USER MOD reduce.3.24.130724 H: found=0, std=0, add=383, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 376 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 327 CYS SG : rot 167:sc= 0.821 USER MOD Set 1.2: A 330 CYS SG : rot -40:sc= 0.801 USER MOD Set 1.3: A 353 CYS SG : rot -128:sc= -6.46! USER MOD Set 1.4: A 355 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.5: A 356 CYS SG : rot 95:sc= 0.0594 USER MOD Set 2.1: A 317 SER OG : rot -108:sc= 0.973 USER MOD Set 2.2: A 319 ASN : amide:sc= 0.79 K(o=1.8,f=-1.2) USER MOD Set 3.1: A 312 CYS SG : rot -134:sc= -1.25 USER MOD Set 3.2: A 315 CYS SG : rot 180:sc= 0.239 USER MOD Set 3.3: A 335 HIS : no HE2:sc= -10.5! C(o=-14!,f=-19!) USER MOD Set 3.4: A 338 CYS SG : rot -139:sc= -2.61! USER MOD Single : A 310 TYR OH : rot 180:sc= 0 USER MOD Single : A 333 SER OG : rot 180:sc= 0 USER MOD Single : A 334 TYR OH : rot 77:sc= 0.769 USER MOD Single : A 336 THR OG1 : rot 63:sc= 0.55 USER MOD Single : A 344 HIS : no HD1:sc=-0.00574 X(o=-0.0057,f=-0.26) USER MOD Single : A 348 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 359 GLN : amide:sc=-0.00372 K(o=-0.0037,f=-1.4!) USER MOD ----------------------------------------------------------------- ATOM 41 N LEU A 309 1.995 13.584 4.598 1.00 0.00 N ATOM 42 CA LEU A 309 3.360 13.275 4.087 1.00 0.00 C ATOM 43 C LEU A 309 3.278 12.139 3.064 1.00 0.00 C ATOM 44 O LEU A 309 3.972 12.141 2.068 1.00 0.00 O ATOM 45 CB LEU A 309 4.256 12.850 5.253 1.00 0.00 C ATOM 46 CG LEU A 309 5.688 12.637 4.752 1.00 0.00 C ATOM 47 CD1 LEU A 309 6.300 13.979 4.346 1.00 0.00 C ATOM 48 CD2 LEU A 309 6.528 12.014 5.869 1.00 0.00 C ATOM 0 HA LEU A 309 3.779 14.161 3.611 1.00 0.00 H new ATOM 0 HB2 LEU A 309 4.242 13.613 6.032 1.00 0.00 H new ATOM 0 HB3 LEU A 309 3.876 11.931 5.700 1.00 0.00 H new ATOM 0 HG LEU A 309 5.672 11.972 3.888 1.00 0.00 H new ATOM 0 HD11 LEU A 309 7.318 13.822 3.991 1.00 0.00 H new ATOM 0 HD12 LEU A 309 5.703 14.425 3.551 1.00 0.00 H new ATOM 0 HD13 LEU A 309 6.315 14.647 5.207 1.00 0.00 H new ATOM 0 HD21 LEU A 309 7.548 11.861 5.515 1.00 0.00 H new ATOM 0 HD22 LEU A 309 6.539 12.681 6.731 1.00 0.00 H new ATOM 0 HD23 LEU A 309 6.097 11.055 6.157 1.00 0.00 H new ATOM 60 N TYR A 310 2.433 11.171 3.306 1.00 0.00 N ATOM 61 CA TYR A 310 2.299 10.034 2.352 1.00 0.00 C ATOM 62 C TYR A 310 0.890 10.011 1.761 1.00 0.00 C ATOM 63 O TYR A 310 -0.095 10.109 2.467 1.00 0.00 O ATOM 64 CB TYR A 310 2.567 8.716 3.081 1.00 0.00 C ATOM 65 CG TYR A 310 4.025 8.351 2.940 1.00 0.00 C ATOM 66 CD1 TYR A 310 4.469 7.704 1.781 1.00 0.00 C ATOM 67 CD2 TYR A 310 4.930 8.660 3.961 1.00 0.00 C ATOM 68 CE1 TYR A 310 5.820 7.365 1.643 1.00 0.00 C ATOM 69 CE2 TYR A 310 6.282 8.321 3.824 1.00 0.00 C ATOM 70 CZ TYR A 310 6.727 7.673 2.665 1.00 0.00 C ATOM 71 OH TYR A 310 8.059 7.338 2.529 1.00 0.00 O ATOM 0 H TYR A 310 1.829 11.120 4.126 1.00 0.00 H new ATOM 0 HA TYR A 310 3.023 10.159 1.547 1.00 0.00 H new ATOM 0 HB2 TYR A 310 2.305 8.811 4.135 1.00 0.00 H new ATOM 0 HB3 TYR A 310 1.941 7.925 2.667 1.00 0.00 H new ATOM 0 HD1 TYR A 310 3.769 7.466 0.993 1.00 0.00 H new ATOM 0 HD2 TYR A 310 4.586 9.160 4.855 1.00 0.00 H new ATOM 0 HE1 TYR A 310 6.163 6.866 0.749 1.00 0.00 H new ATOM 0 HE2 TYR A 310 6.981 8.559 4.612 1.00 0.00 H new ATOM 0 HH TYR A 310 8.551 7.623 3.327 1.00 0.00 H new ATOM 81 N VAL A 311 0.791 9.876 0.467 1.00 0.00 N ATOM 82 CA VAL A 311 -0.546 9.838 -0.188 1.00 0.00 C ATOM 83 C VAL A 311 -0.604 8.634 -1.131 1.00 0.00 C ATOM 84 O VAL A 311 0.413 8.123 -1.557 1.00 0.00 O ATOM 85 CB VAL A 311 -0.754 11.127 -0.986 1.00 0.00 C ATOM 86 CG1 VAL A 311 -0.582 12.333 -0.061 1.00 0.00 C ATOM 87 CG2 VAL A 311 0.278 11.199 -2.114 1.00 0.00 C ATOM 0 H VAL A 311 1.584 9.790 -0.168 1.00 0.00 H new ATOM 0 HA VAL A 311 -1.328 9.750 0.566 1.00 0.00 H new ATOM 0 HB VAL A 311 -1.758 11.134 -1.410 1.00 0.00 H new ATOM 0 HG11 VAL A 311 -0.730 13.251 -0.629 1.00 0.00 H new ATOM 0 HG12 VAL A 311 -1.315 12.282 0.744 1.00 0.00 H new ATOM 0 HG13 VAL A 311 0.422 12.326 0.363 1.00 0.00 H new ATOM 0 HG21 VAL A 311 0.131 12.117 -2.683 1.00 0.00 H new ATOM 0 HG22 VAL A 311 1.282 11.192 -1.690 1.00 0.00 H new ATOM 0 HG23 VAL A 311 0.157 10.340 -2.773 1.00 0.00 H new ATOM 97 N CYS A 312 -1.779 8.172 -1.463 1.00 0.00 N ATOM 98 CA CYS A 312 -1.879 7.001 -2.379 1.00 0.00 C ATOM 99 C CYS A 312 -1.860 7.495 -3.825 1.00 0.00 C ATOM 100 O CYS A 312 -2.680 8.297 -4.228 1.00 0.00 O ATOM 101 CB CYS A 312 -3.180 6.250 -2.099 1.00 0.00 C ATOM 102 SG CYS A 312 -3.471 5.015 -3.390 1.00 0.00 S ATOM 0 H CYS A 312 -2.669 8.552 -1.142 1.00 0.00 H new ATOM 0 HA CYS A 312 -1.037 6.327 -2.217 1.00 0.00 H new ATOM 0 HB2 CYS A 312 -3.127 5.764 -1.125 1.00 0.00 H new ATOM 0 HB3 CYS A 312 -4.014 6.951 -2.060 1.00 0.00 H new ATOM 0 HG CYS A 312 -4.711 5.074 -3.776 1.00 0.00 H new ATOM 107 N LEU A 313 -0.924 7.032 -4.607 1.00 0.00 N ATOM 108 CA LEU A 313 -0.847 7.488 -6.021 1.00 0.00 C ATOM 109 C LEU A 313 -2.132 7.106 -6.757 1.00 0.00 C ATOM 110 O LEU A 313 -2.627 7.843 -7.585 1.00 0.00 O ATOM 111 CB LEU A 313 0.349 6.817 -6.698 1.00 0.00 C ATOM 112 CG LEU A 313 1.623 7.117 -5.905 1.00 0.00 C ATOM 113 CD1 LEU A 313 2.832 6.547 -6.648 1.00 0.00 C ATOM 114 CD2 LEU A 313 1.788 8.631 -5.752 1.00 0.00 C ATOM 0 H LEU A 313 -0.211 6.359 -4.327 1.00 0.00 H new ATOM 0 HA LEU A 313 -0.727 8.571 -6.050 1.00 0.00 H new ATOM 0 HB2 LEU A 313 0.190 5.740 -6.756 1.00 0.00 H new ATOM 0 HB3 LEU A 313 0.451 7.180 -7.721 1.00 0.00 H new ATOM 0 HG LEU A 313 1.551 6.658 -4.919 1.00 0.00 H new ATOM 0 HD11 LEU A 313 3.740 6.760 -6.084 1.00 0.00 H new ATOM 0 HD12 LEU A 313 2.717 5.468 -6.756 1.00 0.00 H new ATOM 0 HD13 LEU A 313 2.902 7.005 -7.635 1.00 0.00 H new ATOM 0 HD21 LEU A 313 2.696 8.843 -5.187 1.00 0.00 H new ATOM 0 HD22 LEU A 313 1.859 9.091 -6.738 1.00 0.00 H new ATOM 0 HD23 LEU A 313 0.927 9.039 -5.222 1.00 0.00 H new ATOM 126 N LEU A 314 -2.671 5.958 -6.462 1.00 0.00 N ATOM 127 CA LEU A 314 -3.919 5.524 -7.143 1.00 0.00 C ATOM 128 C LEU A 314 -5.067 6.468 -6.780 1.00 0.00 C ATOM 129 O LEU A 314 -5.929 6.748 -7.590 1.00 0.00 O ATOM 130 CB LEU A 314 -4.257 4.104 -6.693 1.00 0.00 C ATOM 131 CG LEU A 314 -3.070 3.182 -6.982 1.00 0.00 C ATOM 132 CD1 LEU A 314 -3.439 1.748 -6.610 1.00 0.00 C ATOM 133 CD2 LEU A 314 -2.720 3.245 -8.470 1.00 0.00 C ATOM 0 H LEU A 314 -2.300 5.300 -5.777 1.00 0.00 H new ATOM 0 HA LEU A 314 -3.775 5.547 -8.223 1.00 0.00 H new ATOM 0 HB2 LEU A 314 -4.488 4.094 -5.628 1.00 0.00 H new ATOM 0 HB3 LEU A 314 -5.144 3.747 -7.215 1.00 0.00 H new ATOM 0 HG LEU A 314 -2.211 3.504 -6.394 1.00 0.00 H new ATOM 0 HD11 LEU A 314 -2.595 1.090 -6.815 1.00 0.00 H new ATOM 0 HD12 LEU A 314 -3.687 1.700 -5.550 1.00 0.00 H new ATOM 0 HD13 LEU A 314 -4.299 1.429 -7.199 1.00 0.00 H new ATOM 0 HD21 LEU A 314 -1.875 2.588 -8.673 1.00 0.00 H new ATOM 0 HD22 LEU A 314 -3.579 2.924 -9.060 1.00 0.00 H new ATOM 0 HD23 LEU A 314 -2.457 4.268 -8.739 1.00 0.00 H new ATOM 145 N CYS A 315 -5.086 6.956 -5.569 1.00 0.00 N ATOM 146 CA CYS A 315 -6.182 7.880 -5.150 1.00 0.00 C ATOM 147 C CYS A 315 -5.583 9.153 -4.546 1.00 0.00 C ATOM 148 O CYS A 315 -5.719 10.233 -5.085 1.00 0.00 O ATOM 149 CB CYS A 315 -7.054 7.189 -4.101 1.00 0.00 C ATOM 150 SG CYS A 315 -7.079 5.402 -4.403 1.00 0.00 S ATOM 0 H CYS A 315 -4.390 6.755 -4.851 1.00 0.00 H new ATOM 0 HA CYS A 315 -6.785 8.140 -6.020 1.00 0.00 H new ATOM 0 HB2 CYS A 315 -6.668 7.393 -3.102 1.00 0.00 H new ATOM 0 HB3 CYS A 315 -8.068 7.587 -4.138 1.00 0.00 H new ATOM 0 HG CYS A 315 -7.820 4.821 -3.507 1.00 0.00 H new ATOM 155 N GLY A 316 -4.929 9.029 -3.426 1.00 0.00 N ATOM 156 CA GLY A 316 -4.325 10.223 -2.770 1.00 0.00 C ATOM 157 C GLY A 316 -5.390 10.940 -1.939 1.00 0.00 C ATOM 158 O GLY A 316 -5.461 12.153 -1.912 1.00 0.00 O ATOM 0 H GLY A 316 -4.786 8.147 -2.933 1.00 0.00 H new ATOM 0 HA2 GLY A 316 -3.494 9.920 -2.133 1.00 0.00 H new ATOM 0 HA3 GLY A 316 -3.920 10.899 -3.523 1.00 0.00 H new ATOM 162 N SER A 317 -6.223 10.196 -1.267 1.00 0.00 N ATOM 163 CA SER A 317 -7.296 10.827 -0.440 1.00 0.00 C ATOM 164 C SER A 317 -6.672 11.703 0.651 1.00 0.00 C ATOM 165 O SER A 317 -7.139 12.790 0.930 1.00 0.00 O ATOM 166 CB SER A 317 -8.144 9.735 0.210 1.00 0.00 C ATOM 167 OG SER A 317 -9.281 10.328 0.826 1.00 0.00 O ATOM 0 H SER A 317 -6.209 9.176 -1.253 1.00 0.00 H new ATOM 0 HA SER A 317 -7.922 11.447 -1.081 1.00 0.00 H new ATOM 0 HB2 SER A 317 -8.459 9.009 -0.539 1.00 0.00 H new ATOM 0 HB3 SER A 317 -7.555 9.194 0.951 1.00 0.00 H new ATOM 0 HG SER A 317 -9.176 10.302 1.800 1.00 0.00 H new ATOM 173 N GLY A 318 -5.626 11.236 1.273 1.00 0.00 N ATOM 174 CA GLY A 318 -4.970 12.034 2.349 1.00 0.00 C ATOM 175 C GLY A 318 -5.292 11.415 3.711 1.00 0.00 C ATOM 176 O GLY A 318 -4.433 11.274 4.558 1.00 0.00 O ATOM 0 H GLY A 318 -5.194 10.332 1.082 1.00 0.00 H new ATOM 0 HA2 GLY A 318 -3.891 12.057 2.194 1.00 0.00 H new ATOM 0 HA3 GLY A 318 -5.319 13.066 2.315 1.00 0.00 H new ATOM 180 N ASN A 319 -6.521 11.031 3.922 1.00 0.00 N ATOM 181 CA ASN A 319 -6.895 10.405 5.224 1.00 0.00 C ATOM 182 C ASN A 319 -6.851 8.888 5.066 1.00 0.00 C ATOM 183 O ASN A 319 -7.110 8.140 5.989 1.00 0.00 O ATOM 184 CB ASN A 319 -8.309 10.836 5.616 1.00 0.00 C ATOM 185 CG ASN A 319 -9.323 10.110 4.731 1.00 0.00 C ATOM 186 OD1 ASN A 319 -9.554 10.500 3.604 1.00 0.00 O ATOM 187 ND2 ASN A 319 -9.938 9.056 5.195 1.00 0.00 N ATOM 0 H ASN A 319 -7.283 11.123 3.250 1.00 0.00 H new ATOM 0 HA ASN A 319 -6.199 10.721 6.001 1.00 0.00 H new ATOM 0 HB2 ASN A 319 -8.494 10.605 6.665 1.00 0.00 H new ATOM 0 HB3 ASN A 319 -8.417 11.915 5.503 1.00 0.00 H new ATOM 0 HD21 ASN A 319 -10.612 8.561 4.611 1.00 0.00 H new ATOM 0 HD22 ASN A 319 -9.745 8.728 6.141 1.00 0.00 H new ATOM 194 N ASP A 320 -6.518 8.439 3.893 1.00 0.00 N ATOM 195 CA ASP A 320 -6.437 6.983 3.623 1.00 0.00 C ATOM 196 C ASP A 320 -5.066 6.465 4.059 1.00 0.00 C ATOM 197 O ASP A 320 -4.782 5.284 4.003 1.00 0.00 O ATOM 198 CB ASP A 320 -6.627 6.766 2.125 1.00 0.00 C ATOM 199 CG ASP A 320 -5.564 7.567 1.370 1.00 0.00 C ATOM 200 OD1 ASP A 320 -4.531 7.843 1.958 1.00 0.00 O ATOM 201 OD2 ASP A 320 -5.807 7.905 0.225 1.00 0.00 O ATOM 0 H ASP A 320 -6.294 9.033 3.094 1.00 0.00 H new ATOM 0 HA ASP A 320 -7.207 6.445 4.176 1.00 0.00 H new ATOM 0 HB2 ASP A 320 -6.543 5.706 1.884 1.00 0.00 H new ATOM 0 HB3 ASP A 320 -7.625 7.084 1.822 1.00 0.00 H new ATOM 206 N GLU A 321 -4.212 7.352 4.483 1.00 0.00 N ATOM 207 CA GLU A 321 -2.845 6.951 4.919 1.00 0.00 C ATOM 208 C GLU A 321 -2.923 5.833 5.964 1.00 0.00 C ATOM 209 O GLU A 321 -1.990 5.075 6.140 1.00 0.00 O ATOM 210 CB GLU A 321 -2.137 8.162 5.528 1.00 0.00 C ATOM 211 CG GLU A 321 -0.691 7.795 5.861 1.00 0.00 C ATOM 212 CD GLU A 321 -0.015 8.969 6.570 1.00 0.00 C ATOM 213 OE1 GLU A 321 -0.686 9.960 6.804 1.00 0.00 O ATOM 214 OE2 GLU A 321 1.163 8.858 6.868 1.00 0.00 O ATOM 0 H GLU A 321 -4.405 8.352 4.547 1.00 0.00 H new ATOM 0 HA GLU A 321 -2.290 6.587 4.054 1.00 0.00 H new ATOM 0 HB2 GLU A 321 -2.159 8.998 4.829 1.00 0.00 H new ATOM 0 HB3 GLU A 321 -2.658 8.485 6.429 1.00 0.00 H new ATOM 0 HG2 GLU A 321 -0.667 6.910 6.497 1.00 0.00 H new ATOM 0 HG3 GLU A 321 -0.149 7.547 4.949 1.00 0.00 H new ATOM 221 N ASP A 322 -4.013 5.734 6.673 1.00 0.00 N ATOM 222 CA ASP A 322 -4.126 4.679 7.718 1.00 0.00 C ATOM 223 C ASP A 322 -3.902 3.292 7.104 1.00 0.00 C ATOM 224 O ASP A 322 -3.274 2.442 7.703 1.00 0.00 O ATOM 225 CB ASP A 322 -5.520 4.742 8.340 1.00 0.00 C ATOM 226 CG ASP A 322 -5.668 6.041 9.133 1.00 0.00 C ATOM 227 OD1 ASP A 322 -4.662 6.698 9.351 1.00 0.00 O ATOM 228 OD2 ASP A 322 -6.784 6.359 9.510 1.00 0.00 O ATOM 0 H ASP A 322 -4.829 6.337 6.574 1.00 0.00 H new ATOM 0 HA ASP A 322 -3.367 4.849 8.482 1.00 0.00 H new ATOM 0 HB2 ASP A 322 -6.280 4.691 7.560 1.00 0.00 H new ATOM 0 HB3 ASP A 322 -5.677 3.884 8.994 1.00 0.00 H new ATOM 233 N ARG A 323 -4.405 3.054 5.921 1.00 0.00 N ATOM 234 CA ARG A 323 -4.211 1.718 5.280 1.00 0.00 C ATOM 235 C ARG A 323 -3.269 1.828 4.082 1.00 0.00 C ATOM 236 O ARG A 323 -3.119 0.895 3.319 1.00 0.00 O ATOM 237 CB ARG A 323 -5.555 1.152 4.823 1.00 0.00 C ATOM 238 CG ARG A 323 -6.375 0.746 6.047 1.00 0.00 C ATOM 239 CD ARG A 323 -7.623 -0.010 5.598 1.00 0.00 C ATOM 240 NE ARG A 323 -8.516 -0.238 6.769 1.00 0.00 N ATOM 241 CZ ARG A 323 -8.207 -1.142 7.658 1.00 0.00 C ATOM 242 NH1 ARG A 323 -7.116 -1.845 7.523 1.00 0.00 N ATOM 243 NH2 ARG A 323 -8.989 -1.343 8.683 1.00 0.00 N ATOM 0 H ARG A 323 -4.941 3.725 5.371 1.00 0.00 H new ATOM 0 HA ARG A 323 -3.769 1.047 6.017 1.00 0.00 H new ATOM 0 HB2 ARG A 323 -6.096 1.896 4.239 1.00 0.00 H new ATOM 0 HB3 ARG A 323 -5.398 0.290 4.174 1.00 0.00 H new ATOM 0 HG2 ARG A 323 -5.776 0.119 6.708 1.00 0.00 H new ATOM 0 HG3 ARG A 323 -6.659 1.631 6.617 1.00 0.00 H new ATOM 0 HD2 ARG A 323 -8.149 0.559 4.832 1.00 0.00 H new ATOM 0 HD3 ARG A 323 -7.342 -0.963 5.151 1.00 0.00 H new ATOM 0 HE ARG A 323 -9.368 0.312 6.876 1.00 0.00 H new ATOM 0 HH11 ARG A 323 -6.504 -1.688 6.722 1.00 0.00 H new ATOM 0 HH12 ARG A 323 -6.875 -2.551 8.218 1.00 0.00 H new ATOM 0 HH21 ARG A 323 -9.842 -0.794 8.789 1.00 0.00 H new ATOM 0 HH22 ARG A 323 -8.748 -2.050 9.378 1.00 0.00 H new ATOM 257 N LEU A 324 -2.628 2.948 3.906 1.00 0.00 N ATOM 258 CA LEU A 324 -1.699 3.080 2.753 1.00 0.00 C ATOM 259 C LEU A 324 -0.426 2.293 3.048 1.00 0.00 C ATOM 260 O LEU A 324 0.236 2.510 4.045 1.00 0.00 O ATOM 261 CB LEU A 324 -1.351 4.554 2.535 1.00 0.00 C ATOM 262 CG LEU A 324 -0.394 4.683 1.349 1.00 0.00 C ATOM 263 CD1 LEU A 324 -1.051 4.097 0.101 1.00 0.00 C ATOM 264 CD2 LEU A 324 -0.074 6.160 1.111 1.00 0.00 C ATOM 0 H LEU A 324 -2.706 3.770 4.505 1.00 0.00 H new ATOM 0 HA LEU A 324 -2.175 2.690 1.853 1.00 0.00 H new ATOM 0 HB2 LEU A 324 -2.258 5.129 2.348 1.00 0.00 H new ATOM 0 HB3 LEU A 324 -0.891 4.967 3.433 1.00 0.00 H new ATOM 0 HG LEU A 324 0.527 4.142 1.564 1.00 0.00 H new ATOM 0 HD11 LEU A 324 -0.370 4.188 -0.745 1.00 0.00 H new ATOM 0 HD12 LEU A 324 -1.280 3.045 0.271 1.00 0.00 H new ATOM 0 HD13 LEU A 324 -1.972 4.639 -0.114 1.00 0.00 H new ATOM 0 HD21 LEU A 324 0.608 6.253 0.266 1.00 0.00 H new ATOM 0 HD22 LEU A 324 -0.995 6.702 0.895 1.00 0.00 H new ATOM 0 HD23 LEU A 324 0.393 6.579 2.002 1.00 0.00 H new ATOM 276 N LEU A 325 -0.085 1.371 2.192 1.00 0.00 N ATOM 277 CA LEU A 325 1.134 0.555 2.420 1.00 0.00 C ATOM 278 C LEU A 325 2.236 0.992 1.454 1.00 0.00 C ATOM 279 O LEU A 325 2.005 1.172 0.275 1.00 0.00 O ATOM 280 CB LEU A 325 0.803 -0.918 2.175 1.00 0.00 C ATOM 281 CG LEU A 325 -0.447 -1.297 2.971 1.00 0.00 C ATOM 282 CD1 LEU A 325 -0.734 -2.789 2.793 1.00 0.00 C ATOM 283 CD2 LEU A 325 -0.216 -0.995 4.452 1.00 0.00 C ATOM 0 H LEU A 325 -0.602 1.148 1.341 1.00 0.00 H new ATOM 0 HA LEU A 325 1.478 0.693 3.445 1.00 0.00 H new ATOM 0 HB2 LEU A 325 0.638 -1.093 1.112 1.00 0.00 H new ATOM 0 HB3 LEU A 325 1.642 -1.545 2.474 1.00 0.00 H new ATOM 0 HG LEU A 325 -1.298 -0.719 2.609 1.00 0.00 H new ATOM 0 HD11 LEU A 325 -1.625 -3.058 3.360 1.00 0.00 H new ATOM 0 HD12 LEU A 325 -0.897 -3.005 1.737 1.00 0.00 H new ATOM 0 HD13 LEU A 325 0.115 -3.369 3.154 1.00 0.00 H new ATOM 0 HD21 LEU A 325 -1.106 -1.264 5.021 1.00 0.00 H new ATOM 0 HD22 LEU A 325 0.635 -1.573 4.813 1.00 0.00 H new ATOM 0 HD23 LEU A 325 -0.012 0.068 4.579 1.00 0.00 H new ATOM 295 N LEU A 326 3.436 1.144 1.939 1.00 0.00 N ATOM 296 CA LEU A 326 4.554 1.548 1.045 1.00 0.00 C ATOM 297 C LEU A 326 5.299 0.286 0.612 1.00 0.00 C ATOM 298 O LEU A 326 5.624 -0.558 1.423 1.00 0.00 O ATOM 299 CB LEU A 326 5.504 2.482 1.799 1.00 0.00 C ATOM 300 CG LEU A 326 6.523 3.085 0.823 1.00 0.00 C ATOM 301 CD1 LEU A 326 7.214 4.281 1.481 1.00 0.00 C ATOM 302 CD2 LEU A 326 7.581 2.041 0.438 1.00 0.00 C ATOM 0 H LEU A 326 3.690 1.006 2.917 1.00 0.00 H new ATOM 0 HA LEU A 326 4.169 2.074 0.171 1.00 0.00 H new ATOM 0 HB2 LEU A 326 4.938 3.277 2.285 1.00 0.00 H new ATOM 0 HB3 LEU A 326 6.021 1.932 2.585 1.00 0.00 H new ATOM 0 HG LEU A 326 5.997 3.406 -0.076 1.00 0.00 H new ATOM 0 HD11 LEU A 326 7.938 4.710 0.788 1.00 0.00 H new ATOM 0 HD12 LEU A 326 6.470 5.034 1.740 1.00 0.00 H new ATOM 0 HD13 LEU A 326 7.727 3.953 2.385 1.00 0.00 H new ATOM 0 HD21 LEU A 326 8.296 2.486 -0.255 1.00 0.00 H new ATOM 0 HD22 LEU A 326 8.104 1.706 1.334 1.00 0.00 H new ATOM 0 HD23 LEU A 326 7.095 1.189 -0.039 1.00 0.00 H new ATOM 314 N CYS A 327 5.556 0.136 -0.656 1.00 0.00 N ATOM 315 CA CYS A 327 6.259 -1.090 -1.118 1.00 0.00 C ATOM 316 C CYS A 327 7.764 -0.955 -0.896 1.00 0.00 C ATOM 317 O CYS A 327 8.422 -0.141 -1.512 1.00 0.00 O ATOM 318 CB CYS A 327 5.999 -1.308 -2.607 1.00 0.00 C ATOM 319 SG CYS A 327 6.958 -2.737 -3.159 1.00 0.00 S ATOM 0 H CYS A 327 5.312 0.804 -1.387 1.00 0.00 H new ATOM 0 HA CYS A 327 5.882 -1.938 -0.547 1.00 0.00 H new ATOM 0 HB2 CYS A 327 4.937 -1.474 -2.785 1.00 0.00 H new ATOM 0 HB3 CYS A 327 6.282 -0.421 -3.174 1.00 0.00 H new ATOM 0 HG CYS A 327 6.547 -3.107 -4.335 1.00 0.00 H new ATOM 324 N ASP A 328 8.318 -1.761 -0.034 1.00 0.00 N ATOM 325 CA ASP A 328 9.784 -1.695 0.208 1.00 0.00 C ATOM 326 C ASP A 328 10.511 -2.092 -1.077 1.00 0.00 C ATOM 327 O ASP A 328 11.554 -1.562 -1.406 1.00 0.00 O ATOM 328 CB ASP A 328 10.164 -2.660 1.333 1.00 0.00 C ATOM 329 CG ASP A 328 9.541 -2.185 2.647 1.00 0.00 C ATOM 330 OD1 ASP A 328 9.082 -1.055 2.687 1.00 0.00 O ATOM 331 OD2 ASP A 328 9.534 -2.958 3.590 1.00 0.00 O ATOM 0 H ASP A 328 7.818 -2.462 0.513 1.00 0.00 H new ATOM 0 HA ASP A 328 10.067 -0.683 0.498 1.00 0.00 H new ATOM 0 HB2 ASP A 328 9.816 -3.666 1.096 1.00 0.00 H new ATOM 0 HB3 ASP A 328 11.248 -2.712 1.431 1.00 0.00 H new ATOM 336 N GLY A 329 9.963 -3.028 -1.806 1.00 0.00 N ATOM 337 CA GLY A 329 10.611 -3.474 -3.072 1.00 0.00 C ATOM 338 C GLY A 329 10.793 -2.278 -4.008 1.00 0.00 C ATOM 339 O GLY A 329 11.813 -2.127 -4.650 1.00 0.00 O ATOM 0 H GLY A 329 9.091 -3.504 -1.577 1.00 0.00 H new ATOM 0 HA2 GLY A 329 11.578 -3.929 -2.856 1.00 0.00 H new ATOM 0 HA3 GLY A 329 10.000 -4.237 -3.555 1.00 0.00 H new ATOM 343 N CYS A 330 9.813 -1.421 -4.082 1.00 0.00 N ATOM 344 CA CYS A 330 9.927 -0.227 -4.968 1.00 0.00 C ATOM 345 C CYS A 330 9.145 0.933 -4.347 1.00 0.00 C ATOM 346 O CYS A 330 8.213 0.731 -3.599 1.00 0.00 O ATOM 347 CB CYS A 330 9.371 -0.555 -6.357 1.00 0.00 C ATOM 348 SG CYS A 330 7.578 -0.787 -6.264 1.00 0.00 S ATOM 0 H CYS A 330 8.936 -1.495 -3.566 1.00 0.00 H new ATOM 0 HA CYS A 330 10.975 0.056 -5.071 1.00 0.00 H new ATOM 0 HB2 CYS A 330 9.607 0.251 -7.052 1.00 0.00 H new ATOM 0 HB3 CYS A 330 9.844 -1.458 -6.744 1.00 0.00 H new ATOM 0 HG CYS A 330 7.281 -1.449 -5.185 1.00 0.00 H new ATOM 353 N ASP A 331 9.522 2.144 -4.638 1.00 0.00 N ATOM 354 CA ASP A 331 8.805 3.309 -4.044 1.00 0.00 C ATOM 355 C ASP A 331 7.388 3.397 -4.611 1.00 0.00 C ATOM 356 O ASP A 331 7.145 4.057 -5.602 1.00 0.00 O ATOM 357 CB ASP A 331 9.565 4.595 -4.374 1.00 0.00 C ATOM 358 CG ASP A 331 10.919 4.586 -3.664 1.00 0.00 C ATOM 359 OD1 ASP A 331 11.102 3.753 -2.790 1.00 0.00 O ATOM 360 OD2 ASP A 331 11.750 5.411 -4.004 1.00 0.00 O ATOM 0 H ASP A 331 10.295 2.380 -5.261 1.00 0.00 H new ATOM 0 HA ASP A 331 8.749 3.181 -2.963 1.00 0.00 H new ATOM 0 HB2 ASP A 331 9.708 4.679 -5.451 1.00 0.00 H new ATOM 0 HB3 ASP A 331 8.985 5.463 -4.061 1.00 0.00 H new ATOM 365 N ASP A 332 6.447 2.743 -3.984 1.00 0.00 N ATOM 366 CA ASP A 332 5.043 2.799 -4.483 1.00 0.00 C ATOM 367 C ASP A 332 4.075 2.670 -3.304 1.00 0.00 C ATOM 368 O ASP A 332 4.170 1.750 -2.516 1.00 0.00 O ATOM 369 CB ASP A 332 4.806 1.652 -5.467 1.00 0.00 C ATOM 370 CG ASP A 332 3.426 1.808 -6.110 1.00 0.00 C ATOM 371 OD1 ASP A 332 2.789 2.817 -5.859 1.00 0.00 O ATOM 372 OD2 ASP A 332 3.032 0.916 -6.843 1.00 0.00 O ATOM 0 H ASP A 332 6.590 2.174 -3.150 1.00 0.00 H new ATOM 0 HA ASP A 332 4.874 3.751 -4.987 1.00 0.00 H new ATOM 0 HB2 ASP A 332 5.579 1.652 -6.235 1.00 0.00 H new ATOM 0 HB3 ASP A 332 4.872 0.695 -4.949 1.00 0.00 H new ATOM 377 N SER A 333 3.140 3.578 -3.181 1.00 0.00 N ATOM 378 CA SER A 333 2.164 3.499 -2.054 1.00 0.00 C ATOM 379 C SER A 333 0.754 3.275 -2.614 1.00 0.00 C ATOM 380 O SER A 333 0.330 3.932 -3.548 1.00 0.00 O ATOM 381 CB SER A 333 2.197 4.808 -1.266 1.00 0.00 C ATOM 382 OG SER A 333 3.530 5.067 -0.842 1.00 0.00 O ATOM 0 H SER A 333 3.011 4.369 -3.812 1.00 0.00 H new ATOM 0 HA SER A 333 2.429 2.670 -1.398 1.00 0.00 H new ATOM 0 HB2 SER A 333 1.834 5.628 -1.885 1.00 0.00 H new ATOM 0 HB3 SER A 333 1.535 4.743 -0.403 1.00 0.00 H new ATOM 0 HG SER A 333 3.555 5.907 -0.338 1.00 0.00 H new ATOM 388 N TYR A 334 0.028 2.348 -2.043 1.00 0.00 N ATOM 389 CA TYR A 334 -1.355 2.058 -2.525 1.00 0.00 C ATOM 390 C TYR A 334 -2.196 1.470 -1.384 1.00 0.00 C ATOM 391 O TYR A 334 -1.671 0.965 -0.412 1.00 0.00 O ATOM 392 CB TYR A 334 -1.287 1.069 -3.685 1.00 0.00 C ATOM 393 CG TYR A 334 -0.593 -0.185 -3.225 1.00 0.00 C ATOM 394 CD1 TYR A 334 0.802 -0.248 -3.244 1.00 0.00 C ATOM 395 CD2 TYR A 334 -1.340 -1.279 -2.784 1.00 0.00 C ATOM 396 CE1 TYR A 334 1.456 -1.410 -2.821 1.00 0.00 C ATOM 397 CE2 TYR A 334 -0.688 -2.443 -2.360 1.00 0.00 C ATOM 398 CZ TYR A 334 0.711 -2.509 -2.379 1.00 0.00 C ATOM 399 OH TYR A 334 1.353 -3.656 -1.961 1.00 0.00 O ATOM 0 H TYR A 334 0.337 1.776 -1.257 1.00 0.00 H new ATOM 0 HA TYR A 334 -1.822 2.983 -2.863 1.00 0.00 H new ATOM 0 HB2 TYR A 334 -2.291 0.835 -4.038 1.00 0.00 H new ATOM 0 HB3 TYR A 334 -0.749 1.510 -4.524 1.00 0.00 H new ATOM 0 HD1 TYR A 334 1.376 0.601 -3.585 1.00 0.00 H new ATOM 0 HD2 TYR A 334 -2.419 -1.227 -2.770 1.00 0.00 H new ATOM 0 HE1 TYR A 334 2.535 -1.459 -2.836 1.00 0.00 H new ATOM 0 HE2 TYR A 334 -1.264 -3.290 -2.018 1.00 0.00 H new ATOM 0 HH TYR A 334 1.714 -3.519 -1.060 1.00 0.00 H new ATOM 409 N HIS A 335 -3.497 1.548 -1.490 1.00 0.00 N ATOM 410 CA HIS A 335 -4.374 1.013 -0.407 1.00 0.00 C ATOM 411 C HIS A 335 -4.603 -0.491 -0.586 1.00 0.00 C ATOM 412 O HIS A 335 -4.423 -1.041 -1.654 1.00 0.00 O ATOM 413 CB HIS A 335 -5.727 1.722 -0.450 1.00 0.00 C ATOM 414 CG HIS A 335 -5.518 3.201 -0.323 1.00 0.00 C ATOM 415 ND1 HIS A 335 -6.093 4.110 -1.200 1.00 0.00 N ATOM 416 CD2 HIS A 335 -4.791 3.946 0.571 1.00 0.00 C ATOM 417 CE1 HIS A 335 -5.706 5.337 -0.816 1.00 0.00 C ATOM 418 NE2 HIS A 335 -4.911 5.291 0.254 1.00 0.00 N ATOM 0 H HIS A 335 -3.991 1.960 -2.282 1.00 0.00 H new ATOM 0 HA HIS A 335 -3.882 1.188 0.550 1.00 0.00 H new ATOM 0 HB2 HIS A 335 -6.239 1.495 -1.385 1.00 0.00 H new ATOM 0 HB3 HIS A 335 -6.364 1.363 0.358 1.00 0.00 H new ATOM 0 HD1 HIS A 335 -6.698 3.887 -1.990 1.00 0.00 H new ATOM 0 HD2 HIS A 335 -4.215 3.547 1.393 1.00 0.00 H new ATOM 0 HE1 HIS A 335 -6.002 6.249 -1.313 1.00 0.00 H new ATOM 426 N THR A 336 -5.011 -1.149 0.466 1.00 0.00 N ATOM 427 CA THR A 336 -5.272 -2.611 0.405 1.00 0.00 C ATOM 428 C THR A 336 -6.605 -2.872 -0.301 1.00 0.00 C ATOM 429 O THR A 336 -6.962 -4.004 -0.562 1.00 0.00 O ATOM 430 CB THR A 336 -5.331 -3.149 1.836 1.00 0.00 C ATOM 431 OG1 THR A 336 -6.290 -2.409 2.578 1.00 0.00 O ATOM 432 CG2 THR A 336 -3.956 -3.009 2.492 1.00 0.00 C ATOM 0 H THR A 336 -5.176 -0.725 1.379 1.00 0.00 H new ATOM 0 HA THR A 336 -4.479 -3.110 -0.152 1.00 0.00 H new ATOM 0 HB THR A 336 -5.617 -4.201 1.819 1.00 0.00 H new ATOM 0 HG1 THR A 336 -7.177 -2.532 2.180 1.00 0.00 H new ATOM 0 HG21 THR A 336 -3.999 -3.392 3.511 1.00 0.00 H new ATOM 0 HG22 THR A 336 -3.221 -3.577 1.921 1.00 0.00 H new ATOM 0 HG23 THR A 336 -3.667 -1.958 2.511 1.00 0.00 H new ATOM 440 N PHE A 337 -7.347 -1.837 -0.602 1.00 0.00 N ATOM 441 CA PHE A 337 -8.662 -2.029 -1.278 1.00 0.00 C ATOM 442 C PHE A 337 -8.696 -1.280 -2.617 1.00 0.00 C ATOM 443 O PHE A 337 -9.720 -1.230 -3.269 1.00 0.00 O ATOM 444 CB PHE A 337 -9.773 -1.482 -0.381 1.00 0.00 C ATOM 445 CG PHE A 337 -9.652 0.019 -0.308 1.00 0.00 C ATOM 446 CD1 PHE A 337 -10.304 0.819 -1.252 1.00 0.00 C ATOM 447 CD2 PHE A 337 -8.886 0.610 0.702 1.00 0.00 C ATOM 448 CE1 PHE A 337 -10.190 2.211 -1.188 1.00 0.00 C ATOM 449 CE2 PHE A 337 -8.772 2.004 0.769 1.00 0.00 C ATOM 450 CZ PHE A 337 -9.424 2.804 -0.177 1.00 0.00 C ATOM 0 H PHE A 337 -7.097 -0.867 -0.408 1.00 0.00 H new ATOM 0 HA PHE A 337 -8.808 -3.094 -1.461 1.00 0.00 H new ATOM 0 HB2 PHE A 337 -10.749 -1.762 -0.778 1.00 0.00 H new ATOM 0 HB3 PHE A 337 -9.698 -1.915 0.617 1.00 0.00 H new ATOM 0 HD1 PHE A 337 -10.896 0.361 -2.031 1.00 0.00 H new ATOM 0 HD2 PHE A 337 -8.383 -0.009 1.430 1.00 0.00 H new ATOM 0 HE1 PHE A 337 -10.692 2.828 -1.918 1.00 0.00 H new ATOM 0 HE2 PHE A 337 -8.182 2.461 1.549 1.00 0.00 H new ATOM 0 HZ PHE A 337 -9.336 3.879 -0.127 1.00 0.00 H new ATOM 460 N CYS A 338 -7.602 -0.692 -3.030 1.00 0.00 N ATOM 461 CA CYS A 338 -7.608 0.056 -4.326 1.00 0.00 C ATOM 462 C CYS A 338 -6.467 -0.427 -5.225 1.00 0.00 C ATOM 463 O CYS A 338 -5.870 0.343 -5.952 1.00 0.00 O ATOM 464 CB CYS A 338 -7.456 1.557 -4.053 1.00 0.00 C ATOM 465 SG CYS A 338 -5.704 1.990 -3.906 1.00 0.00 S ATOM 0 H CYS A 338 -6.712 -0.696 -2.532 1.00 0.00 H new ATOM 0 HA CYS A 338 -8.554 -0.126 -4.835 1.00 0.00 H new ATOM 0 HB2 CYS A 338 -7.913 2.129 -4.860 1.00 0.00 H new ATOM 0 HB3 CYS A 338 -7.982 1.823 -3.136 1.00 0.00 H new ATOM 0 HG CYS A 338 -5.546 2.837 -2.932 1.00 0.00 H new ATOM 470 N LEU A 339 -6.169 -1.698 -5.195 1.00 0.00 N ATOM 471 CA LEU A 339 -5.073 -2.230 -6.061 1.00 0.00 C ATOM 472 C LEU A 339 -5.005 -3.750 -5.934 1.00 0.00 C ATOM 473 O LEU A 339 -4.844 -4.462 -6.907 1.00 0.00 O ATOM 474 CB LEU A 339 -3.733 -1.635 -5.624 1.00 0.00 C ATOM 475 CG LEU A 339 -2.632 -2.079 -6.591 1.00 0.00 C ATOM 476 CD1 LEU A 339 -2.857 -1.442 -7.965 1.00 0.00 C ATOM 477 CD2 LEU A 339 -1.271 -1.640 -6.046 1.00 0.00 C ATOM 0 H LEU A 339 -6.635 -2.391 -4.610 1.00 0.00 H new ATOM 0 HA LEU A 339 -5.277 -1.956 -7.096 1.00 0.00 H new ATOM 0 HB2 LEU A 339 -3.796 -0.547 -5.604 1.00 0.00 H new ATOM 0 HB3 LEU A 339 -3.493 -1.959 -4.611 1.00 0.00 H new ATOM 0 HG LEU A 339 -2.657 -3.164 -6.690 1.00 0.00 H new ATOM 0 HD11 LEU A 339 -2.070 -1.762 -8.648 1.00 0.00 H new ATOM 0 HD12 LEU A 339 -3.826 -1.753 -8.356 1.00 0.00 H new ATOM 0 HD13 LEU A 339 -2.836 -0.356 -7.871 1.00 0.00 H new ATOM 0 HD21 LEU A 339 -0.485 -1.955 -6.733 1.00 0.00 H new ATOM 0 HD22 LEU A 339 -1.252 -0.555 -5.946 1.00 0.00 H new ATOM 0 HD23 LEU A 339 -1.105 -2.097 -5.071 1.00 0.00 H new ATOM 489 N ILE A 340 -5.108 -4.248 -4.738 1.00 0.00 N ATOM 490 CA ILE A 340 -5.033 -5.712 -4.518 1.00 0.00 C ATOM 491 C ILE A 340 -6.408 -6.226 -4.081 1.00 0.00 C ATOM 492 O ILE A 340 -7.170 -5.507 -3.467 1.00 0.00 O ATOM 493 CB ILE A 340 -4.003 -5.961 -3.418 1.00 0.00 C ATOM 494 CG1 ILE A 340 -4.529 -5.392 -2.099 1.00 0.00 C ATOM 495 CG2 ILE A 340 -2.692 -5.262 -3.783 1.00 0.00 C ATOM 496 CD1 ILE A 340 -3.441 -5.477 -1.029 1.00 0.00 C ATOM 0 H ILE A 340 -5.243 -3.694 -3.892 1.00 0.00 H new ATOM 0 HA ILE A 340 -4.741 -6.232 -5.430 1.00 0.00 H new ATOM 0 HB ILE A 340 -3.829 -7.032 -3.314 1.00 0.00 H new ATOM 0 HG12 ILE A 340 -4.837 -4.355 -2.236 1.00 0.00 H new ATOM 0 HG13 ILE A 340 -5.411 -5.947 -1.779 1.00 0.00 H new ATOM 0 HG21 ILE A 340 -1.955 -5.438 -2.999 1.00 0.00 H new ATOM 0 HG22 ILE A 340 -2.319 -5.658 -4.727 1.00 0.00 H new ATOM 0 HG23 ILE A 340 -2.866 -4.191 -3.883 1.00 0.00 H new ATOM 0 HD11 ILE A 340 -3.820 -5.071 -0.091 1.00 0.00 H new ATOM 0 HD12 ILE A 340 -3.154 -6.519 -0.883 1.00 0.00 H new ATOM 0 HD13 ILE A 340 -2.571 -4.903 -1.348 1.00 0.00 H new ATOM 508 N PRO A 341 -6.732 -7.462 -4.385 1.00 0.00 N ATOM 509 CA PRO A 341 -8.038 -8.045 -3.997 1.00 0.00 C ATOM 510 C PRO A 341 -8.402 -7.687 -2.549 1.00 0.00 C ATOM 511 O PRO A 341 -9.479 -7.183 -2.299 1.00 0.00 O ATOM 512 CB PRO A 341 -7.873 -9.559 -4.184 1.00 0.00 C ATOM 513 CG PRO A 341 -6.499 -9.788 -4.745 1.00 0.00 C ATOM 514 CD PRO A 341 -5.904 -8.426 -5.116 1.00 0.00 C ATOM 0 HA PRO A 341 -8.854 -7.654 -4.604 1.00 0.00 H new ATOM 0 HB2 PRO A 341 -7.993 -10.080 -3.234 1.00 0.00 H new ATOM 0 HB3 PRO A 341 -8.635 -9.949 -4.859 1.00 0.00 H new ATOM 0 HG2 PRO A 341 -5.868 -10.292 -4.013 1.00 0.00 H new ATOM 0 HG3 PRO A 341 -6.549 -10.433 -5.622 1.00 0.00 H new ATOM 0 HD2 PRO A 341 -4.857 -8.355 -4.822 1.00 0.00 H new ATOM 0 HD3 PRO A 341 -5.946 -8.252 -6.191 1.00 0.00 H new ATOM 522 N PRO A 342 -7.513 -7.902 -1.599 1.00 0.00 N ATOM 523 CA PRO A 342 -7.771 -7.540 -0.185 1.00 0.00 C ATOM 524 C PRO A 342 -8.573 -6.239 -0.067 1.00 0.00 C ATOM 525 O PRO A 342 -8.684 -5.479 -1.007 1.00 0.00 O ATOM 526 CB PRO A 342 -6.372 -7.362 0.400 1.00 0.00 C ATOM 527 CG PRO A 342 -5.473 -8.236 -0.417 1.00 0.00 C ATOM 528 CD PRO A 342 -6.183 -8.526 -1.745 1.00 0.00 C ATOM 0 HA PRO A 342 -8.364 -8.294 0.332 1.00 0.00 H new ATOM 0 HB2 PRO A 342 -6.056 -6.320 0.348 1.00 0.00 H new ATOM 0 HB3 PRO A 342 -6.348 -7.651 1.451 1.00 0.00 H new ATOM 0 HG2 PRO A 342 -4.518 -7.742 -0.594 1.00 0.00 H new ATOM 0 HG3 PRO A 342 -5.258 -9.164 0.112 1.00 0.00 H new ATOM 0 HD2 PRO A 342 -5.637 -8.102 -2.588 1.00 0.00 H new ATOM 0 HD3 PRO A 342 -6.265 -9.598 -1.925 1.00 0.00 H new ATOM 536 N LEU A 343 -9.133 -5.984 1.083 1.00 0.00 N ATOM 537 CA LEU A 343 -9.937 -4.746 1.273 1.00 0.00 C ATOM 538 C LEU A 343 -9.360 -3.942 2.437 1.00 0.00 C ATOM 539 O LEU A 343 -8.427 -3.183 2.271 1.00 0.00 O ATOM 540 CB LEU A 343 -11.389 -5.122 1.581 1.00 0.00 C ATOM 541 CG LEU A 343 -11.956 -5.962 0.434 1.00 0.00 C ATOM 542 CD1 LEU A 343 -13.416 -6.309 0.731 1.00 0.00 C ATOM 543 CD2 LEU A 343 -11.883 -5.161 -0.869 1.00 0.00 C ATOM 0 H LEU A 343 -9.067 -6.585 1.905 1.00 0.00 H new ATOM 0 HA LEU A 343 -9.904 -4.146 0.364 1.00 0.00 H new ATOM 0 HB2 LEU A 343 -11.440 -5.682 2.515 1.00 0.00 H new ATOM 0 HB3 LEU A 343 -11.988 -4.221 1.716 1.00 0.00 H new ATOM 0 HG LEU A 343 -11.374 -6.878 0.334 1.00 0.00 H new ATOM 0 HD11 LEU A 343 -13.821 -6.907 -0.085 1.00 0.00 H new ATOM 0 HD12 LEU A 343 -13.473 -6.876 1.660 1.00 0.00 H new ATOM 0 HD13 LEU A 343 -13.995 -5.391 0.830 1.00 0.00 H new ATOM 0 HD21 LEU A 343 -12.287 -5.758 -1.686 1.00 0.00 H new ATOM 0 HD22 LEU A 343 -12.466 -4.246 -0.766 1.00 0.00 H new ATOM 0 HD23 LEU A 343 -10.845 -4.908 -1.083 1.00 0.00 H new ATOM 555 N HIS A 344 -9.906 -4.103 3.613 1.00 0.00 N ATOM 556 CA HIS A 344 -9.382 -3.348 4.785 1.00 0.00 C ATOM 557 C HIS A 344 -8.657 -4.315 5.723 1.00 0.00 C ATOM 558 O HIS A 344 -9.275 -5.095 6.421 1.00 0.00 O ATOM 559 CB HIS A 344 -10.550 -2.696 5.531 1.00 0.00 C ATOM 560 CG HIS A 344 -11.241 -1.716 4.623 1.00 0.00 C ATOM 561 ND1 HIS A 344 -12.234 -2.103 3.734 1.00 0.00 N ATOM 562 CD2 HIS A 344 -11.097 -0.360 4.458 1.00 0.00 C ATOM 563 CE1 HIS A 344 -12.646 -1.001 3.080 1.00 0.00 C ATOM 564 NE2 HIS A 344 -11.984 0.085 3.484 1.00 0.00 N ATOM 0 H HIS A 344 -10.691 -4.724 3.811 1.00 0.00 H new ATOM 0 HA HIS A 344 -8.690 -2.577 4.446 1.00 0.00 H new ATOM 0 HB2 HIS A 344 -11.254 -3.459 5.863 1.00 0.00 H new ATOM 0 HB3 HIS A 344 -10.186 -2.187 6.424 1.00 0.00 H new ATOM 0 HD2 HIS A 344 -10.402 0.264 5.001 1.00 0.00 H new ATOM 0 HE1 HIS A 344 -13.416 -0.996 2.323 1.00 0.00 H new ATOM 0 HE2 HIS A 344 -12.104 1.041 3.149 1.00 0.00 H new ATOM 573 N ASP A 345 -7.353 -4.273 5.749 1.00 0.00 N ATOM 574 CA ASP A 345 -6.602 -5.194 6.647 1.00 0.00 C ATOM 575 C ASP A 345 -5.257 -4.574 7.031 1.00 0.00 C ATOM 576 O ASP A 345 -4.707 -3.763 6.313 1.00 0.00 O ATOM 577 CB ASP A 345 -6.365 -6.526 5.930 1.00 0.00 C ATOM 578 CG ASP A 345 -5.808 -7.548 6.922 1.00 0.00 C ATOM 579 OD1 ASP A 345 -5.731 -7.224 8.096 1.00 0.00 O ATOM 580 OD2 ASP A 345 -5.465 -8.636 6.490 1.00 0.00 O ATOM 0 H ASP A 345 -6.778 -3.643 5.190 1.00 0.00 H new ATOM 0 HA ASP A 345 -7.186 -5.363 7.552 1.00 0.00 H new ATOM 0 HB2 ASP A 345 -7.298 -6.891 5.501 1.00 0.00 H new ATOM 0 HB3 ASP A 345 -5.667 -6.387 5.104 1.00 0.00 H new ATOM 585 N VAL A 346 -4.719 -4.957 8.159 1.00 0.00 N ATOM 586 CA VAL A 346 -3.407 -4.399 8.592 1.00 0.00 C ATOM 587 C VAL A 346 -2.278 -5.099 7.819 1.00 0.00 C ATOM 588 O VAL A 346 -2.358 -6.279 7.538 1.00 0.00 O ATOM 589 CB VAL A 346 -3.224 -4.638 10.091 1.00 0.00 C ATOM 590 CG1 VAL A 346 -3.928 -3.528 10.876 1.00 0.00 C ATOM 591 CG2 VAL A 346 -3.829 -5.992 10.471 1.00 0.00 C ATOM 0 H VAL A 346 -5.134 -5.634 8.800 1.00 0.00 H new ATOM 0 HA VAL A 346 -3.379 -3.328 8.389 1.00 0.00 H new ATOM 0 HB VAL A 346 -2.161 -4.635 10.330 1.00 0.00 H new ATOM 0 HG11 VAL A 346 -3.797 -3.699 11.945 1.00 0.00 H new ATOM 0 HG12 VAL A 346 -3.498 -2.563 10.607 1.00 0.00 H new ATOM 0 HG13 VAL A 346 -4.991 -3.530 10.636 1.00 0.00 H new ATOM 0 HG21 VAL A 346 -3.698 -6.162 11.540 1.00 0.00 H new ATOM 0 HG22 VAL A 346 -4.892 -5.996 10.230 1.00 0.00 H new ATOM 0 HG23 VAL A 346 -3.328 -6.784 9.914 1.00 0.00 H new ATOM 601 N PRO A 347 -1.234 -4.383 7.473 1.00 0.00 N ATOM 602 CA PRO A 347 -0.080 -4.957 6.715 1.00 0.00 C ATOM 603 C PRO A 347 0.749 -5.939 7.552 1.00 0.00 C ATOM 604 O PRO A 347 0.919 -5.765 8.743 1.00 0.00 O ATOM 605 CB PRO A 347 0.764 -3.735 6.346 1.00 0.00 C ATOM 606 CG PRO A 347 0.413 -2.691 7.352 1.00 0.00 C ATOM 607 CD PRO A 347 -1.034 -2.954 7.767 1.00 0.00 C ATOM 0 HA PRO A 347 -0.420 -5.532 5.854 1.00 0.00 H new ATOM 0 HB2 PRO A 347 1.828 -3.969 6.378 1.00 0.00 H new ATOM 0 HB3 PRO A 347 0.542 -3.396 5.334 1.00 0.00 H new ATOM 0 HG2 PRO A 347 1.079 -2.744 8.213 1.00 0.00 H new ATOM 0 HG3 PRO A 347 0.519 -1.693 6.928 1.00 0.00 H new ATOM 0 HD2 PRO A 347 -1.192 -2.738 8.824 1.00 0.00 H new ATOM 0 HD3 PRO A 347 -1.730 -2.330 7.206 1.00 0.00 H new ATOM 615 N LYS A 348 1.276 -6.961 6.929 1.00 0.00 N ATOM 616 CA LYS A 348 2.108 -7.953 7.671 1.00 0.00 C ATOM 617 C LYS A 348 3.466 -8.102 6.991 1.00 0.00 C ATOM 618 O LYS A 348 3.601 -7.922 5.797 1.00 0.00 O ATOM 619 CB LYS A 348 1.402 -9.307 7.704 1.00 0.00 C ATOM 620 CG LYS A 348 0.237 -9.234 8.686 1.00 0.00 C ATOM 621 CD LYS A 348 -0.425 -10.608 8.801 1.00 0.00 C ATOM 622 CE LYS A 348 -1.649 -10.512 9.713 1.00 0.00 C ATOM 623 NZ LYS A 348 -2.703 -11.450 9.232 1.00 0.00 N ATOM 0 H LYS A 348 1.165 -7.151 5.933 1.00 0.00 H new ATOM 0 HA LYS A 348 2.252 -7.599 8.692 1.00 0.00 H new ATOM 0 HB2 LYS A 348 1.041 -9.568 6.709 1.00 0.00 H new ATOM 0 HB3 LYS A 348 2.100 -10.089 8.005 1.00 0.00 H new ATOM 0 HG2 LYS A 348 0.592 -8.908 9.663 1.00 0.00 H new ATOM 0 HG3 LYS A 348 -0.491 -8.496 8.348 1.00 0.00 H new ATOM 0 HD2 LYS A 348 -0.721 -10.964 7.814 1.00 0.00 H new ATOM 0 HD3 LYS A 348 0.284 -11.332 9.202 1.00 0.00 H new ATOM 0 HE2 LYS A 348 -1.371 -10.755 10.739 1.00 0.00 H new ATOM 0 HE3 LYS A 348 -2.031 -9.491 9.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 348 -3.535 -11.385 9.852 1.00 0.00 H new ATOM 0 HZ2 LYS A 348 -2.975 -11.198 8.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 348 -2.335 -12.423 9.247 1.00 0.00 H new ATOM 637 N GLY A 349 4.475 -8.427 7.749 1.00 0.00 N ATOM 638 CA GLY A 349 5.835 -8.583 7.154 1.00 0.00 C ATOM 639 C GLY A 349 6.110 -7.404 6.225 1.00 0.00 C ATOM 640 O GLY A 349 5.345 -6.462 6.161 1.00 0.00 O ATOM 0 H GLY A 349 4.419 -8.592 8.754 1.00 0.00 H new ATOM 0 HA2 GLY A 349 6.588 -8.625 7.941 1.00 0.00 H new ATOM 0 HA3 GLY A 349 5.899 -9.520 6.601 1.00 0.00 H new ATOM 644 N ASP A 350 7.187 -7.447 5.491 1.00 0.00 N ATOM 645 CA ASP A 350 7.481 -6.328 4.561 1.00 0.00 C ATOM 646 C ASP A 350 6.376 -6.284 3.509 1.00 0.00 C ATOM 647 O ASP A 350 5.945 -7.306 3.013 1.00 0.00 O ATOM 648 CB ASP A 350 8.831 -6.572 3.887 1.00 0.00 C ATOM 649 CG ASP A 350 9.945 -6.494 4.932 1.00 0.00 C ATOM 650 OD1 ASP A 350 9.673 -6.033 6.028 1.00 0.00 O ATOM 651 OD2 ASP A 350 11.054 -6.898 4.619 1.00 0.00 O ATOM 0 H ASP A 350 7.870 -8.204 5.496 1.00 0.00 H new ATOM 0 HA ASP A 350 7.523 -5.381 5.100 1.00 0.00 H new ATOM 0 HB2 ASP A 350 8.837 -7.550 3.406 1.00 0.00 H new ATOM 0 HB3 ASP A 350 8.998 -5.831 3.106 1.00 0.00 H new ATOM 656 N TRP A 351 5.898 -5.122 3.168 1.00 0.00 N ATOM 657 CA TRP A 351 4.810 -5.054 2.157 1.00 0.00 C ATOM 658 C TRP A 351 5.409 -4.852 0.769 1.00 0.00 C ATOM 659 O TRP A 351 6.166 -3.930 0.534 1.00 0.00 O ATOM 660 CB TRP A 351 3.871 -3.893 2.481 1.00 0.00 C ATOM 661 CG TRP A 351 2.562 -4.122 1.798 1.00 0.00 C ATOM 662 CD1 TRP A 351 2.065 -3.369 0.791 1.00 0.00 C ATOM 663 CD2 TRP A 351 1.581 -5.168 2.052 1.00 0.00 C ATOM 664 NE1 TRP A 351 0.838 -3.884 0.413 1.00 0.00 N ATOM 665 CE2 TRP A 351 0.497 -4.995 1.161 1.00 0.00 C ATOM 666 CE3 TRP A 351 1.527 -6.240 2.962 1.00 0.00 C ATOM 667 CZ2 TRP A 351 -0.602 -5.853 1.172 1.00 0.00 C ATOM 668 CZ3 TRP A 351 0.422 -7.107 2.975 1.00 0.00 C ATOM 669 CH2 TRP A 351 -0.641 -6.913 2.082 1.00 0.00 C ATOM 0 H TRP A 351 6.210 -4.225 3.541 1.00 0.00 H new ATOM 0 HA TRP A 351 4.248 -5.988 2.177 1.00 0.00 H new ATOM 0 HB2 TRP A 351 3.725 -3.816 3.558 1.00 0.00 H new ATOM 0 HB3 TRP A 351 4.309 -2.951 2.150 1.00 0.00 H new ATOM 0 HD1 TRP A 351 2.547 -2.507 0.354 1.00 0.00 H new ATOM 0 HE1 TRP A 351 0.256 -3.492 -0.327 1.00 0.00 H new ATOM 0 HE3 TRP A 351 2.340 -6.397 3.655 1.00 0.00 H new ATOM 0 HZ2 TRP A 351 -1.418 -5.699 0.482 1.00 0.00 H new ATOM 0 HZ3 TRP A 351 0.391 -7.927 3.677 1.00 0.00 H new ATOM 0 HH2 TRP A 351 -1.489 -7.582 2.097 1.00 0.00 H new ATOM 680 N ARG A 352 5.073 -5.711 -0.153 1.00 0.00 N ATOM 681 CA ARG A 352 5.611 -5.583 -1.532 1.00 0.00 C ATOM 682 C ARG A 352 4.463 -5.614 -2.534 1.00 0.00 C ATOM 683 O ARG A 352 3.574 -6.438 -2.449 1.00 0.00 O ATOM 684 CB ARG A 352 6.557 -6.748 -1.815 1.00 0.00 C ATOM 685 CG ARG A 352 7.798 -6.625 -0.934 1.00 0.00 C ATOM 686 CD ARG A 352 8.751 -7.778 -1.247 1.00 0.00 C ATOM 687 NE ARG A 352 9.956 -7.679 -0.377 1.00 0.00 N ATOM 688 CZ ARG A 352 10.986 -8.449 -0.600 1.00 0.00 C ATOM 689 NH1 ARG A 352 10.959 -9.307 -1.582 1.00 0.00 N ATOM 690 NH2 ARG A 352 12.042 -8.361 0.162 1.00 0.00 N ATOM 0 H ARG A 352 4.444 -6.501 -0.007 1.00 0.00 H new ATOM 0 HA ARG A 352 6.149 -4.640 -1.625 1.00 0.00 H new ATOM 0 HB2 ARG A 352 6.053 -7.695 -1.621 1.00 0.00 H new ATOM 0 HB3 ARG A 352 6.844 -6.750 -2.867 1.00 0.00 H new ATOM 0 HG2 ARG A 352 8.292 -5.670 -1.112 1.00 0.00 H new ATOM 0 HG3 ARG A 352 7.515 -6.646 0.119 1.00 0.00 H new ATOM 0 HD2 ARG A 352 8.250 -8.732 -1.084 1.00 0.00 H new ATOM 0 HD3 ARG A 352 9.044 -7.747 -2.296 1.00 0.00 H new ATOM 0 HE ARG A 352 9.976 -7.010 0.393 1.00 0.00 H new ATOM 0 HH11 ARG A 352 10.133 -9.376 -2.176 1.00 0.00 H new ATOM 0 HH12 ARG A 352 11.764 -9.909 -1.756 1.00 0.00 H new ATOM 0 HH21 ARG A 352 12.062 -7.691 0.931 1.00 0.00 H new ATOM 0 HH22 ARG A 352 12.848 -8.962 -0.011 1.00 0.00 H new ATOM 704 N CYS A 353 4.482 -4.737 -3.494 1.00 0.00 N ATOM 705 CA CYS A 353 3.403 -4.735 -4.508 1.00 0.00 C ATOM 706 C CYS A 353 3.481 -6.066 -5.275 1.00 0.00 C ATOM 707 O CYS A 353 4.535 -6.663 -5.360 1.00 0.00 O ATOM 708 CB CYS A 353 3.598 -3.543 -5.447 1.00 0.00 C ATOM 709 SG CYS A 353 5.155 -3.718 -6.344 1.00 0.00 S ATOM 0 H CYS A 353 5.199 -4.022 -3.618 1.00 0.00 H new ATOM 0 HA CYS A 353 2.421 -4.640 -4.045 1.00 0.00 H new ATOM 0 HB2 CYS A 353 2.767 -3.483 -6.150 1.00 0.00 H new ATOM 0 HB3 CYS A 353 3.599 -2.615 -4.876 1.00 0.00 H new ATOM 0 HG CYS A 353 5.856 -2.631 -6.213 1.00 0.00 H new ATOM 714 N PRO A 354 2.381 -6.557 -5.793 1.00 0.00 N ATOM 715 CA PRO A 354 2.361 -7.867 -6.512 1.00 0.00 C ATOM 716 C PRO A 354 3.492 -8.025 -7.540 1.00 0.00 C ATOM 717 O PRO A 354 4.079 -9.082 -7.659 1.00 0.00 O ATOM 718 CB PRO A 354 1.012 -7.870 -7.233 1.00 0.00 C ATOM 719 CG PRO A 354 0.135 -6.925 -6.478 1.00 0.00 C ATOM 720 CD PRO A 354 1.046 -5.933 -5.750 1.00 0.00 C ATOM 0 HA PRO A 354 2.502 -8.689 -5.810 1.00 0.00 H new ATOM 0 HB2 PRO A 354 1.124 -7.553 -8.270 1.00 0.00 H new ATOM 0 HB3 PRO A 354 0.582 -8.871 -7.250 1.00 0.00 H new ATOM 0 HG2 PRO A 354 -0.538 -6.401 -7.157 1.00 0.00 H new ATOM 0 HG3 PRO A 354 -0.489 -7.466 -5.766 1.00 0.00 H new ATOM 0 HD2 PRO A 354 1.047 -4.960 -6.242 1.00 0.00 H new ATOM 0 HD3 PRO A 354 0.716 -5.771 -4.724 1.00 0.00 H new ATOM 728 N LYS A 355 3.815 -6.999 -8.279 1.00 0.00 N ATOM 729 CA LYS A 355 4.912 -7.137 -9.282 1.00 0.00 C ATOM 730 C LYS A 355 6.241 -7.415 -8.573 1.00 0.00 C ATOM 731 O LYS A 355 7.033 -8.222 -9.018 1.00 0.00 O ATOM 732 CB LYS A 355 5.023 -5.858 -10.107 1.00 0.00 C ATOM 733 CG LYS A 355 5.130 -4.670 -9.163 1.00 0.00 C ATOM 734 CD LYS A 355 5.160 -3.370 -9.970 1.00 0.00 C ATOM 735 CE LYS A 355 5.460 -2.196 -9.037 1.00 0.00 C ATOM 736 NZ LYS A 355 5.771 -0.984 -9.847 1.00 0.00 N ATOM 0 H LYS A 355 3.373 -6.081 -8.234 1.00 0.00 H new ATOM 0 HA LYS A 355 4.683 -7.972 -9.944 1.00 0.00 H new ATOM 0 HB2 LYS A 355 5.897 -5.903 -10.757 1.00 0.00 H new ATOM 0 HB3 LYS A 355 4.152 -5.749 -10.753 1.00 0.00 H new ATOM 0 HG2 LYS A 355 4.285 -4.663 -8.475 1.00 0.00 H new ATOM 0 HG3 LYS A 355 6.033 -4.754 -8.558 1.00 0.00 H new ATOM 0 HD2 LYS A 355 5.919 -3.431 -10.750 1.00 0.00 H new ATOM 0 HD3 LYS A 355 4.203 -3.217 -10.468 1.00 0.00 H new ATOM 0 HE2 LYS A 355 4.604 -2.004 -8.390 1.00 0.00 H new ATOM 0 HE3 LYS A 355 6.302 -2.439 -8.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 355 5.975 -0.185 -9.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 355 6.600 -1.171 -10.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 355 4.955 -0.749 -10.448 1.00 0.00 H new ATOM 750 N CYS A 356 6.494 -6.760 -7.474 1.00 0.00 N ATOM 751 CA CYS A 356 7.772 -6.999 -6.745 1.00 0.00 C ATOM 752 C CYS A 356 7.819 -8.456 -6.281 1.00 0.00 C ATOM 753 O CYS A 356 8.860 -9.083 -6.271 1.00 0.00 O ATOM 754 CB CYS A 356 7.861 -6.074 -5.527 1.00 0.00 C ATOM 755 SG CYS A 356 8.614 -4.496 -6.006 1.00 0.00 S ATOM 0 H CYS A 356 5.873 -6.071 -7.050 1.00 0.00 H new ATOM 0 HA CYS A 356 8.611 -6.794 -7.410 1.00 0.00 H new ATOM 0 HB2 CYS A 356 6.866 -5.902 -5.116 1.00 0.00 H new ATOM 0 HB3 CYS A 356 8.453 -6.546 -4.743 1.00 0.00 H new ATOM 0 HG CYS A 356 7.680 -3.636 -6.283 1.00 0.00 H new ATOM 760 N LEU A 357 6.696 -8.997 -5.895 1.00 0.00 N ATOM 761 CA LEU A 357 6.669 -10.411 -5.428 1.00 0.00 C ATOM 762 C LEU A 357 7.163 -11.329 -6.546 1.00 0.00 C ATOM 763 O LEU A 357 7.831 -12.315 -6.306 1.00 0.00 O ATOM 764 CB LEU A 357 5.237 -10.792 -5.045 1.00 0.00 C ATOM 765 CG LEU A 357 5.222 -12.202 -4.449 1.00 0.00 C ATOM 766 CD1 LEU A 357 5.926 -12.201 -3.090 1.00 0.00 C ATOM 767 CD2 LEU A 357 3.773 -12.660 -4.269 1.00 0.00 C ATOM 0 H LEU A 357 5.795 -8.519 -5.883 1.00 0.00 H new ATOM 0 HA LEU A 357 7.319 -10.520 -4.560 1.00 0.00 H new ATOM 0 HB2 LEU A 357 4.840 -10.077 -4.324 1.00 0.00 H new ATOM 0 HB3 LEU A 357 4.592 -10.750 -5.923 1.00 0.00 H new ATOM 0 HG LEU A 357 5.743 -12.882 -5.122 1.00 0.00 H new ATOM 0 HD11 LEU A 357 5.911 -13.208 -2.672 1.00 0.00 H new ATOM 0 HD12 LEU A 357 6.959 -11.875 -3.215 1.00 0.00 H new ATOM 0 HD13 LEU A 357 5.410 -11.520 -2.413 1.00 0.00 H new ATOM 0 HD21 LEU A 357 3.759 -13.664 -3.845 1.00 0.00 H new ATOM 0 HD22 LEU A 357 3.256 -11.975 -3.597 1.00 0.00 H new ATOM 0 HD23 LEU A 357 3.271 -12.668 -5.237 1.00 0.00 H new ATOM 779 N ALA A 358 6.837 -11.014 -7.770 1.00 0.00 N ATOM 780 CA ALA A 358 7.287 -11.869 -8.904 1.00 0.00 C ATOM 781 C ALA A 358 8.815 -11.901 -8.946 1.00 0.00 C ATOM 782 O ALA A 358 9.414 -12.886 -9.332 1.00 0.00 O ATOM 783 CB ALA A 358 6.753 -11.295 -10.218 1.00 0.00 C ATOM 0 H ALA A 358 6.279 -10.202 -8.033 1.00 0.00 H new ATOM 0 HA ALA A 358 6.907 -12.881 -8.768 1.00 0.00 H new ATOM 0 HB1 ALA A 358 7.082 -11.920 -11.048 1.00 0.00 H new ATOM 0 HB2 ALA A 358 5.664 -11.273 -10.189 1.00 0.00 H new ATOM 0 HB3 ALA A 358 7.133 -10.282 -10.354 1.00 0.00 H new ATOM 789 N GLN A 359 9.451 -10.834 -8.550 1.00 0.00 N ATOM 790 CA GLN A 359 10.941 -10.804 -8.567 1.00 0.00 C ATOM 791 C GLN A 359 11.482 -11.930 -7.683 1.00 0.00 C ATOM 792 O GLN A 359 12.503 -12.523 -7.971 1.00 0.00 O ATOM 793 CB GLN A 359 11.432 -9.458 -8.034 1.00 0.00 C ATOM 794 CG GLN A 359 10.992 -8.341 -8.982 1.00 0.00 C ATOM 795 CD GLN A 359 11.438 -6.989 -8.423 1.00 0.00 C ATOM 796 OE1 GLN A 359 11.762 -6.878 -7.257 1.00 0.00 O ATOM 797 NE2 GLN A 359 11.470 -5.949 -9.211 1.00 0.00 N ATOM 0 H GLN A 359 9.004 -9.981 -8.215 1.00 0.00 H new ATOM 0 HA GLN A 359 11.295 -10.940 -9.589 1.00 0.00 H new ATOM 0 HB2 GLN A 359 11.030 -9.282 -7.036 1.00 0.00 H new ATOM 0 HB3 GLN A 359 12.518 -9.465 -7.943 1.00 0.00 H new ATOM 0 HG2 GLN A 359 11.424 -8.498 -9.970 1.00 0.00 H new ATOM 0 HG3 GLN A 359 9.909 -8.357 -9.101 1.00 0.00 H new ATOM 0 HE21 GLN A 359 11.198 -6.042 -10.190 1.00 0.00 H new ATOM 0 HE22 GLN A 359 11.767 -5.043 -8.848 1.00 0.00 H new ATOM 806 N GLU A 360 10.804 -12.229 -6.610 1.00 0.00 N ATOM 807 CA GLU A 360 11.277 -13.315 -5.708 1.00 0.00 C ATOM 808 C GLU A 360 10.609 -14.633 -6.101 1.00 0.00 C ATOM 809 O GLU A 360 11.278 -15.652 -6.051 1.00 0.00 O ATOM 810 CB GLU A 360 10.917 -12.971 -4.261 1.00 0.00 C ATOM 811 CG GLU A 360 11.526 -14.011 -3.320 1.00 0.00 C ATOM 812 CD GLU A 360 11.082 -13.724 -1.885 1.00 0.00 C ATOM 813 OE1 GLU A 360 10.331 -12.782 -1.695 1.00 0.00 O ATOM 814 OE2 GLU A 360 11.501 -14.452 -0.999 1.00 0.00 O ATOM 815 OXT GLU A 360 9.438 -14.602 -6.443 1.00 0.00 O ATOM 0 H GLU A 360 9.942 -11.768 -6.319 1.00 0.00 H new ATOM 0 HA GLU A 360 12.359 -13.416 -5.798 1.00 0.00 H new ATOM 0 HB2 GLU A 360 11.288 -11.977 -4.010 1.00 0.00 H new ATOM 0 HB3 GLU A 360 9.834 -12.947 -4.141 1.00 0.00 H new ATOM 0 HG2 GLU A 360 11.212 -15.012 -3.616 1.00 0.00 H new ATOM 0 HG3 GLU A 360 12.614 -13.985 -3.387 1.00 0.00 H new