 1.495 1.00 25.00 N ATOM 114 CA VAL A 8 12.100 -7.986 1.156 1.00 25.00 C ATOM 115 C VAL A 8 12.222 -8.775 2.454 1.00 25.00 C ATOM 116 O VAL A 8 12.730 -8.260 3.434 1.00 25.00 O ATOM 117 CB VAL A 8 13.205 -8.415 0.119 1.00 25.00 C ATOM 118 CG1 VAL A 8 13.724 -7.206 -0.650 1.00 25.00 C ATOM 119 CG2 VAL A 8 14.386 -9.116 0.779 1.00 25.00 C ATOM 0 H VAL A 8 13.141 -6.259 1.756 1.00 25.00 H new ATOM 0 HA VAL A 8 11.141 -8.189 0.678 1.00 25.00 H new ATOM 0 HB VAL A 8 12.725 -9.118 -0.562 1.00 25.00 H new ATOM 0 HG11 VAL A 8 14.486 -7.526 -1.360 1.00 25.00 H new ATOM 0 HG12 VAL A 8 12.901 -6.736 -1.188 1.00 25.00 H new ATOM 0 HG13 VAL A 8 14.157 -6.489 0.048 1.00 25.00 H new ATOM 0 HG21 VAL A 8 15.118 -9.390 0.019 1.00 25.00 H new ATOM 0 HG22 VAL A 8 14.849 -8.445 1.503 1.00 25.00 H new ATOM 0 HG23 VAL A 8 14.038 -10.015 1.288 1.00 25.00 H new ATOM 129 N LEU A 9 11.777 -10.019 2.472 1.00 25.00 N ATOM 130 CA LEU A 9 11.906 -10.844 3.672 1.00 25.00 C ATOM 131 C LEU A 9 13.157 -11.710 3.579 1.00 25.00 C ATOM 132 O LEU A 9 13.483 -12.228 2.511 1.00 25.00 O ATOM 133 CB LEU A 9 10.670 -11.735 3.848 1.00 25.00 C ATOM 134 CG LEU A 9 9.329 -11.001 4.025 1.00 25.00 C ATOM 135 CD1 LEU A 9 8.209 -12.029 4.159 1.00 25.00 C ATOM 136 CD2 LEU A 9 9.332 -10.076 5.248 1.00 25.00 C ATOM 0 H LEU A 9 11.327 -10.481 1.682 1.00 25.00 H new ATOM 0 HA LEU A 9 11.989 -10.185 4.536 1.00 25.00 H new ATOM 0 HB2 LEU A 9 10.592 -12.389 2.980 1.00 25.00 H new ATOM 0 HB3 LEU A 9 10.829 -12.375 4.716 1.00 25.00 H new ATOM 0 HG LEU A 9 9.170 -10.376 3.146 1.00 25.00 H new ATOM 0 HD11 LEU A 9 7.256 -11.515 4.285 1.00 25.00 H new ATOM 0 HD12 LEU A 9 8.172 -12.646 3.261 1.00 25.00 H new ATOM 0 HD13 LEU A 9 8.397 -12.661 5.027 1.00 25.00 H new ATOM 0 HD21 LEU A 9 8.365 -9.580 5.331 1.00 25.00 H new ATOM 0 HD22 LEU A 9 9.518 -10.663 6.148 1.00 25.00 H new ATOM 0 HD23 LEU A 9 10.115 -9.327 5.135 1.00 25.00 H new ATOM 148 N ALA A 10 13.852 -11.880 4.694 1.00 25.00 N ATOM 149 CA ALA A 10 15.046 -12.718 4.741 1.00 25.00 C ATOM 150 C ALA A 10 15.025 -13.582 6.005 1.00 25.00 C ATOM 151 O ALA A 10 14.556 -13.133 7.044 1.00 25.00 O ATOM 152 CB ALA A 10 16.287 -11.846 4.711 1.00 25.00 C ATOM 0 H ALA A 10 13.609 -11.447 5.585 1.00 25.00 H new ATOM 0 HA ALA A 10 15.061 -13.375 3.872 1.00 25.00 H new ATOM 0 HB1 ALA A 10 17.176 -12.476 4.746 1.00 25.00 H new ATOM 0 HB2 ALA A 10 16.296 -11.257 3.794 1.00 25.00 H new ATOM 0 HB3 ALA A 10 16.282 -11.177 5.571 1.00 25.00 H new ATOM 158 N LYS A 11 15.542 -14.807 5.915 1.00 25.00 N ATOM 159 CA LYS A 11 15.607 -15.727 7.061 1.00 25.00 C ATOM 160 C LYS A 11 17.020 -15.832 7.618 1.00 25.00 C ATOM 161 O LYS A 11 17.976 -15.984 6.861 1.00 25.00 O ATOM 162 CB LYS A 11 15.150 -17.131 6.651 1.00 25.00 C ATOM 163 CG LYS A 11 15.345 -18.183 7.757 1.00 25.00 C ATOM 164 CD LYS A 11 14.498 -19.431 7.570 1.00 25.00 C ATOM 165 CE LYS A 11 13.049 -19.158 7.964 1.00 25.00 C ATOM 166 NZ LYS A 11 12.269 -20.395 8.294 1.00 25.00 N ATOM 0 H LYS A 11 15.927 -15.192 5.053 1.00 25.00 H new ATOM 0 HA LYS A 11 14.947 -15.322 7.828 1.00 25.00 H new ATOM 0 HB2 LYS A 11 14.096 -17.096 6.374 1.00 25.00 H new ATOM 0 HB3 LYS A 11 15.702 -17.440 5.764 1.00 25.00 H new ATOM 0 HG2 LYS A 11 16.396 -18.470 7.792 1.00 25.00 H new ATOM 0 HG3 LYS A 11 15.105 -17.733 8.720 1.00 25.00 H new ATOM 0 HD2 LYS A 11 14.543 -19.756 6.531 1.00 25.00 H new ATOM 0 HD3 LYS A 11 14.899 -20.244 8.176 1.00 25.00 H new ATOM 0 HE2 LYS A 11 13.036 -18.491 8.826 1.00 25.00 H new ATOM 0 HE3 LYS A 11 12.553 -18.634 7.147 1.00 25.00 H new ATOM 0 HZ1 LYS A 11 11.296 -20.133 8.552 1.00 25.00 H new ATOM 0 HZ2 LYS A 11 12.250 -21.025 7.467 1.00 25.00 H new ATOM 0 HZ3 LYS A 11 12.719 -20.886 9.093 1.00 25.00 H new ATOM 180 N ALA A 12 17.131 -15.821 8.935 1.00 25.00 N ATOM 181 CA ALA A 12 18.402 -16.028 9.616 1.00 25.00 C ATOM 182 C ALA A 12 18.812 -17.507 9.527 1.00 25.00 C ATOM 183 O ALA A 12 18.037 -18.381 9.900 1.00 25.00 O ATOM 184 CB ALA A 12 18.245 -15.601 11.079 1.00 25.00 C ATOM 0 H ALA A 12 16.343 -15.668 9.565 1.00 25.00 H new ATOM 0 HA ALA A 12 19.182 -15.432 9.143 1.00 25.00 H new ATOM 0 HB1 ALA A 12 19.188 -15.749 11.605 1.00 25.00 H new ATOM 0 HB2 ALA A 12 17.967 -14.548 11.123 1.00 25.00 H new ATOM 0 HB3 ALA A 12 17.468 -16.201 11.552 1.00 25.00 H new ATOM 190 N LEU A 13 20.018 -17.795 9.051 1.00 25.00 N ATOM 191 CA LEU A 13 20.515 -19.177 8.994 1.00 25.00 C ATOM 192 C LEU A 13 21.198 -19.543 10.296 1.00 25.00 C ATOM 193 O LEU A 13 21.398 -20.716 10.593 1.00 25.00 O ATOM 194 CB LEU A 13 21.557 -19.355 7.886 1.00 25.00 C ATOM 195 CG LEU A 13 21.177 -19.219 6.411 1.00 25.00 C ATOM 196 CD1 LEU A 13 19.721 -19.592 6.125 1.00 25.00 C ATOM 197 CD2 LEU A 13 21.475 -17.831 5.935 1.00 25.00 C ATOM 0 H LEU A 13 20.673 -17.097 8.698 1.00 25.00 H new ATOM 0 HA LEU A 13 19.650 -19.812 8.804 1.00 25.00 H new ATOM 0 HB2 LEU A 13 22.351 -18.634 8.078 1.00 25.00 H new ATOM 0 HB3 LEU A 13 21.990 -20.347 8.013 1.00 25.00 H new ATOM 0 HG LEU A 13 21.784 -19.935 5.857 1.00 25.00 H new ATOM 0 HD11 LEU A 13 19.517 -19.473 5.061 1.00 25.00 H new ATOM 0 HD12 LEU A 13 19.547 -20.628 6.414 1.00 25.00 H new ATOM 0 HD13 LEU A 13 19.060 -18.940 6.696 1.00 25.00 H new ATOM 0 HD21 LEU A 13 21.202 -17.740 4.884 1.00 25.00 H new ATOM 0 HD22 LEU A 13 20.901 -17.114 6.522 1.00 25.00 H new ATOM 0 HD23 LEU A 13 22.539 -17.627 6.053 1.00 25.00 H new ATOM 209 N TYR A 14 21.583 -18.520 11.038 1.00 25.00 N ATOM 210 CA TYR A 14 22.296 -18.668 12.297 1.00 25.00 C ATOM 211 C TYR A 14 21.744 -17.568 13.172 1.00 25.00 C ATOM 212 O TYR A 14 21.131 -16.640 12.652 1.00 25.00 O ATOM 213 CB TYR A 14 23.796 -18.455 12.099 1.00 25.00 C ATOM 214 CG TYR A 14 24.406 -19.342 11.035 1.00 25.00 C ATOM 215 CD1 TYR A 14 24.506 -18.896 9.701 1.00 25.00 C ATOM 216 CD2 TYR A 14 24.876 -20.633 11.348 1.00 25.00 C ATOM 217 CE1 TYR A 14 25.057 -19.726 8.694 1.00 25.00 C ATOM 218 CE2 TYR A 14 25.438 -21.464 10.343 1.00 25.00 C ATOM 219 CZ TYR A 14 25.522 -21.002 9.028 1.00 25.00 C ATOM 220 OH TYR A 14 26.065 -21.796 8.051 1.00 25.00 O ATOM 0 H TYR A 14 21.407 -17.549 10.780 1.00 25.00 H new ATOM 0 HA TYR A 14 22.167 -19.663 12.724 1.00 25.00 H new ATOM 0 HB2 TYR A 14 23.973 -17.413 11.835 1.00 25.00 H new ATOM 0 HB3 TYR A 14 24.307 -18.635 13.045 1.00 25.00 H new ATOM 0 HD1 TYR A 14 24.157 -17.907 9.443 1.00 25.00 H new ATOM 0 HD2 TYR A 14 24.808 -20.994 12.363 1.00 25.00 H new ATOM 0 HE1 TYR A 14 25.118 -19.375 7.674 1.00 25.00 H new ATOM 0 HE2 TYR A 14 25.799 -22.450 10.595 1.00 25.00 H new ATOM 0 HH TYR A 14 26.342 -22.651 8.441 1.00 25.00 H new ATOM 230 N ASP A 15 21.958 -17.643 14.471 1.00 25.00 N ATOM 231 CA ASP A 15 21.552 -16.569 15.366 1.00 25.00 C ATOM 232 C ASP A 15 22.597 -15.462 15.300 1.00 25.00 C ATOM 233 O ASP A 15 23.662 -15.625 14.688 1.00 25.00 O ATOM 234 CB ASP A 15 21.427 -17.094 16.798 1.00 25.00 C ATOM 235 CG ASP A 15 22.725 -17.662 17.319 1.00 25.00 C ATOM 236 OD1 ASP A 15 23.339 -17.041 18.202 1.00 25.00 O ATOM 237 OD2 ASP A 15 23.107 -18.759 16.858 1.00 25.00 O ATOM 0 H ASP A 15 22.409 -18.433 14.933 1.00 25.00 H new ATOM 0 HA ASP A 15 20.581 -16.179 15.061 1.00 25.00 H new ATOM 0 HB2 ASP A 15 21.100 -16.285 17.451 1.00 25.00 H new ATOM 0 HB3 ASP A 15 20.656 -17.864 16.834 1.00 25.00 H new ATOM 242 N ASN A 16 22.293 -14.328 15.908 1.00 25.00 N ATOM 243 CA ASN A 16 23.215 -13.207 15.939 1.00 25.00 C ATOM 244 C ASN A 16 23.076 -12.455 17.240 1.00 25.00 C ATOM 245 O ASN A 16 21.964 -12.214 17.708 1.00 25.00 O ATOM 246 CB ASN A 16 22.946 -12.241 14.787 1.00 25.00 C ATOM 247 CG ASN A 16 24.089 -11.285 14.572 1.00 25.00 C ATOM 248 OD1 ASN A 16 25.220 -11.711 14.364 1.00 25.00 O ATOM 249 ND2 ASN A 16 23.825 -10.013 14.658 1.00 25.00 N ATOM 0 H ASN A 16 21.410 -14.160 16.389 1.00 25.00 H new ATOM 0 HA ASN A 16 24.224 -13.608 15.842 1.00 25.00 H new ATOM 0 HB2 ASN A 16 22.771 -12.808 13.873 1.00 25.00 H new ATOM 0 HB3 ASN A 16 22.036 -11.677 14.992 1.00 25.00 H new ATOM 0 HD21 ASN A 16 24.574 -9.328 14.551 1.00 25.00 H new ATOM 0 HD22 ASN A 16 22.870 -9.701 14.832 1.00 25.00 H new ATOM 256 N VAL A 17 24.206 -12.041 17.788 1.00 25.00 N ATOM 257 CA VAL A 17 24.239 -11.243 18.996 1.00 25.00 C ATOM 258 C VAL A 17 24.700 -9.872 18.546 1.00 25.00 C ATOM 259 O VAL A 17 25.721 -9.739 17.870 1.00 25.00 O ATOM 260 CB VAL A 17 25.212 -11.841 20.051 1.00 25.00 C ATOM 261 CG1 VAL A 17 25.271 -10.956 21.307 1.00 25.00 C ATOM 262 CG2 VAL A 17 24.760 -13.267 20.434 1.00 25.00 C ATOM 0 H VAL A 17 25.128 -12.251 17.404 1.00 25.00 H new ATOM 0 HA VAL A 17 23.264 -11.210 19.482 1.00 25.00 H new ATOM 0 HB VAL A 17 26.209 -11.883 19.613 1.00 25.00 H new ATOM 0 HG11 VAL A 17 25.958 -11.396 22.030 1.00 25.00 H new ATOM 0 HG12 VAL A 17 25.620 -9.960 21.034 1.00 25.00 H new ATOM 0 HG13 VAL A 17 24.277 -10.884 21.749 1.00 25.00 H new ATOM 0 HG21 VAL A 17 25.446 -13.680 21.173 1.00 25.00 H new ATOM 0 HG22 VAL A 17 23.754 -13.230 20.853 1.00 25.00 H new ATOM 0 HG23 VAL A 17 24.760 -13.899 19.546 1.00 25.00 H new ATOM 272 N ALA A 18 23.901 -8.874 18.871 1.00 25.00 N ATOM 273 CA ALA A 18 24.189 -7.507 18.501 1.00 25.00 C ATOM 274 C ALA A 18 25.264 -6.972 19.437 1.00 25.00 C ATOM 275 O ALA A 18 25.059 -6.902 20.649 1.00 25.00 O ATOM 276 CB ALA A 18 22.925 -6.670 18.594 1.00 25.00 C ATOM 0 H ALA A 18 23.036 -8.991 19.398 1.00 25.00 H new ATOM 0 HA ALA A 18 24.548 -7.459 17.473 1.00 25.00 H new ATOM 0 HB1 ALA A 18 23.149 -5.641 18.314 1.00 25.00 H new ATOM 0 HB2 ALA A 18 22.171 -7.074 17.919 1.00 25.00 H new ATOM 0 HB3 ALA A 18 22.547 -6.694 19.616 1.00 25.00 H new ATOM 282 N GLU A 19 26.408 -6.632 18.875 1.00 25.00 N ATOM 283 CA GLU A 19 27.532 -6.119 19.654 1.00 25.00 C ATOM 284 C GLU A 19 27.628 -4.615 19.460 1.00 25.00 C ATOM 285 O GLU A 19 28.088 -3.888 20.338 1.00 25.00 O ATOM 286 CB GLU A 19 28.824 -6.804 19.204 1.00 25.00 C ATOM 287 CG GLU A 19 28.822 -8.300 19.503 1.00 25.00 C ATOM 288 CD GLU A 19 30.092 -9.002 19.038 1.00 25.00 C ATOM 289 OE1 GLU A 19 30.819 -9.556 19.884 1.00 25.00 O ATOM 290 OE2 GLU A 19 30.315 -9.067 17.805 1.00 25.00 O ATOM 0 H GLU A 19 26.590 -6.701 17.874 1.00 25.00 H new ATOM 0 HA GLU A 19 27.379 -6.330 20.712 1.00 25.00 H new ATOM 0 HB2 GLU A 19 28.960 -6.650 18.134 1.00 25.00 H new ATOM 0 HB3 GLU A 19 29.673 -6.337 19.704 1.00 25.00 H new ATOM 0 HG2 GLU A 19 28.703 -8.450 20.576 1.00 25.00 H new ATOM 0 HG3 GLU A 19 27.961 -8.761 19.019 1.00 25.00 H new ATOM 297 N SER A 20 27.149 -4.149 18.317 1.00 25.00 N ATOM 298 CA SER A 20 27.121 -2.723 18.017 1.00 25.00 C ATOM 299 C SER A 20 25.716 -2.211 18.280 1.00 25.00 C ATOM 300 O SER A 20 24.744 -2.959 18.157 1.00 25.00 O ATOM 301 CB SER A 20 27.498 -2.503 16.552 1.00 25.00 C ATOM 302 OG SER A 20 28.787 -3.028 16.307 1.00 25.00 O ATOM 0 H SER A 20 26.772 -4.741 17.577 1.00 25.00 H new ATOM 0 HA SER A 20 27.834 -2.186 18.643 1.00 25.00 H new ATOM 0 HB2 SER A 20 26.769 -2.987 15.902 1.00 25.00 H new ATOM 0 HB3 SER A 20 27.478 -1.439 16.317 1.00 25.00 H new ATOM 0 HG SER A 20 29.024 -2.887 15.367 1.00 25.00 H new ATOM 308 N PRO A 21 25.574 -0.915 18.602 1.00 25.00 N ATOM 309 CA PRO A 21 24.232 -0.377 18.854 1.00 25.00 C ATOM 310 C PRO A 21 23.387 -0.289 17.589 1.00 25.00 C ATOM 311 O PRO A 21 22.170 -0.141 17.652 1.00 25.00 O ATOM 312 CB PRO A 21 24.528 1.012 19.421 1.00 25.00 C ATOM 313 CG PRO A 21 25.833 1.384 18.800 1.00 25.00 C ATOM 314 CD PRO A 21 26.613 0.120 18.763 1.00 25.00 C ATOM 0 HA PRO A 21 23.647 -1.011 19.521 1.00 25.00 H new ATOM 0 HB2 PRO A 21 23.745 1.724 19.162 1.00 25.00 H new ATOM 0 HB3 PRO A 21 24.594 0.993 20.509 1.00 25.00 H new ATOM 0 HG2 PRO A 21 25.692 1.791 17.799 1.00 25.00 H new ATOM 0 HG3 PRO A 21 26.346 2.148 19.385 1.00 25.00 H new ATOM 0 HD2 PRO A 21 27.323 0.109 17.936 1.00 25.00 H new ATOM 0 HD3 PRO A 21 27.187 -0.025 19.678 1.00 25.00 H new ATOM 322 N ASP A 22 24.035 -0.401 16.441 1.00 25.00 N ATOM 323 CA ASP A 22 23.365 -0.336 15.162 1.00 25.00 C ATOM 324 C ASP A 22 22.896 -1.718 14.749 1.00 25.00 C ATOM 325 O ASP A 22 22.230 -1.855 13.755 1.00 25.00 O ATOM 326 CB ASP A 22 24.359 0.172 14.106 1.00 25.00 C ATOM 327 CG ASP A 22 23.913 1.464 13.444 1.00 25.00 C ATOM 328 OD1 ASP A 22 24.791 2.207 12.966 1.00 25.00 O ATOM 329 OD2 ASP A 22 22.691 1.715 13.358 1.00 25.00 O ATOM 0 H ASP A 22 25.043 -0.540 16.375 1.00 25.00 H new ATOM 0 HA ASP A 22 22.508 0.333 15.242 1.00 25.00 H new ATOM 0 HB2 ASP A 22 25.331 0.327 14.575 1.00 25.00 H new ATOM 0 HB3 ASP A 22 24.492 -0.594 13.342 1.00 25.00 H new ATOM 334 N GLU A 23 23.317 -2.754 15.459 1.00 25.00 N ATOM 335 CA GLU A 23 23.105 -4.130 15.017 1.00 25.00 C ATOM 336 C GLU A 23 21.837 -4.764 15.598 1.00 25.00 C ATOM 337 O GLU A 23 21.395 -4.419 16.697 1.00 25.00 O ATOM 338 CB GLU A 23 24.346 -4.952 15.402 1.00 25.00 C ATOM 339 CG GLU A 23 24.466 -6.298 14.699 1.00 25.00 C ATOM 340 CD GLU A 23 25.743 -7.041 15.051 1.00 25.00 C ATOM 341 OE1 GLU A 23 26.457 -6.635 15.998 1.00 25.00 O ATOM 342 OE2 GLU A 23 26.015 -8.077 14.404 1.00 25.00 O ATOM 0 H GLU A 23 23.810 -2.670 16.348 1.00 25.00 H new ATOM 0 HA GLU A 23 22.961 -4.123 13.937 1.00 25.00 H new ATOM 0 HB2 GLU A 23 25.237 -4.363 15.183 1.00 25.00 H new ATOM 0 HB3 GLU A 23 24.333 -5.121 16.479 1.00 25.00 H new ATOM 0 HG2 GLU A 23 23.608 -6.917 14.962 1.00 25.00 H new ATOM 0 HG3 GLU A 23 24.428 -6.143 13.621 1.00 25.00 H new ATOM 349 N LEU A 24 21.265 -5.711 14.864 1.00 25.00 N ATOM 350 CA LEU A 24 20.116 -6.479 15.346 1.00 25.00 C ATOM 351 C LEU A 24 20.529 -7.833 15.890 1.00 25.00 C ATOM 352 O LEU A 24 21.361 -8.538 15.316 1.00 25.00 O ATOM 353 CB LEU A 24 19.096 -6.721 14.228 1.00 25.00 C ATOM 354 CG LEU A 24 18.299 -5.502 13.757 1.00 25.00 C ATOM 355 CD1 LEU A 24 17.349 -5.922 12.647 1.00 25.00 C ATOM 356 CD2 LEU A 24 17.516 -4.877 14.914 1.00 25.00 C ATOM 0 H LEU A 24 21.578 -5.969 13.928 1.00 25.00 H new ATOM 0 HA LEU A 24 19.671 -5.881 16.141 1.00 25.00 H new ATOM 0 HB2 LEU A 24 19.623 -7.137 13.369 1.00 25.00 H new ATOM 0 HB3 LEU A 24 18.391 -7.480 14.567 1.00 25.00 H new ATOM 0 HG LEU A 24 18.994 -4.752 13.380 1.00 25.00 H new ATOM 0 HD11 LEU A 24 16.779 -5.056 12.309 1.00 25.00 H new ATOM 0 HD12 LEU A 24 17.921 -6.328 11.813 1.00 25.00 H new ATOM 0 HD13 LEU A 24 16.664 -6.683 13.022 1.00 25.00 H new ATOM 0 HD21 LEU A 24 16.959 -4.013 14.552 1.00 25.00 H new ATOM 0 HD22 LEU A 24 16.822 -5.611 15.322 1.00 25.00 H new ATOM 0 HD23 LEU A 24 18.209 -4.561 15.694 1.00 25.00 H new ATOM 368 N SER A 25 19.880 -8.220 16.973 1.00 25.00 N ATOM 369 CA SER A 25 20.069 -9.517 17.583 1.00 25.00 C ATOM 370 C SER A 25 18.829 -10.325 17.264 1.00 25.00 C ATOM 371 O SER A 25 17.707 -9.835 17.385 1.00 25.00 O ATOM 372 CB SER A 25 20.232 -9.366 19.092 1.00 25.00 C ATOM 373 OG SER A 25 19.558 -8.201 19.549 1.00 25.00 O ATOM 0 H SER A 25 19.200 -7.634 17.457 1.00 25.00 H new ATOM 0 HA SER A 25 20.965 -10.009 17.204 1.00 25.00 H new ATOM 0 HB2 SER A 25 19.834 -10.246 19.597 1.00 25.00 H new ATOM 0 HB3 SER A 25 21.290 -9.305 19.346 1.00 25.00 H new ATOM 0 HG SER A 25 19.670 -8.118 20.519 1.00 25.00 H new ATOM 379 N PHE A 26 19.041 -11.548 16.820 1.00 25.00 N ATOM 380 CA PHE A 26 17.948 -12.441 16.430 1.00 25.00 C ATOM 381 C PHE A 26 18.374 -13.894 16.539 1.00 25.00 C ATOM 382 O PHE A 26 19.549 -14.196 16.733 1.00 25.00 O ATOM 383 CB PHE A 26 17.501 -12.140 15.003 1.00 25.00 C ATOM 384 CG PHE A 26 18.619 -12.110 14.015 1.00 25.00 C ATOM 385 CD1 PHE A 26 19.101 -10.880 13.544 1.00 25.00 C ATOM 386 CD2 PHE A 26 19.190 -13.302 13.528 1.00 25.00 C ATOM 387 CE1 PHE A 26 20.118 -10.829 12.594 1.00 25.00 C ATOM 388 CE2 PHE A 26 20.225 -13.264 12.567 1.00 25.00 C ATOM 389 CZ PHE A 26 20.679 -12.032 12.090 1.00 25.00 C ATOM 0 H PHE A 26 19.969 -11.957 16.717 1.00 25.00 H new ATOM 0 HA PHE A 26 17.113 -12.270 17.110 1.00 25.00 H new ATOM 0 HB2 PHE A 26 16.775 -12.892 14.693 1.00 25.00 H new ATOM 0 HB3 PHE A 26 16.989 -11.178 14.988 1.00 25.00 H new ATOM 0 HD1 PHE A 26 18.678 -9.961 13.923 1.00 25.00 H new ATOM 0 HD2 PHE A 26 18.833 -14.254 13.893 1.00 25.00 H new ATOM 0 HE1 PHE A 26 20.480 -9.875 12.241 1.00 25.00 H new ATOM 0 HE2 PHE A 26 20.663 -14.182 12.203 1.00 25.00 H new ATOM 0 HZ PHE A 26 21.455 -11.995 11.340 1.00 25.00 H new ATOM 399 N ARG A 27 17.412 -14.792 16.405 1.00 25.00 N ATOM 400 CA ARG A 27 17.645 -16.224 16.500 1.00 25.00 C ATOM 401 C ARG A 27 17.667 -16.827 15.100 1.00 25.00 C ATOM 402 O ARG A 27 17.066 -16.297 14.172 1.00 25.00 O ATOM 403 CB ARG A 27 16.500 -16.831 17.328 1.00 25.00 C ATOM 404 CG ARG A 27 16.691 -18.276 17.774 1.00 25.00 C ATOM 405 CD ARG A 27 17.679 -18.385 18.936 1.00 25.00 C ATOM 406 NE ARG A 27 17.952 -19.793 19.280 1.00 25.00 N ATOM 407 CZ ARG A 27 17.164 -20.578 20.010 1.00 25.00 C ATOM 408 NH1 ARG A 27 16.024 -20.165 20.512 1.00 25.00 N ATOM 409 NH2 ARG A 27 17.527 -21.808 20.231 1.00 25.00 N ATOM 0 H ARG A 27 16.439 -14.545 16.226 1.00 25.00 H new ATOM 0 HA ARG A 27 18.602 -16.433 16.978 1.00 25.00 H new ATOM 0 HB2 ARG A 27 16.353 -16.214 18.215 1.00 25.00 H new ATOM 0 HB3 ARG A 27 15.583 -16.771 16.742 1.00 25.00 H new ATOM 0 HG2 ARG A 27 15.730 -18.694 18.073 1.00 25.00 H new ATOM 0 HG3 ARG A 27 17.050 -18.871 16.934 1.00 25.00 H new ATOM 0 HD2 ARG A 27 18.611 -17.886 18.671 1.00 25.00 H new ATOM 0 HD3 ARG A 27 17.277 -17.867 19.807 1.00 25.00 H new ATOM 0 HE ARG A 27 18.819 -20.200 18.928 1.00 25.00 H new ATOM 0 HH11 ARG A 27 15.711 -19.208 20.348 1.00 25.00 H new ATOM 0 HH12 ARG A 27 15.451 -20.801 21.066 1.00 25.00 H new ATOM 0 HH21 ARG A 27 18.405 -22.158 19.847 1.00 25.00 H new ATOM 0 HH22 ARG A 27 16.934 -22.422 20.789 1.00 25.00 H new ATOM 423 N LYS A 28 18.324 -17.968 14.964 1.00 25.00 N ATOM 424 CA LYS A 28 18.285 -18.738 13.727 1.00 25.00 C ATOM 425 C LYS A 28 16.829 -19.050 13.407 1.00 25.00 C ATOM 426 O LYS A 28 16.084 -19.511 14.262 1.00 25.00 O ATOM 427 CB LYS A 28 19.064 -20.043 13.916 1.00 25.00 C ATOM 428 CG LYS A 28 18.922 -21.024 12.771 1.00 25.00 C ATOM 429 CD LYS A 28 19.841 -22.211 12.974 1.00 25.00 C ATOM 430 CE LYS A 28 19.704 -23.206 11.837 1.00 25.00 C ATOM 431 NZ LYS A 28 20.829 -24.176 11.875 1.00 25.00 N ATOM 0 H LYS A 28 18.895 -18.385 15.699 1.00 25.00 H new ATOM 0 HA LYS A 28 18.735 -18.172 12.911 1.00 25.00 H new ATOM 0 HB2 LYS A 28 20.120 -19.807 14.048 1.00 25.00 H new ATOM 0 HB3 LYS A 28 18.728 -20.524 14.835 1.00 25.00 H new ATOM 0 HG2 LYS A 28 17.889 -21.364 12.701 1.00 25.00 H new ATOM 0 HG3 LYS A 28 19.159 -20.530 11.829 1.00 25.00 H new ATOM 0 HD2 LYS A 28 20.874 -21.869 13.040 1.00 25.00 H new ATOM 0 HD3 LYS A 28 19.606 -22.700 13.920 1.00 25.00 H new ATOM 0 HE2 LYS A 28 18.754 -23.734 11.917 1.00 25.00 H new ATOM 0 HE3 LYS A 28 19.697 -22.681 10.882 1.00 25.00 H new ATOM 0 HZ1 LYS A 28 20.729 -24.855 11.093 1.00 25.00 H new ATOM 0 HZ2 LYS A 28 21.730 -23.666 11.778 1.00 25.00 H new ATOM 0 HZ3 LYS A 28 20.816 -24.687 12.781 1.00 25.00 H new ATOM 445 N GLY A 29 16.446 -18.811 12.164 1.00 25.00 N ATOM 446 CA GLY A 29 15.093 -19.091 11.714 1.00 25.00 C ATOM 447 C GLY A 29 14.187 -17.878 11.710 1.00 25.00 C ATOM 448 O GLY A 29 13.097 -17.943 11.135 1.00 25.00 O ATOM 0 H GLY A 29 17.056 -18.422 11.445 1.00 25.00 H new ATOM 0 HA2 GLY A 29 15.134 -19.506 10.707 1.00 25.00 H new ATOM 0 HA3 GLY A 29 14.657 -19.856 12.357 1.00 25.00 H new ATOM 452 N ASP A 30 14.626 -16.780 12.309 1.00 25.00 N ATOM 453 CA ASP A 30 13.812 -15.566 12.384 1.00 25.00 C ATOM 454 C ASP A 30 13.705 -14.936 11.009 1.00 25.00 C ATOM 455 O ASP A 30 14.564 -15.155 10.144 1.00 25.00 O ATOM 456 CB ASP A 30 14.432 -14.546 13.347 1.00 25.00 C ATOM 457 CG ASP A 30 14.235 -14.919 14.813 1.00 25.00 C ATOM 458 OD1 ASP A 30 13.561 -15.930 15.102 1.00 25.00 O ATOM 459 OD2 ASP A 30 14.774 -14.199 15.681 1.00 25.00 O ATOM 0 H ASP A 30 15.542 -16.701 12.752 1.00 25.00 H new ATOM 0 HA ASP A 30 12.824 -15.845 12.751 1.00 25.00 H new ATOM 0 HB2 ASP A 30 15.499 -14.459 13.139 1.00 25.00 H new ATOM 0 HB3 ASP A 30 13.991 -13.566 13.164 1.00 25.00 H new ATOM 464 N ILE A 31 12.661 -14.141 10.815 1.00 25.00 N ATOM 465 CA ILE A 31 12.432 -13.433 9.560 1.00 25.00 C ATOM 466 C ILE A 31 12.497 -11.944 9.839 1.00 25.00 C ATOM 467 O ILE A 31 11.798 -11.449 10.716 1.00 25.00 O ATOM 468 CB ILE A 31 11.034 -13.748 8.952 1.00 25.00 C ATOM 469 CG1 ILE A 31 10.876 -15.254 8.685 1.00 25.00 C ATOM 470 CG2 ILE A 31 10.819 -12.946 7.637 1.00 25.00 C ATOM 471 CD1 ILE A 31 11.924 -15.864 7.764 1.00 25.00 C ATOM 0 H ILE A 31 11.948 -13.968 11.523 1.00 25.00 H new ATOM 0 HA ILE A 31 13.193 -13.754 8.848 1.00 25.00 H new ATOM 0 HB ILE A 31 10.277 -13.447 9.676 1.00 25.00 H new ATOM 0 HG12 ILE A 31 10.904 -15.780 9.639 1.00 25.00 H new ATOM 0 HG13 ILE A 31 9.891 -15.428 8.253 1.00 25.00 H new ATOM 0 HG21 ILE A 31 9.837 -13.178 7.226 1.00 25.00 H new ATOM 0 HG22 ILE A 31 10.881 -11.878 7.848 1.00 25.00 H new ATOM 0 HG23 ILE A 31 11.589 -13.218 6.915 1.00 25.00 H new ATOM 0 HD11 ILE A 31 11.724 -16.928 7.640 1.00 25.00 H new ATOM 0 HD12 ILE A 31 11.885 -15.372 6.792 1.00 25.00 H new ATOM 0 HD13 ILE A 31 12.914 -15.729 8.200 1.00 25.00 H new ATOM 483 N MET A 32 13.305 -11.236 9.066 1.00 25.00 N ATOM 484 CA MET A 32 13.409 -9.784 9.176 1.00 25.00 C ATOM 485 C MET A 32 13.227 -9.161 7.811 1.00 25.00 C ATOM 486 O MET A 32 13.438 -9.808 6.776 1.00 25.00 O ATOM 487 CB MET A 32 14.756 -9.378 9.775 1.00 25.00 C ATOM 488 CG MET A 32 15.968 -9.910 9.037 1.00 25.00 C ATOM 489 SD MET A 32 17.271 -10.290 10.210 1.00 25.00 S ATOM 490 CE MET A 32 16.621 -11.839 10.959 1.00 25.00 C ATOM 0 H MET A 32 13.904 -11.645 8.349 1.00 25.00 H new ATOM 0 HA MET A 32 12.626 -9.424 9.843 1.00 25.00 H new ATOM 0 HB2 MET A 32 14.813 -8.290 9.800 1.00 25.00 H new ATOM 0 HB3 MET A 32 14.797 -9.724 10.808 1.00 25.00 H new ATOM 0 HG2 MET A 32 15.700 -10.804 8.474 1.00 25.00 H new ATOM 0 HG3 MET A 32 16.319 -9.173 8.315 1.00 25.00 H new ATOM 0 HE1 MET A 32 16.637 -11.752 12.045 1.00 25.00 H new ATOM 0 HE2 MET A 32 15.597 -12.004 10.623 1.00 25.00 H new ATOM 0 HE3 MET A 32 17.243 -12.680 10.653 1.00 25.00 H new ATOM 500 N THR A 33 12.807 -7.909 7.820 1.00 25.00 N ATOM 501 CA THR A 33 12.549 -7.163 6.594 1.00 25.00 C ATOM 502 C THR A 33 13.813 -6.441 6.166 1.00 25.00 C ATOM 503 O THR A 33 14.240 -5.523 6.840 1.00 25.00 O ATOM 504 CB THR A 33 11.438 -6.118 6.816 1.00 25.00 C ATOM 505 OG1 THR A 33 10.239 -6.786 7.211 1.00 25.00 O ATOM 506 CG2 THR A 33 11.157 -5.333 5.554 1.00 25.00 C ATOM 0 H THR A 33 12.634 -7.378 8.674 1.00 25.00 H new ATOM 0 HA THR A 33 12.232 -7.867 5.824 1.00 25.00 H new ATOM 0 HB THR A 33 11.774 -5.427 7.590 1.00 25.00 H new ATOM 0 HG1 THR A 33 9.529 -6.126 7.355 1.00 25.00 H new ATOM 0 HG21 THR A 33 10.369 -4.605 5.746 1.00 25.00 H new ATOM 0 HG22 THR A 33 12.062 -4.813 5.240 1.00 25.00 H new ATOM 0 HG23 THR A 33 10.837 -6.014 4.765 1.00 25.00 H new ATOM 514 N VAL A 34 14.406 -6.849 5.058 1.00 25.00 N ATOM 515 CA VAL A 34 15.617 -6.210 4.545 1.00 25.00 C ATOM 516 C VAL A 34 15.222 -4.927 3.857 1.00 25.00 C ATOM 517 O VAL A 34 14.413 -4.925 2.930 1.00 25.00 O ATOM 518 CB VAL A 34 16.365 -7.099 3.536 1.00 25.00 C ATOM 519 CG1 VAL A 34 17.671 -6.443 3.074 1.00 25.00 C ATOM 520 CG2 VAL A 34 16.654 -8.453 4.153 1.00 25.00 C ATOM 0 H VAL A 34 14.070 -7.626 4.489 1.00 25.00 H new ATOM 0 HA VAL A 34 16.285 -6.028 5.387 1.00 25.00 H new ATOM 0 HB VAL A 34 15.726 -7.228 2.662 1.00 25.00 H new ATOM 0 HG11 VAL A 34 18.175 -7.097 2.362 1.00 25.00 H new ATOM 0 HG12 VAL A 34 17.450 -5.489 2.596 1.00 25.00 H new ATOM 0 HG13 VAL A 34 18.319 -6.276 3.935 1.00 25.00 H new ATOM 0 HG21 VAL A 34 17.184 -9.076 3.432 1.00 25.00 H new ATOM 0 HG22 VAL A 34 17.271 -8.323 5.043 1.00 25.00 H new ATOM 0 HG23 VAL A 34 15.716 -8.935 4.429 1.00 25.00 H new ATOM 530 N LEU A 35 15.786 -3.835 4.330 1.00 25.00 N ATOM 531 CA LEU A 35 15.493 -2.519 3.813 1.00 25.00 C ATOM 532 C LEU A 35 16.524 -2.155 2.767 1.00 25.00 C ATOM 533 O LEU A 35 16.175 -1.754 1.672 1.00 25.00 O ATOM 534 CB LEU A 35 15.509 -1.518 4.960 1.00 25.00 C ATOM 535 CG LEU A 35 14.466 -1.809 6.046 1.00 25.00 C ATOM 536 CD1 LEU A 35 14.714 -0.893 7.197 1.00 25.00 C ATOM 537 CD2 LEU A 35 13.043 -1.626 5.529 1.00 25.00 C ATOM 0 H LEU A 35 16.466 -3.838 5.090 1.00 25.00 H new ATOM 0 HA LEU A 35 14.506 -2.504 3.350 1.00 25.00 H new ATOM 0 HB2 LEU A 35 16.501 -1.513 5.413 1.00 25.00 H new ATOM 0 HB3 LEU A 35 15.336 -0.519 4.561 1.00 25.00 H new ATOM 0 HG LEU A 35 14.564 -2.849 6.356 1.00 25.00 H new ATOM 0 HD11 LEU A 35 13.981 -1.086 7.980 1.00 25.00 H new ATOM 0 HD12 LEU A 35 15.717 -1.064 7.589 1.00 25.00 H new ATOM 0 HD13 LEU A 35 14.626 0.141 6.864 1.00 25.00 H new ATOM 0 HD21 LEU A 35 12.335 -1.842 6.329 1.00 25.00 H new ATOM 0 HD22 LEU A 35 12.908 -0.598 5.192 1.00 25.00 H new ATOM 0 HD23 LEU A 35 12.868 -2.307 4.696 1.00 25.00 H new ATOM 549 N GLU A 36 17.794 -2.370 3.064 1.00 25.00 N ATOM 550 CA GLU A 36 18.841 -2.174 2.062 1.00 25.00 C ATOM 551 C GLU A 36 20.009 -3.088 2.378 1.00 25.00 C ATOM 552 O GLU A 36 20.012 -3.750 3.411 1.00 25.00 O ATOM 553 CB GLU A 36 19.273 -0.700 1.972 1.00 25.00 C ATOM 554 CG GLU A 36 20.205 -0.208 3.007 1.00 25.00 C ATOM 555 CD GLU A 36 20.355 1.310 2.964 1.00 25.00 C ATOM 556 OE1 GLU A 36 20.331 1.894 1.861 1.00 25.00 O ATOM 557 OE2 GLU A 36 20.455 1.919 4.050 1.00 25.00 O ATOM 0 H GLU A 36 18.128 -2.677 3.978 1.00 25.00 H new ATOM 0 HA GLU A 36 18.447 -2.434 1.080 1.00 25.00 H new ATOM 0 HB2 GLU A 36 19.735 -0.542 0.998 1.00 25.00 H new ATOM 0 HB3 GLU A 36 18.376 -0.082 2.003 1.00 25.00 H new ATOM 0 HG2 GLU A 36 19.846 -0.509 3.991 1.00 25.00 H new ATOM 0 HG3 GLU A 36 21.181 -0.673 2.867 1.00 25.00 H new ATOM 564 N ARG A 37 20.991 -3.137 1.496 1.00 25.00 N ATOM 565 CA ARG A 37 22.178 -3.955 1.707 1.00 25.00 C ATOM 566 C ARG A 37 23.340 -3.023 1.530 1.00 25.00 C ATOM 567 O ARG A 37 23.213 -2.052 0.795 1.00 25.00 O ATOM 568 CB ARG A 37 22.272 -5.065 0.664 1.00 25.00 C ATOM 569 CG ARG A 37 21.057 -5.982 0.604 1.00 25.00 C ATOM 570 CD ARG A 37 21.335 -7.185 -0.285 1.00 25.00 C ATOM 571 NE ARG A 37 22.009 -6.786 -1.533 1.00 25.00 N ATOM 572 CZ ARG A 37 22.347 -7.603 -2.523 1.00 25.00 C ATOM 573 NH1 ARG A 37 22.077 -8.886 -2.499 1.00 25.00 N ATOM 574 NH2 ARG A 37 22.975 -7.113 -3.556 1.00 25.00 N ATOM 0 H ARG A 37 20.992 -2.616 0.619 1.00 25.00 H new ATOM 0 HA ARG A 37 22.156 -4.428 2.689 1.00 25.00 H new ATOM 0 HB2 ARG A 37 22.418 -4.613 -0.317 1.00 25.00 H new ATOM 0 HB3 ARG A 37 23.156 -5.668 0.872 1.00 25.00 H new ATOM 0 HG2 ARG A 37 20.798 -6.318 1.608 1.00 25.00 H new ATOM 0 HG3 ARG A 37 20.198 -5.431 0.221 1.00 25.00 H new ATOM 0 HD2 ARG A 37 21.956 -7.901 0.253 1.00 25.00 H new ATOM 0 HD3 ARG A 37 20.398 -7.690 -0.521 1.00 25.00 H new ATOM 0 HE ARG A 37 22.235 -5.798 -1.646 1.00 25.00 H new ATOM 0 HH11 ARG A 37 21.590 -9.290 -1.699 1.00 25.00 H new ATOM 0 HH12 ARG A 37 22.354 -9.480 -3.280 1.00 25.00 H new ATOM 0 HH21 ARG A 37 23.198 -6.118 -3.593 1.00 25.00 H new ATOM 0 HH22 ARG A 37 23.243 -7.725 -4.327 1.00 25.00 H new ATOM 588 N ASP A 38 24.440 -3.326 2.203 1.00 25.00 N ATOM 589 CA ASP A 38 25.684 -2.568 2.096 1.00 25.00 C ATOM 590 C ASP A 38 25.406 -1.123 2.536 1.00 25.00 C ATOM 591 O ASP A 38 25.913 -0.137 1.998 1.00 25.00 O ATOM 592 CB ASP A 38 26.245 -2.734 0.676 1.00 25.00 C ATOM 593 CG ASP A 38 26.208 -4.206 0.221 1.00 25.00 C ATOM 594 OD1 ASP A 38 25.504 -4.517 -0.781 1.00 25.00 O ATOM 595 OD2 ASP A 38 26.731 -5.078 0.968 1.00 25.00 O ATOM 0 H ASP A 38 24.498 -4.114 2.848 1.00 25.00 H new ATOM 0 HA ASP A 38 26.467 -2.936 2.759 1.00 25.00 H new ATOM 0 HB2 ASP A 38 25.667 -2.123 -0.018 1.00 25.00 H new ATOM 0 HB3 ASP A 38 27.271 -2.368 0.644 1.00 25.00 H new ATOM 600 N THR A 39 24.528 -1.047 3.528 1.00 25.00 N ATOM 601 CA THR A 39 24.036 0.209 4.093 1.00 25.00 C ATOM 602 C THR A 39 25.161 0.975 4.756 1.00 25.00 C ATOM 603 O THR A 39 26.070 0.382 5.298 1.00 25.00 O ATOM 604 CB THR A 39 22.931 -0.072 5.134 1.00 25.00 C ATOM 605 OG1 THR A 39 22.470 1.152 5.711 1.00 25.00 O ATOM 606 CG2 THR A 39 23.400 -0.977 6.229 1.00 25.00 C ATOM 0 H THR A 39 24.128 -1.873 3.974 1.00 25.00 H new ATOM 0 HA THR A 39 23.628 0.809 3.279 1.00 25.00 H new ATOM 0 HB THR A 39 22.119 -0.570 4.604 1.00 25.00 H new ATOM 0 HG1 THR A 39 21.734 1.511 5.173 1.00 25.00 H new ATOM 0 HG21 THR A 39 22.587 -1.144 6.936 1.00 25.00 H new ATOM 0 HG22 THR A 39 23.713 -1.930 5.804 1.00 25.00 H new ATOM 0 HG23 THR A 39 24.242 -0.516 6.746 1.00 25.00 H new ATOM 614 N GLN A 40 25.101 2.300 4.678 1.00 25.00 N ATOM 615 CA GLN A 40 26.133 3.201 5.220 1.00 25.00 C ATOM 616 C GLN A 40 27.530 2.951 4.623 1.00 25.00 C ATOM 617 O GLN A 40 28.524 3.456 5.134 1.00 25.00 O ATOM 618 CB GLN A 40 26.209 3.117 6.755 1.00 25.00 C ATOM 619 CG GLN A 40 24.866 3.134 7.460 1.00 25.00 C ATOM 620 CD GLN A 40 24.985 3.575 8.911 1.00 25.00 C ATOM 621 OE1 GLN A 40 25.383 4.695 9.188 1.00 25.00 O ATOM 622 NE2 GLN A 40 24.646 2.703 9.826 1.00 25.00 N ATOM 0 H GLN A 40 24.327 2.793 4.232 1.00 25.00 H new ATOM 0 HA GLN A 40 25.823 4.204 4.927 1.00 25.00 H new ATOM 0 HB2 GLN A 40 26.736 2.203 7.029 1.00 25.00 H new ATOM 0 HB3 GLN A 40 26.807 3.952 7.121 1.00 25.00 H new ATOM 0 HG2 GLN A 40 24.189 3.806 6.932 1.00 25.00 H new ATOM 0 HG3 GLN A 40 24.424 2.139 7.420 1.00 25.00 H new ATOM 0 HE21 GLN A 40 24.318 1.777 9.551 1.00 25.00 H new ATOM 0 HE22 GLN A 40 24.710 2.949 10.814 1.00 25.00 H new ATOM 631 N GLY A 41 27.596 2.162 3.556 1.00 25.00 N ATOM 632 CA GLY A 41 28.872 1.800 2.963 1.00 25.00 C ATOM 633 C GLY A 41 29.508 0.634 3.696 1.00 25.00 C ATOM 634 O GLY A 41 30.686 0.340 3.511 1.00 25.00 O ATOM 0 H GLY A 41 26.782 1.764 3.088 1.00 25.00 H new ATOM 0 HA2 GLY A 41 28.727 1.538 1.915 1.00 25.00 H new ATOM 0 HA3 GLY A 41 29.544 2.658 2.988 1.00 25.00 H new ATOM 638 N LEU A 42 28.734 -0.027 4.546 1.00 25.00 N ATOM 639 CA LEU A 42 29.212 -1.161 5.306 1.00 25.00 C ATOM 640 C LEU A 42 28.983 -2.404 4.468 1.00 25.00 C ATOM 641 O LEU A 42 27.945 -3.051 4.561 1.00 25.00 O ATOM 642 CB LEU A 42 28.447 -1.255 6.622 1.00 25.00 C ATOM 643 CG LEU A 42 28.510 -0.021 7.521 1.00 25.00 C ATOM 644 CD1 LEU A 42 27.451 -0.136 8.593 1.00 25.00 C ATOM 645 CD2 LEU A 42 29.860 0.124 8.158 1.00 25.00 C ATOM 0 H LEU A 42 27.759 0.212 4.724 1.00 25.00 H new ATOM 0 HA LEU A 42 30.272 -1.056 5.538 1.00 25.00 H new ATOM 0 HB2 LEU A 42 27.401 -1.464 6.398 1.00 25.00 H new ATOM 0 HB3 LEU A 42 28.830 -2.108 7.182 1.00 25.00 H new ATOM 0 HG LEU A 42 28.332 0.863 6.908 1.00 25.00 H new ATOM 0 HD11 LEU A 42 27.490 0.741 9.239 1.00 25.00 H new ATOM 0 HD12 LEU A 42 26.468 -0.201 8.127 1.00 25.00 H new ATOM 0 HD13 LEU A 42 27.631 -1.032 9.187 1.00 25.00 H new ATOM 0 HD21 LEU A 42 29.870 1.012 8.791 1.00 25.00 H new ATOM 0 HD22 LEU A 42 30.073 -0.756 8.764 1.00 25.00 H new ATOM 0 HD23 LEU A 42 30.620 0.222 7.382 1.00 25.00 H new ATOM 657 N ASP A 43 29.936 -2.711 3.612 1.00 25.00 N ATOM 658 CA ASP A 43 29.816 -3.862 2.723 1.00 25.00 C ATOM 659 C ASP A 43 29.547 -5.130 3.517 1.00 25.00 C ATOM 660 O ASP A 43 30.218 -5.431 4.507 1.00 25.00 O ATOM 661 CB ASP A 43 31.092 -4.055 1.904 1.00 25.00 C ATOM 662 CG ASP A 43 31.192 -3.090 0.738 1.00 25.00 C ATOM 663 OD1 ASP A 43 32.308 -2.595 0.467 1.00 25.00 O ATOM 664 OD2 ASP A 43 30.170 -2.872 0.055 1.00 25.00 O ATOM 0 H ASP A 43 30.803 -2.184 3.509 1.00 25.00 H new ATOM 0 HA ASP A 43 28.980 -3.668 2.050 1.00 25.00 H new ATOM 0 HB2 ASP A 43 31.958 -3.925 2.553 1.00 25.00 H new ATOM 0 HB3 ASP A 43 31.126 -5.077 1.528 1.00 25.00 H new ATOM 669 N GLY A 44 28.539 -5.874 3.094 1.00 25.00 N ATOM 670 CA GLY A 44 28.183 -7.112 3.765 1.00 25.00 C ATOM 671 C GLY A 44 27.183 -6.941 4.894 1.00 25.00 C ATOM 672 O GLY A 44 26.578 -7.926 5.324 1.00 25.00 O ATOM 0 H GLY A 44 27.954 -5.643 2.291 1.00 25.00 H new ATOM 0 HA2 GLY A 44 27.771 -7.805 3.031 1.00 25.00 H new ATOM 0 HA3 GLY A 44 29.088 -7.570 4.163 1.00 25.00 H new ATOM 676 N TRP A 45 26.973 -5.724 5.370 1.00 25.00 N ATOM 677 CA TRP A 45 25.989 -5.459 6.405 1.00 25.00 C ATOM 678 C TRP A 45 24.675 -5.085 5.729 1.00 25.00 C ATOM 679 O TRP A 45 24.646 -4.251 4.836 1.00 25.00 O ATOM 680 CB TRP A 45 26.495 -4.305 7.262 1.00 25.00 C ATOM 681 CG TRP A 45 27.578 -4.728 8.221 1.00 25.00 C ATOM 682 CD1 TRP A 45 28.911 -4.506 8.116 1.00 25.00 C ATOM 683 CD2 TRP A 45 27.410 -5.457 9.448 1.00 25.00 C ATOM 684 NE1 TRP A 45 29.592 -5.012 9.181 1.00 25.00 N ATOM 685 CE2 TRP A 45 28.702 -5.616 10.027 1.00 25.00 C ATOM 686 CE3 TRP A 45 26.296 -5.979 10.125 1.00 25.00 C ATOM 687 CZ2 TRP A 45 28.898 -6.288 11.250 1.00 25.00 C ATOM 688 CZ3 TRP A 45 26.485 -6.637 11.355 1.00 25.00 C ATOM 689 CH2 TRP A 45 27.783 -6.790 11.902 1.00 25.00 C ATOM 0 H TRP A 45 27.477 -4.897 5.051 1.00 25.00 H new ATOM 0 HA TRP A 45 25.832 -6.333 7.037 1.00 25.00 H new ATOM 0 HB2 TRP A 45 26.876 -3.516 6.614 1.00 25.00 H new ATOM 0 HB3 TRP A 45 25.662 -3.882 7.824 1.00 25.00 H new ATOM 0 HD1 TRP A 45 29.376 -3.991 7.289 1.00 25.00 H new ATOM 0 HE1 TRP A 45 30.600 -4.951 9.325 1.00 25.00 H new ATOM 0 HE3 TRP A 45 25.306 -5.877 9.707 1.00 25.00 H new ATOM 0 HZ2 TRP A 45 29.887 -6.408 11.667 1.00 25.00 H new ATOM 0 HZ3 TRP A 45 25.631 -7.029 11.888 1.00 25.00 H new ATOM 0 HH2 TRP A 45 27.905 -7.306 12.843 1.00 25.00 H new ATOM 700 N TRP A 46 23.586 -5.718 6.131 1.00 25.00 N ATOM 701 CA TRP A 46 22.285 -5.462 5.513 1.00 25.00 C ATOM 702 C TRP A 46 21.380 -4.785 6.526 1.00 25.00 C ATOM 703 O TRP A 46 21.224 -5.271 7.639 1.00 25.00 O ATOM 704 CB TRP A 46 21.645 -6.774 5.022 1.00 25.00 C ATOM 705 CG TRP A 46 22.439 -7.480 3.929 1.00 25.00 C ATOM 706 CD1 TRP A 46 23.592 -7.058 3.335 1.00 25.00 C ATOM 707 CD2 TRP A 46 22.143 -8.752 3.310 1.00 25.00 C ATOM 708 NE1 TRP A 46 24.041 -7.945 2.411 1.00 25.00 N ATOM 709 CE2 TRP A 46 23.187 -9.011 2.367 1.00 25.00 C ATOM 710 CE3 TRP A 46 21.111 -9.704 3.457 1.00 25.00 C ATOM 711 CZ2 TRP A 46 23.223 -10.181 1.585 1.00 25.00 C ATOM 712 CZ3 TRP A 46 21.159 -10.892 2.684 1.00 25.00 C ATOM 713 CH2 TRP A 46 22.212 -11.112 1.752 1.00 25.00 C ATOM 0 H TRP A 46 23.571 -6.411 6.879 1.00 25.00 H new ATOM 0 HA TRP A 46 22.422 -4.811 4.649 1.00 25.00 H new ATOM 0 HB2 TRP A 46 21.532 -7.450 5.869 1.00 25.00 H new ATOM 0 HB3 TRP A 46 20.643 -6.560 4.649 1.00 25.00 H new ATOM 0 HD1 TRP A 46 24.089 -6.129 3.572 1.00 25.00 H new ATOM 0 HE1 TRP A 46 24.880 -7.834 1.842 1.00 25.00 H new ATOM 0 HE3 TRP A 46 20.298 -9.530 4.147 1.00 25.00 H new ATOM 0 HZ2 TRP A 46 24.018 -10.348 0.874 1.00 25.00 H new ATOM 0 HZ3 TRP A 46 20.388 -11.638 2.804 1.00 25.00 H new ATOM 0 HH2 TRP A 46 22.223 -12.019 1.166 1.00 25.00 H new ATOM 724 N LEU A 47 20.794 -3.661 6.148 1.00 25.00 N ATOM 725 CA LEU A 47 19.875 -2.946 7.025 1.00 25.00 C ATOM 726 C LEU A 47 18.578 -3.707 7.015 1.00 25.00 C ATOM 727 O LEU A 47 17.989 -3.901 5.957 1.00 25.00 O ATOM 728 CB LEU A 47 19.623 -1.528 6.512 1.00 25.00 C ATOM 729 CG LEU A 47 18.660 -0.661 7.332 1.00 25.00 C ATOM 730 CD1 LEU A 47 19.110 -0.519 8.776 1.00 25.00 C ATOM 731 CD2 LEU A 47 18.533 0.712 6.687 1.00 25.00 C ATOM 0 H LEU A 47 20.937 -3.222 5.239 1.00 25.00 H new ATOM 0 HA LEU A 47 20.297 -2.873 8.028 1.00 25.00 H new ATOM 0 HB2 LEU A 47 20.581 -1.011 6.454 1.00 25.00 H new ATOM 0 HB3 LEU A 47 19.237 -1.597 5.495 1.00 25.00 H new ATOM 0 HG LEU A 47 17.690 -1.157 7.341 1.00 25.00 H new ATOM 0 HD11 LEU A 47 18.399 0.103 9.319 1.00 25.00 H new ATOM 0 HD12 LEU A 47 19.160 -1.504 9.240 1.00 25.00 H new ATOM 0 HD13 LEU A 47 20.095 -0.054 8.806 1.00 25.00 H new ATOM 0 HD21 LEU A 47 17.848 1.327 7.271 1.00 25.00 H new ATOM 0 HD22 LEU A 47 19.512 1.190 6.654 1.00 25.00 H new ATOM 0 HD23 LEU A 47 18.148 0.603 5.673 1.00 25.00 H new ATOM 743 N CYS A 48 18.129 -4.141 8.176 1.00 25.00 N ATOM 744 CA CYS A 48 16.881 -4.862 8.279 1.00 25.00 C ATOM 745 C CYS A 48 16.059 -4.331 9.431 1.00 25.00 C ATOM 746 O CYS A 48 16.540 -3.547 10.243 1.00 25.00 O ATOM 747 CB CYS A 48 17.142 -6.362 8.475 1.00 25.00 C ATOM 748 SG CYS A 48 18.370 -7.050 7.330 1.00 25.00 S ATOM 0 H CYS A 48 18.614 -4.005 9.063 1.00 25.00 H new ATOM 0 HA CYS A 48 16.326 -4.718 7.352 1.00 25.00 H new ATOM 0 HB2 CYS A 48 17.478 -6.532 9.498 1.00 25.00 H new ATOM 0 HB3 CYS A 48 16.204 -6.903 8.354 1.00 25.00 H new ATOM 0 HG CYS A 48 19.492 -6.407 7.459 1.00 25.00 H new ATOM 754 N SER A 49 14.819 -4.780 9.500 1.00 25.00 N ATOM 755 CA SER A 49 13.921 -4.417 10.576 1.00 25.00 C ATOM 756 C SER A 49 13.336 -5.697 11.156 1.00 25.00 C ATOM 757 O SER A 49 12.889 -6.587 10.422 1.00 25.00 O ATOM 758 CB SER A 49 12.845 -3.462 10.052 1.00 25.00 C ATOM 759 OG SER A 49 11.557 -4.056 10.021 1.00 25.00 O ATOM 0 H SER A 49 14.408 -5.408 8.809 1.00 25.00 H new ATOM 0 HA SER A 49 14.448 -3.889 11.371 1.00 25.00 H new ATOM 0 HB2 SER A 49 12.816 -2.573 10.682 1.00 25.00 H new ATOM 0 HB3 SER A 49 13.114 -3.133 9.048 1.00 25.00 H new ATOM 0 HG SER A 49 10.906 -3.407 9.681 1.00 25.00 H new ATOM 765 N LEU A 50 13.411 -5.817 12.472 1.00 25.00 N ATOM 766 CA LEU A 50 12.940 -6.994 13.192 1.00 25.00 C ATOM 767 C LEU A 50 12.339 -6.502 14.501 1.00 25.00 C ATOM 768 O LEU A 50 12.932 -5.667 15.164 1.00 25.00 O ATOM 769 CB LEU A 50 14.112 -7.933 13.484 1.00 25.00 C ATOM 770 CG LEU A 50 13.740 -9.225 14.224 1.00 25.00 C ATOM 771 CD1 LEU A 50 13.783 -10.399 13.303 1.00 25.00 C ATOM 772 CD2 LEU A 50 14.676 -9.430 15.401 1.00 25.00 C ATOM 0 H LEU A 50 13.803 -5.096 13.077 1.00 25.00 H new ATOM 0 HA LEU A 50 12.205 -7.541 12.602 1.00 25.00 H new ATOM 0 HB2 LEU A 50 14.590 -8.197 12.541 1.00 25.00 H new ATOM 0 HB3 LEU A 50 14.851 -7.393 14.076 1.00 25.00 H new ATOM 0 HG LEU A 50 12.720 -9.133 14.596 1.00 25.00 H new ATOM 0 HD11 LEU A 50 13.515 -11.302 13.852 1.00 25.00 H new ATOM 0 HD12 LEU A 50 13.076 -10.247 12.487 1.00 25.00 H new ATOM 0 HD13 LEU A 50 14.789 -10.506 12.897 1.00 25.00 H new ATOM 0 HD21 LEU A 50 14.408 -10.348 15.923 1.00 25.00 H new ATOM 0 HD22 LEU A 50 15.702 -9.503 15.041 1.00 25.00 H new ATOM 0 HD23 LEU A 50 14.591 -8.586 16.085 1.00 25.00 H new ATOM 784 N HIS A 51 11.144 -6.979 14.832 1.00 25.00 N ATOM 785 CA HIS A 51 10.423 -6.577 16.057 1.00 25.00 C ATOM 786 C HIS A 51 10.223 -5.051 16.144 1.00 25.00 C ATOM 787 O HIS A 51 10.143 -4.487 17.228 1.00 25.00 O ATOM 788 CB HIS A 51 11.168 -7.064 17.321 1.00 25.00 C ATOM 789 CG HIS A 51 11.401 -8.542 17.358 1.00 25.00 C ATOM 790 ND1 HIS A 51 12.366 -9.153 18.122 1.00 25.00 N ATOM 791 CD2 HIS A 51 10.772 -9.563 16.710 1.00 25.00 C ATOM 792 CE1 HIS A 51 12.295 -10.465 17.914 1.00 25.00 C ATOM 793 NE2 HIS A 51 11.335 -10.770 17.067 1.00 25.00 N ATOM 0 H HIS A 51 10.638 -7.658 14.263 1.00 25.00 H new ATOM 0 HA HIS A 51 9.441 -7.048 16.005 1.00 25.00 H new ATOM 0 HB2 HIS A 51 12.129 -6.553 17.383 1.00 25.00 H new ATOM 0 HB3 HIS A 51 10.595 -6.775 18.202 1.00 25.00 H new ATOM 0 HD2 HIS A 51 9.952 -9.444 16.018 1.00 25.00 H new ATOM 0 HE1 HIS A 51 12.945 -11.190 18.382 1.00 25.00 H new ATOM 0 HE2 HIS A 51 11.065 -11.699 16.744 1.00 25.00 H new ATOM 801 N GLY A 52 10.154 -4.389 14.995 1.00 25.00 N ATOM 802 CA GLY A 52 9.987 -2.942 14.972 1.00 25.00 C ATOM 803 C GLY A 52 11.269 -2.165 15.240 1.00 25.00 C ATOM 804 O GLY A 52 11.241 -0.945 15.361 1.00 25.00 O ATOM 0 H GLY A 52 10.211 -4.827 14.075 1.00 25.00 H new ATOM 0 HA2 GLY A 52 9.593 -2.648 13.999 1.00 25.00 H new ATOM 0 HA3 GLY A 52 9.242 -2.661 15.716 1.00 25.00 H new ATOM 808 N ARG A 53 12.397 -2.860 15.322 1.00 25.00 N ATOM 809 CA ARG A 53 13.688 -2.235 15.579 1.00 25.00 C ATOM 810 C ARG A 53 14.460 -2.370 14.290 1.00 25.00 C ATOM 811 O ARG A 53 14.426 -3.416 13.657 1.00 25.00 O ATOM 812 CB ARG A 53 14.402 -2.973 16.719 1.00 25.00 C ATOM 813 CG ARG A 53 15.284 -2.097 17.624 1.00 25.00 C ATOM 814 CD ARG A 53 16.614 -1.719 16.977 1.00 25.00 C ATOM 815 NE ARG A 53 17.585 -1.264 17.983 1.00 25.00 N ATOM 816 CZ ARG A 53 18.844 -0.911 17.733 1.00 25.00 C ATOM 817 NH1 ARG A 53 19.360 -0.895 16.533 1.00 25.00 N ATOM 818 NH2 ARG A 53 19.603 -0.560 18.729 1.00 25.00 N ATOM 0 H ARG A 53 12.442 -3.873 15.212 1.00 25.00 H new ATOM 0 HA ARG A 53 13.593 -1.192 15.879 1.00 25.00 H new ATOM 0 HB2 ARG A 53 13.651 -3.463 17.338 1.00 25.00 H new ATOM 0 HB3 ARG A 53 15.022 -3.759 16.288 1.00 25.00 H new ATOM 0 HG2 ARG A 53 14.740 -1.188 17.882 1.00 25.00 H new ATOM 0 HG3 ARG A 53 15.478 -2.627 18.556 1.00 25.00 H new ATOM 0 HD2 ARG A 53 17.018 -2.578 16.441 1.00 25.00 H new ATOM 0 HD3 ARG A 53 16.452 -0.931 16.241 1.00 25.00 H new ATOM 0 HE ARG A 53 17.268 -1.215 18.951 1.00 25.00 H new ATOM 0 HH11 ARG A 53 18.791 -1.162 15.730 1.00 25.00 H new ATOM 0 HH12 ARG A 53 20.332 -0.616 16.399 1.00 25.00 H new ATOM 0 HH21 ARG A 53 19.230 -0.559 19.679 1.00 25.00 H new ATOM 0 HH22 ARG A 53 20.571 -0.286 18.561 1.00 25.00 H new ATOM 832 N GLN A 54 15.141 -1.316 13.896 1.00 25.00 N ATOM 833 CA GLN A 54 15.934 -1.326 12.673 1.00 25.00 C ATOM 834 C GLN A 54 17.401 -1.460 13.029 1.00 25.00 C ATOM 835 O GLN A 54 17.827 -0.962 14.066 1.00 25.00 O ATOM 836 CB GLN A 54 15.708 -0.030 11.906 1.00 25.00 C ATOM 837 CG GLN A 54 14.965 -0.236 10.622 1.00 25.00 C ATOM 838 CD GLN A 54 14.667 1.066 9.902 1.00 25.00 C ATOM 839 OE1 GLN A 54 13.521 1.383 9.638 1.00 25.00 O ATOM 840 NE2 GLN A 54 15.693 1.813 9.575 1.00 25.00 N ATOM 0 H GLN A 54 15.165 -0.432 14.405 1.00 25.00 H new ATOM 0 HA GLN A 54 15.633 -2.168 12.049 1.00 25.00 H new ATOM 0 HB2 GLN A 54 15.152 0.666 12.534 1.00 25.00 H new ATOM 0 HB3 GLN A 54 16.671 0.433 11.692 1.00 25.00 H new ATOM 0 HG2 GLN A 54 15.550 -0.882 9.968 1.00 25.00 H new ATOM 0 HG3 GLN A 54 14.029 -0.755 10.828 1.00 25.00 H new ATOM 0 HE21 GLN A 54 16.638 1.514 9.814 1.00 25.00 H new ATOM 0 HE22 GLN A 54 15.546 2.694 9.082 1.00 25.00 H new ATOM 849 N GLY A 55 18.170 -2.110 12.172 1.00 25.00 N ATOM 850 CA GLY A 55 19.596 -2.233 12.407 1.00 25.00 C ATOM 851 C GLY A 55 20.311 -3.063 11.364 1.00 25.00 C ATOM 852 O GLY A 55 19.668 -3.687 10.518 1.00 25.00 O ATOM 0 H GLY A 55 17.835 -2.555 11.318 1.00 25.00 H new ATOM 0 HA2 GLY A 55 20.039 -1.237 12.433 1.00 25.00 H new ATOM 0 HA3 GLY A 55 19.757 -2.680 13.388 1.00 25.00 H new ATOM 856 N ILE A 56 21.635 -3.061 11.403 1.00 25.00 N ATOM 857 CA ILE A 56 22.440 -3.810 10.447 1.00 25.00 C ATOM 858 C ILE A 56 22.553 -5.267 10.886 1.00 25.00 C ATOM 859 O ILE A 56 22.397 -5.601 12.062 1.00 25.00 O ATOM 860 CB ILE A 56 23.856 -3.177 10.265 1.00 25.00 C ATOM 861 CG1 ILE A 56 24.667 -3.264 11.574 1.00 25.00 C ATOM 862 CG2 ILE A 56 23.702 -1.707 9.826 1.00 25.00 C ATOM 863 CD1 ILE A 56 26.072 -2.689 11.491 1.00 25.00 C ATOM 0 H ILE A 56 22.180 -2.544 12.093 1.00 25.00 H new ATOM 0 HA ILE A 56 21.939 -3.769 9.480 1.00 25.00 H new ATOM 0 HB ILE A 56 24.398 -3.731 9.498 1.00 25.00 H new ATOM 0 HG12 ILE A 56 24.121 -2.741 12.359 1.00 25.00 H new ATOM 0 HG13 ILE A 56 24.734 -4.310 11.875 1.00 25.00 H new ATOM 0 HG21 ILE A 56 24.688 -1.260 9.698 1.00 25.00 H new ATOM 0 HG22 ILE A 56 23.159 -1.664 8.882 1.00 25.00 H new ATOM 0 HG23 ILE A 56 23.150 -1.156 10.588 1.00 25.00 H new ATOM 0 HD11 ILE A 56 26.566 -2.794 12.457 1.00 25.00 H new ATOM 0 HD12 ILE A 56 26.641 -3.226 10.732 1.00 25.00 H new ATOM 0 HD13 ILE A 56 26.018 -1.634 11.224 1.00 25.00 H new ATOM 875 N VAL A 57 22.767 -6.132 9.910 1.00 25.00 N ATOM 876 CA VAL A 57 22.851 -7.575 10.127 1.00 25.00 C ATOM 877 C VAL A 57 23.936 -8.133 9.211 1.00 25.00 C ATOM 878 O VAL A 57 24.024 -7.724 8.057 1.00 25.00 O ATOM 879 CB VAL A 57 21.514 -8.251 9.723 1.00 25.00 C ATOM 880 CG1 VAL A 57 21.585 -9.740 9.856 1.00 25.00 C ATOM 881 CG2 VAL A 57 20.354 -7.684 10.538 1.00 25.00 C ATOM 0 H VAL A 57 22.889 -5.856 8.936 1.00 25.00 H new ATOM 0 HA VAL A 57 23.067 -7.768 11.178 1.00 25.00 H new ATOM 0 HB VAL A 57 21.336 -8.027 8.671 1.00 25.00 H new ATOM 0 HG11 VAL A 57 20.630 -10.177 9.564 1.00 25.00 H new ATOM 0 HG12 VAL A 57 22.373 -10.126 9.210 1.00 25.00 H new ATOM 0 HG13 VAL A 57 21.803 -10.003 10.891 1.00 25.00 H new ATOM 0 HG21 VAL A 57 19.426 -8.172 10.239 1.00 25.00 H new ATOM 0 HG22 VAL A 57 20.532 -7.863 11.598 1.00 25.00 H new ATOM 0 HG23 VAL A 57 20.274 -6.612 10.360 1.00 25.00 H new ATOM 891 N PRO A 58 24.750 -9.089 9.690 1.00 25.00 N ATOM 892 CA PRO A 58 25.730 -9.681 8.775 1.00 25.00 C ATOM 893 C PRO A 58 25.030 -10.512 7.689 1.00 25.00 C ATOM 894 O PRO A 58 24.338 -11.497 7.971 1.00 25.00 O ATOM 895 CB PRO A 58 26.591 -10.536 9.711 1.00 25.00 C ATOM 896 CG PRO A 58 25.690 -10.900 10.822 1.00 25.00 C ATOM 897 CD PRO A 58 24.810 -9.707 11.026 1.00 25.00 C ATOM 0 HA PRO A 58 26.320 -8.952 8.221 1.00 25.00 H new ATOM 0 HB2 PRO A 58 26.969 -11.422 9.202 1.00 25.00 H new ATOM 0 HB3 PRO A 58 27.457 -9.980 10.070 1.00 25.00 H new ATOM 0 HG2 PRO A 58 25.102 -11.785 10.578 1.00 25.00 H new ATOM 0 HG3 PRO A 58 26.254 -11.132 11.726 1.00 25.00 H new ATOM 0 HD2 PRO A 58 23.820 -9.995 11.380 1.00 25.00 H new ATOM 0 HD3 PRO A 58 25.226 -9.023 11.766 1.00 25.00 H new ATOM 905 N GLY A 59 25.176 -10.082 6.443 1.00 25.00 N ATOM 906 CA GLY A 59 24.463 -10.697 5.333 1.00 25.00 C ATOM 907 C GLY A 59 24.798 -12.152 5.105 1.00 25.00 C ATOM 908 O GLY A 59 23.983 -12.907 4.595 1.00 25.00 O ATOM 0 H GLY A 59 25.784 -9.308 6.176 1.00 25.00 H new ATOM 0 HA2 GLY A 59 23.391 -10.607 5.511 1.00 25.00 H new ATOM 0 HA3 GLY A 59 24.683 -10.139 4.423 1.00 25.00 H new ATOM 912 N ASN A 60 25.984 -12.572 5.518 1.00 25.00 N ATOM 913 CA ASN A 60 26.399 -13.968 5.357 1.00 25.00 C ATOM 914 C ASN A 60 25.737 -14.912 6.372 1.00 25.00 C ATOM 915 O ASN A 60 25.888 -16.129 6.273 1.00 25.00 O ATOM 916 CB ASN A 60 27.932 -14.091 5.411 1.00 25.00 C ATOM 917 CG ASN A 60 28.508 -13.779 6.775 1.00 25.00 C ATOM 918 OD1 ASN A 60 27.853 -13.220 7.640 1.00 25.00 O ATOM 919 ND2 ASN A 60 29.750 -14.115 6.956 1.00 25.00 N ATOM 0 H ASN A 60 26.678 -11.973 5.966 1.00 25.00 H new ATOM 0 HA ASN A 60 26.054 -14.284 4.372 1.00 25.00 H new ATOM 0 HB2 ASN A 60 28.219 -15.103 5.126 1.00 25.00 H new ATOM 0 HB3 ASN A 60 28.370 -13.416 4.676 1.00 25.00 H new ATOM 0 HD21 ASN A 60 30.209 -13.913 7.844 1.00 25.00 H new ATOM 0 HD22 ASN A 60 30.266 -14.581 6.210 1.00 25.00 H new ATOM 926 N ARG A 61 24.949 -14.366 7.293 1.00 25.00 N ATOM 927 CA ARG A 61 24.143 -15.187 8.204 1.00 25.00 C ATOM 928 C ARG A 61 22.671 -15.066 7.830 1.00 25.00 C ATOM 929 O ARG A 61 21.803 -15.604 8.520 1.00 25.00 O ATOM 930 CB ARG A 61 24.342 -14.748 9.658 1.00 25.00 C ATOM 931 CG ARG A 61 25.762 -14.918 10.172 1.00 25.00 C ATOM 932 CD ARG A 61 25.804 -14.677 11.666 1.00 25.00 C ATOM 933 NE ARG A 61 27.155 -14.865 12.218 1.00 25.00 N ATOM 934 CZ ARG A 61 27.457 -14.870 13.513 1.00 25.00 C ATOM 935 NH1 ARG A 61 26.559 -14.727 14.452 1.00 25.00 N ATOM 936 NH2 ARG A 61 28.699 -15.044 13.862 1.00 25.00 N ATOM 0 H ARG A 61 24.848 -13.361 7.432 1.00 25.00 H new ATOM 0 HA ARG A 61 24.465 -16.224 8.111 1.00 25.00 H new ATOM 0 HB2 ARG A 61 24.057 -13.700 9.751 1.00 25.00 H new ATOM 0 HB3 ARG A 61 23.667 -15.320 10.294 1.00 25.00 H new ATOM 0 HG2 ARG A 61 26.121 -15.922 9.947 1.00 25.00 H new ATOM 0 HG3 ARG A 61 26.428 -14.220 9.664 1.00 25.00 H new ATOM 0 HD2 ARG A 61 25.463 -13.664 11.879 1.00 25.00 H new ATOM 0 HD3 ARG A 61 25.112 -15.357 12.162 1.00 25.00 H new ATOM 0 HE ARG A 61 27.919 -15.002 11.556 1.00 25.00 H new ATOM 0 HH11 ARG A 61 25.577 -14.605 14.204 1.00 25.00 H new ATOM 0 HH12 ARG A 61 26.840 -14.738 15.432 1.00 25.00 H new ATOM 0 HH21 ARG A 61 29.416 -15.173 13.148 1.00 25.00 H new ATOM 0 HH22 ARG A 61 28.955 -15.052 14.849 1.00 25.00 H new ATOM 950 N LEU A 62 22.392 -14.378 6.730 1.00 25.00 N ATOM 951 CA LEU A 62 21.023 -14.185 6.259 1.00 25.00 C ATOM 952 C LEU A 62 20.808 -14.783 4.891 1.00 25.00 C ATOM 953 O LEU A 62 21.719 -14.900 4.081 1.00 25.00 O ATOM 954 CB LEU A 62 20.692 -12.697 6.154 1.00 25.00 C ATOM 955 CG LEU A 62 19.963 -12.079 7.346 1.00 25.00 C ATOM 956 CD1 LEU A 62 19.733 -10.614 7.045 1.00 25.00 C ATOM 957 CD2 LEU A 62 18.628 -12.746 7.643 1.00 25.00 C ATOM 0 H LEU A 62 23.101 -13.940 6.142 1.00 25.00 H new ATOM 0 HA LEU A 62 20.380 -14.681 6.986 1.00 25.00 H new ATOM 0 HB2 LEU A 62 21.622 -12.150 6.001 1.00 25.00 H new ATOM 0 HB3 LEU A 62 20.082 -12.544 5.264 1.00 25.00 H new ATOM 0 HG LEU A 62 20.585 -12.220 8.230 1.00 25.00 H new ATOM 0 HD11 LEU A 62 19.213 -10.148 7.882 1.00 25.00 H new ATOM 0 HD12 LEU A 62 20.692 -10.119 6.893 1.00 25.00 H new ATOM 0 HD13 LEU A 62 19.128 -10.518 6.143 1.00 25.00 H new ATOM 0 HD21 LEU A 62 18.161 -12.261 8.500 1.00 25.00 H new ATOM 0 HD22 LEU A 62 17.975 -12.656 6.775 1.00 25.00 H new ATOM 0 HD23 LEU A 62 18.790 -13.800 7.867 1.00 25.00 H new ATOM 969 N LYS A 63 19.558 -15.114 4.621 1.00 25.00 N ATOM 970 CA LYS A 63 19.167 -15.574 3.296 1.00 25.00 C ATOM 971 C LYS A 63 17.967 -14.814 2.828 1.00 25.00 C ATOM 972 O LYS A 63 16.906 -14.897 3.431 1.00 25.00 O ATOM 973 CB LYS A 63 18.841 -17.065 3.313 1.00 25.00 C ATOM 974 CG LYS A 63 18.417 -17.609 1.939 1.00 25.00 C ATOM 975 CD LYS A 63 18.435 -19.135 1.873 1.00 25.00 C ATOM 976 CE LYS A 63 19.866 -19.643 1.931 1.00 25.00 C ATOM 977 NZ LYS A 63 19.998 -21.121 1.695 1.00 25.00 N ATOM 0 H LYS A 63 18.796 -15.074 5.298 1.00 25.00 H new ATOM 0 HA LYS A 63 20.002 -15.403 2.617 1.00 25.00 H new ATOM 0 HB2 LYS A 63 19.714 -17.617 3.661 1.00 25.00 H new ATOM 0 HB3 LYS A 63 18.041 -17.247 4.031 1.00 25.00 H new ATOM 0 HG2 LYS A 63 17.414 -17.252 1.706 1.00 25.00 H new ATOM 0 HG3 LYS A 63 19.083 -17.209 1.174 1.00 25.00 H new ATOM 0 HD2 LYS A 63 17.860 -19.549 2.701 1.00 25.00 H new ATOM 0 HD3 LYS A 63 17.958 -19.473 0.953 1.00 25.00 H new ATOM 0 HE2 LYS A 63 20.460 -19.112 1.187 1.00 25.00 H new ATOM 0 HE3 LYS A 63 20.287 -19.402 2.907 1.00 25.00 H new ATOM 0 HZ1 LYS A 63 21.000 -21.393 1.750 1.00 25.00 H new ATOM 0 HZ2 LYS A 63 19.459 -21.638 2.419 1.00 25.00 H new ATOM 0 HZ3 LYS A 63 19.626 -21.357 0.753 1.00 25.00 H new ATOM 991 N ILE A 64 18.124 -14.125 1.716 1.00 25.00 N ATOM 992 CA ILE A 64 17.023 -13.411 1.104 1.00 25.00 C ATOM 993 C ILE A 64 16.036 -14.452 0.618 1.00 25.00 C ATOM 994 O ILE A 64 16.408 -15.386 -0.097 1.00 25.00 O ATOM 995 CB ILE A 64 17.493 -12.571 -0.107 1.00 25.00 C ATOM 996 CG1 ILE A 64 18.604 -11.583 0.298 1.00 25.00 C ATOM 997 CG2 ILE A 64 16.326 -11.816 -0.717 1.00 25.00 C ATOM 998 CD1 ILE A 64 18.188 -10.473 1.280 1.00 25.00 C ATOM 0 H ILE A 64 19.009 -14.045 1.216 1.00 25.00 H new ATOM 0 HA ILE A 64 16.582 -12.730 1.832 1.00 25.00 H new ATOM 0 HB ILE A 64 17.899 -13.258 -0.850 1.00 25.00 H new ATOM 0 HG12 ILE A 64 19.422 -12.149 0.744 1.00 25.00 H new ATOM 0 HG13 ILE A 64 18.995 -11.115 -0.605 1.00 25.00 H new ATOM 0 HG21 ILE A 64 16.676 -11.231 -1.567 1.00 25.00 H new ATOM 0 HG22 ILE A 64 15.569 -12.525 -1.051 1.00 25.00 H new ATOM 0 HG23 ILE A 64 15.894 -11.149 0.029 1.00 25.00 H new ATOM 0 HD11 ILE A 64 19.047 -9.837 1.495 1.00 25.00 H new ATOM 0 HD12 ILE A 64 17.394 -9.873 0.835 1.00 25.00 H new ATOM 0 HD13 ILE A 64 17.828 -10.922 2.206 1.00 25.00 H new ATOM 1010 N LEU A 65 14.783 -14.309 1.006 1.00 25.00 N ATOM 1011 CA LEU A 65 13.753 -15.231 0.568 1.00 25.00 C ATOM 1012 C LEU A 65 13.122 -14.605 -0.666 1.00 25.00 C ATOM 1013 O LEU A 65 12.254 -13.742 -0.579 1.00 25.00 O ATOM 1014 CB LEU A 65 12.740 -15.486 1.685 1.00 25.00 C ATOM 1015 CG LEU A 65 13.362 -15.996 3.000 1.00 25.00 C ATOM 1016 CD1 LEU A 65 12.245 -16.202 4.015 1.00 25.00 C ATOM 1017 CD2 LEU A 65 14.184 -17.308 2.816 1.00 25.00 C ATOM 0 H LEU A 65 14.455 -13.565 1.622 1.00 25.00 H new ATOM 0 HA LEU A 65 14.161 -16.211 0.322 1.00 25.00 H new ATOM 0 HB2 LEU A 65 12.199 -14.562 1.887 1.00 25.00 H new ATOM 0 HB3 LEU A 65 12.008 -16.214 1.336 1.00 25.00 H new ATOM 0 HG LEU A 65 14.070 -15.246 3.354 1.00 25.00 H new ATOM 0 HD11 LEU A 65 12.667 -16.563 4.953 1.00 25.00 H new ATOM 0 HD12 LEU A 65 11.732 -15.256 4.189 1.00 25.00 H new ATOM 0 HD13 LEU A 65 11.535 -16.934 3.631 1.00 25.00 H new ATOM 0 HD21 LEU A 65 14.596 -17.617 3.777 1.00 25.00 H new ATOM 0 HD22 LEU A 65 13.534 -18.094 2.431 1.00 25.00 H new ATOM 0 HD23 LEU A 65 14.997 -17.132 2.112 1.00 25.00 H new ATOM 1327 N PRO A 89 29.255 -18.419 10.500 1.00 25.00 N ATOM 1328 CA PRO A 89 30.427 -17.748 9.928 1.00 25.00 C ATOM 1329 C PRO A 89 30.695 -16.401 10.606 1.00 25.00 C ATOM 1330 O PRO A 89 29.806 -15.832 11.259 1.00 25.00 O ATOM 1331 CB PRO A 89 30.032 -17.568 8.462 1.00 25.00 C ATOM 1332 CG PRO A 89 28.558 -17.439 8.495 1.00 25.00 C ATOM 1333 CD PRO A 89 28.117 -18.407 9.560 1.00 25.00 C ATOM 0 HA PRO A 89 31.350 -18.312 10.060 1.00 25.00 H new ATOM 0 HB2 PRO A 89 30.499 -16.683 8.030 1.00 25.00 H new ATOM 0 HB3 PRO A 89 30.344 -18.420 7.858 1.00 25.00 H new ATOM 0 HG2 PRO A 89 28.254 -16.420 8.735 1.00 25.00 H new ATOM 0 HG3 PRO A 89 28.117 -17.684 7.529 1.00 25.00 H new ATOM 0 HD2 PRO A 89 27.198 -18.080 10.045 1.00 25.00 H new ATOM 0 HD3 PRO A 89 27.925 -19.398 9.148 1.00 25.00 H new ATOM 1341 N PRO A 90 31.923 -15.873 10.471 1.00 25.00 N ATOM 1342 CA PRO A 90 32.205 -14.608 11.158 1.00 25.00 C ATOM 1343 C PRO A 90 31.480 -13.433 10.512 1.00 25.00 C ATOM 1344 O PRO A 90 31.211 -13.445 9.312 1.00 25.00 O ATOM 1345 CB PRO A 90 33.725 -14.474 11.020 1.00 25.00 C ATOM 1346 CG PRO A 90 34.041 -15.177 9.751 1.00 25.00 C ATOM 1347 CD PRO A 90 33.097 -16.356 9.715 1.00 25.00 C ATOM 0 HA PRO A 90 31.863 -14.604 12.193 1.00 25.00 H new ATOM 0 HB2 PRO A 90 34.030 -13.428 10.982 1.00 25.00 H new ATOM 0 HB3 PRO A 90 34.243 -14.927 11.865 1.00 25.00 H new ATOM 0 HG2 PRO A 90 33.892 -14.525 8.890 1.00 25.00 H new ATOM 0 HG3 PRO A 90 35.081 -15.503 9.728 1.00 25.00 H new ATOM 0 HD2 PRO A 90 32.833 -16.629 8.693 1.00 25.00 H new ATOM 0 HD3 PRO A 90 33.538 -17.239 10.177 1.00 25.00 H new ATOM 1355 N LYS A 91 31.149 -12.425 11.307 1.00 25.00 N ATOM 1356 CA LYS A 91 30.501 -11.223 10.783 1.00 25.00 C ATOM 1357 C LYS A 91 31.579 -10.373 10.101 1.00 25.00 C ATOM 1358 O LYS A 91 32.754 -10.453 10.472 1.00 25.00 O ATOM 1359 CB LYS A 91 29.803 -10.437 11.918 1.00 25.00 C ATOM 1360 CG LYS A 91 30.714 -10.038 13.099 1.00 25.00 C ATOM 1361 CD LYS A 91 29.983 -9.162 14.145 1.00 25.00 C ATOM 1362 CE LYS A 91 28.836 -9.904 14.860 1.00 25.00 C ATOM 1363 NZ LYS A 91 28.220 -9.067 15.948 1.00 25.00 N ATOM 0 H LYS A 91 31.316 -12.412 12.313 1.00 25.00 H new ATOM 0 HA LYS A 91 29.728 -11.491 10.063 1.00 25.00 H new ATOM 0 HB2 LYS A 91 29.366 -9.532 11.496 1.00 25.00 H new ATOM 0 HB3 LYS A 91 28.980 -11.039 12.302 1.00 25.00 H new ATOM 0 HG2 LYS A 91 31.090 -10.939 13.584 1.00 25.00 H new ATOM 0 HG3 LYS A 91 31.580 -9.496 12.718 1.00 25.00 H new ATOM 0 HD2 LYS A 91 30.703 -8.816 14.887 1.00 25.00 H new ATOM 0 HD3 LYS A 91 29.583 -8.276 13.652 1.00 25.00 H new ATOM 0 HE2 LYS A 91 28.070 -10.176 14.133 1.00 25.00 H new ATOM 0 HE3 LYS A 91 29.215 -10.833 15.287 1.00 25.00 H new ATOM 0 HZ1 LYS A 91 27.351 -9.526 16.289 1.00 25.00 H new ATOM 0 HZ2 LYS A 91 28.893 -8.971 16.735 1.00 25.00 H new ATOM 0 HZ3 LYS A 91 27.989 -8.125 15.573 1.00 25.00 H new ATOM 1377 N PRO A 92 31.202 -9.569 9.090 1.00 25.00 N ATOM 1378 CA PRO A 92 32.205 -8.685 8.491 1.00 25.00 C ATOM 1379 C PRO A 92 32.605 -7.586 9.487 1.00 25.00 C ATOM 1380 O PRO A 92 31.912 -7.370 10.484 1.00 25.00 O ATOM 1381 CB PRO A 92 31.482 -8.131 7.255 1.00 25.00 C ATOM 1382 CG PRO A 92 30.058 -8.183 7.597 1.00 25.00 C ATOM 1383 CD PRO A 92 29.874 -9.381 8.475 1.00 25.00 C ATOM 0 HA PRO A 92 33.140 -9.179 8.227 1.00 25.00 H new ATOM 0 HB2 PRO A 92 31.799 -7.111 7.036 1.00 25.00 H new ATOM 0 HB3 PRO A 92 31.698 -8.729 6.370 1.00 25.00 H new ATOM 0 HG2 PRO A 92 29.750 -7.273 8.113 1.00 25.00 H new ATOM 0 HG3 PRO A 92 29.446 -8.263 6.698 1.00 25.00 H new ATOM 0 HD2 PRO A 92 29.104 -9.212 9.228 1.00 25.00 H new ATOM 0 HD3 PRO A 92 29.571 -10.256 7.900 1.00 25.00 H new