USER MOD reduce.3.24.130724 H: found=0, std=0, add=609, rem=0, adj=27 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 165:sc= 0.354 USER MOD Set 1.2: A 293 GLN : amide:sc= 0.152 K(o=0.51,f=-0.98) USER MOD Set 2.1: A 254 CYS SG : rot 141:sc= -0.564 USER MOD Set 2.2: A 257 SER OG : rot 90:sc= 1.28 USER MOD Set 2.3: A 277 SER OG : rot 68:sc= 0.612 USER MOD Single : A 245 SER OG : rot 180:sc= 0 USER MOD Single : A 251 TYR OH : rot 150:sc= -0.0251 USER MOD Single : A 261 MET CE :methyl 178:sc= -0.791 (180deg=-0.801) USER MOD Single : A 262 LYS NZ :NH3+ 166:sc= 0.116 (180deg=-0.0475!) USER MOD Single : A 268 SER OG : rot 180:sc= 0 USER MOD Single : A 269 THR OG1 : rot -127:sc= -3.2! USER MOD Single : A 271 GLN :FLIP amide:sc= -5.3! C(o=-8.6!,f=-5.3!) USER MOD Single : A 272 THR OG1 : rot 180:sc= -0.0578 USER MOD Single : A 273 TYR OH : rot 44:sc= 1.22 USER MOD Single : A 276 SER OG : rot 79:sc= 0.708 USER MOD Single : A 279 GLN : amide:sc= -2.79 K(o=-2.8,f=-5.9!) USER MOD Single : A 280 LYS NZ :NH3+ 167:sc= -0.0283 (180deg=-0.193) USER MOD Single : A 286 HIS : no HD1:sc= -0.4 X(o=-0.4,f=-0.00046) USER MOD Single : A 287 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 289 CYS SG : rot -154:sc= 1.74 USER MOD Single : A 291 LYS NZ :NH3+ 169:sc= 0.835 (180deg=0.748) USER MOD Single : A 292 SER OG : rot 129:sc= 0.826 USER MOD Single : A 295 THR OG1 : rot 180:sc= 0 USER MOD Single : A 298 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 302 THR OG1 : rot 180:sc= 0 USER MOD Single : A 304 ASN :FLIP amide:sc= -0.759 F(o=-2.1,f=-0.76) USER MOD Single : A 305 TYR OH : rot 180:sc= 0 USER MOD Single : A 308 LYS NZ :NH3+ 170:sc= 0.765 (180deg=0.624) USER MOD Single : A 309 SER OG : rot 180:sc= 0 USER MOD Single : A 315 CYS SG : rot -61:sc= -2.42! USER MOD Single : A 317 SER OG : rot 180:sc= 0 USER MOD Single : A 318 ASN :FLIP amide:sc= -0.0365 F(o=-1.3!,f=-0.037) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 244 0.552 -18.322 12.581 1.00 0.00 N ATOM 2 CA GLY A 244 1.170 -17.679 11.397 1.00 0.00 C ATOM 3 C GLY A 244 1.639 -16.274 11.701 1.00 0.00 C ATOM 4 O GLY A 244 0.856 -15.434 12.151 1.00 0.00 O ATOM 0 HA2 GLY A 244 2.015 -18.278 11.057 1.00 0.00 H new ATOM 0 HA3 GLY A 244 0.449 -17.653 10.580 1.00 0.00 H new ATOM 10 N SER A 245 2.919 -16.017 11.481 1.00 0.00 N ATOM 11 CA SER A 245 3.477 -14.692 11.696 1.00 0.00 C ATOM 12 C SER A 245 3.670 -13.981 10.357 1.00 0.00 C ATOM 13 O SER A 245 4.490 -14.399 9.539 1.00 0.00 O ATOM 14 CB SER A 245 4.808 -14.797 12.439 1.00 0.00 C ATOM 15 OG SER A 245 4.671 -15.586 13.612 1.00 0.00 O ATOM 0 H SER A 245 3.592 -16.710 11.153 1.00 0.00 H new ATOM 0 HA SER A 245 2.784 -14.110 12.304 1.00 0.00 H new ATOM 0 HB2 SER A 245 5.561 -15.237 11.785 1.00 0.00 H new ATOM 0 HB3 SER A 245 5.161 -13.800 12.705 1.00 0.00 H new ATOM 0 HG SER A 245 5.535 -15.642 14.071 1.00 0.00 H new ATOM 21 N PRO A 246 2.899 -12.918 10.106 1.00 0.00 N ATOM 22 CA PRO A 246 2.981 -12.167 8.855 1.00 0.00 C ATOM 23 C PRO A 246 4.257 -11.334 8.750 1.00 0.00 C ATOM 24 O PRO A 246 4.472 -10.400 9.530 1.00 0.00 O ATOM 25 CB PRO A 246 1.750 -11.262 8.898 1.00 0.00 C ATOM 26 CG PRO A 246 1.461 -11.085 10.348 1.00 0.00 C ATOM 27 CD PRO A 246 1.883 -12.364 11.020 1.00 0.00 C ATOM 0 HA PRO A 246 3.009 -12.829 7.989 1.00 0.00 H new ATOM 0 HB2 PRO A 246 1.945 -10.305 8.413 1.00 0.00 H new ATOM 0 HB3 PRO A 246 0.906 -11.716 8.379 1.00 0.00 H new ATOM 0 HG2 PRO A 246 2.008 -10.234 10.753 1.00 0.00 H new ATOM 0 HG3 PRO A 246 0.401 -10.890 10.513 1.00 0.00 H new ATOM 0 HD2 PRO A 246 2.295 -12.179 12.012 1.00 0.00 H new ATOM 0 HD3 PRO A 246 1.043 -13.047 11.146 1.00 0.00 H new ATOM 35 N GLU A 247 5.106 -11.696 7.799 1.00 0.00 N ATOM 36 CA GLU A 247 6.304 -10.924 7.503 1.00 0.00 C ATOM 37 C GLU A 247 5.913 -9.538 7.012 1.00 0.00 C ATOM 38 O GLU A 247 4.966 -9.398 6.235 1.00 0.00 O ATOM 39 CB GLU A 247 7.149 -11.641 6.445 1.00 0.00 C ATOM 40 CG GLU A 247 7.644 -13.010 6.887 1.00 0.00 C ATOM 41 CD GLU A 247 8.745 -12.936 7.926 1.00 0.00 C ATOM 42 OE1 GLU A 247 8.576 -12.227 8.941 1.00 0.00 O ATOM 43 OE2 GLU A 247 9.795 -13.587 7.730 1.00 0.00 O ATOM 0 H GLU A 247 4.986 -12.524 7.216 1.00 0.00 H new ATOM 0 HA GLU A 247 6.897 -10.826 8.412 1.00 0.00 H new ATOM 0 HB2 GLU A 247 6.559 -11.753 5.536 1.00 0.00 H new ATOM 0 HB3 GLU A 247 8.007 -11.017 6.193 1.00 0.00 H new ATOM 0 HG2 GLU A 247 6.807 -13.579 7.292 1.00 0.00 H new ATOM 0 HG3 GLU A 247 8.009 -13.556 6.017 1.00 0.00 H new ATOM 50 N PHE A 248 6.626 -8.517 7.463 1.00 0.00 N ATOM 51 CA PHE A 248 6.272 -7.152 7.110 1.00 0.00 C ATOM 52 C PHE A 248 7.413 -6.426 6.393 1.00 0.00 C ATOM 53 O PHE A 248 8.177 -5.683 7.009 1.00 0.00 O ATOM 54 CB PHE A 248 5.840 -6.377 8.358 1.00 0.00 C ATOM 55 CG PHE A 248 5.331 -4.995 8.061 1.00 0.00 C ATOM 56 CD1 PHE A 248 4.183 -4.815 7.306 1.00 0.00 C ATOM 57 CD2 PHE A 248 6.006 -3.879 8.526 1.00 0.00 C ATOM 58 CE1 PHE A 248 3.715 -3.547 7.027 1.00 0.00 C ATOM 59 CE2 PHE A 248 5.542 -2.611 8.250 1.00 0.00 C ATOM 60 CZ PHE A 248 4.397 -2.445 7.498 1.00 0.00 C ATOM 0 H PHE A 248 7.443 -8.606 8.067 1.00 0.00 H new ATOM 0 HA PHE A 248 5.436 -7.201 6.413 1.00 0.00 H new ATOM 0 HB2 PHE A 248 5.061 -6.939 8.873 1.00 0.00 H new ATOM 0 HB3 PHE A 248 6.686 -6.305 9.042 1.00 0.00 H new ATOM 0 HD1 PHE A 248 3.649 -5.676 6.932 1.00 0.00 H new ATOM 0 HD2 PHE A 248 6.905 -4.004 9.111 1.00 0.00 H new ATOM 0 HE1 PHE A 248 2.817 -3.418 6.441 1.00 0.00 H new ATOM 0 HE2 PHE A 248 6.074 -1.748 8.622 1.00 0.00 H new ATOM 0 HZ PHE A 248 4.035 -1.452 7.278 1.00 0.00 H new ATOM 70 N PRO A 249 7.580 -6.680 5.085 1.00 0.00 N ATOM 71 CA PRO A 249 8.468 -5.929 4.218 1.00 0.00 C ATOM 72 C PRO A 249 7.681 -5.011 3.282 1.00 0.00 C ATOM 73 O PRO A 249 8.028 -4.868 2.108 1.00 0.00 O ATOM 74 CB PRO A 249 9.120 -7.060 3.427 1.00 0.00 C ATOM 75 CG PRO A 249 8.047 -8.110 3.304 1.00 0.00 C ATOM 76 CD PRO A 249 6.978 -7.782 4.329 1.00 0.00 C ATOM 0 HA PRO A 249 9.162 -5.276 4.747 1.00 0.00 H new ATOM 0 HB2 PRO A 249 9.453 -6.717 2.447 1.00 0.00 H new ATOM 0 HB3 PRO A 249 9.998 -7.449 3.943 1.00 0.00 H new ATOM 0 HG2 PRO A 249 7.627 -8.115 2.298 1.00 0.00 H new ATOM 0 HG3 PRO A 249 8.459 -9.103 3.482 1.00 0.00 H new ATOM 0 HD2 PRO A 249 6.042 -7.484 3.856 1.00 0.00 H new ATOM 0 HD3 PRO A 249 6.755 -8.636 4.968 1.00 0.00 H new ATOM 84 N GLU A 250 6.626 -4.391 3.821 1.00 0.00 N ATOM 85 CA GLU A 250 5.646 -3.663 3.013 1.00 0.00 C ATOM 86 C GLU A 250 4.971 -4.672 2.074 1.00 0.00 C ATOM 87 O GLU A 250 4.676 -5.792 2.510 1.00 0.00 O ATOM 88 CB GLU A 250 6.319 -2.506 2.244 1.00 0.00 C ATOM 89 CG GLU A 250 5.360 -1.403 1.807 1.00 0.00 C ATOM 90 CD GLU A 250 6.074 -0.203 1.206 1.00 0.00 C ATOM 91 OE1 GLU A 250 6.487 -0.276 0.031 1.00 0.00 O ATOM 92 OE2 GLU A 250 6.221 0.826 1.905 1.00 0.00 O ATOM 0 H GLU A 250 6.429 -4.380 4.822 1.00 0.00 H new ATOM 0 HA GLU A 250 4.889 -3.202 3.648 1.00 0.00 H new ATOM 0 HB2 GLU A 250 7.094 -2.069 2.873 1.00 0.00 H new ATOM 0 HB3 GLU A 250 6.815 -2.911 1.362 1.00 0.00 H new ATOM 0 HG2 GLU A 250 4.659 -1.806 1.076 1.00 0.00 H new ATOM 0 HG3 GLU A 250 4.773 -1.078 2.666 1.00 0.00 H new ATOM 99 N TYR A 251 4.716 -4.290 0.818 1.00 0.00 N ATOM 100 CA TYR A 251 4.190 -5.214 -0.202 1.00 0.00 C ATOM 101 C TYR A 251 2.727 -5.580 0.077 1.00 0.00 C ATOM 102 O TYR A 251 1.823 -5.097 -0.592 1.00 0.00 O ATOM 103 CB TYR A 251 5.048 -6.488 -0.256 1.00 0.00 C ATOM 104 CG TYR A 251 5.257 -7.063 -1.640 1.00 0.00 C ATOM 105 CD1 TYR A 251 6.204 -6.520 -2.494 1.00 0.00 C ATOM 106 CD2 TYR A 251 4.534 -8.167 -2.077 1.00 0.00 C ATOM 107 CE1 TYR A 251 6.430 -7.057 -3.746 1.00 0.00 C ATOM 108 CE2 TYR A 251 4.749 -8.708 -3.329 1.00 0.00 C ATOM 109 CZ TYR A 251 5.699 -8.150 -4.160 1.00 0.00 C ATOM 110 OH TYR A 251 5.929 -8.694 -5.407 1.00 0.00 O ATOM 0 H TYR A 251 4.866 -3.340 0.478 1.00 0.00 H new ATOM 0 HA TYR A 251 4.234 -4.708 -1.166 1.00 0.00 H new ATOM 0 HB2 TYR A 251 6.023 -6.270 0.181 1.00 0.00 H new ATOM 0 HB3 TYR A 251 4.581 -7.249 0.370 1.00 0.00 H new ATOM 0 HD1 TYR A 251 6.776 -5.661 -2.174 1.00 0.00 H new ATOM 0 HD2 TYR A 251 3.793 -8.608 -1.427 1.00 0.00 H new ATOM 0 HE1 TYR A 251 7.175 -6.623 -4.397 1.00 0.00 H new ATOM 0 HE2 TYR A 251 4.177 -9.563 -3.656 1.00 0.00 H new ATOM 0 HH TYR A 251 5.738 -9.655 -5.385 1.00 0.00 H new ATOM 120 N PHE A 252 2.501 -6.418 1.086 1.00 0.00 N ATOM 121 CA PHE A 252 1.162 -6.937 1.366 1.00 0.00 C ATOM 122 C PHE A 252 0.475 -6.163 2.489 1.00 0.00 C ATOM 123 O PHE A 252 -0.426 -5.359 2.249 1.00 0.00 O ATOM 124 CB PHE A 252 1.217 -8.417 1.763 1.00 0.00 C ATOM 125 CG PHE A 252 1.765 -9.329 0.708 1.00 0.00 C ATOM 126 CD1 PHE A 252 1.069 -9.546 -0.469 1.00 0.00 C ATOM 127 CD2 PHE A 252 2.973 -9.977 0.899 1.00 0.00 C ATOM 128 CE1 PHE A 252 1.569 -10.397 -1.436 1.00 0.00 C ATOM 129 CE2 PHE A 252 3.478 -10.829 -0.063 1.00 0.00 C ATOM 130 CZ PHE A 252 2.775 -11.038 -1.234 1.00 0.00 C ATOM 0 H PHE A 252 3.225 -6.752 1.722 1.00 0.00 H new ATOM 0 HA PHE A 252 0.588 -6.818 0.447 1.00 0.00 H new ATOM 0 HB2 PHE A 252 1.826 -8.516 2.661 1.00 0.00 H new ATOM 0 HB3 PHE A 252 0.211 -8.747 2.022 1.00 0.00 H new ATOM 0 HD1 PHE A 252 0.126 -9.045 -0.633 1.00 0.00 H new ATOM 0 HD2 PHE A 252 3.527 -9.814 1.812 1.00 0.00 H new ATOM 0 HE1 PHE A 252 1.017 -10.561 -2.349 1.00 0.00 H new ATOM 0 HE2 PHE A 252 4.420 -11.331 0.099 1.00 0.00 H new ATOM 0 HZ PHE A 252 3.168 -11.702 -1.990 1.00 0.00 H new ATOM 140 N ARG A 253 0.907 -6.428 3.719 1.00 0.00 N ATOM 141 CA ARG A 253 0.246 -5.909 4.914 1.00 0.00 C ATOM 142 C ARG A 253 0.289 -4.387 4.934 1.00 0.00 C ATOM 143 O ARG A 253 1.365 -3.793 4.961 1.00 0.00 O ATOM 144 CB ARG A 253 0.925 -6.498 6.162 1.00 0.00 C ATOM 145 CG ARG A 253 0.201 -6.292 7.490 1.00 0.00 C ATOM 146 CD ARG A 253 0.288 -4.856 7.983 1.00 0.00 C ATOM 147 NE ARG A 253 -0.089 -4.719 9.391 1.00 0.00 N ATOM 148 CZ ARG A 253 0.789 -4.644 10.393 1.00 0.00 C ATOM 149 NH1 ARG A 253 2.091 -4.781 10.161 1.00 0.00 N ATOM 150 NH2 ARG A 253 0.364 -4.440 11.631 1.00 0.00 N ATOM 0 H ARG A 253 1.723 -7.007 3.916 1.00 0.00 H new ATOM 0 HA ARG A 253 -0.803 -6.206 4.906 1.00 0.00 H new ATOM 0 HB2 ARG A 253 1.055 -7.569 6.007 1.00 0.00 H new ATOM 0 HB3 ARG A 253 1.922 -6.064 6.245 1.00 0.00 H new ATOM 0 HG2 ARG A 253 -0.847 -6.571 7.376 1.00 0.00 H new ATOM 0 HG3 ARG A 253 0.628 -6.957 8.240 1.00 0.00 H new ATOM 0 HD2 ARG A 253 1.306 -4.490 7.846 1.00 0.00 H new ATOM 0 HD3 ARG A 253 -0.361 -4.227 7.374 1.00 0.00 H new ATOM 0 HE ARG A 253 -1.082 -4.678 9.620 1.00 0.00 H new ATOM 0 HH11 ARG A 253 2.425 -4.945 9.211 1.00 0.00 H new ATOM 0 HH12 ARG A 253 2.755 -4.722 10.933 1.00 0.00 H new ATOM 0 HH21 ARG A 253 -0.634 -4.340 11.818 1.00 0.00 H new ATOM 0 HH22 ARG A 253 1.035 -4.383 12.397 1.00 0.00 H new ATOM 164 N CYS A 254 -0.885 -3.768 4.914 1.00 0.00 N ATOM 165 CA CYS A 254 -0.977 -2.321 5.003 1.00 0.00 C ATOM 166 C CYS A 254 -0.451 -1.836 6.345 1.00 0.00 C ATOM 167 O CYS A 254 -0.981 -2.210 7.392 1.00 0.00 O ATOM 168 CB CYS A 254 -2.408 -1.848 4.843 1.00 0.00 C ATOM 169 SG CYS A 254 -2.589 -0.071 5.097 1.00 0.00 S ATOM 0 H CYS A 254 -1.783 -4.246 4.837 1.00 0.00 H new ATOM 0 HA CYS A 254 -0.373 -1.909 4.195 1.00 0.00 H new ATOM 0 HB2 CYS A 254 -2.762 -2.106 3.845 1.00 0.00 H new ATOM 0 HB3 CYS A 254 -3.043 -2.378 5.553 1.00 0.00 H new ATOM 0 HG CYS A 254 -3.442 0.405 4.239 1.00 0.00 H new ATOM 175 N PRO A 255 0.581 -0.985 6.334 1.00 0.00 N ATOM 176 CA PRO A 255 1.178 -0.439 7.557 1.00 0.00 C ATOM 177 C PRO A 255 0.230 0.510 8.285 1.00 0.00 C ATOM 178 O PRO A 255 0.459 0.881 9.435 1.00 0.00 O ATOM 179 CB PRO A 255 2.407 0.336 7.051 1.00 0.00 C ATOM 180 CG PRO A 255 2.605 -0.102 5.639 1.00 0.00 C ATOM 181 CD PRO A 255 1.248 -0.478 5.128 1.00 0.00 C ATOM 0 HA PRO A 255 1.418 -1.225 8.273 1.00 0.00 H new ATOM 0 HB2 PRO A 255 2.242 1.412 7.108 1.00 0.00 H new ATOM 0 HB3 PRO A 255 3.286 0.115 7.657 1.00 0.00 H new ATOM 0 HG2 PRO A 255 3.039 0.698 5.040 1.00 0.00 H new ATOM 0 HG3 PRO A 255 3.290 -0.948 5.586 1.00 0.00 H new ATOM 0 HD2 PRO A 255 0.723 0.378 4.704 1.00 0.00 H new ATOM 0 HD3 PRO A 255 1.305 -1.236 4.347 1.00 0.00 H new ATOM 189 N ILE A 256 -0.839 0.893 7.606 1.00 0.00 N ATOM 190 CA ILE A 256 -1.743 1.903 8.117 1.00 0.00 C ATOM 191 C ILE A 256 -2.948 1.286 8.832 1.00 0.00 C ATOM 192 O ILE A 256 -3.094 1.440 10.044 1.00 0.00 O ATOM 193 CB ILE A 256 -2.207 2.833 6.973 1.00 0.00 C ATOM 194 CG1 ILE A 256 -0.979 3.467 6.304 1.00 0.00 C ATOM 195 CG2 ILE A 256 -3.153 3.906 7.489 1.00 0.00 C ATOM 196 CD1 ILE A 256 -1.295 4.292 5.076 1.00 0.00 C ATOM 0 H ILE A 256 -1.100 0.516 6.695 1.00 0.00 H new ATOM 0 HA ILE A 256 -1.197 2.491 8.855 1.00 0.00 H new ATOM 0 HB ILE A 256 -2.753 2.242 6.237 1.00 0.00 H new ATOM 0 HG12 ILE A 256 -0.470 4.100 7.031 1.00 0.00 H new ATOM 0 HG13 ILE A 256 -0.282 2.676 6.026 1.00 0.00 H new ATOM 0 HG21 ILE A 256 -3.463 4.546 6.663 1.00 0.00 H new ATOM 0 HG22 ILE A 256 -4.030 3.435 7.932 1.00 0.00 H new ATOM 0 HG23 ILE A 256 -2.645 4.508 8.242 1.00 0.00 H new ATOM 0 HD11 ILE A 256 -0.372 4.703 4.666 1.00 0.00 H new ATOM 0 HD12 ILE A 256 -1.775 3.661 4.328 1.00 0.00 H new ATOM 0 HD13 ILE A 256 -1.966 5.107 5.348 1.00 0.00 H new ATOM 208 N SER A 257 -3.799 0.578 8.099 1.00 0.00 N ATOM 209 CA SER A 257 -5.041 0.080 8.683 1.00 0.00 C ATOM 210 C SER A 257 -5.242 -1.432 8.500 1.00 0.00 C ATOM 211 O SER A 257 -6.277 -1.967 8.905 1.00 0.00 O ATOM 212 CB SER A 257 -6.227 0.854 8.101 1.00 0.00 C ATOM 213 OG SER A 257 -5.882 1.470 6.871 1.00 0.00 O ATOM 0 H SER A 257 -3.658 0.338 7.118 1.00 0.00 H new ATOM 0 HA SER A 257 -4.976 0.245 9.759 1.00 0.00 H new ATOM 0 HB2 SER A 257 -7.067 0.177 7.949 1.00 0.00 H new ATOM 0 HB3 SER A 257 -6.554 1.613 8.812 1.00 0.00 H new ATOM 0 HG SER A 257 -6.066 0.852 6.133 1.00 0.00 H new ATOM 219 N LEU A 258 -4.251 -2.117 7.919 1.00 0.00 N ATOM 220 CA LEU A 258 -4.322 -3.570 7.701 1.00 0.00 C ATOM 221 C LEU A 258 -5.552 -3.949 6.872 1.00 0.00 C ATOM 222 O LEU A 258 -6.102 -5.040 7.014 1.00 0.00 O ATOM 223 CB LEU A 258 -4.359 -4.321 9.039 1.00 0.00 C ATOM 224 CG LEU A 258 -4.283 -5.847 8.941 1.00 0.00 C ATOM 225 CD1 LEU A 258 -3.025 -6.286 8.215 1.00 0.00 C ATOM 226 CD2 LEU A 258 -4.356 -6.477 10.320 1.00 0.00 C ATOM 0 H LEU A 258 -3.386 -1.688 7.589 1.00 0.00 H new ATOM 0 HA LEU A 258 -3.426 -3.858 7.151 1.00 0.00 H new ATOM 0 HB2 LEU A 258 -3.530 -3.972 9.654 1.00 0.00 H new ATOM 0 HB3 LEU A 258 -5.278 -4.053 9.561 1.00 0.00 H new ATOM 0 HG LEU A 258 -5.140 -6.190 8.362 1.00 0.00 H new ATOM 0 HD11 LEU A 258 -2.998 -7.374 8.160 1.00 0.00 H new ATOM 0 HD12 LEU A 258 -3.023 -5.872 7.207 1.00 0.00 H new ATOM 0 HD13 LEU A 258 -2.149 -5.928 8.756 1.00 0.00 H new ATOM 0 HD21 LEU A 258 -4.300 -7.562 10.228 1.00 0.00 H new ATOM 0 HD22 LEU A 258 -3.524 -6.121 10.927 1.00 0.00 H new ATOM 0 HD23 LEU A 258 -5.297 -6.201 10.797 1.00 0.00 H new ATOM 238 N GLU A 259 -5.987 -3.058 6.000 1.00 0.00 N ATOM 239 CA GLU A 259 -7.097 -3.372 5.113 1.00 0.00 C ATOM 240 C GLU A 259 -6.634 -4.373 4.068 1.00 0.00 C ATOM 241 O GLU A 259 -7.442 -5.038 3.424 1.00 0.00 O ATOM 242 CB GLU A 259 -7.636 -2.118 4.414 1.00 0.00 C ATOM 243 CG GLU A 259 -6.679 -1.507 3.394 1.00 0.00 C ATOM 244 CD GLU A 259 -5.544 -0.729 4.015 1.00 0.00 C ATOM 245 OE1 GLU A 259 -5.528 -0.558 5.252 1.00 0.00 O ATOM 246 OE2 GLU A 259 -4.648 -0.307 3.265 1.00 0.00 O ATOM 0 H GLU A 259 -5.596 -2.123 5.886 1.00 0.00 H new ATOM 0 HA GLU A 259 -7.903 -3.794 5.714 1.00 0.00 H new ATOM 0 HB2 GLU A 259 -8.571 -2.369 3.913 1.00 0.00 H new ATOM 0 HB3 GLU A 259 -7.871 -1.368 5.169 1.00 0.00 H new ATOM 0 HG2 GLU A 259 -6.266 -2.303 2.775 1.00 0.00 H new ATOM 0 HG3 GLU A 259 -7.240 -0.847 2.732 1.00 0.00 H new ATOM 253 N LEU A 260 -5.309 -4.467 3.938 1.00 0.00 N ATOM 254 CA LEU A 260 -4.671 -5.264 2.906 1.00 0.00 C ATOM 255 C LEU A 260 -5.288 -4.898 1.565 1.00 0.00 C ATOM 256 O LEU A 260 -6.062 -5.660 0.991 1.00 0.00 O ATOM 257 CB LEU A 260 -4.800 -6.763 3.196 1.00 0.00 C ATOM 258 CG LEU A 260 -3.656 -7.659 2.690 1.00 0.00 C ATOM 259 CD1 LEU A 260 -3.258 -7.322 1.260 1.00 0.00 C ATOM 260 CD2 LEU A 260 -2.462 -7.563 3.625 1.00 0.00 C ATOM 0 H LEU A 260 -4.651 -3.987 4.552 1.00 0.00 H new ATOM 0 HA LEU A 260 -3.603 -5.047 2.885 1.00 0.00 H new ATOM 0 HB2 LEU A 260 -4.887 -6.896 4.274 1.00 0.00 H new ATOM 0 HB3 LEU A 260 -5.732 -7.117 2.755 1.00 0.00 H new ATOM 0 HG LEU A 260 -4.016 -8.688 2.684 1.00 0.00 H new ATOM 0 HD11 LEU A 260 -2.447 -7.979 0.944 1.00 0.00 H new ATOM 0 HD12 LEU A 260 -4.115 -7.461 0.601 1.00 0.00 H new ATOM 0 HD13 LEU A 260 -2.926 -6.285 1.210 1.00 0.00 H new ATOM 0 HD21 LEU A 260 -1.659 -8.201 3.256 1.00 0.00 H new ATOM 0 HD22 LEU A 260 -2.115 -6.531 3.667 1.00 0.00 H new ATOM 0 HD23 LEU A 260 -2.755 -7.888 4.623 1.00 0.00 H new ATOM 272 N MET A 261 -4.971 -3.680 1.142 1.00 0.00 N ATOM 273 CA MET A 261 -5.398 -3.094 -0.130 1.00 0.00 C ATOM 274 C MET A 261 -5.624 -4.125 -1.236 1.00 0.00 C ATOM 275 O MET A 261 -4.912 -5.118 -1.341 1.00 0.00 O ATOM 276 CB MET A 261 -4.324 -2.104 -0.561 1.00 0.00 C ATOM 277 CG MET A 261 -2.928 -2.651 -0.335 1.00 0.00 C ATOM 278 SD MET A 261 -1.641 -1.406 -0.463 1.00 0.00 S ATOM 279 CE MET A 261 -0.265 -2.312 0.240 1.00 0.00 C ATOM 0 H MET A 261 -4.389 -3.048 1.692 1.00 0.00 H new ATOM 0 HA MET A 261 -6.363 -2.612 0.026 1.00 0.00 H new ATOM 0 HB2 MET A 261 -4.454 -1.864 -1.616 1.00 0.00 H new ATOM 0 HB3 MET A 261 -4.444 -1.174 -0.006 1.00 0.00 H new ATOM 0 HG2 MET A 261 -2.882 -3.110 0.653 1.00 0.00 H new ATOM 0 HG3 MET A 261 -2.733 -3.439 -1.062 1.00 0.00 H new ATOM 0 HE1 MET A 261 0.633 -1.695 0.206 1.00 0.00 H new ATOM 0 HE2 MET A 261 -0.489 -2.569 1.275 1.00 0.00 H new ATOM 0 HE3 MET A 261 -0.100 -3.225 -0.332 1.00 0.00 H new ATOM 289 N LYS A 262 -6.638 -3.881 -2.051 1.00 0.00 N ATOM 290 CA LYS A 262 -6.933 -4.746 -3.186 1.00 0.00 C ATOM 291 C LYS A 262 -6.610 -4.004 -4.473 1.00 0.00 C ATOM 292 O LYS A 262 -6.246 -4.598 -5.486 1.00 0.00 O ATOM 293 CB LYS A 262 -8.407 -5.187 -3.178 1.00 0.00 C ATOM 294 CG LYS A 262 -8.826 -5.937 -1.916 1.00 0.00 C ATOM 295 CD LYS A 262 -8.978 -5.000 -0.725 1.00 0.00 C ATOM 296 CE LYS A 262 -9.002 -5.757 0.590 1.00 0.00 C ATOM 297 NZ LYS A 262 -10.247 -6.545 0.766 1.00 0.00 N ATOM 0 H LYS A 262 -7.273 -3.089 -1.949 1.00 0.00 H new ATOM 0 HA LYS A 262 -6.319 -5.644 -3.115 1.00 0.00 H new ATOM 0 HB2 LYS A 262 -9.039 -4.306 -3.291 1.00 0.00 H new ATOM 0 HB3 LYS A 262 -8.589 -5.824 -4.044 1.00 0.00 H new ATOM 0 HG2 LYS A 262 -9.770 -6.452 -2.096 1.00 0.00 H new ATOM 0 HG3 LYS A 262 -8.084 -6.702 -1.685 1.00 0.00 H new ATOM 0 HD2 LYS A 262 -8.155 -4.285 -0.718 1.00 0.00 H new ATOM 0 HD3 LYS A 262 -9.898 -4.425 -0.830 1.00 0.00 H new ATOM 0 HE2 LYS A 262 -8.142 -6.425 0.637 1.00 0.00 H new ATOM 0 HE3 LYS A 262 -8.902 -5.051 1.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 262 -10.123 -7.220 1.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 262 -11.036 -5.904 0.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 262 -10.456 -7.064 -0.111 1.00 0.00 H new ATOM 311 N ASP A 263 -6.734 -2.689 -4.401 1.00 0.00 N ATOM 312 CA ASP A 263 -6.398 -1.809 -5.508 1.00 0.00 C ATOM 313 C ASP A 263 -5.581 -0.646 -4.954 1.00 0.00 C ATOM 314 O ASP A 263 -6.125 0.246 -4.309 1.00 0.00 O ATOM 315 CB ASP A 263 -7.678 -1.288 -6.175 1.00 0.00 C ATOM 316 CG ASP A 263 -7.534 -1.098 -7.673 1.00 0.00 C ATOM 317 OD1 ASP A 263 -6.709 -0.273 -8.111 1.00 0.00 O ATOM 318 OD2 ASP A 263 -8.250 -1.790 -8.432 1.00 0.00 O ATOM 0 H ASP A 263 -7.071 -2.201 -3.571 1.00 0.00 H new ATOM 0 HA ASP A 263 -5.822 -2.349 -6.259 1.00 0.00 H new ATOM 0 HB2 ASP A 263 -8.492 -1.986 -5.980 1.00 0.00 H new ATOM 0 HB3 ASP A 263 -7.957 -0.338 -5.720 1.00 0.00 H new ATOM 323 N PRO A 264 -4.258 -0.668 -5.150 1.00 0.00 N ATOM 324 CA PRO A 264 -3.356 0.328 -4.597 1.00 0.00 C ATOM 325 C PRO A 264 -2.986 1.429 -5.588 1.00 0.00 C ATOM 326 O PRO A 264 -3.193 1.296 -6.797 1.00 0.00 O ATOM 327 CB PRO A 264 -2.139 -0.524 -4.279 1.00 0.00 C ATOM 328 CG PRO A 264 -2.094 -1.533 -5.385 1.00 0.00 C ATOM 329 CD PRO A 264 -3.513 -1.685 -5.900 1.00 0.00 C ATOM 0 HA PRO A 264 -3.790 0.867 -3.755 1.00 0.00 H new ATOM 0 HB2 PRO A 264 -1.230 0.076 -4.251 1.00 0.00 H new ATOM 0 HB3 PRO A 264 -2.234 -1.005 -3.305 1.00 0.00 H new ATOM 0 HG2 PRO A 264 -1.427 -1.203 -6.182 1.00 0.00 H new ATOM 0 HG3 PRO A 264 -1.710 -2.487 -5.022 1.00 0.00 H new ATOM 0 HD2 PRO A 264 -3.571 -1.514 -6.975 1.00 0.00 H new ATOM 0 HD3 PRO A 264 -3.902 -2.686 -5.715 1.00 0.00 H new ATOM 337 N VAL A 265 -2.445 2.517 -5.062 1.00 0.00 N ATOM 338 CA VAL A 265 -1.959 3.611 -5.887 1.00 0.00 C ATOM 339 C VAL A 265 -0.572 4.045 -5.428 1.00 0.00 C ATOM 340 O VAL A 265 -0.301 4.166 -4.231 1.00 0.00 O ATOM 341 CB VAL A 265 -2.922 4.821 -5.877 1.00 0.00 C ATOM 342 CG1 VAL A 265 -4.171 4.527 -6.697 1.00 0.00 C ATOM 343 CG2 VAL A 265 -3.304 5.194 -4.454 1.00 0.00 C ATOM 0 H VAL A 265 -2.331 2.666 -4.059 1.00 0.00 H new ATOM 0 HA VAL A 265 -1.904 3.243 -6.911 1.00 0.00 H new ATOM 0 HB VAL A 265 -2.403 5.666 -6.330 1.00 0.00 H new ATOM 0 HG11 VAL A 265 -4.833 5.393 -6.675 1.00 0.00 H new ATOM 0 HG12 VAL A 265 -3.888 4.313 -7.728 1.00 0.00 H new ATOM 0 HG13 VAL A 265 -4.688 3.664 -6.276 1.00 0.00 H new ATOM 0 HG21 VAL A 265 -3.982 6.047 -4.471 1.00 0.00 H new ATOM 0 HG22 VAL A 265 -3.798 4.348 -3.976 1.00 0.00 H new ATOM 0 HG23 VAL A 265 -2.407 5.455 -3.893 1.00 0.00 H new ATOM 353 N ILE A 266 0.295 4.260 -6.393 1.00 0.00 N ATOM 354 CA ILE A 266 1.682 4.601 -6.141 1.00 0.00 C ATOM 355 C ILE A 266 1.898 6.112 -6.251 1.00 0.00 C ATOM 356 O ILE A 266 1.163 6.798 -6.946 1.00 0.00 O ATOM 357 CB ILE A 266 2.588 3.848 -7.155 1.00 0.00 C ATOM 358 CG1 ILE A 266 3.201 2.600 -6.526 1.00 0.00 C ATOM 359 CG2 ILE A 266 3.678 4.734 -7.724 1.00 0.00 C ATOM 360 CD1 ILE A 266 4.149 1.865 -7.450 1.00 0.00 C ATOM 0 H ILE A 266 0.057 4.203 -7.383 1.00 0.00 H new ATOM 0 HA ILE A 266 1.944 4.299 -5.127 1.00 0.00 H new ATOM 0 HB ILE A 266 1.943 3.547 -7.981 1.00 0.00 H new ATOM 0 HG12 ILE A 266 3.736 2.884 -5.620 1.00 0.00 H new ATOM 0 HG13 ILE A 266 2.401 1.923 -6.225 1.00 0.00 H new ATOM 0 HG21 ILE A 266 4.283 4.161 -8.427 1.00 0.00 H new ATOM 0 HG22 ILE A 266 3.226 5.581 -8.241 1.00 0.00 H new ATOM 0 HG23 ILE A 266 4.310 5.099 -6.914 1.00 0.00 H new ATOM 0 HD11 ILE A 266 4.548 0.989 -6.939 1.00 0.00 H new ATOM 0 HD12 ILE A 266 3.613 1.550 -8.346 1.00 0.00 H new ATOM 0 HD13 ILE A 266 4.969 2.526 -7.731 1.00 0.00 H new ATOM 372 N VAL A 267 2.881 6.624 -5.532 1.00 0.00 N ATOM 373 CA VAL A 267 3.355 7.989 -5.738 1.00 0.00 C ATOM 374 C VAL A 267 4.870 7.982 -5.736 1.00 0.00 C ATOM 375 O VAL A 267 5.485 6.923 -5.578 1.00 0.00 O ATOM 376 CB VAL A 267 2.848 9.004 -4.682 1.00 0.00 C ATOM 377 CG1 VAL A 267 1.332 9.025 -4.614 1.00 0.00 C ATOM 378 CG2 VAL A 267 3.440 8.722 -3.315 1.00 0.00 C ATOM 0 H VAL A 267 3.371 6.116 -4.796 1.00 0.00 H new ATOM 0 HA VAL A 267 2.951 8.320 -6.695 1.00 0.00 H new ATOM 0 HB VAL A 267 3.184 9.991 -4.999 1.00 0.00 H new ATOM 0 HG11 VAL A 267 1.011 9.748 -3.863 1.00 0.00 H new ATOM 0 HG12 VAL A 267 0.928 9.308 -5.586 1.00 0.00 H new ATOM 0 HG13 VAL A 267 0.966 8.034 -4.344 1.00 0.00 H new ATOM 0 HG21 VAL A 267 3.064 9.452 -2.598 1.00 0.00 H new ATOM 0 HG22 VAL A 267 3.156 7.719 -2.995 1.00 0.00 H new ATOM 0 HG23 VAL A 267 4.526 8.792 -3.368 1.00 0.00 H new ATOM 388 N SER A 268 5.469 9.147 -5.902 1.00 0.00 N ATOM 389 CA SER A 268 6.922 9.254 -5.894 1.00 0.00 C ATOM 390 C SER A 268 7.465 8.758 -4.549 1.00 0.00 C ATOM 391 O SER A 268 6.735 8.742 -3.554 1.00 0.00 O ATOM 392 CB SER A 268 7.357 10.704 -6.156 1.00 0.00 C ATOM 393 OG SER A 268 8.753 10.789 -6.408 1.00 0.00 O ATOM 0 H SER A 268 4.978 10.030 -6.043 1.00 0.00 H new ATOM 0 HA SER A 268 7.331 8.633 -6.691 1.00 0.00 H new ATOM 0 HB2 SER A 268 6.807 11.102 -7.009 1.00 0.00 H new ATOM 0 HB3 SER A 268 7.103 11.323 -5.296 1.00 0.00 H new ATOM 0 HG SER A 268 8.999 11.723 -6.573 1.00 0.00 H new ATOM 399 N THR A 269 8.732 8.331 -4.554 1.00 0.00 N ATOM 400 CA THR A 269 9.361 7.618 -3.431 1.00 0.00 C ATOM 401 C THR A 269 9.156 6.114 -3.600 1.00 0.00 C ATOM 402 O THR A 269 9.989 5.308 -3.187 1.00 0.00 O ATOM 403 CB THR A 269 8.841 8.071 -2.045 1.00 0.00 C ATOM 404 OG1 THR A 269 9.032 9.478 -1.893 1.00 0.00 O ATOM 405 CG2 THR A 269 9.546 7.345 -0.906 1.00 0.00 C ATOM 0 H THR A 269 9.359 8.471 -5.346 1.00 0.00 H new ATOM 0 HA THR A 269 10.423 7.864 -3.456 1.00 0.00 H new ATOM 0 HB THR A 269 7.780 7.825 -1.998 1.00 0.00 H new ATOM 0 HG1 THR A 269 9.514 9.654 -1.058 1.00 0.00 H new ATOM 0 HG21 THR A 269 9.150 7.694 0.048 1.00 0.00 H new ATOM 0 HG22 THR A 269 9.377 6.272 -0.999 1.00 0.00 H new ATOM 0 HG23 THR A 269 10.616 7.549 -0.951 1.00 0.00 H new ATOM 413 N GLY A 270 8.056 5.742 -4.244 1.00 0.00 N ATOM 414 CA GLY A 270 7.802 4.345 -4.524 1.00 0.00 C ATOM 415 C GLY A 270 6.926 3.681 -3.483 1.00 0.00 C ATOM 416 O GLY A 270 6.969 2.463 -3.315 1.00 0.00 O ATOM 0 H GLY A 270 7.337 6.384 -4.576 1.00 0.00 H new ATOM 0 HA2 GLY A 270 7.326 4.257 -5.501 1.00 0.00 H new ATOM 0 HA3 GLY A 270 8.752 3.814 -4.583 1.00 0.00 H new ATOM 420 N GLN A 271 6.144 4.476 -2.766 1.00 0.00 N ATOM 421 CA GLN A 271 5.207 3.920 -1.801 1.00 0.00 C ATOM 422 C GLN A 271 3.992 3.368 -2.521 1.00 0.00 C ATOM 423 O GLN A 271 3.636 3.836 -3.604 1.00 0.00 O ATOM 424 CB GLN A 271 4.794 4.975 -0.759 1.00 0.00 C ATOM 425 CG GLN A 271 3.899 6.100 -1.284 1.00 0.00 C ATOM 426 CD GLN A 271 2.427 5.708 -1.408 1.00 0.00 C ATOM 427 OE1 GLN A 271 1.704 6.335 -2.325 1.00 0.00 O flip ATOM 428 NE2 GLN A 271 1.942 4.857 -0.680 1.00 0.00 N flip ATOM 0 H GLN A 271 6.139 5.494 -2.832 1.00 0.00 H new ATOM 0 HA GLN A 271 5.699 3.107 -1.268 1.00 0.00 H new ATOM 0 HB2 GLN A 271 4.275 4.472 0.057 1.00 0.00 H new ATOM 0 HB3 GLN A 271 5.696 5.418 -0.338 1.00 0.00 H new ATOM 0 HG2 GLN A 271 3.982 6.959 -0.618 1.00 0.00 H new ATOM 0 HG3 GLN A 271 4.265 6.417 -2.261 1.00 0.00 H new ATOM 0 HE21 GLN A 271 2.523 4.391 0.017 1.00 0.00 H new ATOM 0 HE22 GLN A 271 0.956 4.612 -0.769 1.00 0.00 H new ATOM 437 N THR A 272 3.375 2.360 -1.936 1.00 0.00 N ATOM 438 CA THR A 272 2.178 1.783 -2.507 1.00 0.00 C ATOM 439 C THR A 272 1.224 1.322 -1.409 1.00 0.00 C ATOM 440 O THR A 272 1.423 0.267 -0.812 1.00 0.00 O ATOM 441 CB THR A 272 2.521 0.587 -3.410 1.00 0.00 C ATOM 442 OG1 THR A 272 3.788 0.798 -4.049 1.00 0.00 O ATOM 443 CG2 THR A 272 1.458 0.411 -4.472 1.00 0.00 C ATOM 0 H THR A 272 3.684 1.925 -1.066 1.00 0.00 H new ATOM 0 HA THR A 272 1.695 2.556 -3.105 1.00 0.00 H new ATOM 0 HB THR A 272 2.568 -0.308 -2.790 1.00 0.00 H new ATOM 0 HG1 THR A 272 3.998 0.030 -4.621 1.00 0.00 H new ATOM 0 HG21 THR A 272 1.713 -0.439 -5.105 1.00 0.00 H new ATOM 0 HG22 THR A 272 0.494 0.233 -3.996 1.00 0.00 H new ATOM 0 HG23 THR A 272 1.400 1.313 -5.082 1.00 0.00 H new ATOM 451 N TYR A 273 0.203 2.123 -1.132 1.00 0.00 N ATOM 452 CA TYR A 273 -0.791 1.774 -0.126 1.00 0.00 C ATOM 453 C TYR A 273 -2.196 1.918 -0.705 1.00 0.00 C ATOM 454 O TYR A 273 -2.359 2.320 -1.863 1.00 0.00 O ATOM 455 CB TYR A 273 -0.637 2.659 1.115 1.00 0.00 C ATOM 456 CG TYR A 273 0.757 2.624 1.701 1.00 0.00 C ATOM 457 CD1 TYR A 273 1.358 1.418 2.038 1.00 0.00 C ATOM 458 CD2 TYR A 273 1.480 3.791 1.898 1.00 0.00 C ATOM 459 CE1 TYR A 273 2.637 1.377 2.552 1.00 0.00 C ATOM 460 CE2 TYR A 273 2.759 3.759 2.414 1.00 0.00 C ATOM 461 CZ TYR A 273 3.334 2.549 2.736 1.00 0.00 C ATOM 462 OH TYR A 273 4.610 2.513 3.241 1.00 0.00 O ATOM 0 H TYR A 273 0.042 3.020 -1.591 1.00 0.00 H new ATOM 0 HA TYR A 273 -0.634 0.737 0.170 1.00 0.00 H new ATOM 0 HB2 TYR A 273 -0.889 3.687 0.854 1.00 0.00 H new ATOM 0 HB3 TYR A 273 -1.351 2.338 1.873 1.00 0.00 H new ATOM 0 HD1 TYR A 273 0.814 0.496 1.895 1.00 0.00 H new ATOM 0 HD2 TYR A 273 1.034 4.741 1.643 1.00 0.00 H new ATOM 0 HE1 TYR A 273 3.089 0.430 2.809 1.00 0.00 H new ATOM 0 HE2 TYR A 273 3.307 4.678 2.565 1.00 0.00 H new ATOM 0 HH TYR A 273 5.114 1.795 2.805 1.00 0.00 H new ATOM 472 N GLU A 274 -3.204 1.586 0.096 1.00 0.00 N ATOM 473 CA GLU A 274 -4.593 1.689 -0.327 1.00 0.00 C ATOM 474 C GLU A 274 -4.957 3.155 -0.544 1.00 0.00 C ATOM 475 O GLU A 274 -4.562 4.016 0.236 1.00 0.00 O ATOM 476 CB GLU A 274 -5.495 1.034 0.726 1.00 0.00 C ATOM 477 CG GLU A 274 -6.948 0.860 0.312 1.00 0.00 C ATOM 478 CD GLU A 274 -7.760 2.119 0.489 1.00 0.00 C ATOM 479 OE1 GLU A 274 -7.788 2.656 1.611 1.00 0.00 O ATOM 480 OE2 GLU A 274 -8.368 2.587 -0.499 1.00 0.00 O ATOM 0 H GLU A 274 -3.081 1.241 1.048 1.00 0.00 H new ATOM 0 HA GLU A 274 -4.737 1.165 -1.272 1.00 0.00 H new ATOM 0 HB2 GLU A 274 -5.085 0.055 0.975 1.00 0.00 H new ATOM 0 HB3 GLU A 274 -5.462 1.635 1.635 1.00 0.00 H new ATOM 0 HG2 GLU A 274 -6.989 0.550 -0.732 1.00 0.00 H new ATOM 0 HG3 GLU A 274 -7.395 0.059 0.900 1.00 0.00 H new ATOM 487 N ARG A 275 -5.716 3.424 -1.600 1.00 0.00 N ATOM 488 CA ARG A 275 -5.999 4.789 -2.049 1.00 0.00 C ATOM 489 C ARG A 275 -6.577 5.665 -0.937 1.00 0.00 C ATOM 490 O ARG A 275 -6.173 6.810 -0.776 1.00 0.00 O ATOM 491 CB ARG A 275 -6.975 4.742 -3.226 1.00 0.00 C ATOM 492 CG ARG A 275 -7.076 6.037 -4.019 1.00 0.00 C ATOM 493 CD ARG A 275 -8.195 5.968 -5.056 1.00 0.00 C ATOM 494 NE ARG A 275 -8.173 4.710 -5.802 1.00 0.00 N ATOM 495 CZ ARG A 275 -8.758 4.515 -6.984 1.00 0.00 C ATOM 496 NH1 ARG A 275 -9.402 5.503 -7.595 1.00 0.00 N ATOM 497 NH2 ARG A 275 -8.703 3.313 -7.548 1.00 0.00 N ATOM 0 H ARG A 275 -6.155 2.703 -2.172 1.00 0.00 H new ATOM 0 HA ARG A 275 -5.053 5.237 -2.353 1.00 0.00 H new ATOM 0 HB2 ARG A 275 -6.672 3.941 -3.901 1.00 0.00 H new ATOM 0 HB3 ARG A 275 -7.965 4.484 -2.850 1.00 0.00 H new ATOM 0 HG2 ARG A 275 -7.259 6.869 -3.339 1.00 0.00 H new ATOM 0 HG3 ARG A 275 -6.127 6.235 -4.518 1.00 0.00 H new ATOM 0 HD2 ARG A 275 -9.158 6.077 -4.558 1.00 0.00 H new ATOM 0 HD3 ARG A 275 -8.098 6.803 -5.750 1.00 0.00 H new ATOM 0 HE ARG A 275 -7.673 3.924 -5.387 1.00 0.00 H new ATOM 0 HH11 ARG A 275 -9.453 6.424 -7.160 1.00 0.00 H new ATOM 0 HH12 ARG A 275 -9.845 5.341 -8.499 1.00 0.00 H new ATOM 0 HH21 ARG A 275 -8.217 2.550 -7.077 1.00 0.00 H new ATOM 0 HH22 ARG A 275 -9.147 3.153 -8.452 1.00 0.00 H new ATOM 511 N SER A 276 -7.504 5.125 -0.167 1.00 0.00 N ATOM 512 CA SER A 276 -8.154 5.885 0.888 1.00 0.00 C ATOM 513 C SER A 276 -7.230 6.030 2.089 1.00 0.00 C ATOM 514 O SER A 276 -7.438 6.885 2.943 1.00 0.00 O ATOM 515 CB SER A 276 -9.444 5.187 1.306 1.00 0.00 C ATOM 516 OG SER A 276 -10.153 4.723 0.171 1.00 0.00 O ATOM 0 H SER A 276 -7.825 4.161 -0.252 1.00 0.00 H new ATOM 0 HA SER A 276 -8.388 6.880 0.509 1.00 0.00 H new ATOM 0 HB2 SER A 276 -9.213 4.349 1.964 1.00 0.00 H new ATOM 0 HB3 SER A 276 -10.069 5.876 1.874 1.00 0.00 H new ATOM 0 HG SER A 276 -9.744 3.894 -0.154 1.00 0.00 H new ATOM 522 N SER A 277 -6.203 5.199 2.134 1.00 0.00 N ATOM 523 CA SER A 277 -5.259 5.205 3.233 1.00 0.00 C ATOM 524 C SER A 277 -4.046 6.072 2.903 1.00 0.00 C ATOM 525 O SER A 277 -3.368 6.563 3.798 1.00 0.00 O ATOM 526 CB SER A 277 -4.837 3.774 3.553 1.00 0.00 C ATOM 527 OG SER A 277 -5.967 2.994 3.900 1.00 0.00 O ATOM 0 H SER A 277 -6.002 4.506 1.413 1.00 0.00 H new ATOM 0 HA SER A 277 -5.741 5.635 4.111 1.00 0.00 H new ATOM 0 HB2 SER A 277 -4.334 3.335 2.691 1.00 0.00 H new ATOM 0 HB3 SER A 277 -4.121 3.774 4.374 1.00 0.00 H new ATOM 0 HG SER A 277 -6.537 2.875 3.112 1.00 0.00 H new ATOM 533 N ILE A 278 -3.781 6.261 1.616 1.00 0.00 N ATOM 534 CA ILE A 278 -2.720 7.170 1.180 1.00 0.00 C ATOM 535 C ILE A 278 -3.275 8.558 0.864 1.00 0.00 C ATOM 536 O ILE A 278 -2.850 9.559 1.444 1.00 0.00 O ATOM 537 CB ILE A 278 -1.949 6.630 -0.059 1.00 0.00 C ATOM 538 CG1 ILE A 278 -1.062 7.720 -0.665 1.00 0.00 C ATOM 539 CG2 ILE A 278 -2.897 6.091 -1.116 1.00 0.00 C ATOM 540 CD1 ILE A 278 0.059 8.150 0.231 1.00 0.00 C ATOM 0 H ILE A 278 -4.282 5.801 0.856 1.00 0.00 H new ATOM 0 HA ILE A 278 -2.020 7.240 2.013 1.00 0.00 H new ATOM 0 HB ILE A 278 -1.320 5.809 0.286 1.00 0.00 H new ATOM 0 HG12 ILE A 278 -0.646 7.357 -1.605 1.00 0.00 H new ATOM 0 HG13 ILE A 278 -1.678 8.587 -0.903 1.00 0.00 H new ATOM 0 HG21 ILE A 278 -2.323 5.723 -1.966 1.00 0.00 H new ATOM 0 HG22 ILE A 278 -3.486 5.276 -0.695 1.00 0.00 H new ATOM 0 HG23 ILE A 278 -3.564 6.887 -1.446 1.00 0.00 H new ATOM 0 HD11 ILE A 278 0.645 8.924 -0.265 1.00 0.00 H new ATOM 0 HD12 ILE A 278 -0.350 8.544 1.161 1.00 0.00 H new ATOM 0 HD13 ILE A 278 0.699 7.295 0.449 1.00 0.00 H new ATOM 552 N GLN A 279 -4.250 8.607 -0.028 1.00 0.00 N ATOM 553 CA GLN A 279 -4.743 9.869 -0.548 1.00 0.00 C ATOM 554 C GLN A 279 -5.446 10.690 0.510 1.00 0.00 C ATOM 555 O GLN A 279 -5.566 11.893 0.360 1.00 0.00 O ATOM 556 CB GLN A 279 -5.682 9.635 -1.724 1.00 0.00 C ATOM 557 CG GLN A 279 -4.953 9.372 -3.028 1.00 0.00 C ATOM 558 CD GLN A 279 -4.231 10.604 -3.535 1.00 0.00 C ATOM 559 OE1 GLN A 279 -3.066 10.826 -3.223 1.00 0.00 O ATOM 560 NE2 GLN A 279 -4.928 11.422 -4.308 1.00 0.00 N ATOM 0 H GLN A 279 -4.717 7.783 -0.408 1.00 0.00 H new ATOM 0 HA GLN A 279 -3.873 10.433 -0.883 1.00 0.00 H new ATOM 0 HB2 GLN A 279 -6.330 8.787 -1.500 1.00 0.00 H new ATOM 0 HB3 GLN A 279 -6.326 10.506 -1.845 1.00 0.00 H new ATOM 0 HG2 GLN A 279 -4.235 8.564 -2.885 1.00 0.00 H new ATOM 0 HG3 GLN A 279 -5.666 9.035 -3.780 1.00 0.00 H new ATOM 0 HE21 GLN A 279 -5.895 11.200 -4.544 1.00 0.00 H new ATOM 0 HE22 GLN A 279 -4.498 12.274 -4.668 1.00 0.00 H new ATOM 569 N LYS A 280 -5.898 10.057 1.584 1.00 0.00 N ATOM 570 CA LYS A 280 -6.602 10.794 2.622 1.00 0.00 C ATOM 571 C LYS A 280 -5.635 11.711 3.371 1.00 0.00 C ATOM 572 O LYS A 280 -6.038 12.744 3.908 1.00 0.00 O ATOM 573 CB LYS A 280 -7.336 9.845 3.587 1.00 0.00 C ATOM 574 CG LYS A 280 -6.606 9.554 4.896 1.00 0.00 C ATOM 575 CD LYS A 280 -5.447 8.593 4.701 1.00 0.00 C ATOM 576 CE LYS A 280 -4.801 8.205 6.023 1.00 0.00 C ATOM 577 NZ LYS A 280 -5.722 7.424 6.893 1.00 0.00 N ATOM 0 H LYS A 280 -5.793 9.057 1.757 1.00 0.00 H new ATOM 0 HA LYS A 280 -7.360 11.414 2.144 1.00 0.00 H new ATOM 0 HB2 LYS A 280 -8.311 10.274 3.821 1.00 0.00 H new ATOM 0 HB3 LYS A 280 -7.518 8.901 3.074 1.00 0.00 H new ATOM 0 HG2 LYS A 280 -6.235 10.488 5.319 1.00 0.00 H new ATOM 0 HG3 LYS A 280 -7.308 9.134 5.616 1.00 0.00 H new ATOM 0 HD2 LYS A 280 -5.801 7.696 4.193 1.00 0.00 H new ATOM 0 HD3 LYS A 280 -4.700 9.052 4.053 1.00 0.00 H new ATOM 0 HE2 LYS A 280 -3.904 7.618 5.828 1.00 0.00 H new ATOM 0 HE3 LYS A 280 -4.485 9.106 6.549 1.00 0.00 H new ATOM 0 HZ1 LYS A 280 -5.183 6.997 7.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 280 -6.452 8.055 7.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 280 -6.175 6.674 6.333 1.00 0.00 H new ATOM 591 N TRP A 281 -4.351 11.347 3.386 1.00 0.00 N ATOM 592 CA TRP A 281 -3.360 12.165 4.061 1.00 0.00 C ATOM 593 C TRP A 281 -2.632 13.058 3.055 1.00 0.00 C ATOM 594 O TRP A 281 -2.232 14.173 3.393 1.00 0.00 O ATOM 595 CB TRP A 281 -2.396 11.305 4.915 1.00 0.00 C ATOM 596 CG TRP A 281 -1.058 10.984 4.303 1.00 0.00 C ATOM 597 CD1 TRP A 281 -0.079 11.869 3.953 1.00 0.00 C ATOM 598 CD2 TRP A 281 -0.525 9.683 4.045 1.00 0.00 C ATOM 599 NE1 TRP A 281 1.002 11.199 3.441 1.00 0.00 N ATOM 600 CE2 TRP A 281 0.761 9.859 3.500 1.00 0.00 C ATOM 601 CE3 TRP A 281 -1.014 8.387 4.201 1.00 0.00 C ATOM 602 CZ2 TRP A 281 1.566 8.794 3.125 1.00 0.00 C ATOM 603 CZ3 TRP A 281 -0.214 7.326 3.826 1.00 0.00 C ATOM 604 CH2 TRP A 281 1.062 7.535 3.294 1.00 0.00 C ATOM 0 H TRP A 281 -3.984 10.504 2.944 1.00 0.00 H new ATOM 0 HA TRP A 281 -3.871 12.823 4.764 1.00 0.00 H new ATOM 0 HB2 TRP A 281 -2.224 11.822 5.859 1.00 0.00 H new ATOM 0 HB3 TRP A 281 -2.896 10.366 5.152 1.00 0.00 H new ATOM 0 HD1 TRP A 281 -0.146 12.941 4.063 1.00 0.00 H new ATOM 0 HE1 TRP A 281 1.849 11.633 3.075 1.00 0.00 H new ATOM 0 HE3 TRP A 281 -2.000 8.216 4.607 1.00 0.00 H new ATOM 0 HZ2 TRP A 281 2.553 8.953 2.715 1.00 0.00 H new ATOM 0 HZ3 TRP A 281 -0.580 6.317 3.946 1.00 0.00 H new ATOM 0 HH2 TRP A 281 1.662 6.683 3.011 1.00 0.00 H new ATOM 615 N LEU A 282 -2.464 12.584 1.813 1.00 0.00 N ATOM 616 CA LEU A 282 -1.917 13.440 0.765 1.00 0.00 C ATOM 617 C LEU A 282 -2.899 14.570 0.479 1.00 0.00 C ATOM 618 O LEU A 282 -2.508 15.693 0.163 1.00 0.00 O ATOM 619 CB LEU A 282 -1.633 12.648 -0.516 1.00 0.00 C ATOM 620 CG LEU A 282 -0.490 11.630 -0.430 1.00 0.00 C ATOM 621 CD1 LEU A 282 -0.205 11.048 -1.803 1.00 0.00 C ATOM 622 CD2 LEU A 282 0.762 12.273 0.143 1.00 0.00 C ATOM 0 H LEU A 282 -2.694 11.635 1.519 1.00 0.00 H new ATOM 0 HA LEU A 282 -0.969 13.851 1.112 1.00 0.00 H new ATOM 0 HB2 LEU A 282 -2.543 12.121 -0.805 1.00 0.00 H new ATOM 0 HB3 LEU A 282 -1.406 13.354 -1.315 1.00 0.00 H new ATOM 0 HG LEU A 282 -0.795 10.824 0.238 1.00 0.00 H new ATOM 0 HD11 LEU A 282 0.609 10.326 -1.730 1.00 0.00 H new ATOM 0 HD12 LEU A 282 -1.099 10.551 -2.180 1.00 0.00 H new ATOM 0 HD13 LEU A 282 0.080 11.849 -2.486 1.00 0.00 H new ATOM 0 HD21 LEU A 282 1.560 11.532 0.195 1.00 0.00 H new ATOM 0 HD22 LEU A 282 1.073 13.098 -0.498 1.00 0.00 H new ATOM 0 HD23 LEU A 282 0.552 12.651 1.144 1.00 0.00 H new ATOM 634 N ASP A 283 -4.178 14.244 0.624 1.00 0.00 N ATOM 635 CA ASP A 283 -5.267 15.216 0.515 1.00 0.00 C ATOM 636 C ASP A 283 -5.093 16.339 1.530 1.00 0.00 C ATOM 637 O ASP A 283 -5.415 17.492 1.258 1.00 0.00 O ATOM 638 CB ASP A 283 -6.609 14.515 0.747 1.00 0.00 C ATOM 639 CG ASP A 283 -7.786 15.462 0.778 1.00 0.00 C ATOM 640 OD1 ASP A 283 -8.269 15.852 -0.304 1.00 0.00 O ATOM 641 OD2 ASP A 283 -8.255 15.792 1.888 1.00 0.00 O ATOM 0 H ASP A 283 -4.494 13.294 0.821 1.00 0.00 H new ATOM 0 HA ASP A 283 -5.247 15.648 -0.486 1.00 0.00 H new ATOM 0 HB2 ASP A 283 -6.766 13.778 -0.041 1.00 0.00 H new ATOM 0 HB3 ASP A 283 -6.567 13.969 1.690 1.00 0.00 H new ATOM 646 N ALA A 284 -4.564 15.989 2.698 1.00 0.00 N ATOM 647 CA ALA A 284 -4.342 16.955 3.771 1.00 0.00 C ATOM 648 C ALA A 284 -3.204 17.920 3.437 1.00 0.00 C ATOM 649 O ALA A 284 -2.980 18.902 4.150 1.00 0.00 O ATOM 650 CB ALA A 284 -4.053 16.228 5.076 1.00 0.00 C ATOM 0 H ALA A 284 -4.279 15.037 2.928 1.00 0.00 H new ATOM 0 HA ALA A 284 -5.251 17.546 3.882 1.00 0.00 H new ATOM 0 HB1 ALA A 284 -3.889 16.957 5.870 1.00 0.00 H new ATOM 0 HB2 ALA A 284 -4.901 15.594 5.335 1.00 0.00 H new ATOM 0 HB3 ALA A 284 -3.162 15.612 4.959 1.00 0.00 H new ATOM 656 N GLY A 285 -2.486 17.644 2.356 1.00 0.00 N ATOM 657 CA GLY A 285 -1.417 18.528 1.931 1.00 0.00 C ATOM 658 C GLY A 285 -0.061 18.095 2.446 1.00 0.00 C ATOM 659 O GLY A 285 0.806 18.926 2.715 1.00 0.00 O ATOM 0 H GLY A 285 -2.624 16.824 1.766 1.00 0.00 H new ATOM 0 HA2 GLY A 285 -1.393 18.564 0.842 1.00 0.00 H new ATOM 0 HA3 GLY A 285 -1.627 19.539 2.279 1.00 0.00 H new ATOM 663 N HIS A 286 0.126 16.795 2.592 1.00 0.00 N ATOM 664 CA HIS A 286 1.406 16.261 3.030 1.00 0.00 C ATOM 665 C HIS A 286 2.115 15.597 1.863 1.00 0.00 C ATOM 666 O HIS A 286 1.509 15.343 0.826 1.00 0.00 O ATOM 667 CB HIS A 286 1.225 15.243 4.156 1.00 0.00 C ATOM 668 CG HIS A 286 0.672 15.805 5.430 1.00 0.00 C ATOM 669 ND1 HIS A 286 1.382 15.887 6.609 1.00 0.00 N ATOM 670 CD2 HIS A 286 -0.561 16.294 5.704 1.00 0.00 C ATOM 671 CE1 HIS A 286 0.575 16.407 7.542 1.00 0.00 C ATOM 672 NE2 HIS A 286 -0.617 16.673 7.041 1.00 0.00 N ATOM 0 H HIS A 286 -0.590 16.090 2.414 1.00 0.00 H new ATOM 0 HA HIS A 286 2.005 17.091 3.405 1.00 0.00 H new ATOM 0 HB2 HIS A 286 0.562 14.451 3.807 1.00 0.00 H new ATOM 0 HB3 HIS A 286 2.190 14.782 4.368 1.00 0.00 H new ATOM 0 HD2 HIS A 286 -1.372 16.377 4.996 1.00 0.00 H new ATOM 0 HE1 HIS A 286 0.861 16.585 8.568 1.00 0.00 H new ATOM 0 HE2 HIS A 286 -1.415 17.074 7.533 1.00 0.00 H new ATOM 680 N LYS A 287 3.396 15.313 2.039 1.00 0.00 N ATOM 681 CA LYS A 287 4.179 14.652 1.008 1.00 0.00 C ATOM 682 C LYS A 287 5.339 13.884 1.634 1.00 0.00 C ATOM 683 O LYS A 287 6.509 14.162 1.382 1.00 0.00 O ATOM 684 CB LYS A 287 4.669 15.665 -0.035 1.00 0.00 C ATOM 685 CG LYS A 287 5.277 16.927 0.555 1.00 0.00 C ATOM 686 CD LYS A 287 5.522 17.964 -0.526 1.00 0.00 C ATOM 687 CE LYS A 287 6.101 19.250 0.041 1.00 0.00 C ATOM 688 NZ LYS A 287 6.326 20.268 -1.018 1.00 0.00 N ATOM 0 H LYS A 287 3.916 15.531 2.889 1.00 0.00 H new ATOM 0 HA LYS A 287 3.543 13.933 0.491 1.00 0.00 H new ATOM 0 HB2 LYS A 287 5.410 15.183 -0.672 1.00 0.00 H new ATOM 0 HB3 LYS A 287 3.832 15.944 -0.675 1.00 0.00 H new ATOM 0 HG2 LYS A 287 4.610 17.337 1.314 1.00 0.00 H new ATOM 0 HG3 LYS A 287 6.216 16.685 1.053 1.00 0.00 H new ATOM 0 HD2 LYS A 287 6.205 17.556 -1.272 1.00 0.00 H new ATOM 0 HD3 LYS A 287 4.585 18.183 -1.038 1.00 0.00 H new ATOM 0 HE2 LYS A 287 5.424 19.653 0.794 1.00 0.00 H new ATOM 0 HE3 LYS A 287 7.044 19.034 0.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 287 6.721 21.130 -0.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 287 6.992 19.894 -1.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 287 5.422 20.493 -1.481 1.00 0.00 H new ATOM 702 N THR A 288 4.986 12.926 2.472 1.00 0.00 N ATOM 703 CA THR A 288 5.949 12.069 3.146 1.00 0.00 C ATOM 704 C THR A 288 5.369 10.665 3.317 1.00 0.00 C ATOM 705 O THR A 288 4.154 10.513 3.399 1.00 0.00 O ATOM 706 CB THR A 288 6.291 12.632 4.534 1.00 0.00 C ATOM 707 OG1 THR A 288 5.142 13.286 5.095 1.00 0.00 O ATOM 708 CG2 THR A 288 7.460 13.603 4.473 1.00 0.00 C ATOM 0 H THR A 288 4.015 12.718 2.707 1.00 0.00 H new ATOM 0 HA THR A 288 6.852 12.028 2.537 1.00 0.00 H new ATOM 0 HB THR A 288 6.583 11.796 5.170 1.00 0.00 H new ATOM 0 HG1 THR A 288 5.279 13.421 6.056 1.00 0.00 H new ATOM 0 HG21 THR A 288 7.672 13.980 5.473 1.00 0.00 H new ATOM 0 HG22 THR A 288 8.340 13.090 4.084 1.00 0.00 H new ATOM 0 HG23 THR A 288 7.207 14.436 3.817 1.00 0.00 H new ATOM 716 N CYS A 289 6.223 9.643 3.358 1.00 0.00 N ATOM 717 CA CYS A 289 5.755 8.281 3.582 1.00 0.00 C ATOM 718 C CYS A 289 5.538 8.043 5.077 1.00 0.00 C ATOM 719 O CYS A 289 6.218 8.649 5.904 1.00 0.00 O ATOM 720 CB CYS A 289 6.772 7.281 3.034 1.00 0.00 C ATOM 721 SG CYS A 289 8.362 7.321 3.885 1.00 0.00 S ATOM 0 H CYS A 289 7.232 9.733 3.240 1.00 0.00 H new ATOM 0 HA CYS A 289 4.808 8.142 3.061 1.00 0.00 H new ATOM 0 HB2 CYS A 289 6.356 6.276 3.108 1.00 0.00 H new ATOM 0 HB3 CYS A 289 6.932 7.483 1.975 1.00 0.00 H new ATOM 0 HG CYS A 289 9.294 6.899 3.083 1.00 0.00 H new ATOM 727 N PRO A 290 4.615 7.144 5.447 1.00 0.00 N ATOM 728 CA PRO A 290 4.298 6.869 6.854 1.00 0.00 C ATOM 729 C PRO A 290 5.389 6.049 7.532 1.00 0.00 C ATOM 730 O PRO A 290 5.346 5.804 8.735 1.00 0.00 O ATOM 731 CB PRO A 290 2.999 6.068 6.769 1.00 0.00 C ATOM 732 CG PRO A 290 3.072 5.380 5.453 1.00 0.00 C ATOM 733 CD PRO A 290 3.808 6.316 4.532 1.00 0.00 C ATOM 0 HA PRO A 290 4.213 7.780 7.446 1.00 0.00 H new ATOM 0 HB2 PRO A 290 2.920 5.352 7.587 1.00 0.00 H new ATOM 0 HB3 PRO A 290 2.127 6.719 6.829 1.00 0.00 H new ATOM 0 HG2 PRO A 290 3.595 4.428 5.540 1.00 0.00 H new ATOM 0 HG3 PRO A 290 2.074 5.162 5.071 1.00 0.00 H new ATOM 0 HD2 PRO A 290 4.435 5.772 3.826 1.00 0.00 H new ATOM 0 HD3 PRO A 290 3.119 6.923 3.944 1.00 0.00 H new ATOM 741 N LYS A 291 6.368 5.636 6.742 1.00 0.00 N ATOM 742 CA LYS A 291 7.449 4.794 7.225 1.00 0.00 C ATOM 743 C LYS A 291 8.529 5.622 7.907 1.00 0.00 C ATOM 744 O LYS A 291 8.712 5.542 9.120 1.00 0.00 O ATOM 745 CB LYS A 291 8.050 4.012 6.056 1.00 0.00 C ATOM 746 CG LYS A 291 7.048 3.109 5.364 1.00 0.00 C ATOM 747 CD LYS A 291 7.631 2.471 4.116 1.00 0.00 C ATOM 748 CE LYS A 291 7.845 3.480 2.995 1.00 0.00 C ATOM 749 NZ LYS A 291 8.293 2.805 1.750 1.00 0.00 N ATOM 0 H LYS A 291 6.435 5.874 5.752 1.00 0.00 H new ATOM 0 HA LYS A 291 7.043 4.100 7.961 1.00 0.00 H new ATOM 0 HB2 LYS A 291 8.459 4.714 5.330 1.00 0.00 H new ATOM 0 HB3 LYS A 291 8.882 3.409 6.420 1.00 0.00 H new ATOM 0 HG2 LYS A 291 6.725 2.329 6.054 1.00 0.00 H new ATOM 0 HG3 LYS A 291 6.162 3.686 5.097 1.00 0.00 H new ATOM 0 HD2 LYS A 291 8.582 1.999 4.363 1.00 0.00 H new ATOM 0 HD3 LYS A 291 6.964 1.682 3.769 1.00 0.00 H new ATOM 0 HE2 LYS A 291 6.918 4.021 2.806 1.00 0.00 H new ATOM 0 HE3 LYS A 291 8.588 4.217 3.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 291 8.253 3.477 0.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 291 9.270 2.469 1.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 291 7.670 1.996 1.550 1.00 0.00 H new ATOM 763 N SER A 292 9.227 6.433 7.127 1.00 0.00 N ATOM 764 CA SER A 292 10.343 7.207 7.650 1.00 0.00 C ATOM 765 C SER A 292 10.203 8.685 7.289 1.00 0.00 C ATOM 766 O SER A 292 11.138 9.464 7.484 1.00 0.00 O ATOM 767 CB SER A 292 11.653 6.658 7.080 1.00 0.00 C ATOM 768 OG SER A 292 11.473 5.357 6.536 1.00 0.00 O ATOM 0 H SER A 292 9.042 6.572 6.134 1.00 0.00 H new ATOM 0 HA SER A 292 10.346 7.121 8.737 1.00 0.00 H new ATOM 0 HB2 SER A 292 12.026 7.330 6.307 1.00 0.00 H new ATOM 0 HB3 SER A 292 12.409 6.625 7.865 1.00 0.00 H new ATOM 0 HG SER A 292 11.832 5.331 5.624 1.00 0.00 H new ATOM 774 N GLN A 293 9.029 9.064 6.769 1.00 0.00 N ATOM 775 CA GLN A 293 8.798 10.426 6.286 1.00 0.00 C ATOM 776 C GLN A 293 9.872 10.805 5.270 1.00 0.00 C ATOM 777 O GLN A 293 10.393 11.918 5.274 1.00 0.00 O ATOM 778 CB GLN A 293 8.779 11.418 7.454 1.00 0.00 C ATOM 779 CG GLN A 293 7.578 11.254 8.377 1.00 0.00 C ATOM 780 CD GLN A 293 6.290 11.798 7.783 1.00 0.00 C ATOM 781 OE1 GLN A 293 5.965 12.976 7.935 1.00 0.00 O ATOM 782 NE2 GLN A 293 5.535 10.946 7.111 1.00 0.00 N ATOM 0 H GLN A 293 8.225 8.444 6.673 1.00 0.00 H new ATOM 0 HA GLN A 293 7.825 10.466 5.797 1.00 0.00 H new ATOM 0 HB2 GLN A 293 9.693 11.298 8.036 1.00 0.00 H new ATOM 0 HB3 GLN A 293 8.785 12.433 7.057 1.00 0.00 H new ATOM 0 HG2 GLN A 293 7.446 10.197 8.608 1.00 0.00 H new ATOM 0 HG3 GLN A 293 7.780 11.763 9.319 1.00 0.00 H new ATOM 0 HE21 GLN A 293 5.833 9.976 7.003 1.00 0.00 H new ATOM 0 HE22 GLN A 293 4.655 11.258 6.701 1.00 0.00 H new ATOM 791 N GLU A 294 10.143 9.868 4.363 1.00 0.00 N ATOM 792 CA GLU A 294 11.242 9.972 3.401 1.00 0.00 C ATOM 793 C GLU A 294 10.986 11.032 2.330 1.00 0.00 C ATOM 794 O GLU A 294 11.751 11.148 1.374 1.00 0.00 O ATOM 795 CB GLU A 294 11.462 8.601 2.758 1.00 0.00 C ATOM 796 CG GLU A 294 11.772 7.524 3.785 1.00 0.00 C ATOM 797 CD GLU A 294 11.439 6.124 3.314 1.00 0.00 C ATOM 798 OE1 GLU A 294 10.510 5.972 2.493 1.00 0.00 O ATOM 799 OE2 GLU A 294 12.071 5.170 3.805 1.00 0.00 O ATOM 0 H GLU A 294 9.602 9.008 4.273 1.00 0.00 H new ATOM 0 HA GLU A 294 12.137 10.288 3.937 1.00 0.00 H new ATOM 0 HB2 GLU A 294 10.571 8.319 2.197 1.00 0.00 H new ATOM 0 HB3 GLU A 294 12.282 8.665 2.043 1.00 0.00 H new ATOM 0 HG2 GLU A 294 12.831 7.570 4.040 1.00 0.00 H new ATOM 0 HG3 GLU A 294 11.215 7.733 4.698 1.00 0.00 H new ATOM 806 N THR A 295 9.926 11.816 2.524 1.00 0.00 N ATOM 807 CA THR A 295 9.545 12.889 1.611 1.00 0.00 C ATOM 808 C THR A 295 9.181 12.350 0.230 1.00 0.00 C ATOM 809 O THR A 295 10.021 11.827 -0.497 1.00 0.00 O ATOM 810 CB THR A 295 10.664 13.933 1.469 1.00 0.00 C ATOM 811 OG1 THR A 295 11.257 14.194 2.749 1.00 0.00 O ATOM 812 CG2 THR A 295 10.118 15.229 0.890 1.00 0.00 C ATOM 0 H THR A 295 9.303 11.722 3.327 1.00 0.00 H new ATOM 0 HA THR A 295 8.667 13.367 2.045 1.00 0.00 H new ATOM 0 HB THR A 295 11.420 13.535 0.792 1.00 0.00 H new ATOM 0 HG1 THR A 295 11.970 14.859 2.650 1.00 0.00 H new ATOM 0 HG21 THR A 295 10.926 15.955 0.797 1.00 0.00 H new ATOM 0 HG22 THR A 295 9.689 15.036 -0.093 1.00 0.00 H new ATOM 0 HG23 THR A 295 9.347 15.626 1.550 1.00 0.00 H new ATOM 820 N LEU A 296 7.925 12.505 -0.138 1.00 0.00 N ATOM 821 CA LEU A 296 7.442 11.998 -1.409 1.00 0.00 C ATOM 822 C LEU A 296 7.751 12.988 -2.526 1.00 0.00 C ATOM 823 O LEU A 296 7.482 12.719 -3.694 1.00 0.00 O ATOM 824 CB LEU A 296 5.941 11.720 -1.327 1.00 0.00 C ATOM 825 CG LEU A 296 5.514 10.883 -0.117 1.00 0.00 C ATOM 826 CD1 LEU A 296 4.029 10.574 -0.173 1.00 0.00 C ATOM 827 CD2 LEU A 296 6.327 9.599 -0.026 1.00 0.00 C ATOM 0 H LEU A 296 7.219 12.979 0.425 1.00 0.00 H new ATOM 0 HA LEU A 296 7.953 11.062 -1.634 1.00 0.00 H new ATOM 0 HB2 LEU A 296 5.409 12.671 -1.300 1.00 0.00 H new ATOM 0 HB3 LEU A 296 5.630 11.206 -2.236 1.00 0.00 H new ATOM 0 HG LEU A 296 5.708 11.469 0.781 1.00 0.00 H new ATOM 0 HD11 LEU A 296 3.748 9.979 0.696 1.00 0.00 H new ATOM 0 HD12 LEU A 296 3.463 11.506 -0.173 1.00 0.00 H new ATOM 0 HD13 LEU A 296 3.808 10.015 -1.082 1.00 0.00 H new ATOM 0 HD21 LEU A 296 6.003 9.024 0.842 1.00 0.00 H new ATOM 0 HD22 LEU A 296 6.176 9.008 -0.930 1.00 0.00 H new ATOM 0 HD23 LEU A 296 7.384 9.844 0.075 1.00 0.00 H new ATOM 839 N LEU A 297 8.327 14.130 -2.140 1.00 0.00 N ATOM 840 CA LEU A 297 8.711 15.187 -3.074 1.00 0.00 C ATOM 841 C LEU A 297 7.503 15.722 -3.836 1.00 0.00 C ATOM 842 O LEU A 297 6.797 16.607 -3.354 1.00 0.00 O ATOM 843 CB LEU A 297 9.795 14.710 -4.054 1.00 0.00 C ATOM 844 CG LEU A 297 11.245 14.949 -3.617 1.00 0.00 C ATOM 845 CD1 LEU A 297 11.502 16.432 -3.398 1.00 0.00 C ATOM 846 CD2 LEU A 297 11.575 14.166 -2.357 1.00 0.00 C ATOM 0 H LEU A 297 8.540 14.346 -1.166 1.00 0.00 H new ATOM 0 HA LEU A 297 9.128 16.001 -2.480 1.00 0.00 H new ATOM 0 HB2 LEU A 297 9.659 13.642 -4.225 1.00 0.00 H new ATOM 0 HB3 LEU A 297 9.637 15.208 -5.011 1.00 0.00 H new ATOM 0 HG LEU A 297 11.896 14.596 -4.417 1.00 0.00 H new ATOM 0 HD11 LEU A 297 12.537 16.580 -3.088 1.00 0.00 H new ATOM 0 HD12 LEU A 297 11.320 16.974 -4.326 1.00 0.00 H new ATOM 0 HD13 LEU A 297 10.834 16.806 -2.622 1.00 0.00 H new ATOM 0 HD21 LEU A 297 12.610 14.355 -2.071 1.00 0.00 H new ATOM 0 HD22 LEU A 297 10.913 14.479 -1.550 1.00 0.00 H new ATOM 0 HD23 LEU A 297 11.440 13.101 -2.545 1.00 0.00 H new ATOM 858 N HIS A 298 7.254 15.164 -5.008 1.00 0.00 N ATOM 859 CA HIS A 298 6.147 15.601 -5.837 1.00 0.00 C ATOM 860 C HIS A 298 5.001 14.611 -5.715 1.00 0.00 C ATOM 861 O HIS A 298 5.105 13.465 -6.162 1.00 0.00 O ATOM 862 CB HIS A 298 6.585 15.737 -7.297 1.00 0.00 C ATOM 863 CG HIS A 298 7.727 16.690 -7.496 1.00 0.00 C ATOM 864 ND1 HIS A 298 7.579 18.052 -7.625 1.00 0.00 N ATOM 865 CD2 HIS A 298 9.061 16.449 -7.574 1.00 0.00 C ATOM 866 CE1 HIS A 298 8.797 18.589 -7.773 1.00 0.00 C ATOM 867 NE2 HIS A 298 9.733 17.658 -7.750 1.00 0.00 N ATOM 0 H HIS A 298 7.806 14.405 -5.407 1.00 0.00 H new ATOM 0 HA HIS A 298 5.812 16.580 -5.495 1.00 0.00 H new ATOM 0 HB2 HIS A 298 6.872 14.755 -7.674 1.00 0.00 H new ATOM 0 HB3 HIS A 298 5.736 16.072 -7.893 1.00 0.00 H new ATOM 0 HD2 HIS A 298 9.527 15.477 -7.510 1.00 0.00 H new ATOM 0 HE1 HIS A 298 8.988 19.645 -7.895 1.00 0.00 H new ATOM 0 HE2 HIS A 298 10.740 17.795 -7.842 1.00 0.00 H new ATOM 875 N ALA A 299 3.921 15.041 -5.084 1.00 0.00 N ATOM 876 CA ALA A 299 2.785 14.169 -4.860 1.00 0.00 C ATOM 877 C ALA A 299 1.933 14.049 -6.118 1.00 0.00 C ATOM 878 O ALA A 299 1.047 14.867 -6.372 1.00 0.00 O ATOM 879 CB ALA A 299 1.955 14.670 -3.688 1.00 0.00 C ATOM 0 H ALA A 299 3.809 15.987 -4.719 1.00 0.00 H new ATOM 0 HA ALA A 299 3.159 13.175 -4.616 1.00 0.00 H new ATOM 0 HB1 ALA A 299 1.106 14.005 -3.533 1.00 0.00 H new ATOM 0 HB2 ALA A 299 2.570 14.689 -2.788 1.00 0.00 H new ATOM 0 HB3 ALA A 299 1.593 15.676 -3.902 1.00 0.00 H new ATOM 885 N GLY A 300 2.238 13.034 -6.904 1.00 0.00 N ATOM 886 CA GLY A 300 1.468 12.734 -8.088 1.00 0.00 C ATOM 887 C GLY A 300 1.062 11.281 -8.098 1.00 0.00 C ATOM 888 O GLY A 300 1.914 10.394 -8.200 1.00 0.00 O ATOM 0 H GLY A 300 3.021 12.401 -6.739 1.00 0.00 H new ATOM 0 HA2 GLY A 300 0.581 13.366 -8.122 1.00 0.00 H new ATOM 0 HA3 GLY A 300 2.055 12.960 -8.978 1.00 0.00 H new ATOM 892 N LEU A 301 -0.231 11.031 -7.976 1.00 0.00 N ATOM 893 CA LEU A 301 -0.722 9.676 -7.809 1.00 0.00 C ATOM 894 C LEU A 301 -0.601 8.898 -9.118 1.00 0.00 C ATOM 895 O LEU A 301 -1.133 9.296 -10.153 1.00 0.00 O ATOM 896 CB LEU A 301 -2.177 9.692 -7.329 1.00 0.00 C ATOM 897 CG LEU A 301 -2.625 8.454 -6.550 1.00 0.00 C ATOM 898 CD1 LEU A 301 -1.962 8.414 -5.178 1.00 0.00 C ATOM 899 CD2 LEU A 301 -4.138 8.432 -6.412 1.00 0.00 C ATOM 0 H LEU A 301 -0.957 11.747 -7.990 1.00 0.00 H new ATOM 0 HA LEU A 301 -0.113 9.178 -7.055 1.00 0.00 H new ATOM 0 HB2 LEU A 301 -2.324 10.569 -6.699 1.00 0.00 H new ATOM 0 HB3 LEU A 301 -2.827 9.809 -8.196 1.00 0.00 H new ATOM 0 HG LEU A 301 -2.316 7.568 -7.105 1.00 0.00 H new ATOM 0 HD11 LEU A 301 -2.293 7.526 -4.639 1.00 0.00 H new ATOM 0 HD12 LEU A 301 -0.879 8.382 -5.298 1.00 0.00 H new ATOM 0 HD13 LEU A 301 -2.239 9.305 -4.614 1.00 0.00 H new ATOM 0 HD21 LEU A 301 -4.440 7.545 -5.855 1.00 0.00 H new ATOM 0 HD22 LEU A 301 -4.468 9.324 -5.879 1.00 0.00 H new ATOM 0 HD23 LEU A 301 -4.593 8.411 -7.402 1.00 0.00 H new ATOM 911 N THR A 302 0.119 7.799 -9.054 1.00 0.00 N ATOM 912 CA THR A 302 0.388 6.963 -10.205 1.00 0.00 C ATOM 913 C THR A 302 -0.199 5.569 -9.994 1.00 0.00 C ATOM 914 O THR A 302 0.157 4.878 -9.042 1.00 0.00 O ATOM 915 CB THR A 302 1.909 6.860 -10.425 1.00 0.00 C ATOM 916 OG1 THR A 302 2.448 8.169 -10.655 1.00 0.00 O ATOM 917 CG2 THR A 302 2.251 5.936 -11.587 1.00 0.00 C ATOM 0 H THR A 302 0.540 7.456 -8.190 1.00 0.00 H new ATOM 0 HA THR A 302 -0.076 7.410 -11.084 1.00 0.00 H new ATOM 0 HB THR A 302 2.354 6.431 -9.527 1.00 0.00 H new ATOM 0 HG1 THR A 302 3.416 8.104 -10.793 1.00 0.00 H new ATOM 0 HG21 THR A 302 3.333 5.890 -11.709 1.00 0.00 H new ATOM 0 HG22 THR A 302 1.867 4.937 -11.383 1.00 0.00 H new ATOM 0 HG23 THR A 302 1.798 6.319 -12.502 1.00 0.00 H new ATOM 925 N PRO A 303 -1.124 5.143 -10.860 1.00 0.00 N ATOM 926 CA PRO A 303 -1.734 3.818 -10.755 1.00 0.00 C ATOM 927 C PRO A 303 -0.736 2.705 -11.061 1.00 0.00 C ATOM 928 O PRO A 303 -0.127 2.679 -12.132 1.00 0.00 O ATOM 929 CB PRO A 303 -2.854 3.848 -11.797 1.00 0.00 C ATOM 930 CG PRO A 303 -2.432 4.887 -12.781 1.00 0.00 C ATOM 931 CD PRO A 303 -1.654 5.912 -12.000 1.00 0.00 C ATOM 0 HA PRO A 303 -2.093 3.610 -9.747 1.00 0.00 H new ATOM 0 HB2 PRO A 303 -2.975 2.876 -12.275 1.00 0.00 H new ATOM 0 HB3 PRO A 303 -3.811 4.101 -11.341 1.00 0.00 H new ATOM 0 HG2 PRO A 303 -1.819 4.450 -13.569 1.00 0.00 H new ATOM 0 HG3 PRO A 303 -3.298 5.340 -13.264 1.00 0.00 H new ATOM 0 HD2 PRO A 303 -0.853 6.349 -12.597 1.00 0.00 H new ATOM 0 HD3 PRO A 303 -2.290 6.733 -11.670 1.00 0.00 H new ATOM 939 N ASN A 304 -0.572 1.791 -10.117 1.00 0.00 N ATOM 940 CA ASN A 304 0.427 0.742 -10.240 1.00 0.00 C ATOM 941 C ASN A 304 -0.222 -0.635 -10.383 1.00 0.00 C ATOM 942 O ASN A 304 -1.237 -0.928 -9.746 1.00 0.00 O ATOM 943 CB ASN A 304 1.349 0.759 -9.027 1.00 0.00 C ATOM 944 CG ASN A 304 0.650 0.323 -7.760 1.00 0.00 C ATOM 945 OD1 ASN A 304 0.859 -0.924 -7.374 1.00 0.00 O flip ATOM 946 ND2 ASN A 304 -0.045 1.105 -7.121 1.00 0.00 N flip ATOM 0 H ASN A 304 -1.119 1.755 -9.257 1.00 0.00 H new ATOM 0 HA ASN A 304 1.008 0.934 -11.142 1.00 0.00 H new ATOM 0 HB2 ASN A 304 2.200 0.103 -9.212 1.00 0.00 H new ATOM 0 HB3 ASN A 304 1.746 1.765 -8.891 1.00 0.00 H new ATOM 0 HD21 ASN A 304 -0.179 2.059 -7.456 1.00 0.00 H new ATOM 0 HD22 ASN A 304 -0.489 0.802 -6.254 1.00 0.00 H new ATOM 953 N TYR A 305 0.351 -1.470 -11.235 1.00 0.00 N ATOM 954 CA TYR A 305 -0.136 -2.832 -11.419 1.00 0.00 C ATOM 955 C TYR A 305 0.573 -3.804 -10.477 1.00 0.00 C ATOM 956 O TYR A 305 -0.018 -4.785 -10.027 1.00 0.00 O ATOM 957 CB TYR A 305 0.060 -3.286 -12.867 1.00 0.00 C ATOM 958 CG TYR A 305 -0.554 -2.357 -13.890 1.00 0.00 C ATOM 959 CD1 TYR A 305 -1.920 -2.374 -14.145 1.00 0.00 C ATOM 960 CD2 TYR A 305 0.233 -1.461 -14.600 1.00 0.00 C ATOM 961 CE1 TYR A 305 -2.481 -1.524 -15.081 1.00 0.00 C ATOM 962 CE2 TYR A 305 -0.321 -0.607 -15.534 1.00 0.00 C ATOM 963 CZ TYR A 305 -1.676 -0.642 -15.771 1.00 0.00 C ATOM 964 OH TYR A 305 -2.232 0.206 -16.703 1.00 0.00 O ATOM 0 H TYR A 305 1.156 -1.229 -11.813 1.00 0.00 H new ATOM 0 HA TYR A 305 -1.201 -2.833 -11.185 1.00 0.00 H new ATOM 0 HB2 TYR A 305 1.128 -3.376 -13.068 1.00 0.00 H new ATOM 0 HB3 TYR A 305 -0.372 -4.279 -12.987 1.00 0.00 H new ATOM 0 HD1 TYR A 305 -2.553 -3.061 -13.604 1.00 0.00 H new ATOM 0 HD2 TYR A 305 1.297 -1.431 -14.419 1.00 0.00 H new ATOM 0 HE1 TYR A 305 -3.544 -1.551 -15.270 1.00 0.00 H new ATOM 0 HE2 TYR A 305 0.307 0.085 -16.076 1.00 0.00 H new ATOM 0 HH TYR A 305 -1.530 0.763 -17.098 1.00 0.00 H new ATOM 974 N VAL A 306 1.841 -3.508 -10.177 1.00 0.00 N ATOM 975 CA VAL A 306 2.730 -4.426 -9.453 1.00 0.00 C ATOM 976 C VAL A 306 2.097 -5.037 -8.200 1.00 0.00 C ATOM 977 O VAL A 306 2.137 -6.250 -8.006 1.00 0.00 O ATOM 978 CB VAL A 306 4.070 -3.736 -9.056 1.00 0.00 C ATOM 979 CG1 VAL A 306 3.826 -2.459 -8.259 1.00 0.00 C ATOM 980 CG2 VAL A 306 4.956 -4.687 -8.257 1.00 0.00 C ATOM 0 H VAL A 306 2.282 -2.624 -10.429 1.00 0.00 H new ATOM 0 HA VAL A 306 2.923 -5.236 -10.156 1.00 0.00 H new ATOM 0 HB VAL A 306 4.583 -3.469 -9.980 1.00 0.00 H new ATOM 0 HG11 VAL A 306 4.782 -2.004 -7.999 1.00 0.00 H new ATOM 0 HG12 VAL A 306 3.243 -1.761 -8.860 1.00 0.00 H new ATOM 0 HG13 VAL A 306 3.278 -2.698 -7.348 1.00 0.00 H new ATOM 0 HG21 VAL A 306 5.885 -4.182 -7.992 1.00 0.00 H new ATOM 0 HG22 VAL A 306 4.436 -4.992 -7.349 1.00 0.00 H new ATOM 0 HG23 VAL A 306 5.180 -5.567 -8.859 1.00 0.00 H new ATOM 990 N LEU A 307 1.501 -4.209 -7.362 1.00 0.00 N ATOM 991 CA LEU A 307 1.137 -4.649 -6.033 1.00 0.00 C ATOM 992 C LEU A 307 -0.230 -5.318 -6.003 1.00 0.00 C ATOM 993 O LEU A 307 -0.433 -6.248 -5.232 1.00 0.00 O ATOM 994 CB LEU A 307 1.176 -3.476 -5.058 1.00 0.00 C ATOM 995 CG LEU A 307 1.462 -3.867 -3.611 1.00 0.00 C ATOM 996 CD1 LEU A 307 2.799 -4.589 -3.522 1.00 0.00 C ATOM 997 CD2 LEU A 307 1.463 -2.638 -2.721 1.00 0.00 C ATOM 0 H LEU A 307 1.262 -3.241 -7.576 1.00 0.00 H new ATOM 0 HA LEU A 307 1.869 -5.396 -5.726 1.00 0.00 H new ATOM 0 HB2 LEU A 307 1.938 -2.770 -5.388 1.00 0.00 H new ATOM 0 HB3 LEU A 307 0.220 -2.954 -5.098 1.00 0.00 H new ATOM 0 HG LEU A 307 0.676 -4.539 -3.266 1.00 0.00 H new ATOM 0 HD11 LEU A 307 2.995 -4.865 -2.486 1.00 0.00 H new ATOM 0 HD12 LEU A 307 2.769 -5.488 -4.137 1.00 0.00 H new ATOM 0 HD13 LEU A 307 3.592 -3.932 -3.879 1.00 0.00 H new ATOM 0 HD21 LEU A 307 1.668 -2.934 -1.692 1.00 0.00 H new ATOM 0 HD22 LEU A 307 2.232 -1.944 -3.060 1.00 0.00 H new ATOM 0 HD23 LEU A 307 0.489 -2.152 -2.771 1.00 0.00 H new ATOM 1009 N LYS A 308 -1.157 -4.874 -6.851 1.00 0.00 N ATOM 1010 CA LYS A 308 -2.523 -5.381 -6.801 1.00 0.00 C ATOM 1011 C LYS A 308 -2.573 -6.866 -7.124 1.00 0.00 C ATOM 1012 O LYS A 308 -3.417 -7.582 -6.605 1.00 0.00 O ATOM 1013 CB LYS A 308 -3.454 -4.595 -7.728 1.00 0.00 C ATOM 1014 CG LYS A 308 -2.993 -4.489 -9.172 1.00 0.00 C ATOM 1015 CD LYS A 308 -4.061 -3.836 -10.032 1.00 0.00 C ATOM 1016 CE LYS A 308 -4.447 -2.462 -9.498 1.00 0.00 C ATOM 1017 NZ LYS A 308 -5.728 -1.976 -10.074 1.00 0.00 N ATOM 0 H LYS A 308 -0.988 -4.173 -7.572 1.00 0.00 H new ATOM 0 HA LYS A 308 -2.878 -5.243 -5.780 1.00 0.00 H new ATOM 0 HB2 LYS A 308 -4.438 -5.064 -7.711 1.00 0.00 H new ATOM 0 HB3 LYS A 308 -3.574 -3.589 -7.327 1.00 0.00 H new ATOM 0 HG2 LYS A 308 -2.073 -3.907 -9.223 1.00 0.00 H new ATOM 0 HG3 LYS A 308 -2.764 -5.482 -9.559 1.00 0.00 H new ATOM 0 HD2 LYS A 308 -3.697 -3.741 -11.055 1.00 0.00 H new ATOM 0 HD3 LYS A 308 -4.943 -4.475 -10.066 1.00 0.00 H new ATOM 0 HE2 LYS A 308 -4.533 -2.507 -8.412 1.00 0.00 H new ATOM 0 HE3 LYS A 308 -3.654 -1.749 -9.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 308 -6.038 -1.125 -9.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 308 -5.592 -1.746 -11.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 308 -6.452 -2.717 -9.983 1.00 0.00 H new ATOM 1031 N SER A 309 -1.652 -7.332 -7.951 1.00 0.00 N ATOM 1032 CA SER A 309 -1.581 -8.747 -8.277 1.00 0.00 C ATOM 1033 C SER A 309 -1.180 -9.564 -7.043 1.00 0.00 C ATOM 1034 O SER A 309 -1.532 -10.736 -6.913 1.00 0.00 O ATOM 1035 CB SER A 309 -0.574 -8.968 -9.406 1.00 0.00 C ATOM 1036 OG SER A 309 -0.807 -8.070 -10.478 1.00 0.00 O ATOM 0 H SER A 309 -0.946 -6.754 -8.407 1.00 0.00 H new ATOM 0 HA SER A 309 -2.565 -9.081 -8.605 1.00 0.00 H new ATOM 0 HB2 SER A 309 0.439 -8.832 -9.027 1.00 0.00 H new ATOM 0 HB3 SER A 309 -0.645 -9.995 -9.765 1.00 0.00 H new ATOM 0 HG SER A 309 -0.150 -8.229 -11.187 1.00 0.00 H new ATOM 1042 N LEU A 310 -0.457 -8.923 -6.131 1.00 0.00 N ATOM 1043 CA LEU A 310 0.049 -9.586 -4.937 1.00 0.00 C ATOM 1044 C LEU A 310 -0.890 -9.398 -3.746 1.00 0.00 C ATOM 1045 O LEU A 310 -1.236 -10.356 -3.062 1.00 0.00 O ATOM 1046 CB LEU A 310 1.447 -9.069 -4.595 1.00 0.00 C ATOM 1047 CG LEU A 310 2.599 -9.692 -5.396 1.00 0.00 C ATOM 1048 CD1 LEU A 310 2.602 -11.205 -5.235 1.00 0.00 C ATOM 1049 CD2 LEU A 310 2.527 -9.306 -6.866 1.00 0.00 C ATOM 0 H LEU A 310 -0.207 -7.936 -6.198 1.00 0.00 H new ATOM 0 HA LEU A 310 0.105 -10.653 -5.150 1.00 0.00 H new ATOM 0 HB2 LEU A 310 1.463 -7.990 -4.749 1.00 0.00 H new ATOM 0 HB3 LEU A 310 1.630 -9.243 -3.535 1.00 0.00 H new ATOM 0 HG LEU A 310 3.534 -9.298 -4.998 1.00 0.00 H new ATOM 0 HD11 LEU A 310 3.425 -11.630 -5.809 1.00 0.00 H new ATOM 0 HD12 LEU A 310 2.725 -11.459 -4.182 1.00 0.00 H new ATOM 0 HD13 LEU A 310 1.658 -11.611 -5.598 1.00 0.00 H new ATOM 0 HD21 LEU A 310 3.357 -9.764 -7.404 1.00 0.00 H new ATOM 0 HD22 LEU A 310 1.585 -9.655 -7.288 1.00 0.00 H new ATOM 0 HD23 LEU A 310 2.587 -8.222 -6.961 1.00 0.00 H new ATOM 1061 N ILE A 311 -1.303 -8.164 -3.502 1.00 0.00 N ATOM 1062 CA ILE A 311 -2.169 -7.862 -2.365 1.00 0.00 C ATOM 1063 C ILE A 311 -3.536 -8.519 -2.518 1.00 0.00 C ATOM 1064 O ILE A 311 -4.128 -8.980 -1.540 1.00 0.00 O ATOM 1065 CB ILE A 311 -2.353 -6.349 -2.178 1.00 0.00 C ATOM 1066 CG1 ILE A 311 -2.790 -5.698 -3.489 1.00 0.00 C ATOM 1067 CG2 ILE A 311 -1.073 -5.722 -1.657 1.00 0.00 C ATOM 1068 CD1 ILE A 311 -2.947 -4.201 -3.400 1.00 0.00 C ATOM 0 H ILE A 311 -1.055 -7.355 -4.072 1.00 0.00 H new ATOM 0 HA ILE A 311 -1.675 -8.267 -1.482 1.00 0.00 H new ATOM 0 HB ILE A 311 -3.138 -6.180 -1.440 1.00 0.00 H new ATOM 0 HG12 ILE A 311 -2.058 -5.932 -4.262 1.00 0.00 H new ATOM 0 HG13 ILE A 311 -3.737 -6.136 -3.804 1.00 0.00 H new ATOM 0 HG21 ILE A 311 -1.219 -4.649 -1.530 1.00 0.00 H new ATOM 0 HG22 ILE A 311 -0.813 -6.169 -0.698 1.00 0.00 H new ATOM 0 HG23 ILE A 311 -0.266 -5.896 -2.369 1.00 0.00 H new ATOM 0 HD11 ILE A 311 -3.259 -3.810 -4.368 1.00 0.00 H new ATOM 0 HD12 ILE A 311 -3.700 -3.958 -2.651 1.00 0.00 H new ATOM 0 HD13 ILE A 311 -1.995 -3.752 -3.117 1.00 0.00 H new ATOM 1080 N ALA A 312 -4.020 -8.587 -3.753 1.00 0.00 N ATOM 1081 CA ALA A 312 -5.295 -9.229 -4.040 1.00 0.00 C ATOM 1082 C ALA A 312 -5.173 -10.740 -3.882 1.00 0.00 C ATOM 1083 O ALA A 312 -6.170 -11.453 -3.854 1.00 0.00 O ATOM 1084 CB ALA A 312 -5.766 -8.870 -5.441 1.00 0.00 C ATOM 0 H ALA A 312 -3.547 -8.204 -4.572 1.00 0.00 H new ATOM 0 HA ALA A 312 -6.037 -8.868 -3.328 1.00 0.00 H new ATOM 0 HB1 ALA A 312 -6.720 -9.358 -5.640 1.00 0.00 H new ATOM 0 HB2 ALA A 312 -5.888 -7.790 -5.518 1.00 0.00 H new ATOM 0 HB3 ALA A 312 -5.028 -9.205 -6.170 1.00 0.00 H new ATOM 1090 N LEU A 313 -3.938 -11.212 -3.780 1.00 0.00 N ATOM 1091 CA LEU A 313 -3.658 -12.619 -3.541 1.00 0.00 C ATOM 1092 C LEU A 313 -3.738 -12.930 -2.047 1.00 0.00 C ATOM 1093 O LEU A 313 -4.205 -13.996 -1.646 1.00 0.00 O ATOM 1094 CB LEU A 313 -2.275 -12.975 -4.123 1.00 0.00 C ATOM 1095 CG LEU A 313 -1.454 -14.043 -3.383 1.00 0.00 C ATOM 1096 CD1 LEU A 313 -0.588 -14.804 -4.372 1.00 0.00 C ATOM 1097 CD2 LEU A 313 -0.562 -13.398 -2.324 1.00 0.00 C ATOM 0 H LEU A 313 -3.104 -10.630 -3.861 1.00 0.00 H new ATOM 0 HA LEU A 313 -4.407 -13.232 -4.042 1.00 0.00 H new ATOM 0 HB2 LEU A 313 -2.417 -13.310 -5.150 1.00 0.00 H new ATOM 0 HB3 LEU A 313 -1.681 -12.062 -4.165 1.00 0.00 H new ATOM 0 HG LEU A 313 -2.145 -14.730 -2.894 1.00 0.00 H new ATOM 0 HD11 LEU A 313 -0.008 -15.560 -3.842 1.00 0.00 H new ATOM 0 HD12 LEU A 313 -1.223 -15.288 -5.114 1.00 0.00 H new ATOM 0 HD13 LEU A 313 0.089 -14.111 -4.871 1.00 0.00 H new ATOM 0 HD21 LEU A 313 0.011 -14.171 -1.811 1.00 0.00 H new ATOM 0 HD22 LEU A 313 0.122 -12.696 -2.802 1.00 0.00 H new ATOM 0 HD23 LEU A 313 -1.181 -12.866 -1.602 1.00 0.00 H new ATOM 1109 N TRP A 314 -3.310 -11.977 -1.227 1.00 0.00 N ATOM 1110 CA TRP A 314 -3.263 -12.182 0.215 1.00 0.00 C ATOM 1111 C TRP A 314 -4.668 -12.101 0.812 1.00 0.00 C ATOM 1112 O TRP A 314 -5.090 -12.993 1.552 1.00 0.00 O ATOM 1113 CB TRP A 314 -2.342 -11.147 0.874 1.00 0.00 C ATOM 1114 CG TRP A 314 -1.759 -11.604 2.179 1.00 0.00 C ATOM 1115 CD1 TRP A 314 -0.487 -12.050 2.389 1.00 0.00 C ATOM 1116 CD2 TRP A 314 -2.418 -11.662 3.450 1.00 0.00 C ATOM 1117 NE1 TRP A 314 -0.314 -12.382 3.712 1.00 0.00 N ATOM 1118 CE2 TRP A 314 -1.486 -12.155 4.384 1.00 0.00 C ATOM 1119 CE3 TRP A 314 -3.703 -11.350 3.887 1.00 0.00 C ATOM 1120 CZ2 TRP A 314 -1.803 -12.335 5.730 1.00 0.00 C ATOM 1121 CZ3 TRP A 314 -4.018 -11.532 5.220 1.00 0.00 C ATOM 1122 CH2 TRP A 314 -3.072 -12.021 6.127 1.00 0.00 C ATOM 0 H TRP A 314 -2.992 -11.058 -1.535 1.00 0.00 H new ATOM 0 HA TRP A 314 -2.861 -13.176 0.409 1.00 0.00 H new ATOM 0 HB2 TRP A 314 -1.530 -10.907 0.188 1.00 0.00 H new ATOM 0 HB3 TRP A 314 -2.903 -10.227 1.039 1.00 0.00 H new ATOM 0 HD1 TRP A 314 0.274 -12.131 1.627 1.00 0.00 H new ATOM 0 HE1 TRP A 314 0.547 -12.739 4.126 1.00 0.00 H new ATOM 0 HE3 TRP A 314 -4.441 -10.972 3.195 1.00 0.00 H new ATOM 0 HZ2 TRP A 314 -1.073 -12.709 6.432 1.00 0.00 H new ATOM 0 HZ3 TRP A 314 -5.012 -11.293 5.568 1.00 0.00 H new ATOM 0 HH2 TRP A 314 -3.350 -12.153 7.162 1.00 0.00 H new ATOM 1133 N CYS A 315 -5.397 -11.042 0.468 1.00 0.00 N ATOM 1134 CA CYS A 315 -6.750 -10.843 0.982 1.00 0.00 C ATOM 1135 C CYS A 315 -7.725 -11.851 0.368 1.00 0.00 C ATOM 1136 O CYS A 315 -8.855 -12.010 0.835 1.00 0.00 O ATOM 1137 CB CYS A 315 -7.216 -9.414 0.706 1.00 0.00 C ATOM 1138 SG CYS A 315 -7.099 -8.917 -1.027 1.00 0.00 S ATOM 0 H CYS A 315 -5.074 -10.309 -0.164 1.00 0.00 H new ATOM 0 HA CYS A 315 -6.732 -11.005 2.060 1.00 0.00 H new ATOM 0 HB2 CYS A 315 -8.251 -9.312 1.032 1.00 0.00 H new ATOM 0 HB3 CYS A 315 -6.623 -8.727 1.310 1.00 0.00 H new ATOM 0 HG CYS A 315 -5.859 -8.980 -1.414 1.00 0.00 H new ATOM 1144 N GLU A 316 -7.283 -12.527 -0.688 1.00 0.00 N ATOM 1145 CA GLU A 316 -8.081 -13.572 -1.311 1.00 0.00 C ATOM 1146 C GLU A 316 -7.899 -14.880 -0.552 1.00 0.00 C ATOM 1147 O GLU A 316 -8.797 -15.719 -0.502 1.00 0.00 O ATOM 1148 CB GLU A 316 -7.676 -13.752 -2.775 1.00 0.00 C ATOM 1149 CG GLU A 316 -8.599 -14.663 -3.564 1.00 0.00 C ATOM 1150 CD GLU A 316 -10.020 -14.146 -3.612 1.00 0.00 C ATOM 1151 OE1 GLU A 316 -10.282 -13.186 -4.367 1.00 0.00 O ATOM 1152 OE2 GLU A 316 -10.884 -14.700 -2.898 1.00 0.00 O ATOM 0 H GLU A 316 -6.377 -12.368 -1.128 1.00 0.00 H new ATOM 0 HA GLU A 316 -9.131 -13.281 -1.277 1.00 0.00 H new ATOM 0 HB2 GLU A 316 -7.649 -12.774 -3.256 1.00 0.00 H new ATOM 0 HB3 GLU A 316 -6.664 -14.155 -2.814 1.00 0.00 H new ATOM 0 HG2 GLU A 316 -8.219 -14.768 -4.580 1.00 0.00 H new ATOM 0 HG3 GLU A 316 -8.592 -15.657 -3.117 1.00 0.00 H new ATOM 1159 N SER A 317 -6.725 -15.049 0.039 1.00 0.00 N ATOM 1160 CA SER A 317 -6.445 -16.222 0.847 1.00 0.00 C ATOM 1161 C SER A 317 -7.212 -16.121 2.161 1.00 0.00 C ATOM 1162 O SER A 317 -7.935 -17.042 2.552 1.00 0.00 O ATOM 1163 CB SER A 317 -4.940 -16.347 1.106 1.00 0.00 C ATOM 1164 OG SER A 317 -4.613 -17.624 1.626 1.00 0.00 O ATOM 0 H SER A 317 -5.952 -14.387 -0.027 1.00 0.00 H new ATOM 0 HA SER A 317 -6.768 -17.115 0.313 1.00 0.00 H new ATOM 0 HB2 SER A 317 -4.394 -16.179 0.178 1.00 0.00 H new ATOM 0 HB3 SER A 317 -4.624 -15.574 1.807 1.00 0.00 H new ATOM 0 HG SER A 317 -3.647 -17.677 1.780 1.00 0.00 H new ATOM 1170 N ASN A 318 -7.058 -14.985 2.827 1.00 0.00 N ATOM 1171 CA ASN A 318 -7.808 -14.686 4.039 1.00 0.00 C ATOM 1172 C ASN A 318 -8.536 -13.364 3.866 1.00 0.00 C ATOM 1173 O ASN A 318 -7.901 -12.335 3.643 1.00 0.00 O ATOM 1174 CB ASN A 318 -6.891 -14.615 5.267 1.00 0.00 C ATOM 1175 CG ASN A 318 -6.305 -15.958 5.670 1.00 0.00 C ATOM 1176 OD1 ASN A 318 -7.038 -17.037 5.429 1.00 0.00 O flip ATOM 1177 ND2 ASN A 318 -5.200 -16.023 6.212 1.00 0.00 N flip ATOM 0 H ASN A 318 -6.413 -14.248 2.544 1.00 0.00 H new ATOM 0 HA ASN A 318 -8.525 -15.491 4.204 1.00 0.00 H new ATOM 0 HB2 ASN A 318 -6.077 -13.920 5.062 1.00 0.00 H new ATOM 0 HB3 ASN A 318 -7.454 -14.207 6.107 1.00 0.00 H new ATOM 0 HD21 ASN A 318 -4.664 -15.172 6.382 1.00 0.00 H new ATOM 0 HD22 ASN A 318 -4.821 -16.928 6.491 1.00 0.00 H new ATOM 1184 N GLY A 319 -9.862 -13.406 3.950 1.00 0.00 N ATOM 1185 CA GLY A 319 -10.669 -12.213 3.771 1.00 0.00 C ATOM 1186 C GLY A 319 -10.311 -11.124 4.757 1.00 0.00 C ATOM 1187 O GLY A 319 -10.706 -11.172 5.921 1.00 0.00 O ATOM 0 H GLY A 319 -10.396 -14.254 4.141 1.00 0.00 H new ATOM 0 HA2 GLY A 319 -10.539 -11.838 2.756 1.00 0.00 H new ATOM 0 HA3 GLY A 319 -11.722 -12.470 3.883 1.00 0.00 H new ATOM 1191 N ILE A 320 -9.541 -10.156 4.296 1.00 0.00 N ATOM 1192 CA ILE A 320 -9.080 -9.070 5.141 1.00 0.00 C ATOM 1193 C ILE A 320 -9.398 -7.727 4.494 1.00 0.00 C ATOM 1194 O ILE A 320 -9.233 -7.561 3.282 1.00 0.00 O ATOM 1195 CB ILE A 320 -7.562 -9.200 5.419 1.00 0.00 C ATOM 1196 CG1 ILE A 320 -7.039 -8.035 6.260 1.00 0.00 C ATOM 1197 CG2 ILE A 320 -6.782 -9.305 4.121 1.00 0.00 C ATOM 1198 CD1 ILE A 320 -5.613 -8.230 6.718 1.00 0.00 C ATOM 0 H ILE A 320 -9.219 -10.100 3.330 1.00 0.00 H new ATOM 0 HA ILE A 320 -9.604 -9.126 6.095 1.00 0.00 H new ATOM 0 HB ILE A 320 -7.415 -10.116 5.991 1.00 0.00 H new ATOM 0 HG12 ILE A 320 -7.105 -7.116 5.678 1.00 0.00 H new ATOM 0 HG13 ILE A 320 -7.680 -7.907 7.132 1.00 0.00 H new ATOM 0 HG21 ILE A 320 -5.718 -9.395 4.342 1.00 0.00 H new ATOM 0 HG22 ILE A 320 -7.114 -10.183 3.567 1.00 0.00 H new ATOM 0 HG23 ILE A 320 -6.953 -8.412 3.520 1.00 0.00 H new ATOM 0 HD11 ILE A 320 -5.300 -7.370 7.310 1.00 0.00 H new ATOM 0 HD12 ILE A 320 -5.546 -9.132 7.326 1.00 0.00 H new ATOM 0 HD13 ILE A 320 -4.962 -8.329 5.849 1.00 0.00 H new ATOM 1210 N GLU A 321 -9.897 -6.797 5.304 1.00 0.00 N ATOM 1211 CA GLU A 321 -10.261 -5.466 4.842 1.00 0.00 C ATOM 1212 C GLU A 321 -10.774 -4.649 6.018 1.00 0.00 C ATOM 1213 O GLU A 321 -11.828 -5.019 6.580 1.00 0.00 O ATOM 1214 CB GLU A 321 -11.323 -5.541 3.746 1.00 0.00 C ATOM 1215 CG GLU A 321 -11.663 -4.195 3.126 1.00 0.00 C ATOM 1216 CD GLU A 321 -12.594 -4.328 1.940 1.00 0.00 C ATOM 1217 OE1 GLU A 321 -12.100 -4.553 0.815 1.00 0.00 O ATOM 1218 OE2 GLU A 321 -13.821 -4.217 2.123 1.00 0.00 O ATOM 1219 OXT GLU A 321 -10.101 -3.681 6.412 1.00 0.00 O ATOM 0 H GLU A 321 -10.059 -6.948 6.300 1.00 0.00 H new ATOM 0 HA GLU A 321 -9.378 -4.985 4.421 1.00 0.00 H new ATOM 0 HB2 GLU A 321 -10.975 -6.214 2.962 1.00 0.00 H new ATOM 0 HB3 GLU A 321 -12.231 -5.978 4.162 1.00 0.00 H new ATOM 0 HG2 GLU A 321 -12.126 -3.557 3.879 1.00 0.00 H new ATOM 0 HG3 GLU A 321 -10.744 -3.700 2.810 1.00 0.00 H new TER 1226 GLU A 321