USER MOD reduce.3.24.130724 H: found=0, std=0, add=544, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 545 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 252 CYS SG : rot 65:sc= -0.685 USER MOD Set 1.2: A 312 CYS SG : rot 69:sc= -4.49! USER MOD Single : A 249 MET CE :methyl -120:sc= -0.984 (180deg=-3.2!) USER MOD Single : A 251 GLN : amide:sc= -1.13 K(o=-1.1,f=-3) USER MOD Single : A 254 SER OG : rot 168:sc= -3.02! USER MOD Single : A 260 GLN : amide:sc= -0.121 X(o=-0.12,f=-0.017) USER MOD Single : A 263 THR OG1 : rot 92:sc= 1.18 USER MOD Single : A 267 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 275 SER OG : rot 80:sc= -3.06! USER MOD Single : A 276 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 278 THR OG1 : rot 44:sc= 0.0294 USER MOD Single : A 279 THR OG1 : rot 180:sc= 0 USER MOD Single : A 280 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 281 ASN : amide:sc=-0.00428 X(o=-0.0043,f=0) USER MOD Single : A 284 ASN : amide:sc= -2.87! C(o=-2.9!,f=-5!) USER MOD Single : A 292 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 294 LYS NZ :NH3+ -125:sc= -0.0328 (180deg=-0.722) USER MOD Single : A 296 ASN : amide:sc= -0.0198 K(o=-0.02,f=-0.55) USER MOD Single : A 299 SER OG : rot 87:sc= 0.148 USER MOD Single : A 300 THR OG1 : rot 78:sc= 0.595 USER MOD Single : A 302 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 305 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 306 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 309 HIS : no HE2:sc= -32.1! C(o=-32!,f=-31!) USER MOD Single : A 310 THR OG1 : rot 180:sc= -0.762 USER MOD Single : A 311 ASN : amide:sc= -2.24! C(o=-2.2!,f=-1.8!) USER MOD ----------------------------------------------------------------- ATOM 75 N ARG A 247 -5.266 -15.594 3.583 1.00 0.00 N ATOM 76 CA ARG A 247 -4.913 -14.895 2.352 1.00 0.00 C ATOM 77 C ARG A 247 -5.253 -13.428 2.445 1.00 0.00 C ATOM 78 O ARG A 247 -5.855 -12.972 3.417 1.00 0.00 O ATOM 79 CB ARG A 247 -5.611 -15.534 1.149 1.00 0.00 C ATOM 80 CG ARG A 247 -4.943 -15.233 -0.183 1.00 0.00 C ATOM 81 CD ARG A 247 -5.287 -16.282 -1.228 1.00 0.00 C ATOM 82 NE ARG A 247 -4.250 -16.399 -2.250 1.00 0.00 N ATOM 83 CZ ARG A 247 -4.448 -16.945 -3.448 1.00 0.00 C ATOM 84 NH1 ARG A 247 -5.639 -17.428 -3.777 1.00 0.00 N ATOM 85 NH2 ARG A 247 -3.450 -17.009 -4.319 1.00 0.00 N ATOM 0 HA ARG A 247 -3.836 -14.983 2.213 1.00 0.00 H new ATOM 0 HB2 ARG A 247 -5.644 -16.614 1.292 1.00 0.00 H new ATOM 0 HB3 ARG A 247 -6.643 -15.186 1.113 1.00 0.00 H new ATOM 0 HG2 ARG A 247 -5.257 -14.250 -0.535 1.00 0.00 H new ATOM 0 HG3 ARG A 247 -3.862 -15.193 -0.048 1.00 0.00 H new ATOM 0 HD2 ARG A 247 -5.426 -17.247 -0.741 1.00 0.00 H new ATOM 0 HD3 ARG A 247 -6.235 -16.025 -1.701 1.00 0.00 H new ATOM 0 HE ARG A 247 -3.320 -16.041 -2.033 1.00 0.00 H new ATOM 0 HH11 ARG A 247 -6.410 -17.382 -3.110 1.00 0.00 H new ATOM 0 HH12 ARG A 247 -5.784 -17.845 -4.697 1.00 0.00 H new ATOM 0 HH21 ARG A 247 -2.532 -16.640 -4.071 1.00 0.00 H new ATOM 0 HH22 ARG A 247 -3.600 -17.427 -5.237 1.00 0.00 H new ATOM 99 N TRP A 248 -4.795 -12.681 1.456 1.00 0.00 N ATOM 100 CA TRP A 248 -4.982 -11.248 1.462 1.00 0.00 C ATOM 101 C TRP A 248 -5.138 -10.625 0.084 1.00 0.00 C ATOM 102 O TRP A 248 -5.032 -11.285 -0.947 1.00 0.00 O ATOM 103 CB TRP A 248 -3.782 -10.647 2.132 1.00 0.00 C ATOM 104 CG TRP A 248 -3.888 -10.559 3.611 1.00 0.00 C ATOM 105 CD1 TRP A 248 -3.224 -11.320 4.523 1.00 0.00 C ATOM 106 CD2 TRP A 248 -4.712 -9.661 4.348 1.00 0.00 C ATOM 107 NE1 TRP A 248 -3.534 -10.896 5.798 1.00 0.00 N ATOM 108 CE2 TRP A 248 -4.460 -9.878 5.711 1.00 0.00 C ATOM 109 CE3 TRP A 248 -5.627 -8.680 3.979 1.00 0.00 C ATOM 110 CZ2 TRP A 248 -5.096 -9.129 6.705 1.00 0.00 C ATOM 111 CZ3 TRP A 248 -6.262 -7.953 4.961 1.00 0.00 C ATOM 112 CH2 TRP A 248 -5.989 -8.176 6.310 1.00 0.00 C ATOM 0 H TRP A 248 -4.294 -13.044 0.645 1.00 0.00 H new ATOM 0 HA TRP A 248 -5.916 -11.043 1.986 1.00 0.00 H new ATOM 0 HB2 TRP A 248 -2.903 -11.239 1.877 1.00 0.00 H new ATOM 0 HB3 TRP A 248 -3.619 -9.647 1.731 1.00 0.00 H new ATOM 0 HD1 TRP A 248 -2.555 -12.134 4.284 1.00 0.00 H new ATOM 0 HE1 TRP A 248 -3.143 -11.273 6.662 1.00 0.00 H new ATOM 0 HE3 TRP A 248 -5.836 -8.491 2.936 1.00 0.00 H new ATOM 0 HZ2 TRP A 248 -4.888 -9.299 7.751 1.00 0.00 H new ATOM 0 HZ3 TRP A 248 -6.983 -7.198 4.682 1.00 0.00 H new ATOM 0 HH2 TRP A 248 -6.495 -7.582 7.057 1.00 0.00 H new ATOM 123 N MET A 249 -5.371 -9.318 0.127 1.00 0.00 N ATOM 124 CA MET A 249 -5.536 -8.469 -1.051 1.00 0.00 C ATOM 125 C MET A 249 -5.746 -7.032 -0.591 1.00 0.00 C ATOM 126 O MET A 249 -6.867 -6.528 -0.578 1.00 0.00 O ATOM 127 CB MET A 249 -6.743 -8.877 -1.873 1.00 0.00 C ATOM 128 CG MET A 249 -6.532 -10.090 -2.762 1.00 0.00 C ATOM 129 SD MET A 249 -7.506 -10.010 -4.278 1.00 0.00 S ATOM 130 CE MET A 249 -6.587 -8.782 -5.205 1.00 0.00 C ATOM 0 H MET A 249 -5.453 -8.804 1.004 1.00 0.00 H new ATOM 0 HA MET A 249 -4.642 -8.571 -1.667 1.00 0.00 H new ATOM 0 HB2 MET A 249 -7.573 -9.081 -1.196 1.00 0.00 H new ATOM 0 HB3 MET A 249 -7.040 -8.035 -2.497 1.00 0.00 H new ATOM 0 HG2 MET A 249 -5.475 -10.171 -3.016 1.00 0.00 H new ATOM 0 HG3 MET A 249 -6.797 -10.992 -2.210 1.00 0.00 H new ATOM 0 HE1 MET A 249 -7.234 -7.933 -5.426 1.00 0.00 H new ATOM 0 HE2 MET A 249 -5.734 -8.444 -4.616 1.00 0.00 H new ATOM 0 HE3 MET A 249 -6.232 -9.220 -6.138 1.00 0.00 H new ATOM 140 N VAL A 250 -4.673 -6.397 -0.180 1.00 0.00 N ATOM 141 CA VAL A 250 -4.747 -5.029 0.332 1.00 0.00 C ATOM 142 C VAL A 250 -5.106 -4.033 -0.744 1.00 0.00 C ATOM 143 O VAL A 250 -4.872 -4.258 -1.931 1.00 0.00 O ATOM 144 CB VAL A 250 -3.446 -4.580 1.013 1.00 0.00 C ATOM 145 CG1 VAL A 250 -2.243 -4.841 0.135 1.00 0.00 C ATOM 146 CG2 VAL A 250 -3.517 -3.109 1.403 1.00 0.00 C ATOM 0 H VAL A 250 -3.735 -6.797 -0.186 1.00 0.00 H new ATOM 0 HA VAL A 250 -5.542 -5.049 1.078 1.00 0.00 H new ATOM 0 HB VAL A 250 -3.330 -5.172 1.921 1.00 0.00 H new ATOM 0 HG11 VAL A 250 -1.340 -4.511 0.648 1.00 0.00 H new ATOM 0 HG12 VAL A 250 -2.171 -5.908 -0.076 1.00 0.00 H new ATOM 0 HG13 VAL A 250 -2.350 -4.292 -0.801 1.00 0.00 H new ATOM 0 HG21 VAL A 250 -2.584 -2.815 1.884 1.00 0.00 H new ATOM 0 HG22 VAL A 250 -3.672 -2.503 0.510 1.00 0.00 H new ATOM 0 HG23 VAL A 250 -4.345 -2.956 2.095 1.00 0.00 H new ATOM 156 N GLN A 251 -5.673 -2.917 -0.309 1.00 0.00 N ATOM 157 CA GLN A 251 -6.060 -1.869 -1.222 1.00 0.00 C ATOM 158 C GLN A 251 -5.914 -0.521 -0.545 1.00 0.00 C ATOM 159 O GLN A 251 -6.895 0.108 -0.147 1.00 0.00 O ATOM 160 CB GLN A 251 -7.493 -2.092 -1.684 1.00 0.00 C ATOM 161 CG GLN A 251 -7.625 -2.336 -3.179 1.00 0.00 C ATOM 162 CD GLN A 251 -8.958 -2.953 -3.552 1.00 0.00 C ATOM 163 OE1 GLN A 251 -10.017 -2.388 -3.275 1.00 0.00 O ATOM 164 NE2 GLN A 251 -8.914 -4.120 -4.185 1.00 0.00 N ATOM 0 H GLN A 251 -5.872 -2.721 0.672 1.00 0.00 H new ATOM 0 HA GLN A 251 -5.410 -1.888 -2.097 1.00 0.00 H new ATOM 0 HB2 GLN A 251 -7.909 -2.945 -1.148 1.00 0.00 H new ATOM 0 HB3 GLN A 251 -8.092 -1.222 -1.413 1.00 0.00 H new ATOM 0 HG2 GLN A 251 -7.504 -1.392 -3.710 1.00 0.00 H new ATOM 0 HG3 GLN A 251 -6.820 -2.992 -3.509 1.00 0.00 H new ATOM 0 HE21 GLN A 251 -8.015 -4.553 -4.395 1.00 0.00 H new ATOM 0 HE22 GLN A 251 -9.780 -4.583 -4.461 1.00 0.00 H new ATOM 173 N CYS A 252 -4.671 -0.096 -0.407 1.00 0.00 N ATOM 174 CA CYS A 252 -4.363 1.171 0.236 1.00 0.00 C ATOM 175 C CYS A 252 -5.189 2.298 -0.359 1.00 0.00 C ATOM 176 O CYS A 252 -5.363 2.381 -1.575 1.00 0.00 O ATOM 177 CB CYS A 252 -2.876 1.509 0.112 1.00 0.00 C ATOM 178 SG CYS A 252 -1.771 0.076 0.124 1.00 0.00 S ATOM 0 H CYS A 252 -3.854 -0.612 -0.733 1.00 0.00 H new ATOM 0 HA CYS A 252 -4.612 1.065 1.292 1.00 0.00 H new ATOM 0 HB2 CYS A 252 -2.719 2.064 -0.813 1.00 0.00 H new ATOM 0 HB3 CYS A 252 -2.598 2.172 0.932 1.00 0.00 H new ATOM 0 HG CYS A 252 -1.991 -0.651 -0.931 1.00 0.00 H new ATOM 184 N GLY A 253 -5.695 3.166 0.507 1.00 0.00 N ATOM 185 CA GLY A 253 -6.493 4.284 0.056 1.00 0.00 C ATOM 186 C GLY A 253 -5.821 5.061 -1.057 1.00 0.00 C ATOM 187 O GLY A 253 -4.720 4.723 -1.487 1.00 0.00 O ATOM 0 H GLY A 253 -5.565 3.113 1.517 1.00 0.00 H new ATOM 0 HA2 GLY A 253 -7.460 3.920 -0.291 1.00 0.00 H new ATOM 0 HA3 GLY A 253 -6.686 4.951 0.896 1.00 0.00 H new ATOM 191 N SER A 254 -6.484 6.104 -1.523 1.00 0.00 N ATOM 192 CA SER A 254 -5.948 6.934 -2.589 1.00 0.00 C ATOM 193 C SER A 254 -5.561 8.302 -2.035 1.00 0.00 C ATOM 194 O SER A 254 -6.414 9.046 -1.548 1.00 0.00 O ATOM 195 CB SER A 254 -6.982 7.058 -3.701 1.00 0.00 C ATOM 196 OG SER A 254 -6.416 7.626 -4.862 1.00 0.00 O ATOM 0 H SER A 254 -7.398 6.398 -1.179 1.00 0.00 H new ATOM 0 HA SER A 254 -5.051 6.474 -3.003 1.00 0.00 H new ATOM 0 HB2 SER A 254 -7.388 6.074 -3.935 1.00 0.00 H new ATOM 0 HB3 SER A 254 -7.814 7.674 -3.360 1.00 0.00 H new ATOM 0 HG SER A 254 -7.033 7.514 -5.615 1.00 0.00 H new ATOM 202 N PHE A 255 -4.263 8.608 -2.051 1.00 0.00 N ATOM 203 CA PHE A 255 -3.772 9.867 -1.484 1.00 0.00 C ATOM 204 C PHE A 255 -3.362 10.897 -2.537 1.00 0.00 C ATOM 205 O PHE A 255 -2.706 10.571 -3.527 1.00 0.00 O ATOM 206 CB PHE A 255 -2.576 9.588 -0.544 1.00 0.00 C ATOM 207 CG PHE A 255 -2.054 8.173 -0.646 1.00 0.00 C ATOM 208 CD1 PHE A 255 -2.880 7.112 -0.306 1.00 0.00 C ATOM 209 CD2 PHE A 255 -0.768 7.893 -1.115 1.00 0.00 C ATOM 210 CE1 PHE A 255 -2.446 5.809 -0.422 1.00 0.00 C ATOM 211 CE2 PHE A 255 -0.340 6.592 -1.236 1.00 0.00 C ATOM 212 CZ PHE A 255 -1.177 5.548 -0.892 1.00 0.00 C ATOM 0 H PHE A 255 -3.538 8.009 -2.446 1.00 0.00 H new ATOM 0 HA PHE A 255 -4.606 10.299 -0.932 1.00 0.00 H new ATOM 0 HB2 PHE A 255 -1.770 10.283 -0.777 1.00 0.00 H new ATOM 0 HB3 PHE A 255 -2.878 9.783 0.485 1.00 0.00 H new ATOM 0 HD1 PHE A 255 -3.878 7.310 0.055 1.00 0.00 H new ATOM 0 HD2 PHE A 255 -0.106 8.703 -1.384 1.00 0.00 H new ATOM 0 HE1 PHE A 255 -3.099 4.994 -0.145 1.00 0.00 H new ATOM 0 HE2 PHE A 255 0.655 6.385 -1.602 1.00 0.00 H new ATOM 0 HZ PHE A 255 -0.837 4.528 -0.991 1.00 0.00 H new ATOM 222 N ARG A 256 -3.740 12.157 -2.285 1.00 0.00 N ATOM 223 CA ARG A 256 -3.401 13.270 -3.178 1.00 0.00 C ATOM 224 C ARG A 256 -1.894 13.419 -3.287 1.00 0.00 C ATOM 225 O ARG A 256 -1.388 14.025 -4.227 1.00 0.00 O ATOM 226 CB ARG A 256 -3.982 14.588 -2.662 1.00 0.00 C ATOM 227 CG ARG A 256 -3.737 14.829 -1.180 1.00 0.00 C ATOM 228 CD ARG A 256 -4.910 15.543 -0.529 1.00 0.00 C ATOM 229 NE ARG A 256 -4.470 16.563 0.420 1.00 0.00 N ATOM 230 CZ ARG A 256 -5.268 17.133 1.319 1.00 0.00 C ATOM 231 NH1 ARG A 256 -6.548 16.789 1.394 1.00 0.00 N ATOM 232 NH2 ARG A 256 -4.786 18.051 2.145 1.00 0.00 N ATOM 0 H ARG A 256 -4.283 12.431 -1.466 1.00 0.00 H new ATOM 0 HA ARG A 256 -3.828 13.046 -4.156 1.00 0.00 H new ATOM 0 HB2 ARG A 256 -3.550 15.412 -3.231 1.00 0.00 H new ATOM 0 HB3 ARG A 256 -5.056 14.599 -2.850 1.00 0.00 H new ATOM 0 HG2 ARG A 256 -3.567 13.876 -0.679 1.00 0.00 H new ATOM 0 HG3 ARG A 256 -2.832 15.423 -1.052 1.00 0.00 H new ATOM 0 HD2 ARG A 256 -5.526 16.006 -1.300 1.00 0.00 H new ATOM 0 HD3 ARG A 256 -5.537 14.815 -0.014 1.00 0.00 H new ATOM 0 HE ARG A 256 -3.493 16.855 0.392 1.00 0.00 H new ATOM 0 HH11 ARG A 256 -6.925 16.084 0.760 1.00 0.00 H new ATOM 0 HH12 ARG A 256 -7.155 17.230 2.085 1.00 0.00 H new ATOM 0 HH21 ARG A 256 -3.804 18.320 2.091 1.00 0.00 H new ATOM 0 HH22 ARG A 256 -5.398 18.488 2.834 1.00 0.00 H new ATOM 246 N GLY A 257 -1.198 12.868 -2.300 1.00 0.00 N ATOM 247 CA GLY A 257 0.245 12.923 -2.245 1.00 0.00 C ATOM 248 C GLY A 257 0.886 12.327 -3.476 1.00 0.00 C ATOM 249 O GLY A 257 1.616 11.355 -3.384 1.00 0.00 O ATOM 0 H GLY A 257 -1.625 12.372 -1.518 1.00 0.00 H new ATOM 0 HA2 GLY A 257 0.564 13.960 -2.137 1.00 0.00 H new ATOM 0 HA3 GLY A 257 0.594 12.389 -1.361 1.00 0.00 H new ATOM 253 N ALA A 258 0.603 12.914 -4.628 1.00 0.00 N ATOM 254 CA ALA A 258 1.148 12.440 -5.901 1.00 0.00 C ATOM 255 C ALA A 258 2.609 12.045 -5.754 1.00 0.00 C ATOM 256 O ALA A 258 3.029 10.986 -6.218 1.00 0.00 O ATOM 257 CB ALA A 258 0.988 13.503 -6.977 1.00 0.00 C ATOM 0 H ALA A 258 -0.006 13.728 -4.713 1.00 0.00 H new ATOM 0 HA ALA A 258 0.587 11.555 -6.201 1.00 0.00 H new ATOM 0 HB1 ALA A 258 1.398 13.134 -7.917 1.00 0.00 H new ATOM 0 HB2 ALA A 258 -0.070 13.732 -7.108 1.00 0.00 H new ATOM 0 HB3 ALA A 258 1.520 14.406 -6.678 1.00 0.00 H new ATOM 263 N GLU A 259 3.367 12.890 -5.075 1.00 0.00 N ATOM 264 CA GLU A 259 4.775 12.612 -4.832 1.00 0.00 C ATOM 265 C GLU A 259 4.893 11.618 -3.686 1.00 0.00 C ATOM 266 O GLU A 259 5.780 10.765 -3.671 1.00 0.00 O ATOM 267 CB GLU A 259 5.533 13.901 -4.502 1.00 0.00 C ATOM 268 CG GLU A 259 6.034 14.642 -5.732 1.00 0.00 C ATOM 269 CD GLU A 259 5.544 16.077 -5.788 1.00 0.00 C ATOM 270 OE1 GLU A 259 4.384 16.292 -6.196 1.00 0.00 O ATOM 271 OE2 GLU A 259 6.322 16.984 -5.424 1.00 0.00 O ATOM 0 H GLU A 259 3.034 13.771 -4.683 1.00 0.00 H new ATOM 0 HA GLU A 259 5.218 12.186 -5.732 1.00 0.00 H new ATOM 0 HB2 GLU A 259 4.880 14.561 -3.931 1.00 0.00 H new ATOM 0 HB3 GLU A 259 6.382 13.660 -3.862 1.00 0.00 H new ATOM 0 HG2 GLU A 259 7.124 14.634 -5.738 1.00 0.00 H new ATOM 0 HG3 GLU A 259 5.706 14.115 -6.628 1.00 0.00 H new ATOM 278 N GLN A 260 3.965 11.725 -2.739 1.00 0.00 N ATOM 279 CA GLN A 260 3.924 10.828 -1.595 1.00 0.00 C ATOM 280 C GLN A 260 3.107 9.580 -1.918 1.00 0.00 C ATOM 281 O GLN A 260 2.927 8.717 -1.065 1.00 0.00 O ATOM 282 CB GLN A 260 3.324 11.536 -0.378 1.00 0.00 C ATOM 283 CG GLN A 260 4.186 11.437 0.871 1.00 0.00 C ATOM 284 CD GLN A 260 4.516 12.794 1.461 1.00 0.00 C ATOM 285 OE1 GLN A 260 5.675 13.095 1.747 1.00 0.00 O ATOM 286 NE2 GLN A 260 3.496 13.623 1.644 1.00 0.00 N ATOM 0 H GLN A 260 3.228 12.430 -2.745 1.00 0.00 H new ATOM 0 HA GLN A 260 4.947 10.530 -1.364 1.00 0.00 H new ATOM 0 HB2 GLN A 260 3.169 12.587 -0.620 1.00 0.00 H new ATOM 0 HB3 GLN A 260 2.343 11.110 -0.167 1.00 0.00 H new ATOM 0 HG2 GLN A 260 3.668 10.836 1.619 1.00 0.00 H new ATOM 0 HG3 GLN A 260 5.112 10.916 0.628 1.00 0.00 H new ATOM 0 HE21 GLN A 260 2.551 13.332 1.393 1.00 0.00 H new ATOM 0 HE22 GLN A 260 3.657 14.551 2.036 1.00 0.00 H new ATOM 295 N ALA A 261 2.622 9.496 -3.157 1.00 0.00 N ATOM 296 CA ALA A 261 1.838 8.358 -3.611 1.00 0.00 C ATOM 297 C ALA A 261 2.684 7.516 -4.556 1.00 0.00 C ATOM 298 O ALA A 261 2.563 6.295 -4.604 1.00 0.00 O ATOM 299 CB ALA A 261 0.565 8.820 -4.287 1.00 0.00 C ATOM 0 H ALA A 261 2.763 10.214 -3.868 1.00 0.00 H new ATOM 0 HA ALA A 261 1.550 7.751 -2.753 1.00 0.00 H new ATOM 0 HB1 ALA A 261 -0.006 7.953 -4.619 1.00 0.00 H new ATOM 0 HB2 ALA A 261 -0.032 9.399 -3.582 1.00 0.00 H new ATOM 0 HB3 ALA A 261 0.815 9.441 -5.147 1.00 0.00 H new ATOM 305 N GLU A 262 3.577 8.190 -5.278 1.00 0.00 N ATOM 306 CA GLU A 262 4.495 7.523 -6.186 1.00 0.00 C ATOM 307 C GLU A 262 5.719 7.118 -5.390 1.00 0.00 C ATOM 308 O GLU A 262 6.214 5.997 -5.509 1.00 0.00 O ATOM 309 CB GLU A 262 4.884 8.449 -7.341 1.00 0.00 C ATOM 310 CG GLU A 262 3.953 8.354 -8.538 1.00 0.00 C ATOM 311 CD GLU A 262 4.656 7.858 -9.787 1.00 0.00 C ATOM 312 OE1 GLU A 262 5.374 6.840 -9.700 1.00 0.00 O ATOM 313 OE2 GLU A 262 4.490 8.489 -10.852 1.00 0.00 O ATOM 0 H GLU A 262 3.681 9.204 -5.248 1.00 0.00 H new ATOM 0 HA GLU A 262 4.020 6.644 -6.622 1.00 0.00 H new ATOM 0 HB2 GLU A 262 4.896 9.478 -6.982 1.00 0.00 H new ATOM 0 HB3 GLU A 262 5.898 8.211 -7.661 1.00 0.00 H new ATOM 0 HG2 GLU A 262 3.128 7.683 -8.299 1.00 0.00 H new ATOM 0 HG3 GLU A 262 3.519 9.334 -8.735 1.00 0.00 H new ATOM 320 N THR A 263 6.162 8.025 -4.522 1.00 0.00 N ATOM 321 CA THR A 263 7.279 7.739 -3.644 1.00 0.00 C ATOM 322 C THR A 263 6.803 6.723 -2.618 1.00 0.00 C ATOM 323 O THR A 263 7.583 5.934 -2.084 1.00 0.00 O ATOM 324 CB THR A 263 7.765 9.012 -2.949 1.00 0.00 C ATOM 325 OG1 THR A 263 8.134 9.994 -3.901 1.00 0.00 O ATOM 326 CG2 THR A 263 8.954 8.782 -2.041 1.00 0.00 C ATOM 0 H THR A 263 5.763 8.957 -4.413 1.00 0.00 H new ATOM 0 HA THR A 263 8.118 7.343 -4.217 1.00 0.00 H new ATOM 0 HB THR A 263 6.925 9.348 -2.341 1.00 0.00 H new ATOM 0 HG1 THR A 263 7.363 10.568 -4.095 1.00 0.00 H new ATOM 0 HG21 THR A 263 9.248 9.725 -1.580 1.00 0.00 H new ATOM 0 HG22 THR A 263 8.685 8.066 -1.264 1.00 0.00 H new ATOM 0 HG23 THR A 263 9.787 8.389 -2.624 1.00 0.00 H new ATOM 334 N VAL A 264 5.489 6.743 -2.383 1.00 0.00 N ATOM 335 CA VAL A 264 4.848 5.824 -1.461 1.00 0.00 C ATOM 336 C VAL A 264 5.125 4.391 -1.891 1.00 0.00 C ATOM 337 O VAL A 264 5.470 3.535 -1.078 1.00 0.00 O ATOM 338 CB VAL A 264 3.307 6.070 -1.411 1.00 0.00 C ATOM 339 CG1 VAL A 264 2.537 4.940 -2.090 1.00 0.00 C ATOM 340 CG2 VAL A 264 2.844 6.258 0.026 1.00 0.00 C ATOM 0 H VAL A 264 4.847 7.398 -2.829 1.00 0.00 H new ATOM 0 HA VAL A 264 5.256 5.994 -0.465 1.00 0.00 H new ATOM 0 HB VAL A 264 3.096 6.985 -1.964 1.00 0.00 H new ATOM 0 HG11 VAL A 264 1.468 5.145 -2.036 1.00 0.00 H new ATOM 0 HG12 VAL A 264 2.841 4.869 -3.134 1.00 0.00 H new ATOM 0 HG13 VAL A 264 2.752 3.998 -1.585 1.00 0.00 H new ATOM 0 HG21 VAL A 264 1.768 6.428 0.042 1.00 0.00 H new ATOM 0 HG22 VAL A 264 3.079 5.364 0.604 1.00 0.00 H new ATOM 0 HG23 VAL A 264 3.354 7.117 0.463 1.00 0.00 H new ATOM 350 N ARG A 265 4.958 4.147 -3.183 1.00 0.00 N ATOM 351 CA ARG A 265 5.173 2.830 -3.749 1.00 0.00 C ATOM 352 C ARG A 265 6.652 2.473 -3.744 1.00 0.00 C ATOM 353 O ARG A 265 7.023 1.321 -3.520 1.00 0.00 O ATOM 354 CB ARG A 265 4.621 2.786 -5.177 1.00 0.00 C ATOM 355 CG ARG A 265 3.508 1.766 -5.359 1.00 0.00 C ATOM 356 CD ARG A 265 3.751 0.878 -6.571 1.00 0.00 C ATOM 357 NE ARG A 265 4.901 -0.004 -6.385 1.00 0.00 N ATOM 358 CZ ARG A 265 6.114 0.228 -6.886 1.00 0.00 C ATOM 359 NH1 ARG A 265 6.355 1.324 -7.597 1.00 0.00 N ATOM 360 NH2 ARG A 265 7.093 -0.640 -6.674 1.00 0.00 N ATOM 0 H ARG A 265 4.672 4.853 -3.861 1.00 0.00 H new ATOM 0 HA ARG A 265 4.647 2.097 -3.137 1.00 0.00 H new ATOM 0 HB2 ARG A 265 4.247 3.774 -5.445 1.00 0.00 H new ATOM 0 HB3 ARG A 265 5.433 2.555 -5.866 1.00 0.00 H new ATOM 0 HG2 ARG A 265 3.431 1.148 -4.465 1.00 0.00 H new ATOM 0 HG3 ARG A 265 2.555 2.283 -5.472 1.00 0.00 H new ATOM 0 HD2 ARG A 265 2.862 0.278 -6.764 1.00 0.00 H new ATOM 0 HD3 ARG A 265 3.912 1.502 -7.450 1.00 0.00 H new ATOM 0 HE ARG A 265 4.767 -0.853 -5.836 1.00 0.00 H new ATOM 0 HH11 ARG A 265 5.608 1.998 -7.764 1.00 0.00 H new ATOM 0 HH12 ARG A 265 7.287 1.492 -7.976 1.00 0.00 H new ATOM 0 HH21 ARG A 265 6.917 -1.484 -6.128 1.00 0.00 H new ATOM 0 HH22 ARG A 265 8.022 -0.464 -7.057 1.00 0.00 H new ATOM 374 N ALA A 266 7.491 3.469 -3.988 1.00 0.00 N ATOM 375 CA ALA A 266 8.927 3.258 -4.007 1.00 0.00 C ATOM 376 C ALA A 266 9.474 3.079 -2.596 1.00 0.00 C ATOM 377 O ALA A 266 10.589 2.596 -2.418 1.00 0.00 O ATOM 378 CB ALA A 266 9.626 4.412 -4.709 1.00 0.00 C ATOM 0 H ALA A 266 7.201 4.429 -4.175 1.00 0.00 H new ATOM 0 HA ALA A 266 9.126 2.342 -4.563 1.00 0.00 H new ATOM 0 HB1 ALA A 266 10.702 4.237 -4.714 1.00 0.00 H new ATOM 0 HB2 ALA A 266 9.266 4.486 -5.735 1.00 0.00 H new ATOM 0 HB3 ALA A 266 9.412 5.342 -4.182 1.00 0.00 H new ATOM 384 N GLN A 267 8.690 3.463 -1.590 1.00 0.00 N ATOM 385 CA GLN A 267 9.123 3.326 -0.208 1.00 0.00 C ATOM 386 C GLN A 267 8.471 2.113 0.460 1.00 0.00 C ATOM 387 O GLN A 267 8.839 1.734 1.571 1.00 0.00 O ATOM 388 CB GLN A 267 8.810 4.598 0.578 1.00 0.00 C ATOM 389 CG GLN A 267 9.588 5.814 0.100 1.00 0.00 C ATOM 390 CD GLN A 267 10.955 5.920 0.746 1.00 0.00 C ATOM 391 OE1 GLN A 267 11.974 5.616 0.124 1.00 0.00 O ATOM 392 NE2 GLN A 267 10.986 6.353 2.001 1.00 0.00 N ATOM 0 H GLN A 267 7.761 3.867 -1.708 1.00 0.00 H new ATOM 0 HA GLN A 267 10.202 3.170 -0.209 1.00 0.00 H new ATOM 0 HB2 GLN A 267 7.743 4.808 0.505 1.00 0.00 H new ATOM 0 HB3 GLN A 267 9.030 4.427 1.632 1.00 0.00 H new ATOM 0 HG2 GLN A 267 9.704 5.764 -0.983 1.00 0.00 H new ATOM 0 HG3 GLN A 267 9.016 6.716 0.318 1.00 0.00 H new ATOM 0 HE21 GLN A 267 10.118 6.594 2.479 1.00 0.00 H new ATOM 0 HE22 GLN A 267 11.878 6.445 2.487 1.00 0.00 H new ATOM 401 N LEU A 268 7.511 1.499 -0.230 1.00 0.00 N ATOM 402 CA LEU A 268 6.822 0.326 0.277 1.00 0.00 C ATOM 403 C LEU A 268 7.278 -0.900 -0.503 1.00 0.00 C ATOM 404 O LEU A 268 7.119 -2.028 -0.047 1.00 0.00 O ATOM 405 CB LEU A 268 5.293 0.575 0.206 1.00 0.00 C ATOM 406 CG LEU A 268 4.452 -0.391 -0.643 1.00 0.00 C ATOM 407 CD1 LEU A 268 3.476 -1.177 0.223 1.00 0.00 C ATOM 408 CD2 LEU A 268 3.698 0.369 -1.729 1.00 0.00 C ATOM 0 H LEU A 268 7.194 1.803 -1.151 1.00 0.00 H new ATOM 0 HA LEU A 268 7.066 0.138 1.322 1.00 0.00 H new ATOM 0 HB2 LEU A 268 4.902 0.555 1.223 1.00 0.00 H new ATOM 0 HB3 LEU A 268 5.135 1.583 -0.177 1.00 0.00 H new ATOM 0 HG LEU A 268 5.133 -1.099 -1.116 1.00 0.00 H new ATOM 0 HD11 LEU A 268 2.895 -1.852 -0.405 1.00 0.00 H new ATOM 0 HD12 LEU A 268 4.030 -1.756 0.962 1.00 0.00 H new ATOM 0 HD13 LEU A 268 2.804 -0.486 0.732 1.00 0.00 H new ATOM 0 HD21 LEU A 268 3.108 -0.331 -2.320 1.00 0.00 H new ATOM 0 HD22 LEU A 268 3.036 1.102 -1.268 1.00 0.00 H new ATOM 0 HD23 LEU A 268 4.410 0.880 -2.377 1.00 0.00 H new ATOM 420 N ALA A 269 7.898 -0.663 -1.657 1.00 0.00 N ATOM 421 CA ALA A 269 8.433 -1.738 -2.470 1.00 0.00 C ATOM 422 C ALA A 269 9.938 -1.815 -2.276 1.00 0.00 C ATOM 423 O ALA A 269 10.525 -2.897 -2.293 1.00 0.00 O ATOM 424 CB ALA A 269 8.081 -1.528 -3.936 1.00 0.00 C ATOM 0 H ALA A 269 8.040 0.269 -2.046 1.00 0.00 H new ATOM 0 HA ALA A 269 7.988 -2.682 -2.157 1.00 0.00 H new ATOM 0 HB1 ALA A 269 8.491 -2.345 -4.529 1.00 0.00 H new ATOM 0 HB2 ALA A 269 6.997 -1.505 -4.050 1.00 0.00 H new ATOM 0 HB3 ALA A 269 8.502 -0.583 -4.280 1.00 0.00 H new ATOM 430 N PHE A 270 10.555 -0.655 -2.056 1.00 0.00 N ATOM 431 CA PHE A 270 11.987 -0.594 -1.818 1.00 0.00 C ATOM 432 C PHE A 270 12.274 -0.976 -0.375 1.00 0.00 C ATOM 433 O PHE A 270 13.319 -1.550 -0.070 1.00 0.00 O ATOM 434 CB PHE A 270 12.534 0.804 -2.107 1.00 0.00 C ATOM 435 CG PHE A 270 14.035 0.876 -2.080 1.00 0.00 C ATOM 436 CD1 PHE A 270 14.720 0.822 -0.877 1.00 0.00 C ATOM 437 CD2 PHE A 270 14.758 0.998 -3.255 1.00 0.00 C ATOM 438 CE1 PHE A 270 16.101 0.888 -0.847 1.00 0.00 C ATOM 439 CE2 PHE A 270 16.138 1.065 -3.232 1.00 0.00 C ATOM 440 CZ PHE A 270 16.811 1.010 -2.026 1.00 0.00 C ATOM 0 H PHE A 270 10.084 0.249 -2.039 1.00 0.00 H new ATOM 0 HA PHE A 270 12.482 -1.294 -2.491 1.00 0.00 H new ATOM 0 HB2 PHE A 270 12.180 1.129 -3.085 1.00 0.00 H new ATOM 0 HB3 PHE A 270 12.131 1.502 -1.373 1.00 0.00 H new ATOM 0 HD1 PHE A 270 14.170 0.727 0.047 1.00 0.00 H new ATOM 0 HD2 PHE A 270 14.237 1.041 -4.200 1.00 0.00 H new ATOM 0 HE1 PHE A 270 16.624 0.844 0.097 1.00 0.00 H new ATOM 0 HE2 PHE A 270 16.690 1.160 -4.155 1.00 0.00 H new ATOM 0 HZ PHE A 270 17.890 1.062 -2.005 1.00 0.00 H new ATOM 450 N GLU A 271 11.323 -0.676 0.514 1.00 0.00 N ATOM 451 CA GLU A 271 11.472 -1.017 1.918 1.00 0.00 C ATOM 452 C GLU A 271 11.616 -2.525 2.059 1.00 0.00 C ATOM 453 O GLU A 271 12.280 -3.017 2.970 1.00 0.00 O ATOM 454 CB GLU A 271 10.270 -0.518 2.725 1.00 0.00 C ATOM 455 CG GLU A 271 10.261 -0.994 4.170 1.00 0.00 C ATOM 456 CD GLU A 271 11.532 -0.632 4.911 1.00 0.00 C ATOM 457 OE1 GLU A 271 12.130 0.416 4.590 1.00 0.00 O ATOM 458 OE2 GLU A 271 11.931 -1.398 5.814 1.00 0.00 O ATOM 0 H GLU A 271 10.451 -0.201 0.282 1.00 0.00 H new ATOM 0 HA GLU A 271 12.366 -0.531 2.309 1.00 0.00 H new ATOM 0 HB2 GLU A 271 10.262 0.572 2.711 1.00 0.00 H new ATOM 0 HB3 GLU A 271 9.353 -0.850 2.237 1.00 0.00 H new ATOM 0 HG2 GLU A 271 9.407 -0.557 4.687 1.00 0.00 H new ATOM 0 HG3 GLU A 271 10.128 -2.076 4.191 1.00 0.00 H new ATOM 465 N GLY A 272 10.998 -3.254 1.130 1.00 0.00 N ATOM 466 CA GLY A 272 11.082 -4.698 1.155 1.00 0.00 C ATOM 467 C GLY A 272 9.744 -5.366 1.378 1.00 0.00 C ATOM 468 O GLY A 272 9.684 -6.445 1.970 1.00 0.00 O ATOM 0 H GLY A 272 10.444 -2.868 0.365 1.00 0.00 H new ATOM 0 HA2 GLY A 272 11.503 -5.048 0.213 1.00 0.00 H new ATOM 0 HA3 GLY A 272 11.769 -5.002 1.944 1.00 0.00 H new ATOM 472 N PHE A 273 8.663 -4.750 0.899 1.00 0.00 N ATOM 473 CA PHE A 273 7.348 -5.348 1.065 1.00 0.00 C ATOM 474 C PHE A 273 6.438 -5.096 -0.134 1.00 0.00 C ATOM 475 O PHE A 273 6.041 -3.969 -0.415 1.00 0.00 O ATOM 476 CB PHE A 273 6.705 -4.926 2.394 1.00 0.00 C ATOM 477 CG PHE A 273 6.220 -3.497 2.535 1.00 0.00 C ATOM 478 CD1 PHE A 273 7.098 -2.421 2.737 1.00 0.00 C ATOM 479 CD2 PHE A 273 4.859 -3.243 2.590 1.00 0.00 C ATOM 480 CE1 PHE A 273 6.615 -1.149 2.983 1.00 0.00 C ATOM 481 CE2 PHE A 273 4.392 -1.977 2.814 1.00 0.00 C ATOM 482 CZ PHE A 273 5.262 -0.933 3.018 1.00 0.00 C ATOM 0 H PHE A 273 8.674 -3.858 0.405 1.00 0.00 H new ATOM 0 HA PHE A 273 7.488 -6.428 1.108 1.00 0.00 H new ATOM 0 HB2 PHE A 273 5.856 -5.585 2.577 1.00 0.00 H new ATOM 0 HB3 PHE A 273 7.429 -5.111 3.187 1.00 0.00 H new ATOM 0 HD1 PHE A 273 8.164 -2.589 2.700 1.00 0.00 H new ATOM 0 HD2 PHE A 273 4.159 -4.054 2.454 1.00 0.00 H new ATOM 0 HE1 PHE A 273 7.300 -0.330 3.147 1.00 0.00 H new ATOM 0 HE2 PHE A 273 3.327 -1.796 2.831 1.00 0.00 H new ATOM 0 HZ PHE A 273 4.879 0.059 3.206 1.00 0.00 H new ATOM 492 N ASP A 274 6.141 -6.190 -0.844 1.00 0.00 N ATOM 493 CA ASP A 274 5.301 -6.176 -2.046 1.00 0.00 C ATOM 494 C ASP A 274 4.220 -5.100 -2.002 1.00 0.00 C ATOM 495 O ASP A 274 3.812 -4.649 -0.932 1.00 0.00 O ATOM 496 CB ASP A 274 4.656 -7.549 -2.246 1.00 0.00 C ATOM 497 CG ASP A 274 5.094 -8.213 -3.537 1.00 0.00 C ATOM 498 OD1 ASP A 274 5.122 -7.524 -4.578 1.00 0.00 O ATOM 499 OD2 ASP A 274 5.408 -9.422 -3.507 1.00 0.00 O ATOM 0 H ASP A 274 6.481 -7.120 -0.597 1.00 0.00 H new ATOM 0 HA ASP A 274 5.954 -5.940 -2.887 1.00 0.00 H new ATOM 0 HB2 ASP A 274 4.912 -8.193 -1.405 1.00 0.00 H new ATOM 0 HB3 ASP A 274 3.571 -7.441 -2.246 1.00 0.00 H new ATOM 504 N SER A 275 3.767 -4.698 -3.188 1.00 0.00 N ATOM 505 CA SER A 275 2.739 -3.674 -3.325 1.00 0.00 C ATOM 506 C SER A 275 2.548 -3.298 -4.790 1.00 0.00 C ATOM 507 O SER A 275 3.318 -3.710 -5.660 1.00 0.00 O ATOM 508 CB SER A 275 3.132 -2.431 -2.539 1.00 0.00 C ATOM 509 OG SER A 275 4.409 -1.968 -2.940 1.00 0.00 O ATOM 0 H SER A 275 4.102 -5.072 -4.076 1.00 0.00 H new ATOM 0 HA SER A 275 1.804 -4.076 -2.934 1.00 0.00 H new ATOM 0 HB2 SER A 275 2.390 -1.647 -2.694 1.00 0.00 H new ATOM 0 HB3 SER A 275 3.140 -2.656 -1.473 1.00 0.00 H new ATOM 0 HG SER A 275 4.326 -1.459 -3.773 1.00 0.00 H new ATOM 515 N LYS A 276 1.520 -2.509 -5.044 1.00 0.00 N ATOM 516 CA LYS A 276 1.203 -2.050 -6.398 1.00 0.00 C ATOM 517 C LYS A 276 0.524 -0.681 -6.360 1.00 0.00 C ATOM 518 O LYS A 276 -0.096 -0.313 -5.363 1.00 0.00 O ATOM 519 CB LYS A 276 0.306 -3.062 -7.115 1.00 0.00 C ATOM 520 CG LYS A 276 1.077 -4.179 -7.799 1.00 0.00 C ATOM 521 CD LYS A 276 0.275 -4.794 -8.935 1.00 0.00 C ATOM 522 CE LYS A 276 0.707 -4.244 -10.285 1.00 0.00 C ATOM 523 NZ LYS A 276 -0.086 -4.825 -11.402 1.00 0.00 N ATOM 0 H LYS A 276 0.880 -2.166 -4.327 1.00 0.00 H new ATOM 0 HA LYS A 276 2.138 -1.959 -6.951 1.00 0.00 H new ATOM 0 HB2 LYS A 276 -0.385 -3.498 -6.394 1.00 0.00 H new ATOM 0 HB3 LYS A 276 -0.296 -2.539 -7.858 1.00 0.00 H new ATOM 0 HG2 LYS A 276 2.018 -3.789 -8.186 1.00 0.00 H new ATOM 0 HG3 LYS A 276 1.327 -4.950 -7.070 1.00 0.00 H new ATOM 0 HD2 LYS A 276 0.400 -5.877 -8.925 1.00 0.00 H new ATOM 0 HD3 LYS A 276 -0.786 -4.594 -8.782 1.00 0.00 H new ATOM 0 HE2 LYS A 276 0.596 -3.160 -10.287 1.00 0.00 H new ATOM 0 HE3 LYS A 276 1.764 -4.457 -10.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 276 0.240 -4.424 -12.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 276 0.039 -5.857 -11.417 1.00 0.00 H new ATOM 0 HZ3 LYS A 276 -1.092 -4.600 -11.267 1.00 0.00 H new ATOM 537 N ILE A 277 0.654 0.073 -7.451 1.00 0.00 N ATOM 538 CA ILE A 277 0.063 1.408 -7.534 1.00 0.00 C ATOM 539 C ILE A 277 -1.109 1.457 -8.512 1.00 0.00 C ATOM 540 O ILE A 277 -1.222 0.622 -9.409 1.00 0.00 O ATOM 541 CB ILE A 277 1.111 2.458 -7.959 1.00 0.00 C ATOM 542 CG1 ILE A 277 0.525 3.869 -7.860 1.00 0.00 C ATOM 543 CG2 ILE A 277 1.606 2.182 -9.371 1.00 0.00 C ATOM 544 CD1 ILE A 277 1.573 4.948 -7.701 1.00 0.00 C ATOM 0 H ILE A 277 1.162 -0.217 -8.287 1.00 0.00 H new ATOM 0 HA ILE A 277 -0.304 1.641 -6.535 1.00 0.00 H new ATOM 0 HB ILE A 277 1.961 2.389 -7.280 1.00 0.00 H new ATOM 0 HG12 ILE A 277 -0.063 4.073 -8.755 1.00 0.00 H new ATOM 0 HG13 ILE A 277 -0.160 3.911 -7.013 1.00 0.00 H new ATOM 0 HG21 ILE A 277 2.344 2.934 -9.651 1.00 0.00 H new ATOM 0 HG22 ILE A 277 2.063 1.193 -9.410 1.00 0.00 H new ATOM 0 HG23 ILE A 277 0.766 2.221 -10.065 1.00 0.00 H new ATOM 0 HD11 ILE A 277 1.086 5.921 -7.637 1.00 0.00 H new ATOM 0 HD12 ILE A 277 2.145 4.768 -6.791 1.00 0.00 H new ATOM 0 HD13 ILE A 277 2.244 4.933 -8.560 1.00 0.00 H new ATOM 556 N THR A 278 -1.972 2.452 -8.327 1.00 0.00 N ATOM 557 CA THR A 278 -3.139 2.639 -9.183 1.00 0.00 C ATOM 558 C THR A 278 -3.927 3.876 -8.755 1.00 0.00 C ATOM 559 O THR A 278 -4.369 3.976 -7.613 1.00 0.00 O ATOM 560 CB THR A 278 -4.043 1.407 -9.136 1.00 0.00 C ATOM 561 OG1 THR A 278 -3.861 0.697 -7.924 1.00 0.00 O ATOM 562 CG2 THR A 278 -3.802 0.442 -10.276 1.00 0.00 C ATOM 0 H THR A 278 -1.883 3.146 -7.585 1.00 0.00 H new ATOM 0 HA THR A 278 -2.789 2.781 -10.205 1.00 0.00 H new ATOM 0 HB THR A 278 -5.059 1.792 -9.219 1.00 0.00 H new ATOM 0 HG1 THR A 278 -3.821 1.330 -7.177 1.00 0.00 H new ATOM 0 HG21 THR A 278 -4.477 -0.409 -10.181 1.00 0.00 H new ATOM 0 HG22 THR A 278 -3.985 0.946 -11.225 1.00 0.00 H new ATOM 0 HG23 THR A 278 -2.770 0.092 -10.245 1.00 0.00 H new ATOM 570 N THR A 279 -4.096 4.817 -9.678 1.00 0.00 N ATOM 571 CA THR A 279 -4.828 6.050 -9.391 1.00 0.00 C ATOM 572 C THR A 279 -6.330 5.793 -9.335 1.00 0.00 C ATOM 573 O THR A 279 -6.834 4.864 -9.965 1.00 0.00 O ATOM 574 CB THR A 279 -4.521 7.107 -10.453 1.00 0.00 C ATOM 575 OG1 THR A 279 -3.144 7.096 -10.789 1.00 0.00 O ATOM 576 CG2 THR A 279 -4.876 8.512 -10.017 1.00 0.00 C ATOM 0 H THR A 279 -3.737 4.752 -10.631 1.00 0.00 H new ATOM 0 HA THR A 279 -4.504 6.416 -8.417 1.00 0.00 H new ATOM 0 HB THR A 279 -5.138 6.843 -11.311 1.00 0.00 H new ATOM 0 HG1 THR A 279 -2.968 7.778 -11.471 1.00 0.00 H new ATOM 0 HG21 THR A 279 -4.633 9.213 -10.816 1.00 0.00 H new ATOM 0 HG22 THR A 279 -5.942 8.566 -9.798 1.00 0.00 H new ATOM 0 HG23 THR A 279 -4.308 8.770 -9.123 1.00 0.00 H new ATOM 584 N ASN A 280 -7.044 6.624 -8.576 1.00 0.00 N ATOM 585 CA ASN A 280 -8.490 6.477 -8.444 1.00 0.00 C ATOM 586 C ASN A 280 -9.077 7.558 -7.541 1.00 0.00 C ATOM 587 O ASN A 280 -8.515 7.881 -6.494 1.00 0.00 O ATOM 588 CB ASN A 280 -8.833 5.094 -7.888 1.00 0.00 C ATOM 589 CG ASN A 280 -10.015 4.463 -8.597 1.00 0.00 C ATOM 590 OD1 ASN A 280 -9.854 3.547 -9.403 1.00 0.00 O ATOM 591 ND2 ASN A 280 -11.214 4.953 -8.300 1.00 0.00 N ATOM 0 H ASN A 280 -6.647 7.400 -8.047 1.00 0.00 H new ATOM 0 HA ASN A 280 -8.928 6.586 -9.436 1.00 0.00 H new ATOM 0 HB2 ASN A 280 -7.965 4.442 -7.983 1.00 0.00 H new ATOM 0 HB3 ASN A 280 -9.053 5.178 -6.824 1.00 0.00 H new ATOM 0 HD21 ASN A 280 -12.047 4.569 -8.746 1.00 0.00 H new ATOM 0 HD22 ASN A 280 -11.302 5.713 -7.626 1.00 0.00 H new ATOM 598 N ASN A 281 -10.218 8.107 -7.954 1.00 0.00 N ATOM 599 CA ASN A 281 -10.902 9.148 -7.187 1.00 0.00 C ATOM 600 C ASN A 281 -10.150 10.480 -7.230 1.00 0.00 C ATOM 601 O ASN A 281 -10.537 11.436 -6.560 1.00 0.00 O ATOM 602 CB ASN A 281 -11.092 8.703 -5.735 1.00 0.00 C ATOM 603 CG ASN A 281 -12.547 8.455 -5.390 1.00 0.00 C ATOM 604 OD1 ASN A 281 -13.101 9.091 -4.493 1.00 0.00 O ATOM 605 ND2 ASN A 281 -13.174 7.526 -6.102 1.00 0.00 N ATOM 0 H ASN A 281 -10.691 7.847 -8.820 1.00 0.00 H new ATOM 0 HA ASN A 281 -11.877 9.302 -7.650 1.00 0.00 H new ATOM 0 HB2 ASN A 281 -10.520 7.792 -5.560 1.00 0.00 H new ATOM 0 HB3 ASN A 281 -10.689 9.466 -5.069 1.00 0.00 H new ATOM 0 HD21 ASN A 281 -14.154 7.315 -5.915 1.00 0.00 H new ATOM 0 HD22 ASN A 281 -12.675 7.023 -6.836 1.00 0.00 H new ATOM 612 N GLY A 282 -9.080 10.544 -8.019 1.00 0.00 N ATOM 613 CA GLY A 282 -8.313 11.772 -8.123 1.00 0.00 C ATOM 614 C GLY A 282 -6.916 11.648 -7.544 1.00 0.00 C ATOM 615 O GLY A 282 -5.997 12.344 -7.975 1.00 0.00 O ATOM 0 H GLY A 282 -8.732 9.770 -8.586 1.00 0.00 H new ATOM 0 HA2 GLY A 282 -8.242 12.062 -9.171 1.00 0.00 H new ATOM 0 HA3 GLY A 282 -8.845 12.571 -7.607 1.00 0.00 H new ATOM 619 N TRP A 283 -6.752 10.760 -6.568 1.00 0.00 N ATOM 620 CA TRP A 283 -5.463 10.549 -5.938 1.00 0.00 C ATOM 621 C TRP A 283 -4.891 9.191 -6.313 1.00 0.00 C ATOM 622 O TRP A 283 -5.558 8.369 -6.942 1.00 0.00 O ATOM 623 CB TRP A 283 -5.562 10.678 -4.409 1.00 0.00 C ATOM 624 CG TRP A 283 -6.953 10.781 -3.842 1.00 0.00 C ATOM 625 CD1 TRP A 283 -7.986 9.927 -4.050 1.00 0.00 C ATOM 626 CD2 TRP A 283 -7.441 11.781 -2.940 1.00 0.00 C ATOM 627 NE1 TRP A 283 -9.098 10.342 -3.358 1.00 0.00 N ATOM 628 CE2 TRP A 283 -8.788 11.480 -2.667 1.00 0.00 C ATOM 629 CE3 TRP A 283 -6.873 12.904 -2.346 1.00 0.00 C ATOM 630 CZ2 TRP A 283 -9.572 12.264 -1.824 1.00 0.00 C ATOM 631 CZ3 TRP A 283 -7.646 13.682 -1.507 1.00 0.00 C ATOM 632 CH2 TRP A 283 -8.985 13.360 -1.254 1.00 0.00 C ATOM 0 H TRP A 283 -7.502 10.175 -6.199 1.00 0.00 H new ATOM 0 HA TRP A 283 -4.789 11.324 -6.304 1.00 0.00 H new ATOM 0 HB2 TRP A 283 -5.071 9.815 -3.959 1.00 0.00 H new ATOM 0 HB3 TRP A 283 -5.000 11.560 -4.102 1.00 0.00 H new ATOM 0 HD1 TRP A 283 -7.941 9.045 -4.672 1.00 0.00 H new ATOM 0 HE1 TRP A 283 -10.006 9.877 -3.360 1.00 0.00 H new ATOM 0 HE3 TRP A 283 -5.842 13.163 -2.538 1.00 0.00 H new ATOM 0 HZ2 TRP A 283 -10.605 12.016 -1.628 1.00 0.00 H new ATOM 0 HZ3 TRP A 283 -7.211 14.552 -1.039 1.00 0.00 H new ATOM 0 HH2 TRP A 283 -9.566 13.989 -0.596 1.00 0.00 H new ATOM 643 N ASN A 284 -3.646 8.975 -5.926 1.00 0.00 N ATOM 644 CA ASN A 284 -2.956 7.719 -6.211 1.00 0.00 C ATOM 645 C ASN A 284 -3.327 6.651 -5.184 1.00 0.00 C ATOM 646 O ASN A 284 -3.120 6.831 -3.985 1.00 0.00 O ATOM 647 CB ASN A 284 -1.441 7.936 -6.222 1.00 0.00 C ATOM 648 CG ASN A 284 -0.832 7.703 -7.591 1.00 0.00 C ATOM 649 OD1 ASN A 284 -0.758 6.569 -8.066 1.00 0.00 O ATOM 650 ND2 ASN A 284 -0.390 8.779 -8.231 1.00 0.00 N ATOM 0 H ASN A 284 -3.086 9.654 -5.411 1.00 0.00 H new ATOM 0 HA ASN A 284 -3.270 7.373 -7.196 1.00 0.00 H new ATOM 0 HB2 ASN A 284 -1.220 8.953 -5.898 1.00 0.00 H new ATOM 0 HB3 ASN A 284 -0.975 7.264 -5.501 1.00 0.00 H new ATOM 0 HD21 ASN A 284 0.032 8.685 -9.155 1.00 0.00 H new ATOM 0 HD22 ASN A 284 -0.472 9.699 -7.799 1.00 0.00 H new ATOM 657 N ARG A 285 -3.880 5.542 -5.665 1.00 0.00 N ATOM 658 CA ARG A 285 -4.287 4.444 -4.793 1.00 0.00 C ATOM 659 C ARG A 285 -3.304 3.280 -4.875 1.00 0.00 C ATOM 660 O ARG A 285 -2.931 2.844 -5.962 1.00 0.00 O ATOM 661 CB ARG A 285 -5.690 3.963 -5.176 1.00 0.00 C ATOM 662 CG ARG A 285 -6.455 3.328 -4.027 1.00 0.00 C ATOM 663 CD ARG A 285 -7.957 3.464 -4.217 1.00 0.00 C ATOM 664 NE ARG A 285 -8.666 2.235 -3.865 1.00 0.00 N ATOM 665 CZ ARG A 285 -8.627 1.123 -4.595 1.00 0.00 C ATOM 666 NH1 ARG A 285 -7.917 1.079 -5.716 1.00 0.00 N ATOM 667 NH2 ARG A 285 -9.301 0.050 -4.204 1.00 0.00 N ATOM 0 H ARG A 285 -4.057 5.379 -6.656 1.00 0.00 H new ATOM 0 HA ARG A 285 -4.295 4.814 -3.768 1.00 0.00 H new ATOM 0 HB2 ARG A 285 -6.262 4.808 -5.558 1.00 0.00 H new ATOM 0 HB3 ARG A 285 -5.607 3.241 -5.988 1.00 0.00 H new ATOM 0 HG2 ARG A 285 -6.191 2.273 -3.951 1.00 0.00 H new ATOM 0 HG3 ARG A 285 -6.162 3.799 -3.089 1.00 0.00 H new ATOM 0 HD2 ARG A 285 -8.327 4.285 -3.603 1.00 0.00 H new ATOM 0 HD3 ARG A 285 -8.170 3.721 -5.255 1.00 0.00 H new ATOM 0 HE ARG A 285 -9.223 2.229 -3.010 1.00 0.00 H new ATOM 0 HH11 ARG A 285 -7.397 1.901 -6.023 1.00 0.00 H new ATOM 0 HH12 ARG A 285 -7.892 0.223 -6.270 1.00 0.00 H new ATOM 0 HH21 ARG A 285 -9.849 0.077 -3.344 1.00 0.00 H new ATOM 0 HH22 ARG A 285 -9.271 -0.803 -4.763 1.00 0.00 H new ATOM 681 N VAL A 286 -2.892 2.774 -3.715 1.00 0.00 N ATOM 682 CA VAL A 286 -1.960 1.655 -3.661 1.00 0.00 C ATOM 683 C VAL A 286 -2.690 0.361 -3.318 1.00 0.00 C ATOM 684 O VAL A 286 -3.778 0.374 -2.746 1.00 0.00 O ATOM 685 CB VAL A 286 -0.836 1.898 -2.632 1.00 0.00 C ATOM 686 CG1 VAL A 286 0.144 0.732 -2.574 1.00 0.00 C ATOM 687 CG2 VAL A 286 -0.107 3.193 -2.941 1.00 0.00 C ATOM 0 H VAL A 286 -3.189 3.121 -2.803 1.00 0.00 H new ATOM 0 HA VAL A 286 -1.509 1.566 -4.649 1.00 0.00 H new ATOM 0 HB VAL A 286 -1.302 1.980 -1.650 1.00 0.00 H new ATOM 0 HG11 VAL A 286 0.919 0.944 -1.837 1.00 0.00 H new ATOM 0 HG12 VAL A 286 -0.388 -0.176 -2.290 1.00 0.00 H new ATOM 0 HG13 VAL A 286 0.602 0.593 -3.553 1.00 0.00 H new ATOM 0 HG21 VAL A 286 0.683 3.350 -2.206 1.00 0.00 H new ATOM 0 HG22 VAL A 286 0.331 3.135 -3.938 1.00 0.00 H new ATOM 0 HG23 VAL A 286 -0.810 4.025 -2.901 1.00 0.00 H new ATOM 697 N VAL A 287 -2.065 -0.746 -3.678 1.00 0.00 N ATOM 698 CA VAL A 287 -2.604 -2.082 -3.437 1.00 0.00 C ATOM 699 C VAL A 287 -1.469 -3.098 -3.525 1.00 0.00 C ATOM 700 O VAL A 287 -0.561 -2.927 -4.326 1.00 0.00 O ATOM 701 CB VAL A 287 -3.693 -2.460 -4.472 1.00 0.00 C ATOM 702 CG1 VAL A 287 -4.724 -1.349 -4.614 1.00 0.00 C ATOM 703 CG2 VAL A 287 -3.072 -2.777 -5.827 1.00 0.00 C ATOM 0 H VAL A 287 -1.161 -0.748 -4.150 1.00 0.00 H new ATOM 0 HA VAL A 287 -3.060 -2.087 -2.447 1.00 0.00 H new ATOM 0 HB VAL A 287 -4.198 -3.353 -4.105 1.00 0.00 H new ATOM 0 HG11 VAL A 287 -5.476 -1.642 -5.347 1.00 0.00 H new ATOM 0 HG12 VAL A 287 -5.204 -1.173 -3.652 1.00 0.00 H new ATOM 0 HG13 VAL A 287 -4.231 -0.435 -4.946 1.00 0.00 H new ATOM 0 HG21 VAL A 287 -3.858 -3.039 -6.535 1.00 0.00 H new ATOM 0 HG22 VAL A 287 -2.531 -1.904 -6.192 1.00 0.00 H new ATOM 0 HG23 VAL A 287 -2.382 -3.615 -5.724 1.00 0.00 H new ATOM 713 N ILE A 288 -1.519 -4.161 -2.733 1.00 0.00 N ATOM 714 CA ILE A 288 -0.467 -5.179 -2.790 1.00 0.00 C ATOM 715 C ILE A 288 -1.043 -6.501 -3.272 1.00 0.00 C ATOM 716 O ILE A 288 -2.068 -6.959 -2.766 1.00 0.00 O ATOM 717 CB ILE A 288 0.234 -5.407 -1.426 1.00 0.00 C ATOM 718 CG1 ILE A 288 0.570 -4.083 -0.735 1.00 0.00 C ATOM 719 CG2 ILE A 288 1.496 -6.237 -1.599 1.00 0.00 C ATOM 720 CD1 ILE A 288 0.643 -4.192 0.775 1.00 0.00 C ATOM 0 H ILE A 288 -2.259 -4.343 -2.055 1.00 0.00 H new ATOM 0 HA ILE A 288 0.282 -4.806 -3.489 1.00 0.00 H new ATOM 0 HB ILE A 288 -0.465 -5.952 -0.792 1.00 0.00 H new ATOM 0 HG12 ILE A 288 1.525 -3.718 -1.112 1.00 0.00 H new ATOM 0 HG13 ILE A 288 -0.183 -3.341 -1.002 1.00 0.00 H new ATOM 0 HG21 ILE A 288 1.971 -6.384 -0.629 1.00 0.00 H new ATOM 0 HG22 ILE A 288 1.239 -7.206 -2.027 1.00 0.00 H new ATOM 0 HG23 ILE A 288 2.185 -5.717 -2.265 1.00 0.00 H new ATOM 0 HD11 ILE A 288 0.885 -3.217 1.199 1.00 0.00 H new ATOM 0 HD12 ILE A 288 -0.319 -4.528 1.162 1.00 0.00 H new ATOM 0 HD13 ILE A 288 1.416 -4.910 1.051 1.00 0.00 H new ATOM 732 N GLY A 289 -0.380 -7.110 -4.255 1.00 0.00 N ATOM 733 CA GLY A 289 -0.845 -8.378 -4.793 1.00 0.00 C ATOM 734 C GLY A 289 -1.352 -9.311 -3.712 1.00 0.00 C ATOM 735 O GLY A 289 -0.839 -9.294 -2.592 1.00 0.00 O ATOM 0 H GLY A 289 0.470 -6.748 -4.687 1.00 0.00 H new ATOM 0 HA2 GLY A 289 -1.642 -8.194 -5.514 1.00 0.00 H new ATOM 0 HA3 GLY A 289 -0.031 -8.861 -5.334 1.00 0.00 H new ATOM 739 N PRO A 290 -2.368 -10.138 -4.007 1.00 0.00 N ATOM 740 CA PRO A 290 -2.928 -11.067 -3.029 1.00 0.00 C ATOM 741 C PRO A 290 -1.837 -11.788 -2.243 1.00 0.00 C ATOM 742 O PRO A 290 -1.187 -12.699 -2.755 1.00 0.00 O ATOM 743 CB PRO A 290 -3.713 -12.051 -3.892 1.00 0.00 C ATOM 744 CG PRO A 290 -4.125 -11.260 -5.088 1.00 0.00 C ATOM 745 CD PRO A 290 -3.048 -10.230 -5.314 1.00 0.00 C ATOM 0 HA PRO A 290 -3.538 -10.565 -2.278 1.00 0.00 H new ATOM 0 HB2 PRO A 290 -3.100 -12.906 -4.175 1.00 0.00 H new ATOM 0 HB3 PRO A 290 -4.579 -12.442 -3.358 1.00 0.00 H new ATOM 0 HG2 PRO A 290 -4.234 -11.905 -5.960 1.00 0.00 H new ATOM 0 HG3 PRO A 290 -5.090 -10.782 -4.923 1.00 0.00 H new ATOM 0 HD2 PRO A 290 -2.360 -10.537 -6.102 1.00 0.00 H new ATOM 0 HD3 PRO A 290 -3.469 -9.270 -5.614 1.00 0.00 H new ATOM 753 N VAL A 291 -1.632 -11.361 -1.002 1.00 0.00 N ATOM 754 CA VAL A 291 -0.606 -11.951 -0.151 1.00 0.00 C ATOM 755 C VAL A 291 -1.177 -13.068 0.717 1.00 0.00 C ATOM 756 O VAL A 291 -2.388 -13.171 0.896 1.00 0.00 O ATOM 757 CB VAL A 291 0.051 -10.886 0.749 1.00 0.00 C ATOM 758 CG1 VAL A 291 0.752 -9.834 -0.097 1.00 0.00 C ATOM 759 CG2 VAL A 291 -0.979 -10.239 1.664 1.00 0.00 C ATOM 0 H VAL A 291 -2.163 -10.609 -0.563 1.00 0.00 H new ATOM 0 HA VAL A 291 0.151 -12.373 -0.812 1.00 0.00 H new ATOM 0 HB VAL A 291 0.795 -11.380 1.374 1.00 0.00 H new ATOM 0 HG11 VAL A 291 1.210 -9.090 0.554 1.00 0.00 H new ATOM 0 HG12 VAL A 291 1.523 -10.309 -0.704 1.00 0.00 H new ATOM 0 HG13 VAL A 291 0.026 -9.348 -0.749 1.00 0.00 H new ATOM 0 HG21 VAL A 291 -0.491 -9.491 2.289 1.00 0.00 H new ATOM 0 HG22 VAL A 291 -1.751 -9.761 1.062 1.00 0.00 H new ATOM 0 HG23 VAL A 291 -1.433 -11.001 2.297 1.00 0.00 H new ATOM 769 N LYS A 292 -0.293 -13.907 1.248 1.00 0.00 N ATOM 770 CA LYS A 292 -0.710 -15.020 2.094 1.00 0.00 C ATOM 771 C LYS A 292 0.031 -14.998 3.427 1.00 0.00 C ATOM 772 O LYS A 292 1.252 -14.845 3.468 1.00 0.00 O ATOM 773 CB LYS A 292 -0.458 -16.351 1.379 1.00 0.00 C ATOM 774 CG LYS A 292 -1.730 -17.073 0.967 1.00 0.00 C ATOM 775 CD LYS A 292 -2.468 -17.643 2.170 1.00 0.00 C ATOM 776 CE LYS A 292 -2.446 -19.163 2.172 1.00 0.00 C ATOM 777 NZ LYS A 292 -3.764 -19.737 2.559 1.00 0.00 N ATOM 0 H LYS A 292 0.715 -13.838 1.108 1.00 0.00 H new ATOM 0 HA LYS A 292 -1.777 -14.916 2.291 1.00 0.00 H new ATOM 0 HB2 LYS A 292 0.149 -16.168 0.492 1.00 0.00 H new ATOM 0 HB3 LYS A 292 0.122 -17.001 2.034 1.00 0.00 H new ATOM 0 HG2 LYS A 292 -2.383 -16.383 0.433 1.00 0.00 H new ATOM 0 HG3 LYS A 292 -1.484 -17.879 0.276 1.00 0.00 H new ATOM 0 HD2 LYS A 292 -2.012 -17.271 3.087 1.00 0.00 H new ATOM 0 HD3 LYS A 292 -3.500 -17.294 2.163 1.00 0.00 H new ATOM 0 HE2 LYS A 292 -2.170 -19.523 1.181 1.00 0.00 H new ATOM 0 HE3 LYS A 292 -1.680 -19.514 2.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 292 -3.707 -20.775 2.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 292 -4.016 -19.414 3.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 292 -4.491 -19.423 1.885 1.00 0.00 H new ATOM 791 N GLY A 293 -0.715 -15.152 4.515 1.00 0.00 N ATOM 792 CA GLY A 293 -0.108 -15.149 5.832 1.00 0.00 C ATOM 793 C GLY A 293 -1.091 -14.793 6.930 1.00 0.00 C ATOM 794 O GLY A 293 -1.993 -15.570 7.241 1.00 0.00 O ATOM 0 H GLY A 293 -1.727 -15.279 4.508 1.00 0.00 H new ATOM 0 HA2 GLY A 293 0.315 -16.133 6.034 1.00 0.00 H new ATOM 0 HA3 GLY A 293 0.718 -14.438 5.845 1.00 0.00 H new ATOM 798 N LYS A 294 -0.909 -13.613 7.519 1.00 0.00 N ATOM 799 CA LYS A 294 -1.775 -13.140 8.596 1.00 0.00 C ATOM 800 C LYS A 294 -1.140 -11.943 9.298 1.00 0.00 C ATOM 801 O LYS A 294 -1.836 -11.035 9.753 1.00 0.00 O ATOM 802 CB LYS A 294 -2.039 -14.257 9.612 1.00 0.00 C ATOM 803 CG LYS A 294 -3.476 -14.750 9.616 1.00 0.00 C ATOM 804 CD LYS A 294 -3.797 -15.526 10.882 1.00 0.00 C ATOM 805 CE LYS A 294 -3.089 -16.870 10.905 1.00 0.00 C ATOM 806 NZ LYS A 294 -1.747 -16.781 11.545 1.00 0.00 N ATOM 0 H LYS A 294 -0.164 -12.963 7.266 1.00 0.00 H new ATOM 0 HA LYS A 294 -2.726 -12.835 8.158 1.00 0.00 H new ATOM 0 HB2 LYS A 294 -1.377 -15.096 9.397 1.00 0.00 H new ATOM 0 HB3 LYS A 294 -1.785 -13.897 10.609 1.00 0.00 H new ATOM 0 HG2 LYS A 294 -4.153 -13.900 9.528 1.00 0.00 H new ATOM 0 HG3 LYS A 294 -3.646 -15.385 8.746 1.00 0.00 H new ATOM 0 HD2 LYS A 294 -3.500 -14.942 11.753 1.00 0.00 H new ATOM 0 HD3 LYS A 294 -4.874 -15.679 10.953 1.00 0.00 H new ATOM 0 HE2 LYS A 294 -3.701 -17.593 11.444 1.00 0.00 H new ATOM 0 HE3 LYS A 294 -2.981 -17.241 9.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 294 -1.026 -17.148 10.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 294 -1.535 -15.788 11.771 1.00 0.00 H new ATOM 0 HZ3 LYS A 294 -1.741 -17.344 12.419 1.00 0.00 H new ATOM 820 N GLU A 295 0.187 -11.954 9.382 1.00 0.00 N ATOM 821 CA GLU A 295 0.923 -10.876 10.026 1.00 0.00 C ATOM 822 C GLU A 295 1.697 -10.048 9.004 1.00 0.00 C ATOM 823 O GLU A 295 2.037 -8.894 9.262 1.00 0.00 O ATOM 824 CB GLU A 295 1.883 -11.441 11.076 1.00 0.00 C ATOM 825 CG GLU A 295 1.292 -11.493 12.475 1.00 0.00 C ATOM 826 CD GLU A 295 1.814 -10.386 13.371 1.00 0.00 C ATOM 827 OE1 GLU A 295 1.384 -9.227 13.195 1.00 0.00 O ATOM 828 OE2 GLU A 295 2.653 -10.680 14.249 1.00 0.00 O ATOM 0 H GLU A 295 0.774 -12.701 9.010 1.00 0.00 H new ATOM 0 HA GLU A 295 0.200 -10.224 10.516 1.00 0.00 H new ATOM 0 HB2 GLU A 295 2.182 -12.446 10.779 1.00 0.00 H new ATOM 0 HB3 GLU A 295 2.787 -10.832 11.095 1.00 0.00 H new ATOM 0 HG2 GLU A 295 0.206 -11.421 12.410 1.00 0.00 H new ATOM 0 HG3 GLU A 295 1.521 -12.459 12.926 1.00 0.00 H new ATOM 835 N ASN A 296 1.973 -10.637 7.844 1.00 0.00 N ATOM 836 CA ASN A 296 2.704 -9.937 6.795 1.00 0.00 C ATOM 837 C ASN A 296 1.896 -8.752 6.282 1.00 0.00 C ATOM 838 O ASN A 296 2.292 -7.602 6.452 1.00 0.00 O ATOM 839 CB ASN A 296 3.031 -10.888 5.642 1.00 0.00 C ATOM 840 CG ASN A 296 3.753 -12.138 6.108 1.00 0.00 C ATOM 841 OD1 ASN A 296 3.209 -13.240 6.053 1.00 0.00 O ATOM 842 ND2 ASN A 296 4.985 -11.970 6.573 1.00 0.00 N ATOM 0 H ASN A 296 1.703 -11.592 7.608 1.00 0.00 H new ATOM 0 HA ASN A 296 3.638 -9.567 7.218 1.00 0.00 H new ATOM 0 HB2 ASN A 296 2.108 -11.172 5.137 1.00 0.00 H new ATOM 0 HB3 ASN A 296 3.648 -10.367 4.910 1.00 0.00 H new ATOM 0 HD21 ASN A 296 5.520 -12.774 6.903 1.00 0.00 H new ATOM 0 HD22 ASN A 296 5.397 -11.037 6.600 1.00 0.00 H new ATOM 849 N ALA A 297 0.754 -9.041 5.669 1.00 0.00 N ATOM 850 CA ALA A 297 -0.125 -8.000 5.149 1.00 0.00 C ATOM 851 C ALA A 297 -0.439 -6.978 6.242 1.00 0.00 C ATOM 852 O ALA A 297 -0.494 -5.776 5.989 1.00 0.00 O ATOM 853 CB ALA A 297 -1.406 -8.631 4.620 1.00 0.00 C ATOM 0 H ALA A 297 0.414 -9.991 5.519 1.00 0.00 H new ATOM 0 HA ALA A 297 0.376 -7.481 4.332 1.00 0.00 H new ATOM 0 HB1 ALA A 297 -2.062 -7.852 4.232 1.00 0.00 H new ATOM 0 HB2 ALA A 297 -1.163 -9.332 3.822 1.00 0.00 H new ATOM 0 HB3 ALA A 297 -1.911 -9.161 5.428 1.00 0.00 H new ATOM 859 N ASP A 298 -0.630 -7.465 7.464 1.00 0.00 N ATOM 860 CA ASP A 298 -0.920 -6.591 8.594 1.00 0.00 C ATOM 861 C ASP A 298 0.303 -5.750 8.936 1.00 0.00 C ATOM 862 O ASP A 298 0.218 -4.526 9.033 1.00 0.00 O ATOM 863 CB ASP A 298 -1.354 -7.411 9.810 1.00 0.00 C ATOM 864 CG ASP A 298 -2.836 -7.737 9.790 1.00 0.00 C ATOM 865 OD1 ASP A 298 -3.651 -6.797 9.891 1.00 0.00 O ATOM 866 OD2 ASP A 298 -3.179 -8.932 9.671 1.00 0.00 O ATOM 0 H ASP A 298 -0.589 -8.457 7.696 1.00 0.00 H new ATOM 0 HA ASP A 298 -1.738 -5.926 8.316 1.00 0.00 H new ATOM 0 HB2 ASP A 298 -0.781 -8.338 9.843 1.00 0.00 H new ATOM 0 HB3 ASP A 298 -1.119 -6.859 10.720 1.00 0.00 H new ATOM 871 N SER A 299 1.451 -6.409 9.090 1.00 0.00 N ATOM 872 CA SER A 299 2.691 -5.706 9.388 1.00 0.00 C ATOM 873 C SER A 299 3.025 -4.768 8.236 1.00 0.00 C ATOM 874 O SER A 299 3.583 -3.688 8.430 1.00 0.00 O ATOM 875 CB SER A 299 3.834 -6.698 9.611 1.00 0.00 C ATOM 876 OG SER A 299 3.782 -7.254 10.913 1.00 0.00 O ATOM 0 H SER A 299 1.545 -7.422 9.013 1.00 0.00 H new ATOM 0 HA SER A 299 2.562 -5.128 10.303 1.00 0.00 H new ATOM 0 HB2 SER A 299 3.777 -7.495 8.870 1.00 0.00 H new ATOM 0 HB3 SER A 299 4.790 -6.195 9.465 1.00 0.00 H new ATOM 0 HG SER A 299 3.194 -8.038 10.911 1.00 0.00 H new ATOM 882 N THR A 300 2.644 -5.193 7.036 1.00 0.00 N ATOM 883 CA THR A 300 2.855 -4.414 5.827 1.00 0.00 C ATOM 884 C THR A 300 2.180 -3.054 5.971 1.00 0.00 C ATOM 885 O THR A 300 2.673 -2.049 5.462 1.00 0.00 O ATOM 886 CB THR A 300 2.300 -5.190 4.628 1.00 0.00 C ATOM 887 OG1 THR A 300 3.222 -6.180 4.208 1.00 0.00 O ATOM 888 CG2 THR A 300 1.981 -4.331 3.427 1.00 0.00 C ATOM 0 H THR A 300 2.180 -6.088 6.877 1.00 0.00 H new ATOM 0 HA THR A 300 3.920 -4.245 5.666 1.00 0.00 H new ATOM 0 HB THR A 300 1.368 -5.627 4.987 1.00 0.00 H new ATOM 0 HG1 THR A 300 3.177 -6.947 4.816 1.00 0.00 H new ATOM 0 HG21 THR A 300 1.594 -4.958 2.624 1.00 0.00 H new ATOM 0 HG22 THR A 300 1.232 -3.587 3.700 1.00 0.00 H new ATOM 0 HG23 THR A 300 2.887 -3.827 3.089 1.00 0.00 H new ATOM 896 N LEU A 301 1.063 -3.027 6.697 1.00 0.00 N ATOM 897 CA LEU A 301 0.349 -1.780 6.935 1.00 0.00 C ATOM 898 C LEU A 301 1.267 -0.811 7.660 1.00 0.00 C ATOM 899 O LEU A 301 1.435 0.336 7.247 1.00 0.00 O ATOM 900 CB LEU A 301 -0.919 -2.022 7.754 1.00 0.00 C ATOM 901 CG LEU A 301 -2.188 -1.409 7.163 1.00 0.00 C ATOM 902 CD1 LEU A 301 -2.017 0.093 6.968 1.00 0.00 C ATOM 903 CD2 LEU A 301 -2.527 -2.086 5.847 1.00 0.00 C ATOM 0 H LEU A 301 0.638 -3.849 7.126 1.00 0.00 H new ATOM 0 HA LEU A 301 0.050 -1.355 5.977 1.00 0.00 H new ATOM 0 HB2 LEU A 301 -1.067 -3.097 7.861 1.00 0.00 H new ATOM 0 HB3 LEU A 301 -0.770 -1.620 8.756 1.00 0.00 H new ATOM 0 HG LEU A 301 -3.012 -1.567 7.859 1.00 0.00 H new ATOM 0 HD11 LEU A 301 -2.931 0.512 6.546 1.00 0.00 H new ATOM 0 HD12 LEU A 301 -1.812 0.564 7.930 1.00 0.00 H new ATOM 0 HD13 LEU A 301 -1.185 0.279 6.288 1.00 0.00 H new ATOM 0 HD21 LEU A 301 -3.433 -1.643 5.433 1.00 0.00 H new ATOM 0 HD22 LEU A 301 -1.704 -1.951 5.146 1.00 0.00 H new ATOM 0 HD23 LEU A 301 -2.689 -3.151 6.016 1.00 0.00 H new ATOM 915 N ASN A 302 1.891 -1.301 8.727 1.00 0.00 N ATOM 916 CA ASN A 302 2.832 -0.498 9.488 1.00 0.00 C ATOM 917 C ASN A 302 4.019 -0.155 8.600 1.00 0.00 C ATOM 918 O ASN A 302 4.631 0.904 8.737 1.00 0.00 O ATOM 919 CB ASN A 302 3.299 -1.253 10.734 1.00 0.00 C ATOM 920 CG ASN A 302 2.515 -0.867 11.973 1.00 0.00 C ATOM 921 OD1 ASN A 302 1.378 -1.300 12.161 1.00 0.00 O ATOM 922 ND2 ASN A 302 3.119 -0.046 12.824 1.00 0.00 N ATOM 0 H ASN A 302 1.760 -2.249 9.081 1.00 0.00 H new ATOM 0 HA ASN A 302 2.343 0.419 9.816 1.00 0.00 H new ATOM 0 HB2 ASN A 302 3.200 -2.325 10.564 1.00 0.00 H new ATOM 0 HB3 ASN A 302 4.358 -1.053 10.901 1.00 0.00 H new ATOM 0 HD21 ASN A 302 2.640 0.250 13.674 1.00 0.00 H new ATOM 0 HD22 ASN A 302 4.062 0.288 12.628 1.00 0.00 H new ATOM 929 N ARG A 303 4.320 -1.060 7.668 1.00 0.00 N ATOM 930 CA ARG A 303 5.411 -0.856 6.730 1.00 0.00 C ATOM 931 C ARG A 303 5.040 0.248 5.748 1.00 0.00 C ATOM 932 O ARG A 303 5.885 1.043 5.346 1.00 0.00 O ATOM 933 CB ARG A 303 5.730 -2.153 5.983 1.00 0.00 C ATOM 934 CG ARG A 303 6.162 -3.289 6.897 1.00 0.00 C ATOM 935 CD ARG A 303 7.316 -4.083 6.301 1.00 0.00 C ATOM 936 NE ARG A 303 8.409 -4.257 7.254 1.00 0.00 N ATOM 937 CZ ARG A 303 9.654 -4.576 6.905 1.00 0.00 C ATOM 938 NH1 ARG A 303 9.966 -4.757 5.627 1.00 0.00 N ATOM 939 NH2 ARG A 303 10.588 -4.713 7.836 1.00 0.00 N ATOM 0 H ARG A 303 3.820 -1.941 7.547 1.00 0.00 H new ATOM 0 HA ARG A 303 6.302 -0.558 7.282 1.00 0.00 H new ATOM 0 HB2 ARG A 303 4.850 -2.465 5.420 1.00 0.00 H new ATOM 0 HB3 ARG A 303 6.520 -1.960 5.258 1.00 0.00 H new ATOM 0 HG2 ARG A 303 6.460 -2.885 7.864 1.00 0.00 H new ATOM 0 HG3 ARG A 303 5.317 -3.954 7.076 1.00 0.00 H new ATOM 0 HD2 ARG A 303 6.956 -5.060 5.980 1.00 0.00 H new ATOM 0 HD3 ARG A 303 7.687 -3.572 5.413 1.00 0.00 H new ATOM 0 HE ARG A 303 8.207 -4.127 8.245 1.00 0.00 H new ATOM 0 HH11 ARG A 303 9.251 -4.652 4.908 1.00 0.00 H new ATOM 0 HH12 ARG A 303 10.921 -5.001 5.365 1.00 0.00 H new ATOM 0 HH21 ARG A 303 10.353 -4.574 8.819 1.00 0.00 H new ATOM 0 HH22 ARG A 303 11.542 -4.957 7.569 1.00 0.00 H new ATOM 953 N LEU A 304 3.760 0.315 5.391 1.00 0.00 N ATOM 954 CA LEU A 304 3.285 1.355 4.489 1.00 0.00 C ATOM 955 C LEU A 304 3.423 2.700 5.178 1.00 0.00 C ATOM 956 O LEU A 304 3.725 3.708 4.540 1.00 0.00 O ATOM 957 CB LEU A 304 1.859 1.043 4.011 1.00 0.00 C ATOM 958 CG LEU A 304 1.841 0.056 2.834 1.00 0.00 C ATOM 959 CD1 LEU A 304 1.079 -1.214 3.171 1.00 0.00 C ATOM 960 CD2 LEU A 304 1.294 0.683 1.558 1.00 0.00 C ATOM 0 H LEU A 304 3.040 -0.333 5.710 1.00 0.00 H new ATOM 0 HA LEU A 304 3.892 1.392 3.584 1.00 0.00 H new ATOM 0 HB2 LEU A 304 1.283 0.628 4.839 1.00 0.00 H new ATOM 0 HB3 LEU A 304 1.367 1.969 3.713 1.00 0.00 H new ATOM 0 HG LEU A 304 2.882 -0.211 2.650 1.00 0.00 H new ATOM 0 HD11 LEU A 304 1.091 -1.884 2.312 1.00 0.00 H new ATOM 0 HD12 LEU A 304 1.550 -1.706 4.022 1.00 0.00 H new ATOM 0 HD13 LEU A 304 0.048 -0.964 3.422 1.00 0.00 H new ATOM 0 HD21 LEU A 304 1.303 -0.056 0.757 1.00 0.00 H new ATOM 0 HD22 LEU A 304 0.272 1.022 1.728 1.00 0.00 H new ATOM 0 HD23 LEU A 304 1.915 1.533 1.275 1.00 0.00 H new ATOM 972 N LYS A 305 3.302 2.702 6.502 1.00 0.00 N ATOM 973 CA LYS A 305 3.513 3.924 7.260 1.00 0.00 C ATOM 974 C LYS A 305 4.942 4.407 7.002 1.00 0.00 C ATOM 975 O LYS A 305 5.242 5.596 7.096 1.00 0.00 O ATOM 976 CB LYS A 305 3.291 3.681 8.755 1.00 0.00 C ATOM 977 CG LYS A 305 2.379 4.707 9.409 1.00 0.00 C ATOM 978 CD LYS A 305 2.841 5.045 10.818 1.00 0.00 C ATOM 979 CE LYS A 305 3.958 6.076 10.805 1.00 0.00 C ATOM 980 NZ LYS A 305 3.437 7.463 10.958 1.00 0.00 N ATOM 0 H LYS A 305 3.063 1.884 7.062 1.00 0.00 H new ATOM 0 HA LYS A 305 2.799 4.683 6.942 1.00 0.00 H new ATOM 0 HB2 LYS A 305 2.865 2.687 8.894 1.00 0.00 H new ATOM 0 HB3 LYS A 305 4.255 3.688 9.263 1.00 0.00 H new ATOM 0 HG2 LYS A 305 2.357 5.614 8.805 1.00 0.00 H new ATOM 0 HG3 LYS A 305 1.360 4.321 9.442 1.00 0.00 H new ATOM 0 HD2 LYS A 305 1.999 5.426 11.397 1.00 0.00 H new ATOM 0 HD3 LYS A 305 3.186 4.139 11.316 1.00 0.00 H new ATOM 0 HE2 LYS A 305 4.660 5.861 11.611 1.00 0.00 H new ATOM 0 HE3 LYS A 305 4.513 5.998 9.870 1.00 0.00 H new ATOM 0 HZ1 LYS A 305 4.230 8.135 10.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 305 2.787 7.678 10.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 305 2.929 7.545 11.862 1.00 0.00 H new ATOM 994 N MET A 306 5.810 3.452 6.643 1.00 0.00 N ATOM 995 CA MET A 306 7.204 3.738 6.327 1.00 0.00 C ATOM 996 C MET A 306 7.285 4.491 5.010 1.00 0.00 C ATOM 997 O MET A 306 8.129 5.368 4.826 1.00 0.00 O ATOM 998 CB MET A 306 8.009 2.433 6.215 1.00 0.00 C ATOM 999 CG MET A 306 9.512 2.639 6.299 1.00 0.00 C ATOM 1000 SD MET A 306 10.093 2.840 7.994 1.00 0.00 S ATOM 1001 CE MET A 306 11.847 3.084 7.722 1.00 0.00 C ATOM 0 H MET A 306 5.561 2.466 6.565 1.00 0.00 H new ATOM 0 HA MET A 306 7.624 4.347 7.128 1.00 0.00 H new ATOM 0 HB2 MET A 306 7.698 1.754 7.009 1.00 0.00 H new ATOM 0 HB3 MET A 306 7.769 1.947 5.269 1.00 0.00 H new ATOM 0 HG2 MET A 306 10.017 1.787 5.845 1.00 0.00 H new ATOM 0 HG3 MET A 306 9.787 3.519 5.718 1.00 0.00 H new ATOM 0 HE1 MET A 306 12.348 3.223 8.680 1.00 0.00 H new ATOM 0 HE2 MET A 306 12.262 2.211 7.219 1.00 0.00 H new ATOM 0 HE3 MET A 306 12.000 3.967 7.101 1.00 0.00 H new ATOM 1011 N ALA A 307 6.393 4.131 4.097 1.00 0.00 N ATOM 1012 CA ALA A 307 6.340 4.753 2.786 1.00 0.00 C ATOM 1013 C ALA A 307 5.690 6.130 2.859 1.00 0.00 C ATOM 1014 O ALA A 307 6.235 7.110 2.353 1.00 0.00 O ATOM 1015 CB ALA A 307 5.601 3.846 1.814 1.00 0.00 C ATOM 0 H ALA A 307 5.692 3.405 4.245 1.00 0.00 H new ATOM 0 HA ALA A 307 7.358 4.894 2.424 1.00 0.00 H new ATOM 0 HB1 ALA A 307 5.564 4.318 0.832 1.00 0.00 H new ATOM 0 HB2 ALA A 307 6.122 2.892 1.739 1.00 0.00 H new ATOM 0 HB3 ALA A 307 4.586 3.677 2.174 1.00 0.00 H new ATOM 1021 N GLY A 308 4.530 6.203 3.506 1.00 0.00 N ATOM 1022 CA GLY A 308 3.842 7.474 3.644 1.00 0.00 C ATOM 1023 C GLY A 308 2.557 7.553 2.843 1.00 0.00 C ATOM 1024 O GLY A 308 2.398 8.439 2.003 1.00 0.00 O ATOM 0 H GLY A 308 4.056 5.408 3.935 1.00 0.00 H new ATOM 0 HA2 GLY A 308 3.616 7.644 4.697 1.00 0.00 H new ATOM 0 HA3 GLY A 308 4.509 8.276 3.327 1.00 0.00 H new ATOM 1028 N HIS A 309 1.630 6.638 3.111 1.00 0.00 N ATOM 1029 CA HIS A 309 0.347 6.632 2.414 1.00 0.00 C ATOM 1030 C HIS A 309 -0.735 7.240 3.294 1.00 0.00 C ATOM 1031 O HIS A 309 -0.939 6.800 4.426 1.00 0.00 O ATOM 1032 CB HIS A 309 -0.063 5.210 2.020 1.00 0.00 C ATOM 1033 CG HIS A 309 1.086 4.311 1.668 1.00 0.00 C ATOM 1034 ND1 HIS A 309 1.357 3.902 0.382 1.00 0.00 N ATOM 1035 CD2 HIS A 309 2.029 3.729 2.447 1.00 0.00 C ATOM 1036 CE1 HIS A 309 2.415 3.110 0.388 1.00 0.00 C ATOM 1037 NE2 HIS A 309 2.842 2.992 1.627 1.00 0.00 N ATOM 0 H HIS A 309 1.741 5.895 3.801 1.00 0.00 H new ATOM 0 HA HIS A 309 0.461 7.227 1.508 1.00 0.00 H new ATOM 0 HB2 HIS A 309 -0.619 4.763 2.844 1.00 0.00 H new ATOM 0 HB3 HIS A 309 -0.742 5.263 1.169 1.00 0.00 H new ATOM 0 HD1 HIS A 309 0.825 4.168 -0.446 1.00 0.00 H new ATOM 0 HD2 HIS A 309 2.123 3.828 3.518 1.00 0.00 H new ATOM 0 HE1 HIS A 309 2.855 2.639 -0.478 1.00 0.00 H new ATOM 1046 N THR A 310 -1.422 8.259 2.787 1.00 0.00 N ATOM 1047 CA THR A 310 -2.472 8.917 3.559 1.00 0.00 C ATOM 1048 C THR A 310 -3.732 8.047 3.698 1.00 0.00 C ATOM 1049 O THR A 310 -4.838 8.514 3.427 1.00 0.00 O ATOM 1050 CB THR A 310 -2.836 10.255 2.913 1.00 0.00 C ATOM 1051 OG1 THR A 310 -1.756 10.750 2.141 1.00 0.00 O ATOM 1052 CG2 THR A 310 -3.209 11.323 3.917 1.00 0.00 C ATOM 0 H THR A 310 -1.273 8.645 1.854 1.00 0.00 H new ATOM 0 HA THR A 310 -2.078 9.082 4.562 1.00 0.00 H new ATOM 0 HB THR A 310 -3.705 10.047 2.289 1.00 0.00 H new ATOM 0 HG1 THR A 310 -2.009 11.605 1.735 1.00 0.00 H new ATOM 0 HG21 THR A 310 -3.456 12.246 3.392 1.00 0.00 H new ATOM 0 HG22 THR A 310 -4.072 10.993 4.496 1.00 0.00 H new ATOM 0 HG23 THR A 310 -2.369 11.501 4.588 1.00 0.00 H new ATOM 1060 N ASN A 311 -3.565 6.792 4.146 1.00 0.00 N ATOM 1061 CA ASN A 311 -4.699 5.877 4.342 1.00 0.00 C ATOM 1062 C ASN A 311 -4.234 4.418 4.479 1.00 0.00 C ATOM 1063 O ASN A 311 -3.899 3.968 5.575 1.00 0.00 O ATOM 1064 CB ASN A 311 -5.719 6.006 3.200 1.00 0.00 C ATOM 1065 CG ASN A 311 -6.923 6.841 3.590 1.00 0.00 C ATOM 1066 OD1 ASN A 311 -7.551 6.604 4.623 1.00 0.00 O ATOM 1067 ND2 ASN A 311 -7.252 7.828 2.763 1.00 0.00 N ATOM 0 H ASN A 311 -2.657 6.389 4.379 1.00 0.00 H new ATOM 0 HA ASN A 311 -5.185 6.164 5.275 1.00 0.00 H new ATOM 0 HB2 ASN A 311 -5.234 6.455 2.333 1.00 0.00 H new ATOM 0 HB3 ASN A 311 -6.052 5.012 2.900 1.00 0.00 H new ATOM 0 HD21 ASN A 311 -8.052 8.424 2.973 1.00 0.00 H new ATOM 0 HD22 ASN A 311 -6.704 7.989 1.918 1.00 0.00 H new ATOM 1074 N CYS A 312 -4.216 3.688 3.362 1.00 0.00 N ATOM 1075 CA CYS A 312 -3.799 2.282 3.343 1.00 0.00 C ATOM 1076 C CYS A 312 -4.651 1.409 4.265 1.00 0.00 C ATOM 1077 O CYS A 312 -4.926 1.780 5.404 1.00 0.00 O ATOM 1078 CB CYS A 312 -2.329 2.154 3.726 1.00 0.00 C ATOM 1079 SG CYS A 312 -1.694 0.464 3.643 1.00 0.00 S ATOM 0 H CYS A 312 -4.488 4.051 2.449 1.00 0.00 H new ATOM 0 HA CYS A 312 -3.943 1.925 2.323 1.00 0.00 H new ATOM 0 HB2 CYS A 312 -1.736 2.787 3.067 1.00 0.00 H new ATOM 0 HB3 CYS A 312 -2.193 2.533 4.739 1.00 0.00 H new ATOM 0 HG CYS A 312 -1.632 0.084 2.401 1.00 0.00 H new ATOM 1085 N ILE A 313 -5.057 0.232 3.769 1.00 0.00 N ATOM 1086 CA ILE A 313 -5.860 -0.689 4.564 1.00 0.00 C ATOM 1087 C ILE A 313 -5.819 -2.091 3.972 1.00 0.00 C ATOM 1088 O ILE A 313 -6.305 -2.318 2.863 1.00 0.00 O ATOM 1089 CB ILE A 313 -7.329 -0.237 4.659 1.00 0.00 C ATOM 1090 CG1 ILE A 313 -7.846 0.197 3.287 1.00 0.00 C ATOM 1091 CG2 ILE A 313 -7.478 0.890 5.671 1.00 0.00 C ATOM 1092 CD1 ILE A 313 -9.281 -0.207 3.026 1.00 0.00 C ATOM 0 H ILE A 313 -4.841 -0.097 2.828 1.00 0.00 H new ATOM 0 HA ILE A 313 -5.428 -0.694 5.565 1.00 0.00 H new ATOM 0 HB ILE A 313 -7.928 -1.082 4.999 1.00 0.00 H new ATOM 0 HG12 ILE A 313 -7.761 1.280 3.202 1.00 0.00 H new ATOM 0 HG13 ILE A 313 -7.209 -0.235 2.515 1.00 0.00 H new ATOM 0 HG21 ILE A 313 -8.523 1.196 5.724 1.00 0.00 H new ATOM 0 HG22 ILE A 313 -7.151 0.544 6.652 1.00 0.00 H new ATOM 0 HG23 ILE A 313 -6.867 1.738 5.363 1.00 0.00 H new ATOM 0 HD11 ILE A 313 -9.580 0.134 2.035 1.00 0.00 H new ATOM 0 HD12 ILE A 313 -9.369 -1.292 3.079 1.00 0.00 H new ATOM 0 HD13 ILE A 313 -9.929 0.246 3.776 1.00 0.00 H new ATOM 1104 N ARG A 314 -5.249 -3.034 4.715 1.00 0.00 N ATOM 1105 CA ARG A 314 -5.163 -4.411 4.250 1.00 0.00 C ATOM 1106 C ARG A 314 -6.555 -5.001 4.114 1.00 0.00 C ATOM 1107 O ARG A 314 -7.307 -5.094 5.084 1.00 0.00 O ATOM 1108 CB ARG A 314 -4.312 -5.272 5.203 1.00 0.00 C ATOM 1109 CG ARG A 314 -3.163 -6.004 4.520 1.00 0.00 C ATOM 1110 CD ARG A 314 -2.093 -5.057 3.970 1.00 0.00 C ATOM 1111 NE ARG A 314 -0.911 -5.773 3.474 1.00 0.00 N ATOM 1112 CZ ARG A 314 -0.906 -6.661 2.472 1.00 0.00 C ATOM 1113 NH1 ARG A 314 -2.033 -7.049 1.888 1.00 0.00 N ATOM 1114 NH2 ARG A 314 0.243 -7.192 2.076 1.00 0.00 N ATOM 0 H ARG A 314 -4.842 -2.870 5.636 1.00 0.00 H new ATOM 0 HA ARG A 314 -4.676 -4.409 3.275 1.00 0.00 H new ATOM 0 HB2 ARG A 314 -3.907 -4.634 5.988 1.00 0.00 H new ATOM 0 HB3 ARG A 314 -4.958 -6.004 5.689 1.00 0.00 H new ATOM 0 HG2 ARG A 314 -2.703 -6.690 5.231 1.00 0.00 H new ATOM 0 HG3 ARG A 314 -3.559 -6.609 3.704 1.00 0.00 H new ATOM 0 HD2 ARG A 314 -2.519 -4.462 3.162 1.00 0.00 H new ATOM 0 HD3 ARG A 314 -1.791 -4.361 4.753 1.00 0.00 H new ATOM 0 HE ARG A 314 -0.020 -5.578 3.931 1.00 0.00 H new ATOM 0 HH11 ARG A 314 -2.926 -6.669 2.201 1.00 0.00 H new ATOM 0 HH12 ARG A 314 -2.006 -7.727 1.126 1.00 0.00 H new ATOM 0 HH21 ARG A 314 1.114 -6.923 2.534 1.00 0.00 H new ATOM 0 HH22 ARG A 314 0.256 -7.869 1.313 1.00 0.00 H new ATOM 1128 N LEU A 315 -6.873 -5.410 2.900 1.00 0.00 N ATOM 1129 CA LEU A 315 -8.154 -6.020 2.598 1.00 0.00 C ATOM 1130 C LEU A 315 -7.940 -7.493 2.307 1.00 0.00 C ATOM 1131 O LEU A 315 -7.145 -7.854 1.445 1.00 0.00 O ATOM 1132 CB LEU A 315 -8.821 -5.347 1.402 1.00 0.00 C ATOM 1133 CG LEU A 315 -10.342 -5.203 1.496 1.00 0.00 C ATOM 1134 CD1 LEU A 315 -11.011 -6.556 1.316 1.00 0.00 C ATOM 1135 CD2 LEU A 315 -10.742 -4.575 2.824 1.00 0.00 C ATOM 0 H LEU A 315 -6.251 -5.329 2.096 1.00 0.00 H new ATOM 0 HA LEU A 315 -8.812 -5.897 3.458 1.00 0.00 H new ATOM 0 HB2 LEU A 315 -8.386 -4.356 1.275 1.00 0.00 H new ATOM 0 HB3 LEU A 315 -8.581 -5.918 0.505 1.00 0.00 H new ATOM 0 HG LEU A 315 -10.678 -4.543 0.696 1.00 0.00 H new ATOM 0 HD11 LEU A 315 -12.093 -6.439 1.385 1.00 0.00 H new ATOM 0 HD12 LEU A 315 -10.752 -6.963 0.339 1.00 0.00 H new ATOM 0 HD13 LEU A 315 -10.669 -7.237 2.095 1.00 0.00 H new ATOM 0 HD21 LEU A 315 -11.827 -4.482 2.870 1.00 0.00 H new ATOM 0 HD22 LEU A 315 -10.397 -5.206 3.643 1.00 0.00 H new ATOM 0 HD23 LEU A 315 -10.289 -3.587 2.911 1.00 0.00 H new ATOM 1147 N ALA A 316 -8.624 -8.341 3.040 1.00 0.00 N ATOM 1148 CA ALA A 316 -8.465 -9.775 2.864 1.00 0.00 C ATOM 1149 C ALA A 316 -9.458 -10.344 1.861 1.00 0.00 C ATOM 1150 O ALA A 316 -10.662 -10.107 1.947 1.00 0.00 O ATOM 1151 CB ALA A 316 -8.571 -10.481 4.202 1.00 0.00 C ATOM 0 H ALA A 316 -9.293 -8.070 3.761 1.00 0.00 H new ATOM 0 HA ALA A 316 -7.471 -9.951 2.453 1.00 0.00 H new ATOM 0 HB1 ALA A 316 -8.450 -11.555 4.057 1.00 0.00 H new ATOM 0 HB2 ALA A 316 -7.791 -10.115 4.869 1.00 0.00 H new ATOM 0 HB3 ALA A 316 -9.548 -10.282 4.642 1.00 0.00 H new ATOM 1157 N ALA A 317 -8.926 -11.100 0.905 1.00 0.00 N ATOM 1158 CA ALA A 317 -9.732 -11.722 -0.137 1.00 0.00 C ATOM 1159 C ALA A 317 -10.922 -12.476 0.453 1.00 0.00 C ATOM 1160 O ALA A 317 -10.832 -13.041 1.543 1.00 0.00 O ATOM 1161 CB ALA A 317 -8.862 -12.656 -0.962 1.00 0.00 C ATOM 0 H ALA A 317 -7.928 -11.297 0.832 1.00 0.00 H new ATOM 0 HA ALA A 317 -10.131 -10.938 -0.780 1.00 0.00 H new ATOM 0 HB1 ALA A 317 -9.465 -13.121 -1.742 1.00 0.00 H new ATOM 0 HB2 ALA A 317 -8.052 -12.089 -1.420 1.00 0.00 H new ATOM 0 HB3 ALA A 317 -8.444 -13.429 -0.317 1.00 0.00 H new