USER MOD reduce.3.24.130724 H: found=0, std=0, add=609, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 610 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 288 THR OG1 : rot 120:sc= 0.117 USER MOD Set 1.2: A 293 GLN :FLIP amide:sc= -0.257 F(o=-4.5!,f=-0.14) USER MOD Single : A 245 SER OG : rot 40:sc= 0.0424 USER MOD Single : A 251 TYR OH : rot 180:sc= 0 USER MOD Single : A 254 CYS SG : rot -61:sc= -2.03! USER MOD Single : A 257 SER OG : rot 180:sc= -0.0608 USER MOD Single : A 261 MET CE :methyl 170:sc= -1.98 (180deg=-2.27) USER MOD Single : A 262 LYS NZ :NH3+ -149:sc= 0.0888 (180deg=-1.53!) USER MOD Single : A 268 SER OG : rot 156:sc= 0.707 USER MOD Single : A 269 THR OG1 : rot -130:sc= -0.858 USER MOD Single : A 271 GLN :FLIP amide:sc= -2.2! C(o=-4.7!,f=-2.2!) USER MOD Single : A 272 THR OG1 : rot 180:sc= -0.188 USER MOD Single : A 273 TYR OH : rot 30:sc= -0.131 USER MOD Single : A 276 SER OG : rot 180:sc= 0 USER MOD Single : A 277 SER OG : rot 6:sc= 0.754 USER MOD Single : A 279 GLN : amide:sc= -4.13! C(o=-4.1!,f=-9.4!) USER MOD Single : A 280 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 286 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 287 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 289 CYS SG : rot 170:sc= 0.579 USER MOD Single : A 291 LYS NZ :NH3+ 175:sc= 1.14 (180deg=1.12) USER MOD Single : A 292 SER OG : rot 180:sc= 0 USER MOD Single : A 295 THR OG1 : rot 180:sc= 0 USER MOD Single : A 298 HIS : no HD1:sc= -1.99 X(o=-2,f=-1.5) USER MOD Single : A 302 THR OG1 : rot 68:sc= 0.0901 USER MOD Single : A 304 ASN : amide:sc= -4.07! C(o=-4.1!,f=-8.9!) USER MOD Single : A 305 TYR OH : rot 180:sc= 0 USER MOD Single : A 308 LYS NZ :NH3+ 148:sc= 1.21 (180deg=1.05) USER MOD Single : A 309 SER OG : rot 180:sc= 0 USER MOD Single : A 315 CYS SG : rot 55:sc= 0.042 USER MOD Single : A 317 SER OG : rot 77:sc= 1.23 USER MOD Single : A 318 ASN : amide:sc= 0.453 K(o=0.45,f=-3.8!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 244 0.363 -22.017 10.200 1.00 0.00 N ATOM 2 CA GLY A 244 1.516 -21.515 9.413 1.00 0.00 C ATOM 3 C GLY A 244 1.750 -20.038 9.645 1.00 0.00 C ATOM 4 O GLY A 244 1.016 -19.400 10.400 1.00 0.00 O ATOM 0 HA2 GLY A 244 2.412 -22.073 9.684 1.00 0.00 H new ATOM 0 HA3 GLY A 244 1.338 -21.693 8.352 1.00 0.00 H new ATOM 10 N SER A 245 2.766 -19.488 9.006 1.00 0.00 N ATOM 11 CA SER A 245 3.090 -18.084 9.165 1.00 0.00 C ATOM 12 C SER A 245 2.434 -17.244 8.068 1.00 0.00 C ATOM 13 O SER A 245 2.623 -17.511 6.882 1.00 0.00 O ATOM 14 CB SER A 245 4.608 -17.913 9.147 1.00 0.00 C ATOM 15 OG SER A 245 5.191 -18.718 8.138 1.00 0.00 O ATOM 0 H SER A 245 3.382 -19.995 8.370 1.00 0.00 H new ATOM 0 HA SER A 245 2.701 -17.734 10.121 1.00 0.00 H new ATOM 0 HB2 SER A 245 4.859 -16.866 8.974 1.00 0.00 H new ATOM 0 HB3 SER A 245 5.021 -18.184 10.119 1.00 0.00 H new ATOM 0 HG SER A 245 4.630 -18.694 7.335 1.00 0.00 H new ATOM 21 N PRO A 246 1.631 -16.237 8.454 1.00 0.00 N ATOM 22 CA PRO A 246 0.990 -15.323 7.498 1.00 0.00 C ATOM 23 C PRO A 246 2.017 -14.496 6.731 1.00 0.00 C ATOM 24 O PRO A 246 1.830 -14.202 5.551 1.00 0.00 O ATOM 25 CB PRO A 246 0.124 -14.418 8.381 1.00 0.00 C ATOM 26 CG PRO A 246 0.714 -14.525 9.745 1.00 0.00 C ATOM 27 CD PRO A 246 1.275 -15.915 9.845 1.00 0.00 C ATOM 0 HA PRO A 246 0.419 -15.858 6.739 1.00 0.00 H new ATOM 0 HB2 PRO A 246 0.140 -13.388 8.025 1.00 0.00 H new ATOM 0 HB3 PRO A 246 -0.917 -14.741 8.375 1.00 0.00 H new ATOM 0 HG2 PRO A 246 1.494 -13.778 9.893 1.00 0.00 H new ATOM 0 HG3 PRO A 246 -0.042 -14.353 10.512 1.00 0.00 H new ATOM 0 HD2 PRO A 246 2.144 -15.952 10.502 1.00 0.00 H new ATOM 0 HD3 PRO A 246 0.543 -16.616 10.246 1.00 0.00 H new ATOM 35 N GLU A 247 3.095 -14.130 7.433 1.00 0.00 N ATOM 36 CA GLU A 247 4.221 -13.396 6.857 1.00 0.00 C ATOM 37 C GLU A 247 3.838 -11.999 6.376 1.00 0.00 C ATOM 38 O GLU A 247 3.122 -11.827 5.388 1.00 0.00 O ATOM 39 CB GLU A 247 4.871 -14.190 5.720 1.00 0.00 C ATOM 40 CG GLU A 247 5.642 -15.407 6.204 1.00 0.00 C ATOM 41 CD GLU A 247 6.730 -15.038 7.191 1.00 0.00 C ATOM 42 OE1 GLU A 247 7.705 -14.373 6.788 1.00 0.00 O ATOM 43 OE2 GLU A 247 6.608 -15.392 8.381 1.00 0.00 O ATOM 0 H GLU A 247 3.209 -14.338 8.425 1.00 0.00 H new ATOM 0 HA GLU A 247 4.945 -13.269 7.662 1.00 0.00 H new ATOM 0 HB2 GLU A 247 4.098 -14.512 5.022 1.00 0.00 H new ATOM 0 HB3 GLU A 247 5.546 -13.536 5.169 1.00 0.00 H new ATOM 0 HG2 GLU A 247 4.952 -16.110 6.672 1.00 0.00 H new ATOM 0 HG3 GLU A 247 6.086 -15.917 5.349 1.00 0.00 H new ATOM 50 N PHE A 248 4.334 -10.999 7.084 1.00 0.00 N ATOM 51 CA PHE A 248 4.189 -9.617 6.656 1.00 0.00 C ATOM 52 C PHE A 248 5.560 -8.969 6.472 1.00 0.00 C ATOM 53 O PHE A 248 5.996 -8.184 7.312 1.00 0.00 O ATOM 54 CB PHE A 248 3.374 -8.803 7.665 1.00 0.00 C ATOM 55 CG PHE A 248 1.917 -9.164 7.723 1.00 0.00 C ATOM 56 CD1 PHE A 248 1.009 -8.550 6.877 1.00 0.00 C ATOM 57 CD2 PHE A 248 1.453 -10.103 8.630 1.00 0.00 C ATOM 58 CE1 PHE A 248 -0.334 -8.867 6.932 1.00 0.00 C ATOM 59 CE2 PHE A 248 0.111 -10.422 8.692 1.00 0.00 C ATOM 60 CZ PHE A 248 -0.783 -9.801 7.840 1.00 0.00 C ATOM 0 H PHE A 248 4.842 -11.118 7.960 1.00 0.00 H new ATOM 0 HA PHE A 248 3.658 -9.623 5.704 1.00 0.00 H new ATOM 0 HB2 PHE A 248 3.808 -8.936 8.656 1.00 0.00 H new ATOM 0 HB3 PHE A 248 3.464 -7.745 7.417 1.00 0.00 H new ATOM 0 HD1 PHE A 248 1.355 -7.815 6.166 1.00 0.00 H new ATOM 0 HD2 PHE A 248 2.149 -10.591 9.296 1.00 0.00 H new ATOM 0 HE1 PHE A 248 -1.031 -8.383 6.264 1.00 0.00 H new ATOM 0 HE2 PHE A 248 -0.239 -11.155 9.404 1.00 0.00 H new ATOM 0 HZ PHE A 248 -1.833 -10.048 7.886 1.00 0.00 H new ATOM 70 N PRO A 249 6.277 -9.317 5.390 1.00 0.00 N ATOM 71 CA PRO A 249 7.576 -8.732 5.087 1.00 0.00 C ATOM 72 C PRO A 249 7.436 -7.409 4.343 1.00 0.00 C ATOM 73 O PRO A 249 7.861 -6.360 4.824 1.00 0.00 O ATOM 74 CB PRO A 249 8.254 -9.788 4.194 1.00 0.00 C ATOM 75 CG PRO A 249 7.237 -10.871 3.973 1.00 0.00 C ATOM 76 CD PRO A 249 5.903 -10.313 4.385 1.00 0.00 C ATOM 0 HA PRO A 249 8.145 -8.502 5.988 1.00 0.00 H new ATOM 0 HB2 PRO A 249 8.569 -9.351 3.246 1.00 0.00 H new ATOM 0 HB3 PRO A 249 9.148 -10.186 4.674 1.00 0.00 H new ATOM 0 HG2 PRO A 249 7.221 -11.177 2.927 1.00 0.00 H new ATOM 0 HG3 PRO A 249 7.483 -11.756 4.560 1.00 0.00 H new ATOM 0 HD2 PRO A 249 5.373 -9.864 3.545 1.00 0.00 H new ATOM 0 HD3 PRO A 249 5.251 -11.082 4.798 1.00 0.00 H new ATOM 84 N GLU A 250 6.814 -7.473 3.174 1.00 0.00 N ATOM 85 CA GLU A 250 6.592 -6.303 2.345 1.00 0.00 C ATOM 86 C GLU A 250 5.553 -6.623 1.274 1.00 0.00 C ATOM 87 O GLU A 250 4.995 -7.719 1.268 1.00 0.00 O ATOM 88 CB GLU A 250 7.909 -5.842 1.706 1.00 0.00 C ATOM 89 CG GLU A 250 8.603 -6.916 0.884 1.00 0.00 C ATOM 90 CD GLU A 250 9.928 -6.454 0.312 1.00 0.00 C ATOM 91 OE1 GLU A 250 9.926 -5.594 -0.594 1.00 0.00 O ATOM 92 OE2 GLU A 250 10.979 -6.960 0.750 1.00 0.00 O ATOM 0 H GLU A 250 6.450 -8.339 2.776 1.00 0.00 H new ATOM 0 HA GLU A 250 6.217 -5.490 2.966 1.00 0.00 H new ATOM 0 HB2 GLU A 250 7.710 -4.981 1.068 1.00 0.00 H new ATOM 0 HB3 GLU A 250 8.585 -5.506 2.492 1.00 0.00 H new ATOM 0 HG2 GLU A 250 8.768 -7.794 1.508 1.00 0.00 H new ATOM 0 HG3 GLU A 250 7.948 -7.223 0.069 1.00 0.00 H new ATOM 99 N TYR A 251 5.300 -5.649 0.397 1.00 0.00 N ATOM 100 CA TYR A 251 4.356 -5.769 -0.732 1.00 0.00 C ATOM 101 C TYR A 251 2.991 -6.355 -0.336 1.00 0.00 C ATOM 102 O TYR A 251 2.304 -6.948 -1.165 1.00 0.00 O ATOM 103 CB TYR A 251 4.977 -6.549 -1.922 1.00 0.00 C ATOM 104 CG TYR A 251 5.329 -8.007 -1.677 1.00 0.00 C ATOM 105 CD1 TYR A 251 4.365 -9.007 -1.748 1.00 0.00 C ATOM 106 CD2 TYR A 251 6.635 -8.381 -1.391 1.00 0.00 C ATOM 107 CE1 TYR A 251 4.695 -10.329 -1.535 1.00 0.00 C ATOM 108 CE2 TYR A 251 6.970 -9.703 -1.178 1.00 0.00 C ATOM 109 CZ TYR A 251 5.995 -10.673 -1.250 1.00 0.00 C ATOM 110 OH TYR A 251 6.321 -11.991 -1.036 1.00 0.00 O ATOM 0 H TYR A 251 5.750 -4.735 0.447 1.00 0.00 H new ATOM 0 HA TYR A 251 4.163 -4.747 -1.058 1.00 0.00 H new ATOM 0 HB2 TYR A 251 4.280 -6.504 -2.759 1.00 0.00 H new ATOM 0 HB3 TYR A 251 5.883 -6.029 -2.234 1.00 0.00 H new ATOM 0 HD1 TYR A 251 3.342 -8.744 -1.973 1.00 0.00 H new ATOM 0 HD2 TYR A 251 7.403 -7.624 -1.334 1.00 0.00 H new ATOM 0 HE1 TYR A 251 3.933 -11.093 -1.592 1.00 0.00 H new ATOM 0 HE2 TYR A 251 7.991 -9.975 -0.956 1.00 0.00 H new ATOM 0 HH TYR A 251 7.280 -12.064 -0.848 1.00 0.00 H new ATOM 120 N PHE A 252 2.573 -6.143 0.909 1.00 0.00 N ATOM 121 CA PHE A 252 1.268 -6.625 1.357 1.00 0.00 C ATOM 122 C PHE A 252 0.436 -5.518 2.005 1.00 0.00 C ATOM 123 O PHE A 252 -0.452 -4.949 1.381 1.00 0.00 O ATOM 124 CB PHE A 252 1.418 -7.798 2.330 1.00 0.00 C ATOM 125 CG PHE A 252 1.736 -9.105 1.663 1.00 0.00 C ATOM 126 CD1 PHE A 252 1.042 -9.507 0.531 1.00 0.00 C ATOM 127 CD2 PHE A 252 2.716 -9.939 2.176 1.00 0.00 C ATOM 128 CE1 PHE A 252 1.320 -10.717 -0.076 1.00 0.00 C ATOM 129 CE2 PHE A 252 3.001 -11.150 1.573 1.00 0.00 C ATOM 130 CZ PHE A 252 2.301 -11.540 0.447 1.00 0.00 C ATOM 0 H PHE A 252 3.111 -5.647 1.619 1.00 0.00 H new ATOM 0 HA PHE A 252 0.740 -6.966 0.467 1.00 0.00 H new ATOM 0 HB2 PHE A 252 2.207 -7.565 3.046 1.00 0.00 H new ATOM 0 HB3 PHE A 252 0.494 -7.907 2.898 1.00 0.00 H new ATOM 0 HD1 PHE A 252 0.276 -8.867 0.119 1.00 0.00 H new ATOM 0 HD2 PHE A 252 3.264 -9.640 3.057 1.00 0.00 H new ATOM 0 HE1 PHE A 252 0.773 -11.019 -0.957 1.00 0.00 H new ATOM 0 HE2 PHE A 252 3.769 -11.790 1.981 1.00 0.00 H new ATOM 0 HZ PHE A 252 2.520 -12.487 -0.024 1.00 0.00 H new ATOM 140 N ARG A 253 0.728 -5.216 3.262 1.00 0.00 N ATOM 141 CA ARG A 253 -0.067 -4.250 4.014 1.00 0.00 C ATOM 142 C ARG A 253 0.537 -2.858 3.939 1.00 0.00 C ATOM 143 O ARG A 253 1.742 -2.707 3.730 1.00 0.00 O ATOM 144 CB ARG A 253 -0.167 -4.663 5.484 1.00 0.00 C ATOM 145 CG ARG A 253 1.185 -4.901 6.137 1.00 0.00 C ATOM 146 CD ARG A 253 1.109 -4.788 7.651 1.00 0.00 C ATOM 147 NE ARG A 253 0.920 -3.400 8.085 1.00 0.00 N ATOM 148 CZ ARG A 253 1.291 -2.930 9.280 1.00 0.00 C ATOM 149 NH1 ARG A 253 1.886 -3.726 10.160 1.00 0.00 N ATOM 150 NH2 ARG A 253 1.077 -1.654 9.583 1.00 0.00 N ATOM 0 H ARG A 253 1.505 -5.623 3.783 1.00 0.00 H new ATOM 0 HA ARG A 253 -1.060 -4.233 3.565 1.00 0.00 H new ATOM 0 HB2 ARG A 253 -0.698 -3.887 6.036 1.00 0.00 H new ATOM 0 HB3 ARG A 253 -0.763 -5.572 5.559 1.00 0.00 H new ATOM 0 HG2 ARG A 253 1.551 -5.891 5.864 1.00 0.00 H new ATOM 0 HG3 ARG A 253 1.906 -4.178 5.754 1.00 0.00 H new ATOM 0 HD2 ARG A 253 0.286 -5.400 8.020 1.00 0.00 H new ATOM 0 HD3 ARG A 253 2.024 -5.185 8.091 1.00 0.00 H new ATOM 0 HE ARG A 253 0.477 -2.752 7.433 1.00 0.00 H new ATOM 0 HH11 ARG A 253 2.063 -4.703 9.926 1.00 0.00 H new ATOM 0 HH12 ARG A 253 2.166 -3.361 11.070 1.00 0.00 H new ATOM 0 HH21 ARG A 253 0.631 -1.037 8.905 1.00 0.00 H new ATOM 0 HH22 ARG A 253 1.359 -1.292 10.494 1.00 0.00 H new ATOM 164 N CYS A 254 -0.298 -1.843 4.115 1.00 0.00 N ATOM 165 CA CYS A 254 0.192 -0.489 4.247 1.00 0.00 C ATOM 166 C CYS A 254 0.733 -0.286 5.659 1.00 0.00 C ATOM 167 O CYS A 254 0.358 -1.013 6.590 1.00 0.00 O ATOM 168 CB CYS A 254 -0.915 0.532 3.981 1.00 0.00 C ATOM 169 SG CYS A 254 -2.075 0.722 5.354 1.00 0.00 S ATOM 0 H CYS A 254 -1.312 -1.936 4.169 1.00 0.00 H new ATOM 0 HA CYS A 254 0.982 -0.338 3.511 1.00 0.00 H new ATOM 0 HB2 CYS A 254 -0.461 1.499 3.765 1.00 0.00 H new ATOM 0 HB3 CYS A 254 -1.467 0.232 3.090 1.00 0.00 H new ATOM 0 HG CYS A 254 -2.666 -0.413 5.583 1.00 0.00 H new ATOM 175 N PRO A 255 1.599 0.712 5.850 1.00 0.00 N ATOM 176 CA PRO A 255 2.130 1.078 7.156 1.00 0.00 C ATOM 177 C PRO A 255 1.205 2.068 7.854 1.00 0.00 C ATOM 178 O PRO A 255 1.557 2.668 8.867 1.00 0.00 O ATOM 179 CB PRO A 255 3.479 1.741 6.819 1.00 0.00 C ATOM 180 CG PRO A 255 3.535 1.847 5.323 1.00 0.00 C ATOM 181 CD PRO A 255 2.145 1.578 4.811 1.00 0.00 C ATOM 0 HA PRO A 255 2.228 0.228 7.831 1.00 0.00 H new ATOM 0 HB2 PRO A 255 3.555 2.725 7.281 1.00 0.00 H new ATOM 0 HB3 PRO A 255 4.310 1.146 7.198 1.00 0.00 H new ATOM 0 HG2 PRO A 255 3.873 2.838 5.019 1.00 0.00 H new ATOM 0 HG3 PRO A 255 4.244 1.128 4.912 1.00 0.00 H new ATOM 0 HD2 PRO A 255 1.567 2.495 4.700 1.00 0.00 H new ATOM 0 HD3 PRO A 255 2.157 1.089 3.837 1.00 0.00 H new ATOM 189 N ILE A 256 0.010 2.213 7.296 1.00 0.00 N ATOM 190 CA ILE A 256 -0.931 3.224 7.741 1.00 0.00 C ATOM 191 C ILE A 256 -1.933 2.653 8.748 1.00 0.00 C ATOM 192 O ILE A 256 -2.058 3.164 9.858 1.00 0.00 O ATOM 193 CB ILE A 256 -1.679 3.836 6.536 1.00 0.00 C ATOM 194 CG1 ILE A 256 -0.667 4.218 5.448 1.00 0.00 C ATOM 195 CG2 ILE A 256 -2.482 5.056 6.971 1.00 0.00 C ATOM 196 CD1 ILE A 256 -1.293 4.608 4.127 1.00 0.00 C ATOM 0 H ILE A 256 -0.330 1.635 6.527 1.00 0.00 H new ATOM 0 HA ILE A 256 -0.361 4.007 8.240 1.00 0.00 H new ATOM 0 HB ILE A 256 -2.375 3.099 6.134 1.00 0.00 H new ATOM 0 HG12 ILE A 256 -0.059 5.048 5.808 1.00 0.00 H new ATOM 0 HG13 ILE A 256 0.007 3.377 5.284 1.00 0.00 H new ATOM 0 HG21 ILE A 256 -3.003 5.475 6.110 1.00 0.00 H new ATOM 0 HG22 ILE A 256 -3.210 4.762 7.727 1.00 0.00 H new ATOM 0 HG23 ILE A 256 -1.809 5.805 7.387 1.00 0.00 H new ATOM 0 HD11 ILE A 256 -0.509 4.863 3.414 1.00 0.00 H new ATOM 0 HD12 ILE A 256 -1.877 3.773 3.741 1.00 0.00 H new ATOM 0 HD13 ILE A 256 -1.945 5.469 4.273 1.00 0.00 H new ATOM 208 N SER A 257 -2.656 1.599 8.371 1.00 0.00 N ATOM 209 CA SER A 257 -3.650 1.022 9.277 1.00 0.00 C ATOM 210 C SER A 257 -3.853 -0.482 9.069 1.00 0.00 C ATOM 211 O SER A 257 -4.817 -1.045 9.583 1.00 0.00 O ATOM 212 CB SER A 257 -4.985 1.755 9.117 1.00 0.00 C ATOM 213 OG SER A 257 -4.841 3.137 9.404 1.00 0.00 O ATOM 0 H SER A 257 -2.576 1.135 7.466 1.00 0.00 H new ATOM 0 HA SER A 257 -3.267 1.150 10.289 1.00 0.00 H new ATOM 0 HB2 SER A 257 -5.355 1.627 8.100 1.00 0.00 H new ATOM 0 HB3 SER A 257 -5.728 1.316 9.784 1.00 0.00 H new ATOM 0 HG SER A 257 -5.705 3.586 9.294 1.00 0.00 H new ATOM 219 N LEU A 258 -2.929 -1.129 8.351 1.00 0.00 N ATOM 220 CA LEU A 258 -3.029 -2.567 8.058 1.00 0.00 C ATOM 221 C LEU A 258 -4.385 -2.893 7.432 1.00 0.00 C ATOM 222 O LEU A 258 -5.265 -3.472 8.071 1.00 0.00 O ATOM 223 CB LEU A 258 -2.820 -3.410 9.328 1.00 0.00 C ATOM 224 CG LEU A 258 -2.070 -4.737 9.134 1.00 0.00 C ATOM 225 CD1 LEU A 258 -1.877 -5.439 10.468 1.00 0.00 C ATOM 226 CD2 LEU A 258 -2.801 -5.652 8.159 1.00 0.00 C ATOM 0 H LEU A 258 -2.101 -0.680 7.960 1.00 0.00 H new ATOM 0 HA LEU A 258 -2.241 -2.817 7.348 1.00 0.00 H new ATOM 0 HB2 LEU A 258 -2.274 -2.809 10.055 1.00 0.00 H new ATOM 0 HB3 LEU A 258 -3.796 -3.626 9.762 1.00 0.00 H new ATOM 0 HG LEU A 258 -1.093 -4.506 8.711 1.00 0.00 H new ATOM 0 HD11 LEU A 258 -1.344 -6.377 10.312 1.00 0.00 H new ATOM 0 HD12 LEU A 258 -1.299 -4.800 11.135 1.00 0.00 H new ATOM 0 HD13 LEU A 258 -2.850 -5.644 10.915 1.00 0.00 H new ATOM 0 HD21 LEU A 258 -2.243 -6.582 8.045 1.00 0.00 H new ATOM 0 HD22 LEU A 258 -3.797 -5.871 8.543 1.00 0.00 H new ATOM 0 HD23 LEU A 258 -2.886 -5.158 7.191 1.00 0.00 H new ATOM 238 N GLU A 259 -4.545 -2.491 6.192 1.00 0.00 N ATOM 239 CA GLU A 259 -5.777 -2.726 5.453 1.00 0.00 C ATOM 240 C GLU A 259 -5.598 -3.837 4.427 1.00 0.00 C ATOM 241 O GLU A 259 -6.573 -4.439 3.986 1.00 0.00 O ATOM 242 CB GLU A 259 -6.233 -1.438 4.751 1.00 0.00 C ATOM 243 CG GLU A 259 -5.106 -0.464 4.408 1.00 0.00 C ATOM 244 CD GLU A 259 -3.981 -1.075 3.593 1.00 0.00 C ATOM 245 OE1 GLU A 259 -3.075 -1.704 4.200 1.00 0.00 O ATOM 246 OE2 GLU A 259 -3.975 -0.903 2.370 1.00 0.00 O ATOM 0 H GLU A 259 -3.830 -1.992 5.663 1.00 0.00 H new ATOM 0 HA GLU A 259 -6.541 -3.036 6.166 1.00 0.00 H new ATOM 0 HB2 GLU A 259 -6.755 -1.706 3.833 1.00 0.00 H new ATOM 0 HB3 GLU A 259 -6.954 -0.928 5.390 1.00 0.00 H new ATOM 0 HG2 GLU A 259 -5.524 0.377 3.856 1.00 0.00 H new ATOM 0 HG3 GLU A 259 -4.693 -0.064 5.334 1.00 0.00 H new ATOM 253 N LEU A 260 -4.340 -4.093 4.068 1.00 0.00 N ATOM 254 CA LEU A 260 -3.997 -5.006 2.985 1.00 0.00 C ATOM 255 C LEU A 260 -4.737 -4.576 1.724 1.00 0.00 C ATOM 256 O LEU A 260 -5.724 -5.194 1.314 1.00 0.00 O ATOM 257 CB LEU A 260 -4.319 -6.459 3.341 1.00 0.00 C ATOM 258 CG LEU A 260 -3.316 -7.514 2.852 1.00 0.00 C ATOM 259 CD1 LEU A 260 -3.038 -7.366 1.367 1.00 0.00 C ATOM 260 CD2 LEU A 260 -2.029 -7.437 3.655 1.00 0.00 C ATOM 0 H LEU A 260 -3.531 -3.671 4.523 1.00 0.00 H new ATOM 0 HA LEU A 260 -2.922 -4.959 2.814 1.00 0.00 H new ATOM 0 HB2 LEU A 260 -4.397 -6.537 4.425 1.00 0.00 H new ATOM 0 HB3 LEU A 260 -5.300 -6.703 2.932 1.00 0.00 H new ATOM 0 HG LEU A 260 -3.760 -8.497 3.006 1.00 0.00 H new ATOM 0 HD11 LEU A 260 -2.324 -8.128 1.053 1.00 0.00 H new ATOM 0 HD12 LEU A 260 -3.967 -7.487 0.809 1.00 0.00 H new ATOM 0 HD13 LEU A 260 -2.623 -6.377 1.171 1.00 0.00 H new ATOM 0 HD21 LEU A 260 -1.330 -8.192 3.295 1.00 0.00 H new ATOM 0 HD22 LEU A 260 -1.586 -6.448 3.539 1.00 0.00 H new ATOM 0 HD23 LEU A 260 -2.246 -7.616 4.708 1.00 0.00 H new ATOM 272 N MET A 261 -4.285 -3.448 1.195 1.00 0.00 N ATOM 273 CA MET A 261 -4.777 -2.855 -0.050 1.00 0.00 C ATOM 274 C MET A 261 -5.148 -3.872 -1.128 1.00 0.00 C ATOM 275 O MET A 261 -4.634 -4.987 -1.170 1.00 0.00 O ATOM 276 CB MET A 261 -3.701 -1.915 -0.585 1.00 0.00 C ATOM 277 CG MET A 261 -2.298 -2.450 -0.351 1.00 0.00 C ATOM 278 SD MET A 261 -1.015 -1.209 -0.555 1.00 0.00 S ATOM 279 CE MET A 261 0.329 -2.033 0.294 1.00 0.00 C ATOM 0 H MET A 261 -3.543 -2.900 1.630 1.00 0.00 H new ATOM 0 HA MET A 261 -5.701 -2.329 0.188 1.00 0.00 H new ATOM 0 HB2 MET A 261 -3.855 -1.761 -1.653 1.00 0.00 H new ATOM 0 HB3 MET A 261 -3.801 -0.942 -0.105 1.00 0.00 H new ATOM 0 HG2 MET A 261 -2.238 -2.861 0.657 1.00 0.00 H new ATOM 0 HG3 MET A 261 -2.111 -3.272 -1.042 1.00 0.00 H new ATOM 0 HE1 MET A 261 1.258 -1.491 0.117 1.00 0.00 H new ATOM 0 HE2 MET A 261 0.122 -2.059 1.364 1.00 0.00 H new ATOM 0 HE3 MET A 261 0.426 -3.052 -0.081 1.00 0.00 H new ATOM 289 N LYS A 262 -6.055 -3.458 -2.000 1.00 0.00 N ATOM 290 CA LYS A 262 -6.468 -4.274 -3.136 1.00 0.00 C ATOM 291 C LYS A 262 -6.058 -3.570 -4.426 1.00 0.00 C ATOM 292 O LYS A 262 -5.543 -4.188 -5.360 1.00 0.00 O ATOM 293 CB LYS A 262 -7.990 -4.513 -3.130 1.00 0.00 C ATOM 294 CG LYS A 262 -8.563 -4.876 -1.765 1.00 0.00 C ATOM 295 CD LYS A 262 -8.835 -3.630 -0.939 1.00 0.00 C ATOM 296 CE LYS A 262 -8.697 -3.896 0.550 1.00 0.00 C ATOM 297 NZ LYS A 262 -8.687 -2.630 1.330 1.00 0.00 N ATOM 0 H LYS A 262 -6.524 -2.554 -1.943 1.00 0.00 H new ATOM 0 HA LYS A 262 -5.979 -5.246 -3.066 1.00 0.00 H new ATOM 0 HB2 LYS A 262 -8.488 -3.614 -3.493 1.00 0.00 H new ATOM 0 HB3 LYS A 262 -8.223 -5.313 -3.833 1.00 0.00 H new ATOM 0 HG2 LYS A 262 -9.487 -5.440 -1.893 1.00 0.00 H new ATOM 0 HG3 LYS A 262 -7.865 -5.523 -1.234 1.00 0.00 H new ATOM 0 HD2 LYS A 262 -8.142 -2.841 -1.233 1.00 0.00 H new ATOM 0 HD3 LYS A 262 -9.840 -3.266 -1.151 1.00 0.00 H new ATOM 0 HE2 LYS A 262 -9.521 -4.526 0.886 1.00 0.00 H new ATOM 0 HE3 LYS A 262 -7.776 -4.448 0.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 262 -8.102 -2.751 2.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 262 -8.293 -1.865 0.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 262 -9.659 -2.387 1.609 1.00 0.00 H new ATOM 311 N ASP A 263 -6.287 -2.265 -4.455 1.00 0.00 N ATOM 312 CA ASP A 263 -5.837 -1.416 -5.548 1.00 0.00 C ATOM 313 C ASP A 263 -4.904 -0.356 -4.983 1.00 0.00 C ATOM 314 O ASP A 263 -5.344 0.606 -4.348 1.00 0.00 O ATOM 315 CB ASP A 263 -7.026 -0.750 -6.253 1.00 0.00 C ATOM 316 CG ASP A 263 -6.627 -0.018 -7.524 1.00 0.00 C ATOM 317 OD1 ASP A 263 -6.046 1.082 -7.438 1.00 0.00 O ATOM 318 OD2 ASP A 263 -6.896 -0.539 -8.626 1.00 0.00 O ATOM 0 H ASP A 263 -6.790 -1.765 -3.722 1.00 0.00 H new ATOM 0 HA ASP A 263 -5.314 -2.025 -6.285 1.00 0.00 H new ATOM 0 HB2 ASP A 263 -7.770 -1.509 -6.495 1.00 0.00 H new ATOM 0 HB3 ASP A 263 -7.500 -0.047 -5.568 1.00 0.00 H new ATOM 323 N PRO A 264 -3.596 -0.544 -5.165 1.00 0.00 N ATOM 324 CA PRO A 264 -2.585 0.337 -4.615 1.00 0.00 C ATOM 325 C PRO A 264 -2.087 1.377 -5.612 1.00 0.00 C ATOM 326 O PRO A 264 -2.073 1.148 -6.826 1.00 0.00 O ATOM 327 CB PRO A 264 -1.472 -0.647 -4.277 1.00 0.00 C ATOM 328 CG PRO A 264 -1.584 -1.726 -5.312 1.00 0.00 C ATOM 329 CD PRO A 264 -2.981 -1.661 -5.887 1.00 0.00 C ATOM 0 HA PRO A 264 -2.956 0.927 -3.777 1.00 0.00 H new ATOM 0 HB2 PRO A 264 -0.495 -0.166 -4.312 1.00 0.00 H new ATOM 0 HB3 PRO A 264 -1.593 -1.050 -3.271 1.00 0.00 H new ATOM 0 HG2 PRO A 264 -0.840 -1.584 -6.096 1.00 0.00 H new ATOM 0 HG3 PRO A 264 -1.397 -2.704 -4.868 1.00 0.00 H new ATOM 0 HD2 PRO A 264 -2.965 -1.484 -6.962 1.00 0.00 H new ATOM 0 HD3 PRO A 264 -3.525 -2.592 -5.726 1.00 0.00 H new ATOM 337 N VAL A 265 -1.669 2.513 -5.094 1.00 0.00 N ATOM 338 CA VAL A 265 -1.104 3.556 -5.921 1.00 0.00 C ATOM 339 C VAL A 265 0.330 3.843 -5.506 1.00 0.00 C ATOM 340 O VAL A 265 0.644 3.930 -4.315 1.00 0.00 O ATOM 341 CB VAL A 265 -1.938 4.859 -5.864 1.00 0.00 C ATOM 342 CG1 VAL A 265 -3.301 4.654 -6.509 1.00 0.00 C ATOM 343 CG2 VAL A 265 -2.101 5.346 -4.431 1.00 0.00 C ATOM 0 H VAL A 265 -1.711 2.737 -4.100 1.00 0.00 H new ATOM 0 HA VAL A 265 -1.120 3.195 -6.949 1.00 0.00 H new ATOM 0 HB VAL A 265 -1.398 5.623 -6.423 1.00 0.00 H new ATOM 0 HG11 VAL A 265 -3.871 5.582 -6.458 1.00 0.00 H new ATOM 0 HG12 VAL A 265 -3.170 4.365 -7.552 1.00 0.00 H new ATOM 0 HG13 VAL A 265 -3.840 3.868 -5.980 1.00 0.00 H new ATOM 0 HG21 VAL A 265 -2.691 6.262 -4.423 1.00 0.00 H new ATOM 0 HG22 VAL A 265 -2.609 4.582 -3.843 1.00 0.00 H new ATOM 0 HG23 VAL A 265 -1.119 5.543 -4.000 1.00 0.00 H new ATOM 353 N ILE A 266 1.201 3.951 -6.490 1.00 0.00 N ATOM 354 CA ILE A 266 2.572 4.340 -6.248 1.00 0.00 C ATOM 355 C ILE A 266 2.664 5.852 -6.240 1.00 0.00 C ATOM 356 O ILE A 266 1.974 6.530 -6.996 1.00 0.00 O ATOM 357 CB ILE A 266 3.546 3.744 -7.302 1.00 0.00 C ATOM 358 CG1 ILE A 266 4.352 2.603 -6.694 1.00 0.00 C ATOM 359 CG2 ILE A 266 4.485 4.794 -7.873 1.00 0.00 C ATOM 360 CD1 ILE A 266 5.435 2.079 -7.607 1.00 0.00 C ATOM 0 H ILE A 266 0.979 3.773 -7.470 1.00 0.00 H new ATOM 0 HA ILE A 266 2.873 3.942 -5.279 1.00 0.00 H new ATOM 0 HB ILE A 266 2.938 3.363 -8.123 1.00 0.00 H new ATOM 0 HG12 ILE A 266 4.806 2.944 -5.763 1.00 0.00 H new ATOM 0 HG13 ILE A 266 3.676 1.787 -6.439 1.00 0.00 H new ATOM 0 HG21 ILE A 266 5.147 4.331 -8.605 1.00 0.00 H new ATOM 0 HG22 ILE A 266 3.903 5.579 -8.356 1.00 0.00 H new ATOM 0 HG23 ILE A 266 5.080 5.226 -7.068 1.00 0.00 H new ATOM 0 HD11 ILE A 266 5.969 1.269 -7.111 1.00 0.00 H new ATOM 0 HD12 ILE A 266 4.986 1.707 -8.528 1.00 0.00 H new ATOM 0 HD13 ILE A 266 6.133 2.883 -7.842 1.00 0.00 H new ATOM 372 N VAL A 267 3.476 6.375 -5.354 1.00 0.00 N ATOM 373 CA VAL A 267 3.692 7.801 -5.281 1.00 0.00 C ATOM 374 C VAL A 267 5.186 8.052 -5.174 1.00 0.00 C ATOM 375 O VAL A 267 5.967 7.099 -5.066 1.00 0.00 O ATOM 376 CB VAL A 267 2.950 8.423 -4.065 1.00 0.00 C ATOM 377 CG1 VAL A 267 2.820 9.936 -4.193 1.00 0.00 C ATOM 378 CG2 VAL A 267 1.582 7.785 -3.881 1.00 0.00 C ATOM 0 H VAL A 267 4.001 5.831 -4.669 1.00 0.00 H new ATOM 0 HA VAL A 267 3.293 8.273 -6.179 1.00 0.00 H new ATOM 0 HB VAL A 267 3.553 8.218 -3.180 1.00 0.00 H new ATOM 0 HG11 VAL A 267 2.296 10.331 -3.323 1.00 0.00 H new ATOM 0 HG12 VAL A 267 3.812 10.383 -4.252 1.00 0.00 H new ATOM 0 HG13 VAL A 267 2.259 10.178 -5.096 1.00 0.00 H new ATOM 0 HG21 VAL A 267 1.082 8.237 -3.024 1.00 0.00 H new ATOM 0 HG22 VAL A 267 0.982 7.945 -4.777 1.00 0.00 H new ATOM 0 HG23 VAL A 267 1.700 6.715 -3.710 1.00 0.00 H new ATOM 388 N SER A 268 5.582 9.310 -5.202 1.00 0.00 N ATOM 389 CA SER A 268 6.979 9.676 -5.058 1.00 0.00 C ATOM 390 C SER A 268 7.521 9.182 -3.715 1.00 0.00 C ATOM 391 O SER A 268 6.751 8.946 -2.778 1.00 0.00 O ATOM 392 CB SER A 268 7.119 11.194 -5.164 1.00 0.00 C ATOM 393 OG SER A 268 6.361 11.691 -6.257 1.00 0.00 O ATOM 0 H SER A 268 4.951 10.102 -5.324 1.00 0.00 H new ATOM 0 HA SER A 268 7.558 9.207 -5.853 1.00 0.00 H new ATOM 0 HB2 SER A 268 6.782 11.661 -4.239 1.00 0.00 H new ATOM 0 HB3 SER A 268 8.168 11.460 -5.292 1.00 0.00 H new ATOM 0 HG SER A 268 6.146 12.635 -6.103 1.00 0.00 H new ATOM 399 N THR A 269 8.842 9.009 -3.649 1.00 0.00 N ATOM 400 CA THR A 269 9.527 8.423 -2.490 1.00 0.00 C ATOM 401 C THR A 269 9.465 6.900 -2.565 1.00 0.00 C ATOM 402 O THR A 269 9.967 6.189 -1.686 1.00 0.00 O ATOM 403 CB THR A 269 8.942 8.901 -1.142 1.00 0.00 C ATOM 404 OG1 THR A 269 8.682 10.301 -1.201 1.00 0.00 O ATOM 405 CG2 THR A 269 9.892 8.616 0.013 1.00 0.00 C ATOM 0 H THR A 269 9.475 9.273 -4.404 1.00 0.00 H new ATOM 0 HA THR A 269 10.562 8.761 -2.530 1.00 0.00 H new ATOM 0 HB THR A 269 8.016 8.353 -0.967 1.00 0.00 H new ATOM 0 HG1 THR A 269 9.075 10.740 -0.418 1.00 0.00 H new ATOM 0 HG21 THR A 269 9.447 8.966 0.945 1.00 0.00 H new ATOM 0 HG22 THR A 269 10.074 7.543 0.078 1.00 0.00 H new ATOM 0 HG23 THR A 269 10.836 9.135 -0.156 1.00 0.00 H new ATOM 413 N GLY A 270 8.828 6.401 -3.619 1.00 0.00 N ATOM 414 CA GLY A 270 8.784 4.974 -3.849 1.00 0.00 C ATOM 415 C GLY A 270 7.845 4.274 -2.898 1.00 0.00 C ATOM 416 O GLY A 270 8.194 3.261 -2.295 1.00 0.00 O ATOM 0 H GLY A 270 8.341 6.963 -4.318 1.00 0.00 H new ATOM 0 HA2 GLY A 270 8.470 4.782 -4.875 1.00 0.00 H new ATOM 0 HA3 GLY A 270 9.786 4.559 -3.740 1.00 0.00 H new ATOM 420 N GLN A 271 6.664 4.839 -2.719 1.00 0.00 N ATOM 421 CA GLN A 271 5.657 4.203 -1.889 1.00 0.00 C ATOM 422 C GLN A 271 4.536 3.609 -2.736 1.00 0.00 C ATOM 423 O GLN A 271 4.164 4.174 -3.761 1.00 0.00 O ATOM 424 CB GLN A 271 5.086 5.210 -0.894 1.00 0.00 C ATOM 425 CG GLN A 271 4.259 6.314 -1.529 1.00 0.00 C ATOM 426 CD GLN A 271 3.632 7.225 -0.498 1.00 0.00 C ATOM 427 OE1 GLN A 271 2.458 7.751 -0.805 1.00 0.00 O flip ATOM 428 NE2 GLN A 271 4.192 7.441 0.577 1.00 0.00 N flip ATOM 0 H GLN A 271 6.381 5.727 -3.132 1.00 0.00 H new ATOM 0 HA GLN A 271 6.134 3.389 -1.343 1.00 0.00 H new ATOM 0 HB2 GLN A 271 4.467 4.678 -0.171 1.00 0.00 H new ATOM 0 HB3 GLN A 271 5.908 5.661 -0.339 1.00 0.00 H new ATOM 0 HG2 GLN A 271 4.891 6.902 -2.194 1.00 0.00 H new ATOM 0 HG3 GLN A 271 3.476 5.871 -2.144 1.00 0.00 H new ATOM 0 HE21 GLN A 271 5.098 7.016 0.775 1.00 0.00 H new ATOM 0 HE22 GLN A 271 3.750 8.045 1.270 1.00 0.00 H new ATOM 437 N THR A 272 4.022 2.459 -2.317 1.00 0.00 N ATOM 438 CA THR A 272 2.875 1.843 -2.972 1.00 0.00 C ATOM 439 C THR A 272 1.858 1.410 -1.919 1.00 0.00 C ATOM 440 O THR A 272 2.035 0.377 -1.278 1.00 0.00 O ATOM 441 CB THR A 272 3.297 0.611 -3.804 1.00 0.00 C ATOM 442 OG1 THR A 272 4.614 0.808 -4.333 1.00 0.00 O ATOM 443 CG2 THR A 272 2.322 0.375 -4.949 1.00 0.00 C ATOM 0 H THR A 272 4.384 1.932 -1.522 1.00 0.00 H new ATOM 0 HA THR A 272 2.434 2.579 -3.644 1.00 0.00 H new ATOM 0 HB THR A 272 3.291 -0.262 -3.151 1.00 0.00 H new ATOM 0 HG1 THR A 272 4.876 0.023 -4.858 1.00 0.00 H new ATOM 0 HG21 THR A 272 2.638 -0.497 -5.522 1.00 0.00 H new ATOM 0 HG22 THR A 272 1.324 0.203 -4.547 1.00 0.00 H new ATOM 0 HG23 THR A 272 2.306 1.250 -5.599 1.00 0.00 H new ATOM 451 N TYR A 273 0.814 2.213 -1.727 1.00 0.00 N ATOM 452 CA TYR A 273 -0.174 1.963 -0.677 1.00 0.00 C ATOM 453 C TYR A 273 -1.578 2.170 -1.234 1.00 0.00 C ATOM 454 O TYR A 273 -1.730 2.710 -2.330 1.00 0.00 O ATOM 455 CB TYR A 273 0.078 2.890 0.515 1.00 0.00 C ATOM 456 CG TYR A 273 1.488 2.773 1.033 1.00 0.00 C ATOM 457 CD1 TYR A 273 2.009 1.536 1.390 1.00 0.00 C ATOM 458 CD2 TYR A 273 2.310 3.883 1.131 1.00 0.00 C ATOM 459 CE1 TYR A 273 3.310 1.409 1.826 1.00 0.00 C ATOM 460 CE2 TYR A 273 3.611 3.765 1.576 1.00 0.00 C ATOM 461 CZ TYR A 273 4.106 2.528 1.919 1.00 0.00 C ATOM 462 OH TYR A 273 5.406 2.409 2.349 1.00 0.00 O ATOM 0 H TYR A 273 0.629 3.046 -2.286 1.00 0.00 H new ATOM 0 HA TYR A 273 -0.082 0.933 -0.333 1.00 0.00 H new ATOM 0 HB2 TYR A 273 -0.115 3.921 0.219 1.00 0.00 H new ATOM 0 HB3 TYR A 273 -0.623 2.651 1.315 1.00 0.00 H new ATOM 0 HD1 TYR A 273 1.383 0.658 1.325 1.00 0.00 H new ATOM 0 HD2 TYR A 273 1.928 4.855 0.855 1.00 0.00 H new ATOM 0 HE1 TYR A 273 3.702 0.439 2.093 1.00 0.00 H new ATOM 0 HE2 TYR A 273 4.238 4.641 1.655 1.00 0.00 H new ATOM 0 HH TYR A 273 5.754 1.528 2.097 1.00 0.00 H new ATOM 472 N GLU A 274 -2.599 1.745 -0.498 1.00 0.00 N ATOM 473 CA GLU A 274 -3.974 1.882 -0.966 1.00 0.00 C ATOM 474 C GLU A 274 -4.381 3.346 -1.031 1.00 0.00 C ATOM 475 O GLU A 274 -4.148 4.111 -0.099 1.00 0.00 O ATOM 476 CB GLU A 274 -4.944 1.110 -0.068 1.00 0.00 C ATOM 477 CG GLU A 274 -6.380 1.130 -0.575 1.00 0.00 C ATOM 478 CD GLU A 274 -7.264 0.115 0.118 1.00 0.00 C ATOM 479 OE1 GLU A 274 -7.284 -1.055 -0.318 1.00 0.00 O ATOM 480 OE2 GLU A 274 -7.955 0.483 1.088 1.00 0.00 O ATOM 0 H GLU A 274 -2.503 1.306 0.418 1.00 0.00 H new ATOM 0 HA GLU A 274 -4.022 1.459 -1.969 1.00 0.00 H new ATOM 0 HB2 GLU A 274 -4.609 0.076 0.013 1.00 0.00 H new ATOM 0 HB3 GLU A 274 -4.914 1.534 0.936 1.00 0.00 H new ATOM 0 HG2 GLU A 274 -6.797 2.127 -0.430 1.00 0.00 H new ATOM 0 HG3 GLU A 274 -6.384 0.936 -1.648 1.00 0.00 H new ATOM 487 N ARG A 275 -4.996 3.722 -2.143 1.00 0.00 N ATOM 488 CA ARG A 275 -5.434 5.095 -2.377 1.00 0.00 C ATOM 489 C ARG A 275 -6.269 5.631 -1.218 1.00 0.00 C ATOM 490 O ARG A 275 -6.079 6.764 -0.784 1.00 0.00 O ATOM 491 CB ARG A 275 -6.237 5.151 -3.684 1.00 0.00 C ATOM 492 CG ARG A 275 -7.081 6.407 -3.851 1.00 0.00 C ATOM 493 CD ARG A 275 -7.829 6.403 -5.177 1.00 0.00 C ATOM 494 NE ARG A 275 -6.916 6.416 -6.319 1.00 0.00 N ATOM 495 CZ ARG A 275 -7.012 5.588 -7.361 1.00 0.00 C ATOM 496 NH1 ARG A 275 -8.003 4.706 -7.426 1.00 0.00 N ATOM 497 NH2 ARG A 275 -6.132 5.657 -8.351 1.00 0.00 N ATOM 0 H ARG A 275 -5.207 3.085 -2.911 1.00 0.00 H new ATOM 0 HA ARG A 275 -4.551 5.729 -2.455 1.00 0.00 H new ATOM 0 HB2 ARG A 275 -5.546 5.078 -4.524 1.00 0.00 H new ATOM 0 HB3 ARG A 275 -6.890 4.280 -3.732 1.00 0.00 H new ATOM 0 HG2 ARG A 275 -7.794 6.480 -3.030 1.00 0.00 H new ATOM 0 HG3 ARG A 275 -6.441 7.287 -3.796 1.00 0.00 H new ATOM 0 HD2 ARG A 275 -8.466 5.520 -5.232 1.00 0.00 H new ATOM 0 HD3 ARG A 275 -8.484 7.272 -5.227 1.00 0.00 H new ATOM 0 HE ARG A 275 -6.159 7.100 -6.319 1.00 0.00 H new ATOM 0 HH11 ARG A 275 -8.694 4.660 -6.678 1.00 0.00 H new ATOM 0 HH12 ARG A 275 -8.073 4.075 -8.224 1.00 0.00 H new ATOM 0 HH21 ARG A 275 -5.379 6.344 -8.317 1.00 0.00 H new ATOM 0 HH22 ARG A 275 -6.208 5.023 -9.146 1.00 0.00 H new ATOM 511 N SER A 276 -7.158 4.804 -0.695 1.00 0.00 N ATOM 512 CA SER A 276 -8.090 5.234 0.327 1.00 0.00 C ATOM 513 C SER A 276 -7.377 5.555 1.640 1.00 0.00 C ATOM 514 O SER A 276 -7.895 6.306 2.462 1.00 0.00 O ATOM 515 CB SER A 276 -9.147 4.148 0.543 1.00 0.00 C ATOM 516 OG SER A 276 -9.722 3.752 -0.695 1.00 0.00 O ATOM 0 H SER A 276 -7.252 3.825 -0.965 1.00 0.00 H new ATOM 0 HA SER A 276 -8.573 6.150 -0.012 1.00 0.00 H new ATOM 0 HB2 SER A 276 -8.694 3.285 1.032 1.00 0.00 H new ATOM 0 HB3 SER A 276 -9.926 4.519 1.209 1.00 0.00 H new ATOM 0 HG SER A 276 -10.394 3.056 -0.536 1.00 0.00 H new ATOM 522 N SER A 277 -6.189 4.994 1.831 1.00 0.00 N ATOM 523 CA SER A 277 -5.430 5.233 3.048 1.00 0.00 C ATOM 524 C SER A 277 -4.405 6.351 2.845 1.00 0.00 C ATOM 525 O SER A 277 -4.193 7.177 3.732 1.00 0.00 O ATOM 526 CB SER A 277 -4.760 3.937 3.527 1.00 0.00 C ATOM 527 OG SER A 277 -4.094 3.268 2.472 1.00 0.00 O ATOM 0 H SER A 277 -5.734 4.374 1.161 1.00 0.00 H new ATOM 0 HA SER A 277 -6.120 5.561 3.825 1.00 0.00 H new ATOM 0 HB2 SER A 277 -4.047 4.168 4.319 1.00 0.00 H new ATOM 0 HB3 SER A 277 -5.512 3.277 3.958 1.00 0.00 H new ATOM 0 HG SER A 277 -4.115 3.825 1.666 1.00 0.00 H new ATOM 533 N ILE A 278 -3.795 6.397 1.664 1.00 0.00 N ATOM 534 CA ILE A 278 -2.755 7.379 1.393 1.00 0.00 C ATOM 535 C ILE A 278 -3.337 8.709 0.920 1.00 0.00 C ATOM 536 O ILE A 278 -2.995 9.767 1.450 1.00 0.00 O ATOM 537 CB ILE A 278 -1.729 6.854 0.354 1.00 0.00 C ATOM 538 CG1 ILE A 278 -0.724 7.937 -0.003 1.00 0.00 C ATOM 539 CG2 ILE A 278 -2.416 6.361 -0.908 1.00 0.00 C ATOM 540 CD1 ILE A 278 0.034 8.455 1.184 1.00 0.00 C ATOM 0 H ILE A 278 -4.002 5.770 0.886 1.00 0.00 H new ATOM 0 HA ILE A 278 -2.238 7.548 2.338 1.00 0.00 H new ATOM 0 HB ILE A 278 -1.206 6.014 0.812 1.00 0.00 H new ATOM 0 HG12 ILE A 278 -0.017 7.542 -0.733 1.00 0.00 H new ATOM 0 HG13 ILE A 278 -1.247 8.765 -0.482 1.00 0.00 H new ATOM 0 HG21 ILE A 278 -1.667 6.001 -1.613 1.00 0.00 H new ATOM 0 HG22 ILE A 278 -3.098 5.549 -0.657 1.00 0.00 H new ATOM 0 HG23 ILE A 278 -2.976 7.179 -1.361 1.00 0.00 H new ATOM 0 HD11 ILE A 278 0.734 9.225 0.861 1.00 0.00 H new ATOM 0 HD12 ILE A 278 -0.665 8.880 1.905 1.00 0.00 H new ATOM 0 HD13 ILE A 278 0.584 7.637 1.650 1.00 0.00 H new ATOM 552 N GLN A 279 -4.237 8.659 -0.048 1.00 0.00 N ATOM 553 CA GLN A 279 -4.772 9.877 -0.639 1.00 0.00 C ATOM 554 C GLN A 279 -5.723 10.551 0.322 1.00 0.00 C ATOM 555 O GLN A 279 -6.039 11.724 0.182 1.00 0.00 O ATOM 556 CB GLN A 279 -5.457 9.589 -1.967 1.00 0.00 C ATOM 557 CG GLN A 279 -4.473 9.393 -3.101 1.00 0.00 C ATOM 558 CD GLN A 279 -5.109 9.576 -4.466 1.00 0.00 C ATOM 559 OE1 GLN A 279 -5.527 8.616 -5.104 1.00 0.00 O ATOM 560 NE2 GLN A 279 -5.206 10.819 -4.909 1.00 0.00 N ATOM 0 H GLN A 279 -4.611 7.795 -0.440 1.00 0.00 H new ATOM 0 HA GLN A 279 -3.941 10.554 -0.837 1.00 0.00 H new ATOM 0 HB2 GLN A 279 -6.073 8.695 -1.867 1.00 0.00 H new ATOM 0 HB3 GLN A 279 -6.128 10.413 -2.211 1.00 0.00 H new ATOM 0 HG2 GLN A 279 -3.651 10.100 -2.990 1.00 0.00 H new ATOM 0 HG3 GLN A 279 -4.044 8.393 -3.036 1.00 0.00 H new ATOM 0 HE21 GLN A 279 -4.845 11.590 -4.347 1.00 0.00 H new ATOM 0 HE22 GLN A 279 -5.641 11.006 -5.812 1.00 0.00 H new ATOM 569 N LYS A 280 -6.144 9.792 1.312 1.00 0.00 N ATOM 570 CA LYS A 280 -6.944 10.308 2.398 1.00 0.00 C ATOM 571 C LYS A 280 -6.215 11.452 3.108 1.00 0.00 C ATOM 572 O LYS A 280 -6.815 12.479 3.429 1.00 0.00 O ATOM 573 CB LYS A 280 -7.240 9.158 3.358 1.00 0.00 C ATOM 574 CG LYS A 280 -7.145 9.518 4.828 1.00 0.00 C ATOM 575 CD LYS A 280 -6.921 8.278 5.667 1.00 0.00 C ATOM 576 CE LYS A 280 -8.151 7.384 5.679 1.00 0.00 C ATOM 577 NZ LYS A 280 -8.001 6.240 6.615 1.00 0.00 N ATOM 0 H LYS A 280 -5.939 8.795 1.384 1.00 0.00 H new ATOM 0 HA LYS A 280 -7.881 10.715 2.017 1.00 0.00 H new ATOM 0 HB2 LYS A 280 -8.243 8.782 3.154 1.00 0.00 H new ATOM 0 HB3 LYS A 280 -6.546 8.343 3.152 1.00 0.00 H new ATOM 0 HG2 LYS A 280 -6.327 10.221 4.984 1.00 0.00 H new ATOM 0 HG3 LYS A 280 -8.060 10.018 5.145 1.00 0.00 H new ATOM 0 HD2 LYS A 280 -6.069 7.722 5.276 1.00 0.00 H new ATOM 0 HD3 LYS A 280 -6.671 8.568 6.687 1.00 0.00 H new ATOM 0 HE2 LYS A 280 -9.024 7.972 5.963 1.00 0.00 H new ATOM 0 HE3 LYS A 280 -8.335 7.007 4.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 280 -8.862 5.657 6.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 280 -7.184 5.663 6.330 1.00 0.00 H new ATOM 0 HZ3 LYS A 280 -7.852 6.598 7.580 1.00 0.00 H new ATOM 591 N TRP A 281 -4.918 11.277 3.350 1.00 0.00 N ATOM 592 CA TRP A 281 -4.152 12.304 4.031 1.00 0.00 C ATOM 593 C TRP A 281 -3.367 13.155 3.031 1.00 0.00 C ATOM 594 O TRP A 281 -3.123 14.337 3.275 1.00 0.00 O ATOM 595 CB TRP A 281 -3.254 11.687 5.121 1.00 0.00 C ATOM 596 CG TRP A 281 -1.826 11.424 4.746 1.00 0.00 C ATOM 597 CD1 TRP A 281 -0.869 12.341 4.423 1.00 0.00 C ATOM 598 CD2 TRP A 281 -1.181 10.152 4.724 1.00 0.00 C ATOM 599 NE1 TRP A 281 0.320 11.711 4.160 1.00 0.00 N ATOM 600 CE2 TRP A 281 0.155 10.367 4.347 1.00 0.00 C ATOM 601 CE3 TRP A 281 -1.610 8.848 4.974 1.00 0.00 C ATOM 602 CZ2 TRP A 281 1.065 9.329 4.220 1.00 0.00 C ATOM 603 CZ3 TRP A 281 -0.705 7.818 4.847 1.00 0.00 C ATOM 604 CH2 TRP A 281 0.619 8.065 4.473 1.00 0.00 C ATOM 0 H TRP A 281 -4.387 10.446 3.088 1.00 0.00 H new ATOM 0 HA TRP A 281 -4.844 12.977 4.538 1.00 0.00 H new ATOM 0 HB2 TRP A 281 -3.262 12.351 5.985 1.00 0.00 H new ATOM 0 HB3 TRP A 281 -3.702 10.745 5.438 1.00 0.00 H new ATOM 0 HD1 TRP A 281 -1.025 13.409 4.381 1.00 0.00 H new ATOM 0 HE1 TRP A 281 1.185 12.169 3.872 1.00 0.00 H new ATOM 0 HE3 TRP A 281 -2.632 8.650 5.262 1.00 0.00 H new ATOM 0 HZ2 TRP A 281 2.089 9.514 3.931 1.00 0.00 H new ATOM 0 HZ3 TRP A 281 -1.023 6.804 5.039 1.00 0.00 H new ATOM 0 HH2 TRP A 281 1.305 7.236 4.382 1.00 0.00 H new ATOM 615 N LEU A 282 -2.975 12.562 1.900 1.00 0.00 N ATOM 616 CA LEU A 282 -2.292 13.319 0.849 1.00 0.00 C ATOM 617 C LEU A 282 -3.176 14.444 0.332 1.00 0.00 C ATOM 618 O LEU A 282 -2.712 15.569 0.137 1.00 0.00 O ATOM 619 CB LEU A 282 -1.886 12.424 -0.322 1.00 0.00 C ATOM 620 CG LEU A 282 -0.627 11.585 -0.114 1.00 0.00 C ATOM 621 CD1 LEU A 282 -0.213 10.938 -1.426 1.00 0.00 C ATOM 622 CD2 LEU A 282 0.501 12.440 0.439 1.00 0.00 C ATOM 0 H LEU A 282 -3.116 11.574 1.691 1.00 0.00 H new ATOM 0 HA LEU A 282 -1.390 13.737 1.296 1.00 0.00 H new ATOM 0 HB2 LEU A 282 -2.715 11.752 -0.545 1.00 0.00 H new ATOM 0 HB3 LEU A 282 -1.740 13.052 -1.201 1.00 0.00 H new ATOM 0 HG LEU A 282 -0.844 10.801 0.611 1.00 0.00 H new ATOM 0 HD11 LEU A 282 0.686 10.341 -1.270 1.00 0.00 H new ATOM 0 HD12 LEU A 282 -1.017 10.296 -1.785 1.00 0.00 H new ATOM 0 HD13 LEU A 282 -0.010 11.713 -2.166 1.00 0.00 H new ATOM 0 HD21 LEU A 282 1.389 11.824 0.580 1.00 0.00 H new ATOM 0 HD22 LEU A 282 0.725 13.244 -0.262 1.00 0.00 H new ATOM 0 HD23 LEU A 282 0.199 12.866 1.396 1.00 0.00 H new ATOM 634 N ASP A 283 -4.452 14.137 0.125 1.00 0.00 N ATOM 635 CA ASP A 283 -5.412 15.130 -0.360 1.00 0.00 C ATOM 636 C ASP A 283 -5.654 16.204 0.690 1.00 0.00 C ATOM 637 O ASP A 283 -6.067 17.317 0.368 1.00 0.00 O ATOM 638 CB ASP A 283 -6.739 14.478 -0.748 1.00 0.00 C ATOM 639 CG ASP A 283 -7.069 14.672 -2.214 1.00 0.00 C ATOM 640 OD1 ASP A 283 -6.551 13.903 -3.047 1.00 0.00 O ATOM 641 OD2 ASP A 283 -7.850 15.594 -2.541 1.00 0.00 O ATOM 0 H ASP A 283 -4.848 13.211 0.284 1.00 0.00 H new ATOM 0 HA ASP A 283 -4.982 15.592 -1.249 1.00 0.00 H new ATOM 0 HB2 ASP A 283 -6.696 13.412 -0.526 1.00 0.00 H new ATOM 0 HB3 ASP A 283 -7.539 14.898 -0.139 1.00 0.00 H new ATOM 646 N ALA A 284 -5.385 15.864 1.946 1.00 0.00 N ATOM 647 CA ALA A 284 -5.502 16.820 3.039 1.00 0.00 C ATOM 648 C ALA A 284 -4.395 17.865 2.958 1.00 0.00 C ATOM 649 O ALA A 284 -4.522 18.960 3.502 1.00 0.00 O ATOM 650 CB ALA A 284 -5.464 16.101 4.378 1.00 0.00 C ATOM 0 H ALA A 284 -5.084 14.932 2.232 1.00 0.00 H new ATOM 0 HA ALA A 284 -6.460 17.331 2.950 1.00 0.00 H new ATOM 0 HB1 ALA A 284 -5.552 16.829 5.184 1.00 0.00 H new ATOM 0 HB2 ALA A 284 -6.292 15.394 4.435 1.00 0.00 H new ATOM 0 HB3 ALA A 284 -4.521 15.564 4.476 1.00 0.00 H new ATOM 656 N GLY A 285 -3.310 17.523 2.275 1.00 0.00 N ATOM 657 CA GLY A 285 -2.244 18.479 2.059 1.00 0.00 C ATOM 658 C GLY A 285 -0.989 18.169 2.848 1.00 0.00 C ATOM 659 O GLY A 285 -0.258 19.079 3.239 1.00 0.00 O ATOM 0 H GLY A 285 -3.150 16.602 1.868 1.00 0.00 H new ATOM 0 HA2 GLY A 285 -1.999 18.505 0.997 1.00 0.00 H new ATOM 0 HA3 GLY A 285 -2.598 19.474 2.329 1.00 0.00 H new ATOM 663 N HIS A 286 -0.727 16.894 3.086 1.00 0.00 N ATOM 664 CA HIS A 286 0.500 16.485 3.762 1.00 0.00 C ATOM 665 C HIS A 286 1.292 15.545 2.864 1.00 0.00 C ATOM 666 O HIS A 286 1.035 14.344 2.832 1.00 0.00 O ATOM 667 CB HIS A 286 0.198 15.792 5.100 1.00 0.00 C ATOM 668 CG HIS A 286 -0.561 16.640 6.073 1.00 0.00 C ATOM 669 ND1 HIS A 286 0.014 17.288 7.143 1.00 0.00 N ATOM 670 CD2 HIS A 286 -1.885 16.925 6.130 1.00 0.00 C ATOM 671 CE1 HIS A 286 -0.955 17.932 7.800 1.00 0.00 C ATOM 672 NE2 HIS A 286 -2.129 17.746 7.226 1.00 0.00 N ATOM 0 H HIS A 286 -1.343 16.125 2.823 1.00 0.00 H new ATOM 0 HA HIS A 286 1.087 17.380 3.969 1.00 0.00 H new ATOM 0 HB2 HIS A 286 -0.372 14.884 4.905 1.00 0.00 H new ATOM 0 HB3 HIS A 286 1.138 15.486 5.558 1.00 0.00 H new ATOM 0 HD2 HIS A 286 -2.632 16.571 5.435 1.00 0.00 H new ATOM 0 HE1 HIS A 286 -0.798 18.528 8.687 1.00 0.00 H new ATOM 0 HE2 HIS A 286 -3.028 18.125 7.524 1.00 0.00 H new ATOM 680 N LYS A 287 2.242 16.093 2.116 1.00 0.00 N ATOM 681 CA LYS A 287 3.013 15.286 1.176 1.00 0.00 C ATOM 682 C LYS A 287 4.191 14.612 1.875 1.00 0.00 C ATOM 683 O LYS A 287 5.330 15.062 1.792 1.00 0.00 O ATOM 684 CB LYS A 287 3.482 16.107 -0.046 1.00 0.00 C ATOM 685 CG LYS A 287 4.315 17.349 0.267 1.00 0.00 C ATOM 686 CD LYS A 287 3.452 18.546 0.638 1.00 0.00 C ATOM 687 CE LYS A 287 4.273 19.825 0.697 1.00 0.00 C ATOM 688 NZ LYS A 287 5.250 19.822 1.820 1.00 0.00 N ATOM 0 H LYS A 287 2.496 17.081 2.140 1.00 0.00 H new ATOM 0 HA LYS A 287 2.350 14.507 0.799 1.00 0.00 H new ATOM 0 HB2 LYS A 287 4.066 15.455 -0.695 1.00 0.00 H new ATOM 0 HB3 LYS A 287 2.603 16.415 -0.612 1.00 0.00 H new ATOM 0 HG2 LYS A 287 4.998 17.128 1.087 1.00 0.00 H new ATOM 0 HG3 LYS A 287 4.928 17.600 -0.599 1.00 0.00 H new ATOM 0 HD2 LYS A 287 2.651 18.659 -0.093 1.00 0.00 H new ATOM 0 HD3 LYS A 287 2.979 18.370 1.604 1.00 0.00 H new ATOM 0 HE2 LYS A 287 4.807 19.955 -0.245 1.00 0.00 H new ATOM 0 HE3 LYS A 287 3.603 20.678 0.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 287 5.785 20.714 1.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 287 4.742 19.726 2.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 287 5.907 19.024 1.706 1.00 0.00 H new ATOM 702 N THR A 288 3.898 13.533 2.581 1.00 0.00 N ATOM 703 CA THR A 288 4.907 12.781 3.312 1.00 0.00 C ATOM 704 C THR A 288 4.589 11.287 3.256 1.00 0.00 C ATOM 705 O THR A 288 3.424 10.908 3.191 1.00 0.00 O ATOM 706 CB THR A 288 4.961 13.236 4.784 1.00 0.00 C ATOM 707 OG1 THR A 288 3.629 13.382 5.287 1.00 0.00 O ATOM 708 CG2 THR A 288 5.718 14.548 4.933 1.00 0.00 C ATOM 0 H THR A 288 2.955 13.153 2.664 1.00 0.00 H new ATOM 0 HA THR A 288 5.875 12.966 2.847 1.00 0.00 H new ATOM 0 HB THR A 288 5.493 12.477 5.358 1.00 0.00 H new ATOM 0 HG1 THR A 288 3.497 12.775 6.045 1.00 0.00 H new ATOM 0 HG21 THR A 288 5.737 14.840 5.983 1.00 0.00 H new ATOM 0 HG22 THR A 288 6.739 14.422 4.573 1.00 0.00 H new ATOM 0 HG23 THR A 288 5.221 15.323 4.350 1.00 0.00 H new ATOM 716 N CYS A 289 5.618 10.438 3.252 1.00 0.00 N ATOM 717 CA CYS A 289 5.405 8.996 3.247 1.00 0.00 C ATOM 718 C CYS A 289 5.210 8.481 4.668 1.00 0.00 C ATOM 719 O CYS A 289 5.789 9.021 5.606 1.00 0.00 O ATOM 720 CB CYS A 289 6.595 8.284 2.597 1.00 0.00 C ATOM 721 SG CYS A 289 8.195 8.686 3.341 1.00 0.00 S ATOM 0 H CYS A 289 6.597 10.724 3.252 1.00 0.00 H new ATOM 0 HA CYS A 289 4.506 8.785 2.669 1.00 0.00 H new ATOM 0 HB2 CYS A 289 6.438 7.207 2.659 1.00 0.00 H new ATOM 0 HB3 CYS A 289 6.624 8.541 1.538 1.00 0.00 H new ATOM 0 HG CYS A 289 9.105 7.884 2.873 1.00 0.00 H new ATOM 727 N PRO A 290 4.405 7.421 4.844 1.00 0.00 N ATOM 728 CA PRO A 290 4.163 6.818 6.161 1.00 0.00 C ATOM 729 C PRO A 290 5.384 6.062 6.675 1.00 0.00 C ATOM 730 O PRO A 290 5.388 5.537 7.787 1.00 0.00 O ATOM 731 CB PRO A 290 3.010 5.847 5.903 1.00 0.00 C ATOM 732 CG PRO A 290 3.113 5.508 4.459 1.00 0.00 C ATOM 733 CD PRO A 290 3.654 6.735 3.778 1.00 0.00 C ATOM 0 HA PRO A 290 3.943 7.568 6.920 1.00 0.00 H new ATOM 0 HB2 PRO A 290 3.097 4.956 6.525 1.00 0.00 H new ATOM 0 HB3 PRO A 290 2.048 6.305 6.134 1.00 0.00 H new ATOM 0 HG2 PRO A 290 3.773 4.654 4.306 1.00 0.00 H new ATOM 0 HG3 PRO A 290 2.139 5.235 4.053 1.00 0.00 H new ATOM 0 HD2 PRO A 290 4.298 6.476 2.937 1.00 0.00 H new ATOM 0 HD3 PRO A 290 2.853 7.361 3.385 1.00 0.00 H new ATOM 741 N LYS A 291 6.416 6.012 5.842 1.00 0.00 N ATOM 742 CA LYS A 291 7.641 5.300 6.167 1.00 0.00 C ATOM 743 C LYS A 291 8.518 6.125 7.104 1.00 0.00 C ATOM 744 O LYS A 291 8.819 5.702 8.222 1.00 0.00 O ATOM 745 CB LYS A 291 8.400 4.962 4.877 1.00 0.00 C ATOM 746 CG LYS A 291 7.553 4.187 3.878 1.00 0.00 C ATOM 747 CD LYS A 291 8.328 3.797 2.626 1.00 0.00 C ATOM 748 CE LYS A 291 8.680 4.999 1.758 1.00 0.00 C ATOM 749 NZ LYS A 291 9.273 4.578 0.453 1.00 0.00 N ATOM 0 H LYS A 291 6.426 6.462 4.927 1.00 0.00 H new ATOM 0 HA LYS A 291 7.382 4.374 6.681 1.00 0.00 H new ATOM 0 HB2 LYS A 291 8.747 5.885 4.413 1.00 0.00 H new ATOM 0 HB3 LYS A 291 9.286 4.378 5.125 1.00 0.00 H new ATOM 0 HG2 LYS A 291 7.167 3.287 4.356 1.00 0.00 H new ATOM 0 HG3 LYS A 291 6.691 4.791 3.593 1.00 0.00 H new ATOM 0 HD2 LYS A 291 9.244 3.282 2.916 1.00 0.00 H new ATOM 0 HD3 LYS A 291 7.737 3.092 2.042 1.00 0.00 H new ATOM 0 HE2 LYS A 291 7.784 5.593 1.577 1.00 0.00 H new ATOM 0 HE3 LYS A 291 9.385 5.639 2.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 291 9.422 5.415 -0.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 291 10.184 4.106 0.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 291 8.626 3.920 -0.026 1.00 0.00 H new ATOM 763 N SER A 292 8.919 7.304 6.648 1.00 0.00 N ATOM 764 CA SER A 292 9.770 8.177 7.446 1.00 0.00 C ATOM 765 C SER A 292 9.387 9.644 7.251 1.00 0.00 C ATOM 766 O SER A 292 10.119 10.542 7.663 1.00 0.00 O ATOM 767 CB SER A 292 11.238 7.962 7.069 1.00 0.00 C ATOM 768 OG SER A 292 11.580 6.585 7.114 1.00 0.00 O ATOM 0 H SER A 292 8.670 7.677 5.732 1.00 0.00 H new ATOM 0 HA SER A 292 9.628 7.926 8.497 1.00 0.00 H new ATOM 0 HB2 SER A 292 11.421 8.353 6.068 1.00 0.00 H new ATOM 0 HB3 SER A 292 11.878 8.521 7.751 1.00 0.00 H new ATOM 0 HG SER A 292 12.522 6.474 6.868 1.00 0.00 H new ATOM 774 N GLN A 293 8.226 9.874 6.626 1.00 0.00 N ATOM 775 CA GLN A 293 7.727 11.228 6.358 1.00 0.00 C ATOM 776 C GLN A 293 8.759 12.034 5.567 1.00 0.00 C ATOM 777 O GLN A 293 8.970 13.216 5.821 1.00 0.00 O ATOM 778 CB GLN A 293 7.389 11.942 7.676 1.00 0.00 C ATOM 779 CG GLN A 293 6.572 11.097 8.653 1.00 0.00 C ATOM 780 CD GLN A 293 5.065 11.154 8.442 1.00 0.00 C ATOM 781 OE1 GLN A 293 4.625 11.271 7.203 1.00 0.00 O flip ATOM 782 NE2 GLN A 293 4.296 11.062 9.397 1.00 0.00 N flip ATOM 0 H GLN A 293 7.610 9.132 6.294 1.00 0.00 H new ATOM 0 HA GLN A 293 6.819 11.149 5.760 1.00 0.00 H new ATOM 0 HB2 GLN A 293 8.317 12.243 8.162 1.00 0.00 H new ATOM 0 HB3 GLN A 293 6.836 12.854 7.451 1.00 0.00 H new ATOM 0 HG2 GLN A 293 6.897 10.060 8.574 1.00 0.00 H new ATOM 0 HG3 GLN A 293 6.795 11.424 9.669 1.00 0.00 H new ATOM 0 HE21 GLN A 293 4.666 10.973 10.343 1.00 0.00 H new ATOM 0 HE22 GLN A 293 3.288 11.075 9.243 1.00 0.00 H new ATOM 791 N GLU A 294 9.349 11.386 4.565 1.00 0.00 N ATOM 792 CA GLU A 294 10.466 11.951 3.803 1.00 0.00 C ATOM 793 C GLU A 294 10.035 13.036 2.817 1.00 0.00 C ATOM 794 O GLU A 294 10.861 13.536 2.057 1.00 0.00 O ATOM 795 CB GLU A 294 11.184 10.834 3.047 1.00 0.00 C ATOM 796 CG GLU A 294 11.825 9.800 3.955 1.00 0.00 C ATOM 797 CD GLU A 294 12.997 10.359 4.733 1.00 0.00 C ATOM 798 OE1 GLU A 294 12.775 11.144 5.674 1.00 0.00 O ATOM 799 OE2 GLU A 294 14.150 10.018 4.398 1.00 0.00 O ATOM 0 H GLU A 294 9.068 10.455 4.257 1.00 0.00 H new ATOM 0 HA GLU A 294 11.134 12.423 4.524 1.00 0.00 H new ATOM 0 HB2 GLU A 294 10.472 10.336 2.389 1.00 0.00 H new ATOM 0 HB3 GLU A 294 11.953 11.273 2.411 1.00 0.00 H new ATOM 0 HG2 GLU A 294 11.078 9.420 4.652 1.00 0.00 H new ATOM 0 HG3 GLU A 294 12.161 8.954 3.356 1.00 0.00 H new ATOM 806 N THR A 295 8.761 13.413 2.856 1.00 0.00 N ATOM 807 CA THR A 295 8.200 14.369 1.905 1.00 0.00 C ATOM 808 C THR A 295 8.144 13.778 0.498 1.00 0.00 C ATOM 809 O THR A 295 9.172 13.508 -0.123 1.00 0.00 O ATOM 810 CB THR A 295 8.999 15.688 1.871 1.00 0.00 C ATOM 811 OG1 THR A 295 9.034 16.270 3.183 1.00 0.00 O ATOM 812 CG2 THR A 295 8.382 16.674 0.890 1.00 0.00 C ATOM 0 H THR A 295 8.091 13.067 3.543 1.00 0.00 H new ATOM 0 HA THR A 295 7.188 14.587 2.247 1.00 0.00 H new ATOM 0 HB THR A 295 10.014 15.464 1.542 1.00 0.00 H new ATOM 0 HG1 THR A 295 9.544 17.106 3.156 1.00 0.00 H new ATOM 0 HG21 THR A 295 8.964 17.595 0.885 1.00 0.00 H new ATOM 0 HG22 THR A 295 8.381 16.240 -0.110 1.00 0.00 H new ATOM 0 HG23 THR A 295 7.358 16.894 1.191 1.00 0.00 H new ATOM 820 N LEU A 296 6.938 13.576 -0.002 1.00 0.00 N ATOM 821 CA LEU A 296 6.768 13.044 -1.341 1.00 0.00 C ATOM 822 C LEU A 296 6.888 14.177 -2.347 1.00 0.00 C ATOM 823 O LEU A 296 5.937 14.933 -2.555 1.00 0.00 O ATOM 824 CB LEU A 296 5.412 12.354 -1.498 1.00 0.00 C ATOM 825 CG LEU A 296 4.939 11.559 -0.283 1.00 0.00 C ATOM 826 CD1 LEU A 296 3.582 10.935 -0.548 1.00 0.00 C ATOM 827 CD2 LEU A 296 5.948 10.490 0.086 1.00 0.00 C ATOM 0 H LEU A 296 6.069 13.771 0.495 1.00 0.00 H new ATOM 0 HA LEU A 296 7.545 12.300 -1.519 1.00 0.00 H new ATOM 0 HB2 LEU A 296 4.663 13.111 -1.730 1.00 0.00 H new ATOM 0 HB3 LEU A 296 5.462 11.682 -2.354 1.00 0.00 H new ATOM 0 HG LEU A 296 4.846 12.248 0.557 1.00 0.00 H new ATOM 0 HD11 LEU A 296 3.262 10.373 0.329 1.00 0.00 H new ATOM 0 HD12 LEU A 296 2.856 11.720 -0.760 1.00 0.00 H new ATOM 0 HD13 LEU A 296 3.651 10.263 -1.404 1.00 0.00 H new ATOM 0 HD21 LEU A 296 5.590 9.936 0.954 1.00 0.00 H new ATOM 0 HD22 LEU A 296 6.077 9.806 -0.753 1.00 0.00 H new ATOM 0 HD23 LEU A 296 6.904 10.958 0.323 1.00 0.00 H new ATOM 839 N LEU A 297 8.072 14.315 -2.928 1.00 0.00 N ATOM 840 CA LEU A 297 8.336 15.374 -3.893 1.00 0.00 C ATOM 841 C LEU A 297 7.334 15.313 -5.039 1.00 0.00 C ATOM 842 O LEU A 297 7.291 14.321 -5.765 1.00 0.00 O ATOM 843 CB LEU A 297 9.763 15.255 -4.428 1.00 0.00 C ATOM 844 CG LEU A 297 10.197 16.377 -5.368 1.00 0.00 C ATOM 845 CD1 LEU A 297 10.152 17.717 -4.652 1.00 0.00 C ATOM 846 CD2 LEU A 297 11.591 16.112 -5.904 1.00 0.00 C ATOM 0 H LEU A 297 8.868 13.704 -2.747 1.00 0.00 H new ATOM 0 HA LEU A 297 8.228 16.336 -3.392 1.00 0.00 H new ATOM 0 HB2 LEU A 297 10.450 15.224 -3.582 1.00 0.00 H new ATOM 0 HB3 LEU A 297 9.860 14.304 -4.953 1.00 0.00 H new ATOM 0 HG LEU A 297 9.504 16.409 -6.208 1.00 0.00 H new ATOM 0 HD11 LEU A 297 10.464 18.506 -5.336 1.00 0.00 H new ATOM 0 HD12 LEU A 297 9.135 17.914 -4.311 1.00 0.00 H new ATOM 0 HD13 LEU A 297 10.824 17.694 -3.794 1.00 0.00 H new ATOM 0 HD21 LEU A 297 11.884 16.922 -6.572 1.00 0.00 H new ATOM 0 HD22 LEU A 297 12.295 16.054 -5.074 1.00 0.00 H new ATOM 0 HD23 LEU A 297 11.597 15.170 -6.452 1.00 0.00 H new ATOM 858 N HIS A 298 6.549 16.389 -5.178 1.00 0.00 N ATOM 859 CA HIS A 298 5.417 16.468 -6.115 1.00 0.00 C ATOM 860 C HIS A 298 4.566 15.193 -6.088 1.00 0.00 C ATOM 861 O HIS A 298 4.884 14.183 -6.715 1.00 0.00 O ATOM 862 CB HIS A 298 5.853 16.846 -7.553 1.00 0.00 C ATOM 863 CG HIS A 298 6.765 15.879 -8.255 1.00 0.00 C ATOM 864 ND1 HIS A 298 6.320 14.824 -9.022 1.00 0.00 N ATOM 865 CD2 HIS A 298 8.120 15.841 -8.320 1.00 0.00 C ATOM 866 CE1 HIS A 298 7.388 14.193 -9.517 1.00 0.00 C ATOM 867 NE2 HIS A 298 8.508 14.771 -9.122 1.00 0.00 N ATOM 0 H HIS A 298 6.683 17.242 -4.636 1.00 0.00 H new ATOM 0 HA HIS A 298 4.786 17.285 -5.766 1.00 0.00 H new ATOM 0 HB2 HIS A 298 4.956 16.970 -8.160 1.00 0.00 H new ATOM 0 HB3 HIS A 298 6.349 17.816 -7.515 1.00 0.00 H new ATOM 0 HD2 HIS A 298 8.790 16.530 -7.828 1.00 0.00 H new ATOM 0 HE1 HIS A 298 7.342 13.324 -10.157 1.00 0.00 H new ATOM 0 HE2 HIS A 298 9.461 14.491 -9.356 1.00 0.00 H new ATOM 875 N ALA A 299 3.458 15.251 -5.366 1.00 0.00 N ATOM 876 CA ALA A 299 2.629 14.075 -5.172 1.00 0.00 C ATOM 877 C ALA A 299 1.794 13.783 -6.413 1.00 0.00 C ATOM 878 O ALA A 299 0.711 14.341 -6.604 1.00 0.00 O ATOM 879 CB ALA A 299 1.739 14.246 -3.948 1.00 0.00 C ATOM 0 H ALA A 299 3.115 16.095 -4.908 1.00 0.00 H new ATOM 0 HA ALA A 299 3.285 13.221 -5.003 1.00 0.00 H new ATOM 0 HB1 ALA A 299 1.124 13.355 -3.818 1.00 0.00 H new ATOM 0 HB2 ALA A 299 2.360 14.391 -3.064 1.00 0.00 H new ATOM 0 HB3 ALA A 299 1.095 15.114 -4.085 1.00 0.00 H new ATOM 885 N GLY A 300 2.335 12.932 -7.272 1.00 0.00 N ATOM 886 CA GLY A 300 1.614 12.484 -8.439 1.00 0.00 C ATOM 887 C GLY A 300 1.302 11.010 -8.348 1.00 0.00 C ATOM 888 O GLY A 300 2.196 10.171 -8.465 1.00 0.00 O ATOM 0 H GLY A 300 3.272 12.541 -7.177 1.00 0.00 H new ATOM 0 HA2 GLY A 300 0.688 13.050 -8.538 1.00 0.00 H new ATOM 0 HA3 GLY A 300 2.205 12.680 -9.334 1.00 0.00 H new ATOM 892 N LEU A 301 0.036 10.699 -8.123 1.00 0.00 N ATOM 893 CA LEU A 301 -0.391 9.322 -7.920 1.00 0.00 C ATOM 894 C LEU A 301 -0.160 8.500 -9.185 1.00 0.00 C ATOM 895 O LEU A 301 -0.561 8.897 -10.283 1.00 0.00 O ATOM 896 CB LEU A 301 -1.874 9.257 -7.521 1.00 0.00 C ATOM 897 CG LEU A 301 -2.230 9.724 -6.099 1.00 0.00 C ATOM 898 CD1 LEU A 301 -1.491 8.902 -5.060 1.00 0.00 C ATOM 899 CD2 LEU A 301 -1.943 11.207 -5.912 1.00 0.00 C ATOM 0 H LEU A 301 -0.718 11.384 -8.076 1.00 0.00 H new ATOM 0 HA LEU A 301 0.205 8.904 -7.108 1.00 0.00 H new ATOM 0 HB2 LEU A 301 -2.443 9.859 -8.229 1.00 0.00 H new ATOM 0 HB3 LEU A 301 -2.212 8.227 -7.635 1.00 0.00 H new ATOM 0 HG LEU A 301 -3.301 9.572 -5.961 1.00 0.00 H new ATOM 0 HD11 LEU A 301 -1.759 9.251 -4.063 1.00 0.00 H new ATOM 0 HD12 LEU A 301 -1.766 7.852 -5.164 1.00 0.00 H new ATOM 0 HD13 LEU A 301 -0.416 9.012 -5.206 1.00 0.00 H new ATOM 0 HD21 LEU A 301 -2.206 11.503 -4.897 1.00 0.00 H new ATOM 0 HD22 LEU A 301 -0.883 11.397 -6.082 1.00 0.00 H new ATOM 0 HD23 LEU A 301 -2.534 11.784 -6.623 1.00 0.00 H new ATOM 911 N THR A 302 0.499 7.370 -9.019 1.00 0.00 N ATOM 912 CA THR A 302 0.854 6.500 -10.124 1.00 0.00 C ATOM 913 C THR A 302 0.570 5.036 -9.765 1.00 0.00 C ATOM 914 O THR A 302 1.396 4.376 -9.145 1.00 0.00 O ATOM 915 CB THR A 302 2.351 6.676 -10.464 1.00 0.00 C ATOM 916 OG1 THR A 302 2.609 8.039 -10.830 1.00 0.00 O ATOM 917 CG2 THR A 302 2.786 5.744 -11.584 1.00 0.00 C ATOM 0 H THR A 302 0.805 7.027 -8.108 1.00 0.00 H new ATOM 0 HA THR A 302 0.251 6.769 -10.991 1.00 0.00 H new ATOM 0 HB THR A 302 2.929 6.419 -9.577 1.00 0.00 H new ATOM 0 HG1 THR A 302 2.490 8.616 -10.047 1.00 0.00 H new ATOM 0 HG21 THR A 302 3.844 5.897 -11.794 1.00 0.00 H new ATOM 0 HG22 THR A 302 2.622 4.710 -11.281 1.00 0.00 H new ATOM 0 HG23 THR A 302 2.203 5.956 -12.481 1.00 0.00 H new ATOM 925 N PRO A 303 -0.616 4.518 -10.118 1.00 0.00 N ATOM 926 CA PRO A 303 -1.011 3.138 -9.787 1.00 0.00 C ATOM 927 C PRO A 303 -0.009 2.099 -10.297 1.00 0.00 C ATOM 928 O PRO A 303 0.227 1.987 -11.500 1.00 0.00 O ATOM 929 CB PRO A 303 -2.360 2.975 -10.495 1.00 0.00 C ATOM 930 CG PRO A 303 -2.876 4.363 -10.657 1.00 0.00 C ATOM 931 CD PRO A 303 -1.667 5.228 -10.866 1.00 0.00 C ATOM 0 HA PRO A 303 -1.056 2.978 -8.710 1.00 0.00 H new ATOM 0 HB2 PRO A 303 -2.243 2.482 -11.460 1.00 0.00 H new ATOM 0 HB3 PRO A 303 -3.045 2.365 -9.906 1.00 0.00 H new ATOM 0 HG2 PRO A 303 -3.556 4.430 -11.506 1.00 0.00 H new ATOM 0 HG3 PRO A 303 -3.434 4.678 -9.775 1.00 0.00 H new ATOM 0 HD2 PRO A 303 -1.416 5.322 -11.923 1.00 0.00 H new ATOM 0 HD3 PRO A 303 -1.822 6.237 -10.484 1.00 0.00 H new ATOM 939 N ASN A 304 0.595 1.347 -9.379 1.00 0.00 N ATOM 940 CA ASN A 304 1.554 0.323 -9.766 1.00 0.00 C ATOM 941 C ASN A 304 0.883 -1.049 -9.766 1.00 0.00 C ATOM 942 O ASN A 304 0.157 -1.389 -8.831 1.00 0.00 O ATOM 943 CB ASN A 304 2.756 0.290 -8.837 1.00 0.00 C ATOM 944 CG ASN A 304 3.887 -0.521 -9.439 1.00 0.00 C ATOM 945 OD1 ASN A 304 3.913 -1.739 -9.334 1.00 0.00 O ATOM 946 ND2 ASN A 304 4.829 0.152 -10.082 1.00 0.00 N ATOM 0 H ASN A 304 0.438 1.428 -8.374 1.00 0.00 H new ATOM 0 HA ASN A 304 1.905 0.570 -10.768 1.00 0.00 H new ATOM 0 HB2 ASN A 304 3.097 1.307 -8.642 1.00 0.00 H new ATOM 0 HB3 ASN A 304 2.467 -0.139 -7.878 1.00 0.00 H new ATOM 0 HD21 ASN A 304 5.610 -0.346 -10.510 1.00 0.00 H new ATOM 0 HD22 ASN A 304 4.774 1.168 -10.149 1.00 0.00 H new ATOM 953 N TYR A 305 1.136 -1.841 -10.798 1.00 0.00 N ATOM 954 CA TYR A 305 0.442 -3.115 -10.969 1.00 0.00 C ATOM 955 C TYR A 305 1.144 -4.294 -10.285 1.00 0.00 C ATOM 956 O TYR A 305 0.566 -5.378 -10.202 1.00 0.00 O ATOM 957 CB TYR A 305 0.243 -3.410 -12.458 1.00 0.00 C ATOM 958 CG TYR A 305 -0.764 -2.494 -13.121 1.00 0.00 C ATOM 959 CD1 TYR A 305 -0.388 -1.250 -13.613 1.00 0.00 C ATOM 960 CD2 TYR A 305 -2.095 -2.873 -13.242 1.00 0.00 C ATOM 961 CE1 TYR A 305 -1.311 -0.413 -14.210 1.00 0.00 C ATOM 962 CE2 TYR A 305 -3.023 -2.039 -13.836 1.00 0.00 C ATOM 963 CZ TYR A 305 -2.626 -0.811 -14.318 1.00 0.00 C ATOM 964 OH TYR A 305 -3.547 0.022 -14.906 1.00 0.00 O ATOM 0 H TYR A 305 1.814 -1.627 -11.529 1.00 0.00 H new ATOM 0 HA TYR A 305 -0.524 -3.007 -10.476 1.00 0.00 H new ATOM 0 HB2 TYR A 305 1.200 -3.318 -12.971 1.00 0.00 H new ATOM 0 HB3 TYR A 305 -0.083 -4.443 -12.576 1.00 0.00 H new ATOM 0 HD1 TYR A 305 0.641 -0.933 -13.527 1.00 0.00 H new ATOM 0 HD2 TYR A 305 -2.410 -3.835 -12.866 1.00 0.00 H new ATOM 0 HE1 TYR A 305 -1.003 0.550 -14.591 1.00 0.00 H new ATOM 0 HE2 TYR A 305 -4.054 -2.348 -13.922 1.00 0.00 H new ATOM 0 HH TYR A 305 -4.427 -0.409 -14.903 1.00 0.00 H new ATOM 974 N VAL A 306 2.366 -4.100 -9.782 1.00 0.00 N ATOM 975 CA VAL A 306 3.109 -5.209 -9.165 1.00 0.00 C ATOM 976 C VAL A 306 2.443 -5.650 -7.870 1.00 0.00 C ATOM 977 O VAL A 306 2.459 -6.825 -7.511 1.00 0.00 O ATOM 978 CB VAL A 306 4.593 -4.850 -8.859 1.00 0.00 C ATOM 979 CG1 VAL A 306 4.726 -3.972 -7.613 1.00 0.00 C ATOM 980 CG2 VAL A 306 5.424 -6.114 -8.702 1.00 0.00 C ATOM 0 H VAL A 306 2.857 -3.206 -9.787 1.00 0.00 H new ATOM 0 HA VAL A 306 3.097 -6.018 -9.896 1.00 0.00 H new ATOM 0 HB VAL A 306 4.969 -4.277 -9.706 1.00 0.00 H new ATOM 0 HG11 VAL A 306 5.778 -3.746 -7.438 1.00 0.00 H new ATOM 0 HG12 VAL A 306 4.176 -3.043 -7.762 1.00 0.00 H new ATOM 0 HG13 VAL A 306 4.320 -4.500 -6.751 1.00 0.00 H new ATOM 0 HG21 VAL A 306 6.459 -5.845 -8.489 1.00 0.00 H new ATOM 0 HG22 VAL A 306 5.027 -6.711 -7.881 1.00 0.00 H new ATOM 0 HG23 VAL A 306 5.383 -6.693 -9.624 1.00 0.00 H new ATOM 990 N LEU A 307 1.830 -4.701 -7.194 1.00 0.00 N ATOM 991 CA LEU A 307 1.336 -4.930 -5.856 1.00 0.00 C ATOM 992 C LEU A 307 -0.042 -5.573 -5.881 1.00 0.00 C ATOM 993 O LEU A 307 -0.303 -6.503 -5.125 1.00 0.00 O ATOM 994 CB LEU A 307 1.296 -3.608 -5.098 1.00 0.00 C ATOM 995 CG LEU A 307 1.485 -3.725 -3.593 1.00 0.00 C ATOM 996 CD1 LEU A 307 2.866 -4.274 -3.288 1.00 0.00 C ATOM 997 CD2 LEU A 307 1.289 -2.380 -2.928 1.00 0.00 C ATOM 0 H LEU A 307 1.662 -3.761 -7.552 1.00 0.00 H new ATOM 0 HA LEU A 307 2.010 -5.619 -5.347 1.00 0.00 H new ATOM 0 HB2 LEU A 307 2.071 -2.954 -5.497 1.00 0.00 H new ATOM 0 HB3 LEU A 307 0.339 -3.123 -5.293 1.00 0.00 H new ATOM 0 HG LEU A 307 0.738 -4.412 -3.196 1.00 0.00 H new ATOM 0 HD11 LEU A 307 2.995 -4.355 -2.209 1.00 0.00 H new ATOM 0 HD12 LEU A 307 2.974 -5.259 -3.742 1.00 0.00 H new ATOM 0 HD13 LEU A 307 3.622 -3.602 -3.694 1.00 0.00 H new ATOM 0 HD21 LEU A 307 1.428 -2.483 -1.852 1.00 0.00 H new ATOM 0 HD22 LEU A 307 2.016 -1.670 -3.322 1.00 0.00 H new ATOM 0 HD23 LEU A 307 0.281 -2.017 -3.131 1.00 0.00 H new ATOM 1009 N LYS A 308 -0.901 -5.089 -6.778 1.00 0.00 N ATOM 1010 CA LYS A 308 -2.285 -5.544 -6.872 1.00 0.00 C ATOM 1011 C LYS A 308 -2.381 -7.068 -6.913 1.00 0.00 C ATOM 1012 O LYS A 308 -3.148 -7.661 -6.167 1.00 0.00 O ATOM 1013 CB LYS A 308 -2.947 -4.944 -8.114 1.00 0.00 C ATOM 1014 CG LYS A 308 -4.365 -5.439 -8.357 1.00 0.00 C ATOM 1015 CD LYS A 308 -5.039 -4.664 -9.476 1.00 0.00 C ATOM 1016 CE LYS A 308 -5.244 -3.210 -9.088 1.00 0.00 C ATOM 1017 NZ LYS A 308 -5.903 -2.433 -10.166 1.00 0.00 N ATOM 0 H LYS A 308 -0.655 -4.371 -7.459 1.00 0.00 H new ATOM 0 HA LYS A 308 -2.808 -5.205 -5.978 1.00 0.00 H new ATOM 0 HB2 LYS A 308 -2.963 -3.859 -8.016 1.00 0.00 H new ATOM 0 HB3 LYS A 308 -2.337 -5.176 -8.987 1.00 0.00 H new ATOM 0 HG2 LYS A 308 -4.344 -6.499 -8.609 1.00 0.00 H new ATOM 0 HG3 LYS A 308 -4.948 -5.340 -7.441 1.00 0.00 H new ATOM 0 HD2 LYS A 308 -4.431 -4.720 -10.379 1.00 0.00 H new ATOM 0 HD3 LYS A 308 -6.001 -5.120 -9.710 1.00 0.00 H new ATOM 0 HE2 LYS A 308 -5.849 -3.159 -8.183 1.00 0.00 H new ATOM 0 HE3 LYS A 308 -4.280 -2.758 -8.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 308 -6.494 -1.687 -9.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 308 -5.179 -1.999 -10.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 308 -6.499 -3.067 -10.736 1.00 0.00 H new ATOM 1031 N SER A 309 -1.573 -7.698 -7.757 1.00 0.00 N ATOM 1032 CA SER A 309 -1.655 -9.143 -7.946 1.00 0.00 C ATOM 1033 C SER A 309 -1.173 -9.900 -6.706 1.00 0.00 C ATOM 1034 O SER A 309 -1.498 -11.071 -6.528 1.00 0.00 O ATOM 1035 CB SER A 309 -0.841 -9.564 -9.174 1.00 0.00 C ATOM 1036 OG SER A 309 -1.056 -10.930 -9.494 1.00 0.00 O ATOM 0 H SER A 309 -0.858 -7.236 -8.318 1.00 0.00 H new ATOM 0 HA SER A 309 -2.702 -9.399 -8.106 1.00 0.00 H new ATOM 0 HB2 SER A 309 -1.116 -8.942 -10.026 1.00 0.00 H new ATOM 0 HB3 SER A 309 0.219 -9.395 -8.985 1.00 0.00 H new ATOM 0 HG SER A 309 -0.525 -11.169 -10.282 1.00 0.00 H new ATOM 1042 N LEU A 310 -0.408 -9.232 -5.854 1.00 0.00 N ATOM 1043 CA LEU A 310 0.144 -9.868 -4.664 1.00 0.00 C ATOM 1044 C LEU A 310 -0.755 -9.630 -3.453 1.00 0.00 C ATOM 1045 O LEU A 310 -1.045 -10.547 -2.686 1.00 0.00 O ATOM 1046 CB LEU A 310 1.554 -9.337 -4.392 1.00 0.00 C ATOM 1047 CG LEU A 310 2.572 -9.592 -5.509 1.00 0.00 C ATOM 1048 CD1 LEU A 310 3.889 -8.897 -5.203 1.00 0.00 C ATOM 1049 CD2 LEU A 310 2.789 -11.087 -5.700 1.00 0.00 C ATOM 0 H LEU A 310 -0.155 -8.250 -5.964 1.00 0.00 H new ATOM 0 HA LEU A 310 0.197 -10.942 -4.841 1.00 0.00 H new ATOM 0 HB2 LEU A 310 1.493 -8.263 -4.215 1.00 0.00 H new ATOM 0 HB3 LEU A 310 1.925 -9.791 -3.473 1.00 0.00 H new ATOM 0 HG LEU A 310 2.175 -9.179 -6.436 1.00 0.00 H new ATOM 0 HD11 LEU A 310 4.598 -9.090 -6.008 1.00 0.00 H new ATOM 0 HD12 LEU A 310 3.722 -7.823 -5.116 1.00 0.00 H new ATOM 0 HD13 LEU A 310 4.292 -9.278 -4.265 1.00 0.00 H new ATOM 0 HD21 LEU A 310 3.515 -11.250 -6.497 1.00 0.00 H new ATOM 0 HD22 LEU A 310 3.164 -11.522 -4.773 1.00 0.00 H new ATOM 0 HD23 LEU A 310 1.844 -11.561 -5.967 1.00 0.00 H new ATOM 1061 N ILE A 311 -1.207 -8.398 -3.296 1.00 0.00 N ATOM 1062 CA ILE A 311 -2.048 -8.026 -2.165 1.00 0.00 C ATOM 1063 C ILE A 311 -3.454 -8.609 -2.297 1.00 0.00 C ATOM 1064 O ILE A 311 -4.071 -9.012 -1.307 1.00 0.00 O ATOM 1065 CB ILE A 311 -2.139 -6.492 -2.026 1.00 0.00 C ATOM 1066 CG1 ILE A 311 -2.600 -5.864 -3.345 1.00 0.00 C ATOM 1067 CG2 ILE A 311 -0.803 -5.917 -1.594 1.00 0.00 C ATOM 1068 CD1 ILE A 311 -2.559 -4.353 -3.357 1.00 0.00 C ATOM 0 H ILE A 311 -1.006 -7.633 -3.940 1.00 0.00 H new ATOM 0 HA ILE A 311 -1.582 -8.440 -1.271 1.00 0.00 H new ATOM 0 HB ILE A 311 -2.875 -6.255 -1.258 1.00 0.00 H new ATOM 0 HG12 ILE A 311 -1.972 -6.240 -4.153 1.00 0.00 H new ATOM 0 HG13 ILE A 311 -3.619 -6.191 -3.554 1.00 0.00 H new ATOM 0 HG21 ILE A 311 -0.886 -4.834 -1.501 1.00 0.00 H new ATOM 0 HG22 ILE A 311 -0.517 -6.343 -0.632 1.00 0.00 H new ATOM 0 HG23 ILE A 311 -0.044 -6.160 -2.338 1.00 0.00 H new ATOM 0 HD11 ILE A 311 -2.900 -3.987 -4.325 1.00 0.00 H new ATOM 0 HD12 ILE A 311 -3.209 -3.965 -2.573 1.00 0.00 H new ATOM 0 HD13 ILE A 311 -1.538 -4.015 -3.181 1.00 0.00 H new ATOM 1080 N ALA A 312 -3.939 -8.686 -3.530 1.00 0.00 N ATOM 1081 CA ALA A 312 -5.297 -9.137 -3.794 1.00 0.00 C ATOM 1082 C ALA A 312 -5.496 -10.596 -3.395 1.00 0.00 C ATOM 1083 O ALA A 312 -6.606 -11.006 -3.047 1.00 0.00 O ATOM 1084 CB ALA A 312 -5.636 -8.928 -5.262 1.00 0.00 C ATOM 0 H ALA A 312 -3.408 -8.440 -4.366 1.00 0.00 H new ATOM 0 HA ALA A 312 -5.976 -8.542 -3.183 1.00 0.00 H new ATOM 0 HB1 ALA A 312 -6.654 -9.268 -5.452 1.00 0.00 H new ATOM 0 HB2 ALA A 312 -5.555 -7.869 -5.507 1.00 0.00 H new ATOM 0 HB3 ALA A 312 -4.942 -9.497 -5.880 1.00 0.00 H new ATOM 1090 N LEU A 313 -4.423 -11.378 -3.420 1.00 0.00 N ATOM 1091 CA LEU A 313 -4.520 -12.791 -3.083 1.00 0.00 C ATOM 1092 C LEU A 313 -4.435 -13.007 -1.575 1.00 0.00 C ATOM 1093 O LEU A 313 -4.978 -13.981 -1.049 1.00 0.00 O ATOM 1094 CB LEU A 313 -3.448 -13.615 -3.821 1.00 0.00 C ATOM 1095 CG LEU A 313 -1.981 -13.208 -3.600 1.00 0.00 C ATOM 1096 CD1 LEU A 313 -1.438 -13.746 -2.281 1.00 0.00 C ATOM 1097 CD2 LEU A 313 -1.118 -13.684 -4.759 1.00 0.00 C ATOM 0 H LEU A 313 -3.486 -11.061 -3.667 1.00 0.00 H new ATOM 0 HA LEU A 313 -5.497 -13.142 -3.415 1.00 0.00 H new ATOM 0 HB2 LEU A 313 -3.559 -14.658 -3.525 1.00 0.00 H new ATOM 0 HB3 LEU A 313 -3.657 -13.563 -4.890 1.00 0.00 H new ATOM 0 HG LEU A 313 -1.946 -12.120 -3.553 1.00 0.00 H new ATOM 0 HD11 LEU A 313 -0.399 -13.437 -2.162 1.00 0.00 H new ATOM 0 HD12 LEU A 313 -2.031 -13.352 -1.456 1.00 0.00 H new ATOM 0 HD13 LEU A 313 -1.495 -14.835 -2.281 1.00 0.00 H new ATOM 0 HD21 LEU A 313 -0.083 -13.388 -4.587 1.00 0.00 H new ATOM 0 HD22 LEU A 313 -1.177 -14.770 -4.835 1.00 0.00 H new ATOM 0 HD23 LEU A 313 -1.475 -13.236 -5.686 1.00 0.00 H new ATOM 1109 N TRP A 314 -3.773 -12.092 -0.874 1.00 0.00 N ATOM 1110 CA TRP A 314 -3.575 -12.253 0.557 1.00 0.00 C ATOM 1111 C TRP A 314 -4.882 -11.991 1.296 1.00 0.00 C ATOM 1112 O TRP A 314 -5.328 -12.818 2.090 1.00 0.00 O ATOM 1113 CB TRP A 314 -2.473 -11.323 1.076 1.00 0.00 C ATOM 1114 CG TRP A 314 -1.838 -11.821 2.343 1.00 0.00 C ATOM 1115 CD1 TRP A 314 -0.619 -12.418 2.462 1.00 0.00 C ATOM 1116 CD2 TRP A 314 -2.397 -11.785 3.661 1.00 0.00 C ATOM 1117 NE1 TRP A 314 -0.380 -12.753 3.773 1.00 0.00 N ATOM 1118 CE2 TRP A 314 -1.459 -12.374 4.529 1.00 0.00 C ATOM 1119 CE3 TRP A 314 -3.597 -11.307 4.193 1.00 0.00 C ATOM 1120 CZ2 TRP A 314 -1.688 -12.503 5.895 1.00 0.00 C ATOM 1121 CZ3 TRP A 314 -3.824 -11.435 5.548 1.00 0.00 C ATOM 1122 CH2 TRP A 314 -2.874 -12.029 6.386 1.00 0.00 C ATOM 0 H TRP A 314 -3.370 -11.243 -1.270 1.00 0.00 H new ATOM 0 HA TRP A 314 -3.258 -13.279 0.743 1.00 0.00 H new ATOM 0 HB2 TRP A 314 -1.706 -11.214 0.309 1.00 0.00 H new ATOM 0 HB3 TRP A 314 -2.893 -10.332 1.251 1.00 0.00 H new ATOM 0 HD1 TRP A 314 0.061 -12.601 1.644 1.00 0.00 H new ATOM 0 HE1 TRP A 314 0.462 -13.209 4.126 1.00 0.00 H new ATOM 0 HE3 TRP A 314 -4.335 -10.845 3.554 1.00 0.00 H new ATOM 0 HZ2 TRP A 314 -0.956 -12.961 6.544 1.00 0.00 H new ATOM 0 HZ3 TRP A 314 -4.750 -11.071 5.968 1.00 0.00 H new ATOM 0 HH2 TRP A 314 -3.081 -12.115 7.442 1.00 0.00 H new ATOM 1133 N CYS A 315 -5.506 -10.852 1.015 1.00 0.00 N ATOM 1134 CA CYS A 315 -6.783 -10.516 1.637 1.00 0.00 C ATOM 1135 C CYS A 315 -7.848 -11.536 1.250 1.00 0.00 C ATOM 1136 O CYS A 315 -8.738 -11.850 2.039 1.00 0.00 O ATOM 1137 CB CYS A 315 -7.213 -9.096 1.249 1.00 0.00 C ATOM 1138 SG CYS A 315 -8.951 -8.715 1.575 1.00 0.00 S ATOM 0 H CYS A 315 -5.152 -10.150 0.365 1.00 0.00 H new ATOM 0 HA CYS A 315 -6.662 -10.547 2.720 1.00 0.00 H new ATOM 0 HB2 CYS A 315 -6.591 -8.383 1.790 1.00 0.00 H new ATOM 0 HB3 CYS A 315 -7.016 -8.949 0.187 1.00 0.00 H new ATOM 0 HG CYS A 315 -9.220 -8.950 2.825 1.00 0.00 H new ATOM 1144 N GLU A 316 -7.722 -12.084 0.046 1.00 0.00 N ATOM 1145 CA GLU A 316 -8.640 -13.107 -0.439 1.00 0.00 C ATOM 1146 C GLU A 316 -8.549 -14.365 0.426 1.00 0.00 C ATOM 1147 O GLU A 316 -9.506 -15.135 0.536 1.00 0.00 O ATOM 1148 CB GLU A 316 -8.309 -13.450 -1.894 1.00 0.00 C ATOM 1149 CG GLU A 316 -9.372 -14.280 -2.593 1.00 0.00 C ATOM 1150 CD GLU A 316 -10.652 -13.506 -2.820 1.00 0.00 C ATOM 1151 OE1 GLU A 316 -10.723 -12.754 -3.812 1.00 0.00 O ATOM 1152 OE2 GLU A 316 -11.594 -13.644 -2.011 1.00 0.00 O ATOM 0 H GLU A 316 -6.987 -11.834 -0.616 1.00 0.00 H new ATOM 0 HA GLU A 316 -9.657 -12.720 -0.381 1.00 0.00 H new ATOM 0 HB2 GLU A 316 -8.163 -12.524 -2.450 1.00 0.00 H new ATOM 0 HB3 GLU A 316 -7.364 -13.992 -1.922 1.00 0.00 H new ATOM 0 HG2 GLU A 316 -8.986 -14.627 -3.551 1.00 0.00 H new ATOM 0 HG3 GLU A 316 -9.588 -15.166 -1.996 1.00 0.00 H new ATOM 1159 N SER A 317 -7.404 -14.543 1.061 1.00 0.00 N ATOM 1160 CA SER A 317 -7.125 -15.736 1.839 1.00 0.00 C ATOM 1161 C SER A 317 -7.432 -15.534 3.325 1.00 0.00 C ATOM 1162 O SER A 317 -7.164 -16.415 4.143 1.00 0.00 O ATOM 1163 CB SER A 317 -5.656 -16.112 1.658 1.00 0.00 C ATOM 1164 OG SER A 317 -5.360 -16.364 0.293 1.00 0.00 O ATOM 0 H SER A 317 -6.642 -13.865 1.052 1.00 0.00 H new ATOM 0 HA SER A 317 -7.770 -16.538 1.481 1.00 0.00 H new ATOM 0 HB2 SER A 317 -5.022 -15.306 2.028 1.00 0.00 H new ATOM 0 HB3 SER A 317 -5.427 -16.996 2.253 1.00 0.00 H new ATOM 0 HG SER A 317 -5.291 -15.514 -0.189 1.00 0.00 H new ATOM 1170 N ASN A 318 -7.996 -14.384 3.679 1.00 0.00 N ATOM 1171 CA ASN A 318 -8.256 -14.081 5.083 1.00 0.00 C ATOM 1172 C ASN A 318 -9.474 -13.182 5.244 1.00 0.00 C ATOM 1173 O ASN A 318 -10.488 -13.584 5.815 1.00 0.00 O ATOM 1174 CB ASN A 318 -7.027 -13.416 5.719 1.00 0.00 C ATOM 1175 CG ASN A 318 -7.263 -13.004 7.162 1.00 0.00 C ATOM 1176 OD1 ASN A 318 -7.720 -11.894 7.433 1.00 0.00 O ATOM 1177 ND2 ASN A 318 -6.943 -13.887 8.092 1.00 0.00 N ATOM 0 H ASN A 318 -8.279 -13.655 3.024 1.00 0.00 H new ATOM 0 HA ASN A 318 -8.462 -15.022 5.593 1.00 0.00 H new ATOM 0 HB2 ASN A 318 -6.183 -14.105 5.676 1.00 0.00 H new ATOM 0 HB3 ASN A 318 -6.752 -12.538 5.135 1.00 0.00 H new ATOM 0 HD21 ASN A 318 -7.072 -13.659 9.078 1.00 0.00 H new ATOM 0 HD22 ASN A 318 -6.567 -14.796 7.824 1.00 0.00 H new ATOM 1184 N GLY A 319 -9.369 -11.975 4.725 1.00 0.00 N ATOM 1185 CA GLY A 319 -10.403 -10.986 4.912 1.00 0.00 C ATOM 1186 C GLY A 319 -9.803 -9.632 5.200 1.00 0.00 C ATOM 1187 O GLY A 319 -9.985 -8.696 4.421 1.00 0.00 O ATOM 0 H GLY A 319 -8.574 -11.658 4.169 1.00 0.00 H new ATOM 0 HA2 GLY A 319 -11.025 -10.931 4.019 1.00 0.00 H new ATOM 0 HA3 GLY A 319 -11.053 -11.284 5.735 1.00 0.00 H new ATOM 1191 N ILE A 320 -9.048 -9.561 6.307 1.00 0.00 N ATOM 1192 CA ILE A 320 -8.322 -8.356 6.734 1.00 0.00 C ATOM 1193 C ILE A 320 -9.224 -7.099 6.677 1.00 0.00 C ATOM 1194 O ILE A 320 -10.451 -7.222 6.686 1.00 0.00 O ATOM 1195 CB ILE A 320 -7.028 -8.196 5.880 1.00 0.00 C ATOM 1196 CG1 ILE A 320 -5.904 -7.519 6.678 1.00 0.00 C ATOM 1197 CG2 ILE A 320 -7.285 -7.462 4.577 1.00 0.00 C ATOM 1198 CD1 ILE A 320 -5.139 -8.483 7.553 1.00 0.00 C ATOM 0 H ILE A 320 -8.923 -10.351 6.940 1.00 0.00 H new ATOM 0 HA ILE A 320 -8.028 -8.469 7.778 1.00 0.00 H new ATOM 0 HB ILE A 320 -6.700 -9.203 5.624 1.00 0.00 H new ATOM 0 HG12 ILE A 320 -5.213 -7.038 5.986 1.00 0.00 H new ATOM 0 HG13 ILE A 320 -6.331 -6.732 7.300 1.00 0.00 H new ATOM 0 HG21 ILE A 320 -6.353 -7.376 4.018 1.00 0.00 H new ATOM 0 HG22 ILE A 320 -8.013 -8.016 3.985 1.00 0.00 H new ATOM 0 HG23 ILE A 320 -7.673 -6.466 4.791 1.00 0.00 H new ATOM 0 HD11 ILE A 320 -4.359 -7.945 8.091 1.00 0.00 H new ATOM 0 HD12 ILE A 320 -5.820 -8.945 8.268 1.00 0.00 H new ATOM 0 HD13 ILE A 320 -4.685 -9.256 6.933 1.00 0.00 H new ATOM 1210 N GLU A 321 -8.614 -5.906 6.691 1.00 0.00 N ATOM 1211 CA GLU A 321 -9.326 -4.644 6.494 1.00 0.00 C ATOM 1212 C GLU A 321 -10.377 -4.422 7.579 1.00 0.00 C ATOM 1213 O GLU A 321 -9.983 -4.090 8.721 1.00 0.00 O ATOM 1214 CB GLU A 321 -9.966 -4.620 5.101 1.00 0.00 C ATOM 1215 CG GLU A 321 -9.665 -3.362 4.303 1.00 0.00 C ATOM 1216 CD GLU A 321 -10.356 -2.132 4.851 1.00 0.00 C ATOM 1217 OE1 GLU A 321 -9.782 -1.462 5.728 1.00 0.00 O ATOM 1218 OE2 GLU A 321 -11.475 -1.826 4.387 1.00 0.00 O ATOM 1219 OXT GLU A 321 -11.584 -4.592 7.295 1.00 0.00 O ATOM 0 H GLU A 321 -7.611 -5.793 6.840 1.00 0.00 H new ATOM 0 HA GLU A 321 -8.607 -3.828 6.567 1.00 0.00 H new ATOM 0 HB2 GLU A 321 -9.619 -5.486 4.538 1.00 0.00 H new ATOM 0 HB3 GLU A 321 -11.046 -4.721 5.207 1.00 0.00 H new ATOM 0 HG2 GLU A 321 -8.588 -3.193 4.295 1.00 0.00 H new ATOM 0 HG3 GLU A 321 -9.972 -3.513 3.268 1.00 0.00 H new TER 1226 GLU A 321