USER MOD reduce.3.24.130724 H: found=0, std=0, add=462, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 471 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 215 MET CE :methyl -121:sc= 0 (180deg=0) USER MOD Set 1.2: A 216 THR OG1 : rot 97:sc= 0.795 USER MOD Set 2.1: A 155 GLN : amide:sc= -2.87! C(o=-4.3!,f=-15!) USER MOD Set 2.2: A 198 CYS SG : rot 125:sc= -0.713 USER MOD Set 2.3: A 218 CYS SG : rot 171:sc= -0.744 USER MOD Single : A 149 SER OG : rot 150:sc= -0.221 USER MOD Single : A 164 TYR OH : rot -165:sc= 0.503 USER MOD Single : A 169 TYR OH : rot 30:sc= -0.608 USER MOD Single : A 170 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 171 THR OG1 : rot -124:sc= -0.79 USER MOD Single : A 186 THR OG1 : rot -29:sc= 0.753 USER MOD Single : A 188 THR OG1 : rot 180:sc= 0 USER MOD Single : A 192 GLN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : A 193 ASN : amide:sc= -5.95! C(o=-6!,f=-6.6!) USER MOD Single : A 195 ASN : amide:sc= -2.48! C(o=-2.5!,f=-5!) USER MOD Single : A 199 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 200 THR OG1 : rot 180:sc= 0 USER MOD Single : A 203 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 210 THR OG1 : rot 180:sc= 0 USER MOD Single : A 214 MET CE :methyl -143:sc= -2.19 (180deg=-3.55!) USER MOD Single : A 219 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 15 N SER A 149 -13.469 4.772 7.115 1.00 0.00 N ATOM 16 CA SER A 149 -12.181 5.120 7.691 1.00 0.00 C ATOM 17 C SER A 149 -11.050 4.568 6.820 1.00 0.00 C ATOM 18 O SER A 149 -11.303 3.858 5.847 1.00 0.00 O ATOM 19 CB SER A 149 -12.055 4.591 9.120 1.00 0.00 C ATOM 20 OG SER A 149 -11.048 5.276 9.858 1.00 0.00 O ATOM 0 HA SER A 149 -12.106 6.207 7.726 1.00 0.00 H new ATOM 0 HB2 SER A 149 -13.012 4.696 9.631 1.00 0.00 H new ATOM 0 HB3 SER A 149 -11.823 3.526 9.093 1.00 0.00 H new ATOM 0 HG SER A 149 -11.290 5.288 10.808 1.00 0.00 H new ATOM 26 N ILE A 150 -9.830 4.917 7.199 1.00 0.00 N ATOM 27 CA ILE A 150 -8.661 4.465 6.464 1.00 0.00 C ATOM 28 C ILE A 150 -8.357 3.014 6.840 1.00 0.00 C ATOM 29 O ILE A 150 -7.640 2.319 6.121 1.00 0.00 O ATOM 30 CB ILE A 150 -7.485 5.418 6.689 1.00 0.00 C ATOM 31 CG1 ILE A 150 -7.928 6.877 6.555 1.00 0.00 C ATOM 32 CG2 ILE A 150 -6.322 5.084 5.753 1.00 0.00 C ATOM 33 CD1 ILE A 150 -7.899 7.326 5.092 1.00 0.00 C ATOM 0 H ILE A 150 -9.625 5.507 8.005 1.00 0.00 H new ATOM 0 HA ILE A 150 -8.855 4.483 5.392 1.00 0.00 H new ATOM 0 HB ILE A 150 -7.126 5.283 7.709 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -8.935 6.993 6.955 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -7.274 7.516 7.148 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -5.499 5.776 5.933 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -5.986 4.064 5.940 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -6.651 5.174 4.718 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -8.218 8.366 5.024 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -6.885 7.231 4.702 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -8.573 6.701 4.506 1.00 0.00 H new ATOM 45 N LEU A 151 -8.915 2.598 7.969 1.00 0.00 N ATOM 46 CA LEU A 151 -8.713 1.243 8.448 1.00 0.00 C ATOM 47 C LEU A 151 -9.331 0.256 7.456 1.00 0.00 C ATOM 48 O LEU A 151 -8.808 -0.838 7.255 1.00 0.00 O ATOM 49 CB LEU A 151 -9.245 1.095 9.875 1.00 0.00 C ATOM 50 CG LEU A 151 -10.767 1.074 10.026 1.00 0.00 C ATOM 51 CD1 LEU A 151 -11.269 -0.340 10.328 1.00 0.00 C ATOM 52 CD2 LEU A 151 -11.228 2.084 11.078 1.00 0.00 C ATOM 0 H LEU A 151 -9.507 3.177 8.565 1.00 0.00 H new ATOM 0 HA LEU A 151 -7.649 1.014 8.503 1.00 0.00 H new ATOM 0 HB2 LEU A 151 -8.846 0.173 10.296 1.00 0.00 H new ATOM 0 HB3 LEU A 151 -8.852 1.916 10.475 1.00 0.00 H new ATOM 0 HG LEU A 151 -11.209 1.376 9.076 1.00 0.00 H new ATOM 0 HD11 LEU A 151 -12.354 -0.327 10.431 1.00 0.00 H new ATOM 0 HD12 LEU A 151 -10.990 -1.007 9.512 1.00 0.00 H new ATOM 0 HD13 LEU A 151 -10.821 -0.695 11.256 1.00 0.00 H new ATOM 0 HD21 LEU A 151 -12.314 2.048 11.165 1.00 0.00 H new ATOM 0 HD22 LEU A 151 -10.778 1.838 12.040 1.00 0.00 H new ATOM 0 HD23 LEU A 151 -10.921 3.086 10.779 1.00 0.00 H new ATOM 64 N ASP A 152 -10.438 0.679 6.863 1.00 0.00 N ATOM 65 CA ASP A 152 -11.134 -0.153 5.895 1.00 0.00 C ATOM 66 C ASP A 152 -10.255 -0.333 4.657 1.00 0.00 C ATOM 67 O ASP A 152 -10.458 -1.260 3.876 1.00 0.00 O ATOM 68 CB ASP A 152 -12.447 0.497 5.455 1.00 0.00 C ATOM 69 CG ASP A 152 -13.624 -0.468 5.298 1.00 0.00 C ATOM 70 OD1 ASP A 152 -13.585 -1.396 4.477 1.00 0.00 O ATOM 71 OD2 ASP A 152 -14.628 -0.232 6.074 1.00 0.00 O ATOM 0 H ASP A 152 -10.870 1.587 7.034 1.00 0.00 H new ATOM 0 HA ASP A 152 -11.347 -1.113 6.366 1.00 0.00 H new ATOM 0 HB2 ASP A 152 -12.718 1.262 6.182 1.00 0.00 H new ATOM 0 HB3 ASP A 152 -12.283 1.005 4.504 1.00 0.00 H new ATOM 77 N ILE A 153 -9.296 0.571 4.516 1.00 0.00 N ATOM 78 CA ILE A 153 -8.385 0.524 3.385 1.00 0.00 C ATOM 79 C ILE A 153 -7.253 -0.460 3.688 1.00 0.00 C ATOM 80 O ILE A 153 -6.289 -0.113 4.369 1.00 0.00 O ATOM 81 CB ILE A 153 -7.899 1.930 3.030 1.00 0.00 C ATOM 82 CG1 ILE A 153 -9.048 2.792 2.504 1.00 0.00 C ATOM 83 CG2 ILE A 153 -6.729 1.874 2.046 1.00 0.00 C ATOM 84 CD1 ILE A 153 -10.206 2.831 3.504 1.00 0.00 C ATOM 0 H ILE A 153 -9.130 1.340 5.166 1.00 0.00 H new ATOM 0 HA ILE A 153 -8.899 0.156 2.497 1.00 0.00 H new ATOM 0 HB ILE A 153 -7.532 2.403 3.941 1.00 0.00 H new ATOM 0 HG12 ILE A 153 -8.691 3.805 2.316 1.00 0.00 H new ATOM 0 HG13 ILE A 153 -9.399 2.395 1.551 1.00 0.00 H new ATOM 0 HG21 ILE A 153 -6.403 2.887 1.810 1.00 0.00 H new ATOM 0 HG22 ILE A 153 -5.903 1.322 2.494 1.00 0.00 H new ATOM 0 HG23 ILE A 153 -7.046 1.373 1.131 1.00 0.00 H new ATOM 0 HD11 ILE A 153 -11.010 3.450 3.106 1.00 0.00 H new ATOM 0 HD12 ILE A 153 -10.576 1.820 3.672 1.00 0.00 H new ATOM 0 HD13 ILE A 153 -9.858 3.251 4.448 1.00 0.00 H new ATOM 96 N ARG A 154 -7.408 -1.668 3.167 1.00 0.00 N ATOM 97 CA ARG A 154 -6.410 -2.706 3.372 1.00 0.00 C ATOM 98 C ARG A 154 -6.060 -3.377 2.044 1.00 0.00 C ATOM 99 O ARG A 154 -6.715 -3.136 1.031 1.00 0.00 O ATOM 100 CB ARG A 154 -6.913 -3.764 4.355 1.00 0.00 C ATOM 101 CG ARG A 154 -5.816 -4.156 5.348 1.00 0.00 C ATOM 102 CD ARG A 154 -6.195 -5.427 6.111 1.00 0.00 C ATOM 103 NE ARG A 154 -4.987 -6.245 6.362 1.00 0.00 N ATOM 104 CZ ARG A 154 -3.975 -5.872 7.176 1.00 0.00 C ATOM 105 NH1 ARG A 154 -4.019 -4.688 7.823 1.00 0.00 N ATOM 106 NH2 ARG A 154 -2.945 -6.681 7.326 1.00 0.00 N ATOM 0 H ARG A 154 -8.209 -1.952 2.603 1.00 0.00 H new ATOM 0 HA ARG A 154 -5.520 -2.234 3.788 1.00 0.00 H new ATOM 0 HB2 ARG A 154 -7.778 -3.381 4.896 1.00 0.00 H new ATOM 0 HB3 ARG A 154 -7.245 -4.646 3.807 1.00 0.00 H new ATOM 0 HG2 ARG A 154 -4.878 -4.313 4.816 1.00 0.00 H new ATOM 0 HG3 ARG A 154 -5.650 -3.341 6.052 1.00 0.00 H new ATOM 0 HD2 ARG A 154 -6.670 -5.166 7.056 1.00 0.00 H new ATOM 0 HD3 ARG A 154 -6.921 -6.003 5.537 1.00 0.00 H new ATOM 0 HE ARG A 154 -4.914 -7.147 5.891 1.00 0.00 H new ATOM 0 HH11 ARG A 154 -4.820 -4.068 7.699 1.00 0.00 H new ATOM 0 HH12 ARG A 154 -3.251 -4.413 8.436 1.00 0.00 H new ATOM 0 HH21 ARG A 154 -2.921 -7.573 6.831 1.00 0.00 H new ATOM 0 HH22 ARG A 154 -2.172 -6.415 7.937 1.00 0.00 H new ATOM 120 N GLN A 155 -5.028 -4.206 2.089 1.00 0.00 N ATOM 121 CA GLN A 155 -4.584 -4.914 0.901 1.00 0.00 C ATOM 122 C GLN A 155 -5.450 -6.153 0.666 1.00 0.00 C ATOM 123 O GLN A 155 -5.176 -7.220 1.214 1.00 0.00 O ATOM 124 CB GLN A 155 -3.105 -5.292 1.009 1.00 0.00 C ATOM 125 CG GLN A 155 -2.246 -4.410 0.101 1.00 0.00 C ATOM 126 CD GLN A 155 -0.791 -4.387 0.575 1.00 0.00 C ATOM 127 OE1 GLN A 155 -0.285 -5.335 1.154 1.00 0.00 O ATOM 128 NE2 GLN A 155 -0.149 -3.257 0.298 1.00 0.00 N ATOM 0 H GLN A 155 -4.486 -4.403 2.930 1.00 0.00 H new ATOM 0 HA GLN A 155 -4.694 -4.250 0.044 1.00 0.00 H new ATOM 0 HB2 GLN A 155 -2.774 -5.188 2.042 1.00 0.00 H new ATOM 0 HB3 GLN A 155 -2.973 -6.339 0.736 1.00 0.00 H new ATOM 0 HG2 GLN A 155 -2.293 -4.782 -0.923 1.00 0.00 H new ATOM 0 HG3 GLN A 155 -2.645 -3.396 0.091 1.00 0.00 H new ATOM 0 HE21 GLN A 155 -0.632 -2.502 -0.190 1.00 0.00 H new ATOM 0 HE22 GLN A 155 0.827 -3.144 0.573 1.00 0.00 H new ATOM 196 N PRO A 160 -5.944 -5.705 -6.251 1.00 0.00 N ATOM 197 CA PRO A 160 -4.556 -5.344 -6.484 1.00 0.00 C ATOM 198 C PRO A 160 -4.119 -4.211 -5.554 1.00 0.00 C ATOM 199 O PRO A 160 -4.943 -3.632 -4.847 1.00 0.00 O ATOM 200 CB PRO A 160 -4.489 -4.967 -7.955 1.00 0.00 C ATOM 201 CG PRO A 160 -5.920 -4.681 -8.377 1.00 0.00 C ATOM 202 CD PRO A 160 -6.842 -5.218 -7.293 1.00 0.00 C ATOM 0 HA PRO A 160 -3.867 -6.160 -6.264 1.00 0.00 H new ATOM 0 HB2 PRO A 160 -3.855 -4.093 -8.106 1.00 0.00 H new ATOM 0 HB3 PRO A 160 -4.062 -5.777 -8.547 1.00 0.00 H new ATOM 0 HG2 PRO A 160 -6.072 -3.610 -8.511 1.00 0.00 H new ATOM 0 HG3 PRO A 160 -6.138 -5.156 -9.334 1.00 0.00 H new ATOM 0 HD2 PRO A 160 -7.503 -4.439 -6.914 1.00 0.00 H new ATOM 0 HD3 PRO A 160 -7.477 -6.018 -7.674 1.00 0.00 H new ATOM 210 N PHE A 161 -2.826 -3.928 -5.586 1.00 0.00 N ATOM 211 CA PHE A 161 -2.271 -2.873 -4.754 1.00 0.00 C ATOM 212 C PHE A 161 -2.714 -1.494 -5.248 1.00 0.00 C ATOM 213 O PHE A 161 -2.791 -0.547 -4.467 1.00 0.00 O ATOM 214 CB PHE A 161 -0.748 -2.974 -4.862 1.00 0.00 C ATOM 215 CG PHE A 161 0.005 -1.952 -4.007 1.00 0.00 C ATOM 216 CD1 PHE A 161 -0.020 -2.048 -2.651 1.00 0.00 C ATOM 217 CD2 PHE A 161 0.701 -0.947 -4.606 1.00 0.00 C ATOM 218 CE1 PHE A 161 0.678 -1.099 -1.860 1.00 0.00 C ATOM 219 CE2 PHE A 161 1.400 0.002 -3.813 1.00 0.00 C ATOM 220 CZ PHE A 161 1.374 -0.095 -2.457 1.00 0.00 C ATOM 0 H PHE A 161 -2.146 -4.410 -6.174 1.00 0.00 H new ATOM 0 HA PHE A 161 -2.616 -2.989 -3.727 1.00 0.00 H new ATOM 0 HB2 PHE A 161 -0.439 -3.977 -4.568 1.00 0.00 H new ATOM 0 HB3 PHE A 161 -0.458 -2.844 -5.905 1.00 0.00 H new ATOM 0 HD1 PHE A 161 -0.571 -2.846 -2.176 1.00 0.00 H new ATOM 0 HD2 PHE A 161 0.722 -0.871 -5.683 1.00 0.00 H new ATOM 0 HE1 PHE A 161 0.656 -1.174 -0.783 1.00 0.00 H new ATOM 0 HE2 PHE A 161 1.952 0.800 -4.287 1.00 0.00 H new ATOM 0 HZ PHE A 161 1.906 0.626 -1.854 1.00 0.00 H new ATOM 230 N ARG A 162 -2.995 -1.426 -6.542 1.00 0.00 N ATOM 231 CA ARG A 162 -3.429 -0.180 -7.148 1.00 0.00 C ATOM 232 C ARG A 162 -4.787 0.240 -6.585 1.00 0.00 C ATOM 233 O ARG A 162 -4.979 1.399 -6.217 1.00 0.00 O ATOM 234 CB ARG A 162 -3.536 -0.316 -8.668 1.00 0.00 C ATOM 235 CG ARG A 162 -2.298 0.263 -9.358 1.00 0.00 C ATOM 236 CD ARG A 162 -2.268 -0.119 -10.840 1.00 0.00 C ATOM 237 NE ARG A 162 -2.284 1.101 -11.677 1.00 0.00 N ATOM 238 CZ ARG A 162 -1.175 1.770 -12.063 1.00 0.00 C ATOM 239 NH1 ARG A 162 0.048 1.340 -11.688 1.00 0.00 N ATOM 240 NH2 ARG A 162 -1.306 2.849 -12.811 1.00 0.00 N ATOM 0 H ARG A 162 -2.930 -2.214 -7.186 1.00 0.00 H new ATOM 0 HA ARG A 162 -2.684 0.580 -6.913 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -3.648 -1.367 -8.936 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -4.429 0.200 -9.021 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -2.296 1.348 -9.258 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -1.398 -0.104 -8.866 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -1.375 -0.706 -11.055 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -3.127 -0.746 -11.080 1.00 0.00 H new ATOM 0 HE ARG A 162 -3.189 1.460 -11.982 1.00 0.00 H new ATOM 0 HH11 ARG A 162 0.140 0.505 -11.109 1.00 0.00 H new ATOM 0 HH12 ARG A 162 0.881 1.850 -11.983 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -2.234 3.167 -13.089 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -0.479 3.365 -13.111 1.00 0.00 H new ATOM 254 N ASP A 163 -5.695 -0.723 -6.531 1.00 0.00 N ATOM 255 CA ASP A 163 -7.029 -0.467 -6.018 1.00 0.00 C ATOM 256 C ASP A 163 -6.942 -0.118 -4.531 1.00 0.00 C ATOM 257 O ASP A 163 -7.711 0.704 -4.037 1.00 0.00 O ATOM 258 CB ASP A 163 -7.920 -1.703 -6.162 1.00 0.00 C ATOM 259 CG ASP A 163 -8.638 -1.830 -7.507 1.00 0.00 C ATOM 260 OD1 ASP A 163 -9.778 -2.310 -7.580 1.00 0.00 O ATOM 261 OD2 ASP A 163 -7.968 -1.405 -8.525 1.00 0.00 O ATOM 0 H ASP A 163 -5.532 -1.683 -6.835 1.00 0.00 H new ATOM 0 HA ASP A 163 -7.458 0.356 -6.589 1.00 0.00 H new ATOM 0 HB2 ASP A 163 -7.309 -2.592 -6.008 1.00 0.00 H new ATOM 0 HB3 ASP A 163 -8.667 -1.688 -5.368 1.00 0.00 H new ATOM 267 N TYR A 164 -5.997 -0.761 -3.861 1.00 0.00 N ATOM 268 CA TYR A 164 -5.798 -0.530 -2.439 1.00 0.00 C ATOM 269 C TYR A 164 -5.303 0.895 -2.181 1.00 0.00 C ATOM 270 O TYR A 164 -5.770 1.560 -1.257 1.00 0.00 O ATOM 271 CB TYR A 164 -4.718 -1.519 -1.997 1.00 0.00 C ATOM 272 CG TYR A 164 -4.133 -1.226 -0.616 1.00 0.00 C ATOM 273 CD1 TYR A 164 -4.972 -1.055 0.468 1.00 0.00 C ATOM 274 CD2 TYR A 164 -2.765 -1.131 -0.451 1.00 0.00 C ATOM 275 CE1 TYR A 164 -4.420 -0.779 1.768 1.00 0.00 C ATOM 276 CE2 TYR A 164 -2.214 -0.855 0.851 1.00 0.00 C ATOM 277 CZ TYR A 164 -3.068 -0.692 1.896 1.00 0.00 C ATOM 278 OH TYR A 164 -2.548 -0.430 3.125 1.00 0.00 O ATOM 0 H TYR A 164 -5.361 -1.442 -4.276 1.00 0.00 H new ATOM 0 HA TYR A 164 -6.733 -0.662 -1.894 1.00 0.00 H new ATOM 0 HB2 TYR A 164 -5.139 -2.524 -1.996 1.00 0.00 H new ATOM 0 HB3 TYR A 164 -3.912 -1.512 -2.730 1.00 0.00 H new ATOM 0 HD1 TYR A 164 -6.042 -1.128 0.340 1.00 0.00 H new ATOM 0 HD2 TYR A 164 -2.108 -1.264 -1.298 1.00 0.00 H new ATOM 0 HE1 TYR A 164 -5.065 -0.644 2.624 1.00 0.00 H new ATOM 0 HE2 TYR A 164 -1.146 -0.779 0.994 1.00 0.00 H new ATOM 0 HH TYR A 164 -1.609 -0.166 3.033 1.00 0.00 H new ATOM 288 N VAL A 165 -4.365 1.322 -3.013 1.00 0.00 N ATOM 289 CA VAL A 165 -3.802 2.656 -2.887 1.00 0.00 C ATOM 290 C VAL A 165 -4.893 3.692 -3.160 1.00 0.00 C ATOM 291 O VAL A 165 -5.005 4.684 -2.441 1.00 0.00 O ATOM 292 CB VAL A 165 -2.591 2.803 -3.810 1.00 0.00 C ATOM 293 CG1 VAL A 165 -2.352 4.270 -4.171 1.00 0.00 C ATOM 294 CG2 VAL A 165 -1.342 2.182 -3.179 1.00 0.00 C ATOM 0 H VAL A 165 -3.980 0.768 -3.778 1.00 0.00 H new ATOM 0 HA VAL A 165 -3.441 2.824 -1.872 1.00 0.00 H new ATOM 0 HB VAL A 165 -2.804 2.262 -4.732 1.00 0.00 H new ATOM 0 HG11 VAL A 165 -1.486 4.347 -4.828 1.00 0.00 H new ATOM 0 HG12 VAL A 165 -3.230 4.667 -4.681 1.00 0.00 H new ATOM 0 HG13 VAL A 165 -2.170 4.843 -3.262 1.00 0.00 H new ATOM 0 HG21 VAL A 165 -0.496 2.300 -3.856 1.00 0.00 H new ATOM 0 HG22 VAL A 165 -1.124 2.682 -2.235 1.00 0.00 H new ATOM 0 HG23 VAL A 165 -1.515 1.121 -2.997 1.00 0.00 H new ATOM 304 N ASP A 166 -5.667 3.429 -4.203 1.00 0.00 N ATOM 305 CA ASP A 166 -6.745 4.327 -4.580 1.00 0.00 C ATOM 306 C ASP A 166 -7.703 4.493 -3.400 1.00 0.00 C ATOM 307 O ASP A 166 -8.133 5.605 -3.097 1.00 0.00 O ATOM 308 CB ASP A 166 -7.541 3.766 -5.760 1.00 0.00 C ATOM 309 CG ASP A 166 -8.380 4.795 -6.521 1.00 0.00 C ATOM 310 OD1 ASP A 166 -7.944 5.934 -6.747 1.00 0.00 O ATOM 311 OD2 ASP A 166 -9.543 4.382 -6.894 1.00 0.00 O ATOM 0 H ASP A 166 -5.569 2.607 -4.799 1.00 0.00 H new ATOM 0 HA ASP A 166 -6.304 5.282 -4.864 1.00 0.00 H new ATOM 0 HB2 ASP A 166 -6.847 3.298 -6.458 1.00 0.00 H new ATOM 0 HB3 ASP A 166 -8.202 2.981 -5.393 1.00 0.00 H new ATOM 317 N ARG A 167 -8.009 3.371 -2.766 1.00 0.00 N ATOM 318 CA ARG A 167 -8.908 3.377 -1.623 1.00 0.00 C ATOM 319 C ARG A 167 -8.301 4.184 -0.474 1.00 0.00 C ATOM 320 O ARG A 167 -8.989 4.978 0.165 1.00 0.00 O ATOM 321 CB ARG A 167 -9.200 1.955 -1.143 1.00 0.00 C ATOM 322 CG ARG A 167 -10.704 1.730 -0.974 1.00 0.00 C ATOM 323 CD ARG A 167 -11.279 2.655 0.101 1.00 0.00 C ATOM 324 NE ARG A 167 -12.596 3.174 -0.330 1.00 0.00 N ATOM 325 CZ ARG A 167 -13.706 2.415 -0.447 1.00 0.00 C ATOM 326 NH1 ARG A 167 -13.666 1.094 -0.166 1.00 0.00 N ATOM 327 NH2 ARG A 167 -14.831 2.982 -0.840 1.00 0.00 N ATOM 0 H ARG A 167 -7.651 2.451 -3.022 1.00 0.00 H new ATOM 0 HA ARG A 167 -9.843 3.838 -1.940 1.00 0.00 H new ATOM 0 HB2 ARG A 167 -8.800 1.237 -1.858 1.00 0.00 H new ATOM 0 HB3 ARG A 167 -8.693 1.777 -0.195 1.00 0.00 H new ATOM 0 HG2 ARG A 167 -11.211 1.909 -1.922 1.00 0.00 H new ATOM 0 HG3 ARG A 167 -10.892 0.691 -0.703 1.00 0.00 H new ATOM 0 HD2 ARG A 167 -11.382 2.113 1.041 1.00 0.00 H new ATOM 0 HD3 ARG A 167 -10.595 3.483 0.284 1.00 0.00 H new ATOM 0 HE ARG A 167 -12.670 4.167 -0.552 1.00 0.00 H new ATOM 0 HH11 ARG A 167 -12.792 0.663 0.137 1.00 0.00 H new ATOM 0 HH12 ARG A 167 -14.509 0.527 -0.257 1.00 0.00 H new ATOM 0 HH21 ARG A 167 -14.853 3.980 -1.050 1.00 0.00 H new ATOM 0 HH22 ARG A 167 -15.679 2.422 -0.933 1.00 0.00 H new ATOM 341 N PHE A 168 -7.017 3.950 -0.244 1.00 0.00 N ATOM 342 CA PHE A 168 -6.309 4.643 0.819 1.00 0.00 C ATOM 343 C PHE A 168 -6.371 6.159 0.620 1.00 0.00 C ATOM 344 O PHE A 168 -6.661 6.900 1.558 1.00 0.00 O ATOM 345 CB PHE A 168 -4.849 4.191 0.751 1.00 0.00 C ATOM 346 CG PHE A 168 -3.976 4.736 1.884 1.00 0.00 C ATOM 347 CD1 PHE A 168 -3.393 5.959 1.766 1.00 0.00 C ATOM 348 CD2 PHE A 168 -3.781 3.996 3.009 1.00 0.00 C ATOM 349 CE1 PHE A 168 -2.584 6.464 2.818 1.00 0.00 C ATOM 350 CE2 PHE A 168 -2.972 4.502 4.060 1.00 0.00 C ATOM 351 CZ PHE A 168 -2.390 5.725 3.942 1.00 0.00 C ATOM 0 H PHE A 168 -6.449 3.290 -0.776 1.00 0.00 H new ATOM 0 HA PHE A 168 -6.763 4.411 1.783 1.00 0.00 H new ATOM 0 HB2 PHE A 168 -4.815 3.102 0.772 1.00 0.00 H new ATOM 0 HB3 PHE A 168 -4.426 4.505 -0.203 1.00 0.00 H new ATOM 0 HD1 PHE A 168 -3.545 6.546 0.872 1.00 0.00 H new ATOM 0 HD2 PHE A 168 -4.242 3.024 3.102 1.00 0.00 H new ATOM 0 HE1 PHE A 168 -2.123 7.436 2.725 1.00 0.00 H new ATOM 0 HE2 PHE A 168 -2.819 3.915 4.954 1.00 0.00 H new ATOM 0 HZ PHE A 168 -1.774 6.109 4.741 1.00 0.00 H new ATOM 361 N TYR A 169 -6.092 6.574 -0.608 1.00 0.00 N ATOM 362 CA TYR A 169 -6.113 7.989 -0.942 1.00 0.00 C ATOM 363 C TYR A 169 -7.549 8.506 -1.047 1.00 0.00 C ATOM 364 O TYR A 169 -7.788 9.709 -0.941 1.00 0.00 O ATOM 365 CB TYR A 169 -5.439 8.109 -2.309 1.00 0.00 C ATOM 366 CG TYR A 169 -3.910 8.058 -2.256 1.00 0.00 C ATOM 367 CD1 TYR A 169 -3.278 7.037 -1.574 1.00 0.00 C ATOM 368 CD2 TYR A 169 -3.164 9.030 -2.888 1.00 0.00 C ATOM 369 CE1 TYR A 169 -1.839 6.989 -1.523 1.00 0.00 C ATOM 370 CE2 TYR A 169 -1.726 8.982 -2.838 1.00 0.00 C ATOM 371 CZ TYR A 169 -1.135 7.964 -2.158 1.00 0.00 C ATOM 372 OH TYR A 169 0.225 7.918 -2.111 1.00 0.00 O ATOM 0 H TYR A 169 -5.851 5.956 -1.383 1.00 0.00 H new ATOM 0 HA TYR A 169 -5.606 8.573 -0.173 1.00 0.00 H new ATOM 0 HB2 TYR A 169 -5.797 7.304 -2.951 1.00 0.00 H new ATOM 0 HB3 TYR A 169 -5.745 9.047 -2.773 1.00 0.00 H new ATOM 0 HD1 TYR A 169 -3.862 6.275 -1.079 1.00 0.00 H new ATOM 0 HD2 TYR A 169 -3.659 9.828 -3.421 1.00 0.00 H new ATOM 0 HE1 TYR A 169 -1.331 6.197 -0.993 1.00 0.00 H new ATOM 0 HE2 TYR A 169 -1.131 9.737 -3.329 1.00 0.00 H new ATOM 0 HH TYR A 169 0.519 6.985 -2.044 1.00 0.00 H new ATOM 382 N LYS A 170 -8.467 7.573 -1.255 1.00 0.00 N ATOM 383 CA LYS A 170 -9.873 7.920 -1.376 1.00 0.00 C ATOM 384 C LYS A 170 -10.412 8.330 -0.004 1.00 0.00 C ATOM 385 O LYS A 170 -11.118 9.331 0.116 1.00 0.00 O ATOM 386 CB LYS A 170 -10.652 6.777 -2.028 1.00 0.00 C ATOM 387 CG LYS A 170 -10.931 7.073 -3.502 1.00 0.00 C ATOM 388 CD LYS A 170 -11.260 5.789 -4.267 1.00 0.00 C ATOM 389 CE LYS A 170 -11.689 6.101 -5.702 1.00 0.00 C ATOM 390 NZ LYS A 170 -13.107 6.524 -5.740 1.00 0.00 N ATOM 0 H LYS A 170 -8.264 6.577 -1.343 1.00 0.00 H new ATOM 0 HA LYS A 170 -9.999 8.778 -2.037 1.00 0.00 H new ATOM 0 HB2 LYS A 170 -10.085 5.850 -1.941 1.00 0.00 H new ATOM 0 HB3 LYS A 170 -11.593 6.626 -1.499 1.00 0.00 H new ATOM 0 HG2 LYS A 170 -11.762 7.773 -3.585 1.00 0.00 H new ATOM 0 HG3 LYS A 170 -10.062 7.555 -3.950 1.00 0.00 H new ATOM 0 HD2 LYS A 170 -10.388 5.135 -4.278 1.00 0.00 H new ATOM 0 HD3 LYS A 170 -12.057 5.250 -3.754 1.00 0.00 H new ATOM 0 HE2 LYS A 170 -11.058 6.889 -6.113 1.00 0.00 H new ATOM 0 HE3 LYS A 170 -11.549 5.220 -6.329 1.00 0.00 H new ATOM 0 HZ1 LYS A 170 -13.381 6.732 -6.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 170 -13.707 5.761 -5.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 170 -13.230 7.377 -5.158 1.00 0.00 H new ATOM 404 N THR A 171 -10.061 7.535 0.997 1.00 0.00 N ATOM 405 CA THR A 171 -10.501 7.802 2.355 1.00 0.00 C ATOM 406 C THR A 171 -9.722 8.978 2.947 1.00 0.00 C ATOM 407 O THR A 171 -10.285 9.798 3.672 1.00 0.00 O ATOM 408 CB THR A 171 -10.357 6.510 3.161 1.00 0.00 C ATOM 409 OG1 THR A 171 -11.330 5.637 2.594 1.00 0.00 O ATOM 410 CG2 THR A 171 -10.806 6.673 4.615 1.00 0.00 C ATOM 0 H THR A 171 -9.477 6.705 0.894 1.00 0.00 H new ATOM 0 HA THR A 171 -11.549 8.102 2.379 1.00 0.00 H new ATOM 0 HB THR A 171 -9.318 6.181 3.137 1.00 0.00 H new ATOM 0 HG1 THR A 171 -11.934 5.319 3.297 1.00 0.00 H new ATOM 0 HG21 THR A 171 -10.683 5.727 5.142 1.00 0.00 H new ATOM 0 HG22 THR A 171 -10.201 7.439 5.099 1.00 0.00 H new ATOM 0 HG23 THR A 171 -11.855 6.969 4.641 1.00 0.00 H new ATOM 418 N LEU A 172 -8.440 9.023 2.616 1.00 0.00 N ATOM 419 CA LEU A 172 -7.578 10.086 3.105 1.00 0.00 C ATOM 420 C LEU A 172 -8.152 11.439 2.682 1.00 0.00 C ATOM 421 O LEU A 172 -8.213 12.370 3.485 1.00 0.00 O ATOM 422 CB LEU A 172 -6.136 9.859 2.647 1.00 0.00 C ATOM 423 CG LEU A 172 -5.658 10.729 1.480 1.00 0.00 C ATOM 424 CD1 LEU A 172 -5.608 12.204 1.883 1.00 0.00 C ATOM 425 CD2 LEU A 172 -4.314 10.235 0.944 1.00 0.00 C ATOM 0 H LEU A 172 -7.977 8.341 2.015 1.00 0.00 H new ATOM 0 HA LEU A 172 -7.547 10.080 4.195 1.00 0.00 H new ATOM 0 HB2 LEU A 172 -5.475 10.030 3.496 1.00 0.00 H new ATOM 0 HB3 LEU A 172 -6.026 8.812 2.363 1.00 0.00 H new ATOM 0 HG LEU A 172 -6.380 10.641 0.668 1.00 0.00 H new ATOM 0 HD11 LEU A 172 -5.266 12.801 1.038 1.00 0.00 H new ATOM 0 HD12 LEU A 172 -6.603 12.534 2.181 1.00 0.00 H new ATOM 0 HD13 LEU A 172 -4.919 12.330 2.718 1.00 0.00 H new ATOM 0 HD21 LEU A 172 -3.997 10.869 0.116 1.00 0.00 H new ATOM 0 HD22 LEU A 172 -3.569 10.275 1.738 1.00 0.00 H new ATOM 0 HD23 LEU A 172 -4.417 9.208 0.595 1.00 0.00 H new ATOM 437 N ARG A 173 -8.558 11.506 1.422 1.00 0.00 N ATOM 438 CA ARG A 173 -9.126 12.730 0.883 1.00 0.00 C ATOM 439 C ARG A 173 -10.621 12.806 1.201 1.00 0.00 C ATOM 440 O ARG A 173 -11.313 13.711 0.734 1.00 0.00 O ATOM 441 CB ARG A 173 -8.928 12.808 -0.631 1.00 0.00 C ATOM 442 CG ARG A 173 -7.863 13.844 -0.992 1.00 0.00 C ATOM 443 CD ARG A 173 -7.986 14.271 -2.457 1.00 0.00 C ATOM 444 NE ARG A 173 -7.354 13.259 -3.333 1.00 0.00 N ATOM 445 CZ ARG A 173 -7.201 13.403 -4.667 1.00 0.00 C ATOM 446 NH1 ARG A 173 -7.632 14.521 -5.290 1.00 0.00 N ATOM 447 NH2 ARG A 173 -6.623 12.436 -5.354 1.00 0.00 N ATOM 0 H ARG A 173 -8.505 10.732 0.759 1.00 0.00 H new ATOM 0 HA ARG A 173 -8.609 13.569 1.349 1.00 0.00 H new ATOM 0 HB2 ARG A 173 -8.634 11.831 -1.014 1.00 0.00 H new ATOM 0 HB3 ARG A 173 -9.871 13.068 -1.112 1.00 0.00 H new ATOM 0 HG2 ARG A 173 -7.965 14.716 -0.346 1.00 0.00 H new ATOM 0 HG3 ARG A 173 -6.871 13.429 -0.813 1.00 0.00 H new ATOM 0 HD2 ARG A 173 -9.036 14.390 -2.723 1.00 0.00 H new ATOM 0 HD3 ARG A 173 -7.509 15.240 -2.603 1.00 0.00 H new ATOM 0 HE ARG A 173 -7.013 12.400 -2.902 1.00 0.00 H new ATOM 0 HH11 ARG A 173 -8.077 15.265 -4.753 1.00 0.00 H new ATOM 0 HH12 ARG A 173 -7.512 14.621 -6.298 1.00 0.00 H new ATOM 0 HH21 ARG A 173 -6.299 11.595 -4.877 1.00 0.00 H new ATOM 0 HH22 ARG A 173 -6.500 12.530 -6.362 1.00 0.00 H new ATOM 461 N ALA A 174 -11.077 11.845 1.990 1.00 0.00 N ATOM 462 CA ALA A 174 -12.477 11.793 2.375 1.00 0.00 C ATOM 463 C ALA A 174 -12.651 12.457 3.743 1.00 0.00 C ATOM 464 O ALA A 174 -13.762 12.826 4.120 1.00 0.00 O ATOM 465 CB ALA A 174 -12.954 10.338 2.369 1.00 0.00 C ATOM 0 H ALA A 174 -10.501 11.095 2.374 1.00 0.00 H new ATOM 0 HA ALA A 174 -13.092 12.342 1.662 1.00 0.00 H new ATOM 0 HB1 ALA A 174 -14.004 10.298 2.658 1.00 0.00 H new ATOM 0 HB2 ALA A 174 -12.837 9.921 1.369 1.00 0.00 H new ATOM 0 HB3 ALA A 174 -12.361 9.758 3.076 1.00 0.00 H new ATOM 630 N THR A 186 1.280 9.124 5.636 1.00 0.00 N ATOM 631 CA THR A 186 0.360 8.368 4.803 1.00 0.00 C ATOM 632 C THR A 186 1.002 7.053 4.357 1.00 0.00 C ATOM 633 O THR A 186 0.478 5.975 4.635 1.00 0.00 O ATOM 634 CB THR A 186 -0.066 9.262 3.637 1.00 0.00 C ATOM 635 OG1 THR A 186 1.141 9.899 3.229 1.00 0.00 O ATOM 636 CG2 THR A 186 -0.966 10.416 4.083 1.00 0.00 C ATOM 0 HA THR A 186 -0.534 8.085 5.358 1.00 0.00 H new ATOM 0 HB THR A 186 -0.588 8.662 2.891 1.00 0.00 H new ATOM 0 HG1 THR A 186 1.740 9.989 4.000 1.00 0.00 H new ATOM 0 HG21 THR A 186 -1.240 11.020 3.218 1.00 0.00 H new ATOM 0 HG22 THR A 186 -1.868 10.016 4.546 1.00 0.00 H new ATOM 0 HG23 THR A 186 -0.433 11.036 4.804 1.00 0.00 H new ATOM 644 N GLU A 187 2.130 7.184 3.672 1.00 0.00 N ATOM 645 CA GLU A 187 2.849 6.019 3.185 1.00 0.00 C ATOM 646 C GLU A 187 3.023 4.994 4.308 1.00 0.00 C ATOM 647 O GLU A 187 2.939 3.790 4.073 1.00 0.00 O ATOM 648 CB GLU A 187 4.202 6.418 2.592 1.00 0.00 C ATOM 649 CG GLU A 187 5.100 5.195 2.401 1.00 0.00 C ATOM 650 CD GLU A 187 5.846 4.855 3.692 1.00 0.00 C ATOM 651 OE1 GLU A 187 5.805 5.634 4.655 1.00 0.00 O ATOM 652 OE2 GLU A 187 6.486 3.735 3.672 1.00 0.00 O ATOM 0 H GLU A 187 2.563 8.079 3.443 1.00 0.00 H new ATOM 0 HA GLU A 187 2.262 5.560 2.389 1.00 0.00 H new ATOM 0 HB2 GLU A 187 4.051 6.915 1.634 1.00 0.00 H new ATOM 0 HB3 GLU A 187 4.694 7.135 3.249 1.00 0.00 H new ATOM 0 HG2 GLU A 187 4.497 4.342 2.090 1.00 0.00 H new ATOM 0 HG3 GLU A 187 5.817 5.387 1.603 1.00 0.00 H new ATOM 660 N THR A 188 3.262 5.510 5.504 1.00 0.00 N ATOM 661 CA THR A 188 3.448 4.655 6.664 1.00 0.00 C ATOM 662 C THR A 188 2.140 3.946 7.019 1.00 0.00 C ATOM 663 O THR A 188 2.154 2.799 7.466 1.00 0.00 O ATOM 664 CB THR A 188 4.001 5.515 7.803 1.00 0.00 C ATOM 665 OG1 THR A 188 4.983 4.687 8.419 1.00 0.00 O ATOM 666 CG2 THR A 188 2.970 5.757 8.907 1.00 0.00 C ATOM 0 H THR A 188 3.331 6.510 5.695 1.00 0.00 H new ATOM 0 HA THR A 188 4.166 3.862 6.458 1.00 0.00 H new ATOM 0 HB THR A 188 4.337 6.472 7.405 1.00 0.00 H new ATOM 0 HG1 THR A 188 5.394 5.168 9.168 1.00 0.00 H new ATOM 0 HG21 THR A 188 3.413 6.372 9.690 1.00 0.00 H new ATOM 0 HG22 THR A 188 2.103 6.270 8.490 1.00 0.00 H new ATOM 0 HG23 THR A 188 2.658 4.802 9.329 1.00 0.00 H new ATOM 674 N LEU A 189 1.043 4.656 6.807 1.00 0.00 N ATOM 675 CA LEU A 189 -0.271 4.108 7.100 1.00 0.00 C ATOM 676 C LEU A 189 -0.593 3.002 6.092 1.00 0.00 C ATOM 677 O LEU A 189 -1.050 1.925 6.473 1.00 0.00 O ATOM 678 CB LEU A 189 -1.318 5.222 7.145 1.00 0.00 C ATOM 679 CG LEU A 189 -1.795 5.639 8.538 1.00 0.00 C ATOM 680 CD1 LEU A 189 -2.707 6.865 8.462 1.00 0.00 C ATOM 681 CD2 LEU A 189 -2.468 4.469 9.259 1.00 0.00 C ATOM 0 H LEU A 189 1.036 5.606 6.436 1.00 0.00 H new ATOM 0 HA LEU A 189 -0.282 3.652 8.090 1.00 0.00 H new ATOM 0 HB2 LEU A 189 -0.907 6.100 6.646 1.00 0.00 H new ATOM 0 HB3 LEU A 189 -2.185 4.902 6.567 1.00 0.00 H new ATOM 0 HG LEU A 189 -0.923 5.923 9.127 1.00 0.00 H new ATOM 0 HD11 LEU A 189 -3.031 7.140 9.466 1.00 0.00 H new ATOM 0 HD12 LEU A 189 -2.162 7.697 8.016 1.00 0.00 H new ATOM 0 HD13 LEU A 189 -3.578 6.633 7.850 1.00 0.00 H new ATOM 0 HD21 LEU A 189 -2.798 4.791 10.247 1.00 0.00 H new ATOM 0 HD22 LEU A 189 -3.329 4.132 8.681 1.00 0.00 H new ATOM 0 HD23 LEU A 189 -1.758 3.649 9.364 1.00 0.00 H new ATOM 693 N LEU A 190 -0.342 3.306 4.827 1.00 0.00 N ATOM 694 CA LEU A 190 -0.599 2.351 3.763 1.00 0.00 C ATOM 695 C LEU A 190 0.197 1.072 4.027 1.00 0.00 C ATOM 696 O LEU A 190 -0.333 -0.031 3.899 1.00 0.00 O ATOM 697 CB LEU A 190 -0.316 2.982 2.398 1.00 0.00 C ATOM 698 CG LEU A 190 -0.473 2.058 1.188 1.00 0.00 C ATOM 699 CD1 LEU A 190 -1.776 2.351 0.441 1.00 0.00 C ATOM 700 CD2 LEU A 190 0.746 2.147 0.268 1.00 0.00 C ATOM 0 H LEU A 190 0.037 4.200 4.515 1.00 0.00 H new ATOM 0 HA LEU A 190 -1.653 2.072 3.747 1.00 0.00 H new ATOM 0 HB2 LEU A 190 -0.983 3.835 2.268 1.00 0.00 H new ATOM 0 HB3 LEU A 190 0.702 3.371 2.404 1.00 0.00 H new ATOM 0 HG LEU A 190 -0.531 1.031 1.548 1.00 0.00 H new ATOM 0 HD11 LEU A 190 -1.864 1.681 -0.414 1.00 0.00 H new ATOM 0 HD12 LEU A 190 -2.622 2.197 1.111 1.00 0.00 H new ATOM 0 HD13 LEU A 190 -1.772 3.384 0.094 1.00 0.00 H new ATOM 0 HD21 LEU A 190 0.609 1.481 -0.584 1.00 0.00 H new ATOM 0 HD22 LEU A 190 0.860 3.171 -0.087 1.00 0.00 H new ATOM 0 HD23 LEU A 190 1.640 1.853 0.818 1.00 0.00 H new ATOM 712 N VAL A 191 1.456 1.261 4.392 1.00 0.00 N ATOM 713 CA VAL A 191 2.330 0.136 4.676 1.00 0.00 C ATOM 714 C VAL A 191 1.823 -0.598 5.919 1.00 0.00 C ATOM 715 O VAL A 191 1.730 -1.824 5.924 1.00 0.00 O ATOM 716 CB VAL A 191 3.776 0.620 4.817 1.00 0.00 C ATOM 717 CG1 VAL A 191 4.700 -0.528 5.231 1.00 0.00 C ATOM 718 CG2 VAL A 191 4.262 1.277 3.524 1.00 0.00 C ATOM 0 H VAL A 191 1.892 2.177 4.498 1.00 0.00 H new ATOM 0 HA VAL A 191 2.317 -0.575 3.850 1.00 0.00 H new ATOM 0 HB VAL A 191 3.803 1.372 5.605 1.00 0.00 H new ATOM 0 HG11 VAL A 191 5.721 -0.158 5.324 1.00 0.00 H new ATOM 0 HG12 VAL A 191 4.372 -0.932 6.189 1.00 0.00 H new ATOM 0 HG13 VAL A 191 4.666 -1.313 4.475 1.00 0.00 H new ATOM 0 HG21 VAL A 191 5.292 1.612 3.651 1.00 0.00 H new ATOM 0 HG22 VAL A 191 4.213 0.555 2.708 1.00 0.00 H new ATOM 0 HG23 VAL A 191 3.628 2.133 3.290 1.00 0.00 H new ATOM 728 N GLN A 192 1.506 0.183 6.942 1.00 0.00 N ATOM 729 CA GLN A 192 1.010 -0.379 8.186 1.00 0.00 C ATOM 730 C GLN A 192 -0.345 -1.052 7.961 1.00 0.00 C ATOM 731 O GLN A 192 -0.630 -2.093 8.551 1.00 0.00 O ATOM 732 CB GLN A 192 0.915 0.695 9.273 1.00 0.00 C ATOM 733 CG GLN A 192 2.269 0.908 9.954 1.00 0.00 C ATOM 734 CD GLN A 192 2.132 1.822 11.173 1.00 0.00 C ATOM 735 OE1 GLN A 192 1.069 2.339 11.477 1.00 0.00 O ATOM 736 NE2 GLN A 192 3.263 1.992 11.850 1.00 0.00 N ATOM 0 H GLN A 192 1.583 1.200 6.934 1.00 0.00 H new ATOM 0 HA GLN A 192 1.717 -1.135 8.528 1.00 0.00 H new ATOM 0 HB2 GLN A 192 0.573 1.632 8.834 1.00 0.00 H new ATOM 0 HB3 GLN A 192 0.173 0.401 10.015 1.00 0.00 H new ATOM 0 HG2 GLN A 192 2.681 -0.053 10.260 1.00 0.00 H new ATOM 0 HG3 GLN A 192 2.972 1.345 9.245 1.00 0.00 H new ATOM 0 HE21 GLN A 192 4.117 1.529 11.540 1.00 0.00 H new ATOM 0 HE22 GLN A 192 3.277 2.585 12.680 1.00 0.00 H new ATOM 745 N ASN A 193 -1.145 -0.430 7.107 1.00 0.00 N ATOM 746 CA ASN A 193 -2.463 -0.957 6.797 1.00 0.00 C ATOM 747 C ASN A 193 -2.352 -1.946 5.635 1.00 0.00 C ATOM 748 O ASN A 193 -3.364 -2.428 5.126 1.00 0.00 O ATOM 749 CB ASN A 193 -3.420 0.162 6.377 1.00 0.00 C ATOM 750 CG ASN A 193 -4.872 -0.222 6.663 1.00 0.00 C ATOM 751 OD1 ASN A 193 -5.201 -1.370 6.910 1.00 0.00 O ATOM 752 ND2 ASN A 193 -5.720 0.802 6.619 1.00 0.00 N ATOM 0 H ASN A 193 -0.906 0.434 6.620 1.00 0.00 H new ATOM 0 HA ASN A 193 -2.850 -1.445 7.692 1.00 0.00 H new ATOM 0 HB2 ASN A 193 -3.170 1.078 6.912 1.00 0.00 H new ATOM 0 HB3 ASN A 193 -3.298 0.370 5.314 1.00 0.00 H new ATOM 0 HD21 ASN A 193 -6.713 0.650 6.798 1.00 0.00 H new ATOM 0 HD22 ASN A 193 -5.378 1.739 6.406 1.00 0.00 H new ATOM 759 N ALA A 194 -1.115 -2.218 5.247 1.00 0.00 N ATOM 760 CA ALA A 194 -0.859 -3.140 4.153 1.00 0.00 C ATOM 761 C ALA A 194 -0.532 -4.522 4.724 1.00 0.00 C ATOM 762 O ALA A 194 -0.121 -4.639 5.878 1.00 0.00 O ATOM 763 CB ALA A 194 0.265 -2.590 3.274 1.00 0.00 C ATOM 0 H ALA A 194 -0.279 -1.816 5.671 1.00 0.00 H new ATOM 0 HA ALA A 194 -1.742 -3.244 3.523 1.00 0.00 H new ATOM 0 HB1 ALA A 194 0.457 -3.282 2.454 1.00 0.00 H new ATOM 0 HB2 ALA A 194 -0.030 -1.621 2.871 1.00 0.00 H new ATOM 0 HB3 ALA A 194 1.170 -2.475 3.870 1.00 0.00 H new ATOM 769 N ASN A 195 -0.725 -5.533 3.889 1.00 0.00 N ATOM 770 CA ASN A 195 -0.454 -6.900 4.296 1.00 0.00 C ATOM 771 C ASN A 195 0.916 -6.966 4.973 1.00 0.00 C ATOM 772 O ASN A 195 1.646 -5.976 5.004 1.00 0.00 O ATOM 773 CB ASN A 195 -0.430 -7.839 3.089 1.00 0.00 C ATOM 774 CG ASN A 195 -1.548 -8.880 3.179 1.00 0.00 C ATOM 775 OD1 ASN A 195 -2.452 -8.788 3.994 1.00 0.00 O ATOM 776 ND2 ASN A 195 -1.438 -9.871 2.300 1.00 0.00 N ATOM 0 H ASN A 195 -1.066 -5.432 2.933 1.00 0.00 H new ATOM 0 HA ASN A 195 -1.244 -7.210 4.980 1.00 0.00 H new ATOM 0 HB2 ASN A 195 -0.541 -7.260 2.172 1.00 0.00 H new ATOM 0 HB3 ASN A 195 0.536 -8.342 3.034 1.00 0.00 H new ATOM 0 HD21 ASN A 195 -2.136 -10.615 2.280 1.00 0.00 H new ATOM 0 HD22 ASN A 195 -0.656 -9.887 1.645 1.00 0.00 H new ATOM 783 N PRO A 196 1.232 -8.172 5.514 1.00 0.00 N ATOM 784 CA PRO A 196 2.502 -8.380 6.189 1.00 0.00 C ATOM 785 C PRO A 196 3.648 -8.493 5.181 1.00 0.00 C ATOM 786 O PRO A 196 4.652 -7.792 5.297 1.00 0.00 O ATOM 787 CB PRO A 196 2.308 -9.644 7.012 1.00 0.00 C ATOM 788 CG PRO A 196 1.106 -10.351 6.411 1.00 0.00 C ATOM 789 CD PRO A 196 0.393 -9.367 5.498 1.00 0.00 C ATOM 0 HA PRO A 196 2.780 -7.542 6.829 1.00 0.00 H new ATOM 0 HB2 PRO A 196 3.194 -10.277 6.971 1.00 0.00 H new ATOM 0 HB3 PRO A 196 2.136 -9.404 8.061 1.00 0.00 H new ATOM 0 HG2 PRO A 196 1.422 -11.231 5.851 1.00 0.00 H new ATOM 0 HG3 PRO A 196 0.435 -10.697 7.197 1.00 0.00 H new ATOM 0 HD2 PRO A 196 0.291 -9.766 4.489 1.00 0.00 H new ATOM 0 HD3 PRO A 196 -0.613 -9.150 5.858 1.00 0.00 H new ATOM 797 N ASP A 197 3.458 -9.380 4.216 1.00 0.00 N ATOM 798 CA ASP A 197 4.462 -9.593 3.187 1.00 0.00 C ATOM 799 C ASP A 197 4.856 -8.245 2.577 1.00 0.00 C ATOM 800 O ASP A 197 6.033 -7.895 2.549 1.00 0.00 O ATOM 801 CB ASP A 197 3.921 -10.481 2.065 1.00 0.00 C ATOM 802 CG ASP A 197 4.817 -11.662 1.685 1.00 0.00 C ATOM 803 OD1 ASP A 197 5.679 -11.552 0.801 1.00 0.00 O ATOM 804 OD2 ASP A 197 4.600 -12.746 2.350 1.00 0.00 O ATOM 0 H ASP A 197 2.624 -9.960 4.125 1.00 0.00 H new ATOM 0 HA ASP A 197 5.321 -10.080 3.649 1.00 0.00 H new ATOM 0 HB2 ASP A 197 2.946 -10.866 2.365 1.00 0.00 H new ATOM 0 HB3 ASP A 197 3.762 -9.865 1.180 1.00 0.00 H new ATOM 810 N CYS A 198 3.846 -7.530 2.104 1.00 0.00 N ATOM 811 CA CYS A 198 4.073 -6.230 1.496 1.00 0.00 C ATOM 812 C CYS A 198 4.848 -5.363 2.490 1.00 0.00 C ATOM 813 O CYS A 198 5.723 -4.592 2.096 1.00 0.00 O ATOM 814 CB CYS A 198 2.760 -5.570 1.067 1.00 0.00 C ATOM 815 SG CYS A 198 3.106 -4.104 0.030 1.00 0.00 S ATOM 0 H CYS A 198 2.870 -7.826 2.129 1.00 0.00 H new ATOM 0 HA CYS A 198 4.660 -6.349 0.585 1.00 0.00 H new ATOM 0 HB2 CYS A 198 2.150 -6.282 0.512 1.00 0.00 H new ATOM 0 HB3 CYS A 198 2.187 -5.276 1.946 1.00 0.00 H new ATOM 0 HG CYS A 198 2.478 -4.216 -1.103 1.00 0.00 H new ATOM 821 N LYS A 199 4.500 -5.518 3.760 1.00 0.00 N ATOM 822 CA LYS A 199 5.153 -4.759 4.812 1.00 0.00 C ATOM 823 C LYS A 199 6.654 -5.050 4.789 1.00 0.00 C ATOM 824 O LYS A 199 7.471 -4.136 4.896 1.00 0.00 O ATOM 825 CB LYS A 199 4.493 -5.041 6.163 1.00 0.00 C ATOM 826 CG LYS A 199 4.831 -3.947 7.178 1.00 0.00 C ATOM 827 CD LYS A 199 4.644 -4.449 8.611 1.00 0.00 C ATOM 828 CE LYS A 199 5.346 -3.530 9.611 1.00 0.00 C ATOM 829 NZ LYS A 199 5.349 -4.139 10.960 1.00 0.00 N ATOM 0 H LYS A 199 3.774 -6.158 4.083 1.00 0.00 H new ATOM 0 HA LYS A 199 5.033 -3.689 4.641 1.00 0.00 H new ATOM 0 HB2 LYS A 199 3.412 -5.104 6.037 1.00 0.00 H new ATOM 0 HB3 LYS A 199 4.827 -6.008 6.540 1.00 0.00 H new ATOM 0 HG2 LYS A 199 5.861 -3.620 7.035 1.00 0.00 H new ATOM 0 HG3 LYS A 199 4.194 -3.079 7.007 1.00 0.00 H new ATOM 0 HD2 LYS A 199 3.581 -4.502 8.845 1.00 0.00 H new ATOM 0 HD3 LYS A 199 5.041 -5.460 8.700 1.00 0.00 H new ATOM 0 HE2 LYS A 199 6.370 -3.345 9.287 1.00 0.00 H new ATOM 0 HE3 LYS A 199 4.842 -2.564 9.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 199 5.829 -3.502 11.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 199 4.369 -4.294 11.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 199 5.850 -5.050 10.929 1.00 0.00 H new ATOM 843 N THR A 200 6.976 -6.329 4.647 1.00 0.00 N ATOM 844 CA THR A 200 8.364 -6.751 4.608 1.00 0.00 C ATOM 845 C THR A 200 9.060 -6.185 3.368 1.00 0.00 C ATOM 846 O THR A 200 10.202 -5.737 3.442 1.00 0.00 O ATOM 847 CB THR A 200 8.396 -8.279 4.679 1.00 0.00 C ATOM 848 OG1 THR A 200 7.825 -8.580 5.949 1.00 0.00 O ATOM 849 CG2 THR A 200 9.819 -8.832 4.769 1.00 0.00 C ATOM 0 H THR A 200 6.298 -7.086 4.558 1.00 0.00 H new ATOM 0 HA THR A 200 8.920 -6.360 5.460 1.00 0.00 H new ATOM 0 HB THR A 200 7.901 -8.693 3.800 1.00 0.00 H new ATOM 0 HG1 THR A 200 7.805 -9.551 6.077 1.00 0.00 H new ATOM 0 HG21 THR A 200 9.784 -9.920 4.817 1.00 0.00 H new ATOM 0 HG22 THR A 200 10.385 -8.526 3.889 1.00 0.00 H new ATOM 0 HG23 THR A 200 10.304 -8.445 5.665 1.00 0.00 H new ATOM 857 N ILE A 201 8.340 -6.226 2.255 1.00 0.00 N ATOM 858 CA ILE A 201 8.873 -5.724 1.001 1.00 0.00 C ATOM 859 C ILE A 201 9.123 -4.219 1.123 1.00 0.00 C ATOM 860 O ILE A 201 10.117 -3.708 0.611 1.00 0.00 O ATOM 861 CB ILE A 201 7.953 -6.102 -0.162 1.00 0.00 C ATOM 862 CG1 ILE A 201 7.349 -7.492 0.047 1.00 0.00 C ATOM 863 CG2 ILE A 201 8.687 -5.991 -1.499 1.00 0.00 C ATOM 864 CD1 ILE A 201 7.293 -8.269 -1.269 1.00 0.00 C ATOM 0 H ILE A 201 7.393 -6.599 2.197 1.00 0.00 H new ATOM 0 HA ILE A 201 9.834 -6.190 0.782 1.00 0.00 H new ATOM 0 HB ILE A 201 7.126 -5.392 -0.189 1.00 0.00 H new ATOM 0 HG12 ILE A 201 7.943 -8.045 0.775 1.00 0.00 H new ATOM 0 HG13 ILE A 201 6.345 -7.398 0.461 1.00 0.00 H new ATOM 0 HG21 ILE A 201 8.011 -6.265 -2.309 1.00 0.00 H new ATOM 0 HG22 ILE A 201 9.029 -4.966 -1.643 1.00 0.00 H new ATOM 0 HG23 ILE A 201 9.545 -6.663 -1.500 1.00 0.00 H new ATOM 0 HD11 ILE A 201 6.860 -9.253 -1.092 1.00 0.00 H new ATOM 0 HD12 ILE A 201 6.678 -7.725 -1.987 1.00 0.00 H new ATOM 0 HD13 ILE A 201 8.301 -8.383 -1.668 1.00 0.00 H new ATOM 876 N LEU A 202 8.203 -3.553 1.806 1.00 0.00 N ATOM 877 CA LEU A 202 8.310 -2.117 2.003 1.00 0.00 C ATOM 878 C LEU A 202 9.435 -1.827 2.999 1.00 0.00 C ATOM 879 O LEU A 202 10.112 -0.806 2.894 1.00 0.00 O ATOM 880 CB LEU A 202 6.958 -1.531 2.414 1.00 0.00 C ATOM 881 CG LEU A 202 5.851 -1.596 1.360 1.00 0.00 C ATOM 882 CD1 LEU A 202 4.486 -1.822 2.011 1.00 0.00 C ATOM 883 CD2 LEU A 202 5.863 -0.348 0.474 1.00 0.00 C ATOM 0 H LEU A 202 7.380 -3.981 2.230 1.00 0.00 H new ATOM 0 HA LEU A 202 8.575 -1.622 1.069 1.00 0.00 H new ATOM 0 HB2 LEU A 202 6.614 -2.054 3.306 1.00 0.00 H new ATOM 0 HB3 LEU A 202 7.106 -0.488 2.693 1.00 0.00 H new ATOM 0 HG LEU A 202 6.045 -2.452 0.714 1.00 0.00 H new ATOM 0 HD11 LEU A 202 3.717 -1.864 1.239 1.00 0.00 H new ATOM 0 HD12 LEU A 202 4.497 -2.762 2.563 1.00 0.00 H new ATOM 0 HD13 LEU A 202 4.269 -1.002 2.695 1.00 0.00 H new ATOM 0 HD21 LEU A 202 5.066 -0.420 -0.266 1.00 0.00 H new ATOM 0 HD22 LEU A 202 5.707 0.537 1.090 1.00 0.00 H new ATOM 0 HD23 LEU A 202 6.824 -0.271 -0.034 1.00 0.00 H new ATOM 895 N LYS A 203 9.598 -2.741 3.944 1.00 0.00 N ATOM 896 CA LYS A 203 10.629 -2.596 4.957 1.00 0.00 C ATOM 897 C LYS A 203 12.005 -2.709 4.299 1.00 0.00 C ATOM 898 O LYS A 203 12.949 -2.031 4.703 1.00 0.00 O ATOM 899 CB LYS A 203 10.407 -3.595 6.094 1.00 0.00 C ATOM 900 CG LYS A 203 9.575 -2.972 7.216 1.00 0.00 C ATOM 901 CD LYS A 203 9.000 -4.051 8.137 1.00 0.00 C ATOM 902 CE LYS A 203 8.879 -3.539 9.574 1.00 0.00 C ATOM 903 NZ LYS A 203 10.190 -3.605 10.259 1.00 0.00 N ATOM 0 H LYS A 203 9.033 -3.586 4.029 1.00 0.00 H new ATOM 0 HA LYS A 203 10.575 -1.609 5.416 1.00 0.00 H new ATOM 0 HB2 LYS A 203 9.901 -4.481 5.711 1.00 0.00 H new ATOM 0 HB3 LYS A 203 11.369 -3.922 6.488 1.00 0.00 H new ATOM 0 HG2 LYS A 203 10.194 -2.287 7.795 1.00 0.00 H new ATOM 0 HG3 LYS A 203 8.763 -2.384 6.788 1.00 0.00 H new ATOM 0 HD2 LYS A 203 8.020 -4.360 7.774 1.00 0.00 H new ATOM 0 HD3 LYS A 203 9.641 -4.933 8.114 1.00 0.00 H new ATOM 0 HE2 LYS A 203 8.515 -2.512 9.571 1.00 0.00 H new ATOM 0 HE3 LYS A 203 8.147 -4.135 10.119 1.00 0.00 H new ATOM 0 HZ1 LYS A 203 10.091 -3.254 11.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 203 10.522 -4.590 10.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 203 10.879 -3.017 9.748 1.00 0.00 H new ATOM 917 N ALA A 204 12.077 -3.571 3.295 1.00 0.00 N ATOM 918 CA ALA A 204 13.322 -3.782 2.577 1.00 0.00 C ATOM 919 C ALA A 204 13.539 -2.631 1.593 1.00 0.00 C ATOM 920 O ALA A 204 14.676 -2.240 1.331 1.00 0.00 O ATOM 921 CB ALA A 204 13.287 -5.144 1.882 1.00 0.00 C ATOM 0 H ALA A 204 11.293 -4.132 2.962 1.00 0.00 H new ATOM 0 HA ALA A 204 14.166 -3.790 3.267 1.00 0.00 H new ATOM 0 HB1 ALA A 204 14.221 -5.302 1.343 1.00 0.00 H new ATOM 0 HB2 ALA A 204 13.161 -5.930 2.627 1.00 0.00 H new ATOM 0 HB3 ALA A 204 12.454 -5.173 1.180 1.00 0.00 H new ATOM 927 N LEU A 205 12.432 -2.119 1.076 1.00 0.00 N ATOM 928 CA LEU A 205 12.487 -1.020 0.127 1.00 0.00 C ATOM 929 C LEU A 205 13.296 0.129 0.731 1.00 0.00 C ATOM 930 O LEU A 205 14.500 0.235 0.500 1.00 0.00 O ATOM 931 CB LEU A 205 11.077 -0.617 -0.308 1.00 0.00 C ATOM 932 CG LEU A 205 10.738 -0.850 -1.781 1.00 0.00 C ATOM 933 CD1 LEU A 205 10.151 -2.246 -1.995 1.00 0.00 C ATOM 934 CD2 LEU A 205 9.812 0.247 -2.311 1.00 0.00 C ATOM 0 H LEU A 205 11.491 -2.445 1.296 1.00 0.00 H new ATOM 0 HA LEU A 205 13.001 -1.328 -0.784 1.00 0.00 H new ATOM 0 HB2 LEU A 205 10.359 -1.167 0.301 1.00 0.00 H new ATOM 0 HB3 LEU A 205 10.938 0.441 -0.087 1.00 0.00 H new ATOM 0 HG LEU A 205 11.663 -0.798 -2.356 1.00 0.00 H new ATOM 0 HD11 LEU A 205 9.919 -2.385 -3.051 1.00 0.00 H new ATOM 0 HD12 LEU A 205 10.875 -2.997 -1.681 1.00 0.00 H new ATOM 0 HD13 LEU A 205 9.240 -2.352 -1.406 1.00 0.00 H new ATOM 0 HD21 LEU A 205 9.587 0.057 -3.360 1.00 0.00 H new ATOM 0 HD22 LEU A 205 8.886 0.251 -1.736 1.00 0.00 H new ATOM 0 HD23 LEU A 205 10.303 1.215 -2.215 1.00 0.00 H new ATOM 946 N GLY A 206 12.604 0.963 1.494 1.00 0.00 N ATOM 947 CA GLY A 206 13.242 2.101 2.132 1.00 0.00 C ATOM 948 C GLY A 206 12.212 2.983 2.838 1.00 0.00 C ATOM 949 O GLY A 206 11.021 2.918 2.535 1.00 0.00 O ATOM 0 H GLY A 206 11.606 0.872 1.685 1.00 0.00 H new ATOM 0 HA2 GLY A 206 13.981 1.751 2.853 1.00 0.00 H new ATOM 0 HA3 GLY A 206 13.778 2.688 1.386 1.00 0.00 H new ATOM 953 N PRO A 207 12.719 3.810 3.792 1.00 0.00 N ATOM 954 CA PRO A 207 11.855 4.705 4.544 1.00 0.00 C ATOM 955 C PRO A 207 11.426 5.899 3.688 1.00 0.00 C ATOM 956 O PRO A 207 11.650 7.048 4.063 1.00 0.00 O ATOM 957 CB PRO A 207 12.671 5.109 5.760 1.00 0.00 C ATOM 958 CG PRO A 207 14.119 4.801 5.413 1.00 0.00 C ATOM 959 CD PRO A 207 14.122 3.914 4.178 1.00 0.00 C ATOM 0 HA PRO A 207 10.921 4.233 4.847 1.00 0.00 H new ATOM 0 HB2 PRO A 207 12.540 6.168 5.984 1.00 0.00 H new ATOM 0 HB3 PRO A 207 12.355 4.555 6.644 1.00 0.00 H new ATOM 0 HG2 PRO A 207 14.671 5.722 5.223 1.00 0.00 H new ATOM 0 HG3 PRO A 207 14.613 4.299 6.245 1.00 0.00 H new ATOM 0 HD2 PRO A 207 14.721 4.350 3.379 1.00 0.00 H new ATOM 0 HD3 PRO A 207 14.546 2.934 4.396 1.00 0.00 H new ATOM 967 N GLY A 208 10.814 5.585 2.555 1.00 0.00 N ATOM 968 CA GLY A 208 10.351 6.616 1.644 1.00 0.00 C ATOM 969 C GLY A 208 10.521 6.179 0.187 1.00 0.00 C ATOM 970 O GLY A 208 11.146 6.881 -0.607 1.00 0.00 O ATOM 0 H GLY A 208 10.628 4.630 2.248 1.00 0.00 H new ATOM 0 HA2 GLY A 208 9.302 6.836 1.841 1.00 0.00 H new ATOM 0 HA3 GLY A 208 10.908 7.537 1.818 1.00 0.00 H new ATOM 974 N ALA A 209 9.952 5.022 -0.119 1.00 0.00 N ATOM 975 CA ALA A 209 10.034 4.483 -1.466 1.00 0.00 C ATOM 976 C ALA A 209 9.004 5.184 -2.353 1.00 0.00 C ATOM 977 O ALA A 209 8.045 5.771 -1.854 1.00 0.00 O ATOM 978 CB ALA A 209 9.830 2.967 -1.421 1.00 0.00 C ATOM 0 H ALA A 209 9.433 4.444 0.542 1.00 0.00 H new ATOM 0 HA ALA A 209 11.019 4.667 -1.895 1.00 0.00 H new ATOM 0 HB1 ALA A 209 9.891 2.561 -2.431 1.00 0.00 H new ATOM 0 HB2 ALA A 209 10.603 2.514 -0.801 1.00 0.00 H new ATOM 0 HB3 ALA A 209 8.850 2.744 -0.999 1.00 0.00 H new ATOM 984 N THR A 210 9.236 5.098 -3.656 1.00 0.00 N ATOM 985 CA THR A 210 8.340 5.718 -4.618 1.00 0.00 C ATOM 986 C THR A 210 7.107 4.839 -4.840 1.00 0.00 C ATOM 987 O THR A 210 7.159 3.627 -4.637 1.00 0.00 O ATOM 988 CB THR A 210 9.134 5.986 -5.899 1.00 0.00 C ATOM 989 OG1 THR A 210 9.400 7.384 -5.854 1.00 0.00 O ATOM 990 CG2 THR A 210 8.288 5.806 -7.160 1.00 0.00 C ATOM 0 H THR A 210 10.031 4.609 -4.067 1.00 0.00 H new ATOM 0 HA THR A 210 7.960 6.671 -4.249 1.00 0.00 H new ATOM 0 HB THR A 210 9.993 5.317 -5.942 1.00 0.00 H new ATOM 0 HG1 THR A 210 9.913 7.645 -6.647 1.00 0.00 H new ATOM 0 HG21 THR A 210 8.899 6.008 -8.040 1.00 0.00 H new ATOM 0 HG22 THR A 210 7.914 4.783 -7.205 1.00 0.00 H new ATOM 0 HG23 THR A 210 7.447 6.499 -7.136 1.00 0.00 H new ATOM 998 N LEU A 211 6.027 5.485 -5.254 1.00 0.00 N ATOM 999 CA LEU A 211 4.783 4.777 -5.506 1.00 0.00 C ATOM 1000 C LEU A 211 5.053 3.596 -6.439 1.00 0.00 C ATOM 1001 O LEU A 211 4.560 2.493 -6.210 1.00 0.00 O ATOM 1002 CB LEU A 211 3.716 5.742 -6.027 1.00 0.00 C ATOM 1003 CG LEU A 211 2.470 5.900 -5.152 1.00 0.00 C ATOM 1004 CD1 LEU A 211 2.358 7.326 -4.611 1.00 0.00 C ATOM 1005 CD2 LEU A 211 1.210 5.472 -5.907 1.00 0.00 C ATOM 0 H LEU A 211 5.987 6.490 -5.421 1.00 0.00 H new ATOM 0 HA LEU A 211 4.383 4.365 -4.579 1.00 0.00 H new ATOM 0 HB2 LEU A 211 4.173 6.723 -6.155 1.00 0.00 H new ATOM 0 HB3 LEU A 211 3.402 5.406 -7.015 1.00 0.00 H new ATOM 0 HG LEU A 211 2.570 5.236 -4.293 1.00 0.00 H new ATOM 0 HD11 LEU A 211 1.464 7.411 -3.993 1.00 0.00 H new ATOM 0 HD12 LEU A 211 3.238 7.558 -4.011 1.00 0.00 H new ATOM 0 HD13 LEU A 211 2.292 8.027 -5.443 1.00 0.00 H new ATOM 0 HD21 LEU A 211 0.340 5.595 -5.262 1.00 0.00 H new ATOM 0 HD22 LEU A 211 1.092 6.090 -6.797 1.00 0.00 H new ATOM 0 HD23 LEU A 211 1.299 4.426 -6.201 1.00 0.00 H new ATOM 1017 N GLU A 212 5.836 3.867 -7.475 1.00 0.00 N ATOM 1018 CA GLU A 212 6.177 2.840 -8.444 1.00 0.00 C ATOM 1019 C GLU A 212 6.939 1.702 -7.764 1.00 0.00 C ATOM 1020 O GLU A 212 6.781 0.538 -8.133 1.00 0.00 O ATOM 1021 CB GLU A 212 6.986 3.428 -9.603 1.00 0.00 C ATOM 1022 CG GLU A 212 6.073 4.138 -10.604 1.00 0.00 C ATOM 1023 CD GLU A 212 6.754 4.268 -11.969 1.00 0.00 C ATOM 1024 OE1 GLU A 212 7.326 5.323 -12.278 1.00 0.00 O ATOM 1025 OE2 GLU A 212 6.675 3.222 -12.719 1.00 0.00 O ATOM 0 H GLU A 212 6.243 4.783 -7.663 1.00 0.00 H new ATOM 0 HA GLU A 212 5.253 2.435 -8.858 1.00 0.00 H new ATOM 0 HB2 GLU A 212 7.724 4.131 -9.216 1.00 0.00 H new ATOM 0 HB3 GLU A 212 7.536 2.633 -10.107 1.00 0.00 H new ATOM 0 HG2 GLU A 212 5.141 3.582 -10.710 1.00 0.00 H new ATOM 0 HG3 GLU A 212 5.813 5.127 -10.227 1.00 0.00 H new ATOM 1033 N GLU A 213 7.749 2.076 -6.786 1.00 0.00 N ATOM 1034 CA GLU A 213 8.535 1.099 -6.050 1.00 0.00 C ATOM 1035 C GLU A 213 7.640 0.301 -5.101 1.00 0.00 C ATOM 1036 O GLU A 213 7.829 -0.902 -4.927 1.00 0.00 O ATOM 1037 CB GLU A 213 9.677 1.776 -5.289 1.00 0.00 C ATOM 1038 CG GLU A 213 10.842 0.809 -5.073 1.00 0.00 C ATOM 1039 CD GLU A 213 11.520 0.462 -6.399 1.00 0.00 C ATOM 1040 OE1 GLU A 213 11.331 -0.648 -6.921 1.00 0.00 O ATOM 1041 OE2 GLU A 213 12.264 1.392 -6.892 1.00 0.00 O ATOM 0 H GLU A 213 7.879 3.042 -6.485 1.00 0.00 H new ATOM 0 HA GLU A 213 8.979 0.406 -6.765 1.00 0.00 H new ATOM 0 HB2 GLU A 213 10.022 2.648 -5.845 1.00 0.00 H new ATOM 0 HB3 GLU A 213 9.314 2.135 -4.326 1.00 0.00 H new ATOM 0 HG2 GLU A 213 11.569 1.256 -4.395 1.00 0.00 H new ATOM 0 HG3 GLU A 213 10.480 -0.102 -4.597 1.00 0.00 H new ATOM 1049 N MET A 214 6.685 1.003 -4.511 1.00 0.00 N ATOM 1050 CA MET A 214 5.759 0.375 -3.584 1.00 0.00 C ATOM 1051 C MET A 214 4.877 -0.650 -4.299 1.00 0.00 C ATOM 1052 O MET A 214 4.723 -1.777 -3.831 1.00 0.00 O ATOM 1053 CB MET A 214 4.876 1.446 -2.939 1.00 0.00 C ATOM 1054 CG MET A 214 5.631 2.186 -1.833 1.00 0.00 C ATOM 1055 SD MET A 214 4.503 3.208 -0.902 1.00 0.00 S ATOM 1056 CE MET A 214 4.283 4.556 -2.050 1.00 0.00 C ATOM 0 H MET A 214 6.532 2.001 -4.657 1.00 0.00 H new ATOM 0 HA MET A 214 6.337 -0.142 -2.818 1.00 0.00 H new ATOM 0 HB2 MET A 214 4.547 2.156 -3.698 1.00 0.00 H new ATOM 0 HB3 MET A 214 3.980 0.983 -2.526 1.00 0.00 H new ATOM 0 HG2 MET A 214 6.116 1.469 -1.171 1.00 0.00 H new ATOM 0 HG3 MET A 214 6.418 2.802 -2.268 1.00 0.00 H new ATOM 0 HE1 MET A 214 4.208 5.494 -1.500 1.00 0.00 H new ATOM 0 HE2 MET A 214 5.136 4.600 -2.728 1.00 0.00 H new ATOM 0 HE3 MET A 214 3.370 4.399 -2.625 1.00 0.00 H new ATOM 1066 N MET A 215 4.320 -0.222 -5.423 1.00 0.00 N ATOM 1067 CA MET A 215 3.457 -1.089 -6.207 1.00 0.00 C ATOM 1068 C MET A 215 4.263 -2.200 -6.882 1.00 0.00 C ATOM 1069 O MET A 215 3.757 -3.302 -7.090 1.00 0.00 O ATOM 1070 CB MET A 215 2.735 -0.262 -7.273 1.00 0.00 C ATOM 1071 CG MET A 215 3.632 -0.034 -8.491 1.00 0.00 C ATOM 1072 SD MET A 215 3.438 -1.376 -9.653 1.00 0.00 S ATOM 1073 CE MET A 215 4.388 -0.739 -11.024 1.00 0.00 C ATOM 0 H MET A 215 4.450 0.713 -5.809 1.00 0.00 H new ATOM 0 HA MET A 215 2.730 -1.549 -5.537 1.00 0.00 H new ATOM 0 HB2 MET A 215 1.823 -0.774 -7.579 1.00 0.00 H new ATOM 0 HB3 MET A 215 2.436 0.698 -6.853 1.00 0.00 H new ATOM 0 HG2 MET A 215 3.376 0.912 -8.969 1.00 0.00 H new ATOM 0 HG3 MET A 215 4.673 0.039 -8.177 1.00 0.00 H new ATOM 0 HE1 MET A 215 3.750 -0.662 -11.904 1.00 0.00 H new ATOM 0 HE2 MET A 215 4.777 0.247 -10.770 1.00 0.00 H new ATOM 0 HE3 MET A 215 5.218 -1.413 -11.236 1.00 0.00 H new ATOM 1083 N THR A 216 5.506 -1.873 -7.205 1.00 0.00 N ATOM 1084 CA THR A 216 6.388 -2.829 -7.854 1.00 0.00 C ATOM 1085 C THR A 216 6.727 -3.974 -6.897 1.00 0.00 C ATOM 1086 O THR A 216 6.798 -5.132 -7.308 1.00 0.00 O ATOM 1087 CB THR A 216 7.619 -2.073 -8.356 1.00 0.00 C ATOM 1088 OG1 THR A 216 7.234 -1.599 -9.643 1.00 0.00 O ATOM 1089 CG2 THR A 216 8.803 -2.999 -8.637 1.00 0.00 C ATOM 0 H THR A 216 5.923 -0.959 -7.029 1.00 0.00 H new ATOM 0 HA THR A 216 5.904 -3.295 -8.712 1.00 0.00 H new ATOM 0 HB THR A 216 7.912 -1.327 -7.618 1.00 0.00 H new ATOM 0 HG1 THR A 216 6.932 -0.669 -9.572 1.00 0.00 H new ATOM 0 HG21 THR A 216 9.649 -2.410 -8.991 1.00 0.00 H new ATOM 0 HG22 THR A 216 9.081 -3.522 -7.722 1.00 0.00 H new ATOM 0 HG23 THR A 216 8.523 -3.726 -9.399 1.00 0.00 H new ATOM 1097 N ALA A 217 6.927 -3.611 -5.638 1.00 0.00 N ATOM 1098 CA ALA A 217 7.257 -4.593 -4.620 1.00 0.00 C ATOM 1099 C ALA A 217 6.017 -5.431 -4.305 1.00 0.00 C ATOM 1100 O ALA A 217 6.110 -6.647 -4.137 1.00 0.00 O ATOM 1101 CB ALA A 217 7.810 -3.882 -3.383 1.00 0.00 C ATOM 0 H ALA A 217 6.867 -2.650 -5.300 1.00 0.00 H new ATOM 0 HA ALA A 217 8.031 -5.271 -4.979 1.00 0.00 H new ATOM 0 HB1 ALA A 217 8.057 -4.620 -2.620 1.00 0.00 H new ATOM 0 HB2 ALA A 217 8.707 -3.325 -3.654 1.00 0.00 H new ATOM 0 HB3 ALA A 217 7.060 -3.194 -2.993 1.00 0.00 H new ATOM 1107 N CYS A 218 4.883 -4.749 -4.234 1.00 0.00 N ATOM 1108 CA CYS A 218 3.626 -5.415 -3.943 1.00 0.00 C ATOM 1109 C CYS A 218 3.348 -6.426 -5.058 1.00 0.00 C ATOM 1110 O CYS A 218 2.971 -7.565 -4.787 1.00 0.00 O ATOM 1111 CB CYS A 218 2.480 -4.415 -3.780 1.00 0.00 C ATOM 1112 SG CYS A 218 1.085 -5.199 -2.892 1.00 0.00 S ATOM 0 H CYS A 218 4.809 -3.741 -4.373 1.00 0.00 H new ATOM 0 HA CYS A 218 3.701 -5.939 -2.990 1.00 0.00 H new ATOM 0 HB2 CYS A 218 2.826 -3.540 -3.230 1.00 0.00 H new ATOM 0 HB3 CYS A 218 2.149 -4.066 -4.758 1.00 0.00 H new ATOM 0 HG CYS A 218 0.197 -4.297 -2.595 1.00 0.00 H new ATOM 1118 N GLN A 219 3.545 -5.973 -6.286 1.00 0.00 N ATOM 1119 CA GLN A 219 3.320 -6.823 -7.442 1.00 0.00 C ATOM 1120 C GLN A 219 4.260 -8.030 -7.405 1.00 0.00 C ATOM 1121 O GLN A 219 3.944 -9.085 -7.951 1.00 0.00 O ATOM 1122 CB GLN A 219 3.490 -6.035 -8.743 1.00 0.00 C ATOM 1123 CG GLN A 219 2.254 -6.177 -9.634 1.00 0.00 C ATOM 1124 CD GLN A 219 2.216 -7.551 -10.307 1.00 0.00 C ATOM 1125 OE1 GLN A 219 1.463 -8.433 -9.930 1.00 0.00 O ATOM 1126 NE2 GLN A 219 3.068 -7.680 -11.320 1.00 0.00 N ATOM 0 H GLN A 219 3.858 -5.028 -6.506 1.00 0.00 H new ATOM 0 HA GLN A 219 2.293 -7.186 -7.407 1.00 0.00 H new ATOM 0 HB2 GLN A 219 3.660 -4.983 -8.516 1.00 0.00 H new ATOM 0 HB3 GLN A 219 4.371 -6.392 -9.277 1.00 0.00 H new ATOM 0 HG2 GLN A 219 1.353 -6.036 -9.037 1.00 0.00 H new ATOM 0 HG3 GLN A 219 2.258 -5.396 -10.394 1.00 0.00 H new ATOM 0 HE21 GLN A 219 3.670 -6.900 -11.582 1.00 0.00 H new ATOM 0 HE22 GLN A 219 3.119 -8.559 -11.834 1.00 0.00 H new ATOM 1135 N GLY A 220 5.398 -7.833 -6.756 1.00 0.00 N ATOM 1136 CA GLY A 220 6.386 -8.891 -6.639 1.00 0.00 C ATOM 1137 C GLY A 220 5.949 -9.940 -5.614 1.00 0.00 C ATOM 1138 O GLY A 220 6.364 -11.096 -5.688 1.00 0.00 O ATOM 0 H GLY A 220 5.658 -6.956 -6.305 1.00 0.00 H new ATOM 0 HA2 GLY A 220 6.533 -9.365 -7.609 1.00 0.00 H new ATOM 0 HA3 GLY A 220 7.345 -8.466 -6.343 1.00 0.00 H new ATOM 1142 N VAL A 221 5.118 -9.498 -4.681 1.00 0.00 N ATOM 1143 CA VAL A 221 4.620 -10.384 -3.643 1.00 0.00 C ATOM 1144 C VAL A 221 4.129 -11.686 -4.280 1.00 0.00 C ATOM 1145 O VAL A 221 3.521 -11.666 -5.349 1.00 0.00 O ATOM 1146 CB VAL A 221 3.541 -9.676 -2.823 1.00 0.00 C ATOM 1147 CG1 VAL A 221 2.155 -9.894 -3.436 1.00 0.00 C ATOM 1148 CG2 VAL A 221 3.572 -10.129 -1.363 1.00 0.00 C ATOM 0 H VAL A 221 4.777 -8.538 -4.623 1.00 0.00 H new ATOM 0 HA VAL A 221 5.419 -10.644 -2.948 1.00 0.00 H new ATOM 0 HB VAL A 221 3.754 -8.607 -2.845 1.00 0.00 H new ATOM 0 HG11 VAL A 221 1.406 -9.380 -2.834 1.00 0.00 H new ATOM 0 HG12 VAL A 221 2.139 -9.497 -4.451 1.00 0.00 H new ATOM 0 HG13 VAL A 221 1.932 -10.961 -3.460 1.00 0.00 H new ATOM 0 HG21 VAL A 221 2.794 -9.609 -0.804 1.00 0.00 H new ATOM 0 HG22 VAL A 221 3.399 -11.204 -1.312 1.00 0.00 H new ATOM 0 HG23 VAL A 221 4.545 -9.897 -0.931 1.00 0.00 H new