USER MOD reduce.3.24.130724 H: found=0, std=0, add=837, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 842 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 311 SER OG : rot 153:sc= 0.937 USER MOD Set 1.2: A 317 THR OG1 : rot 74:sc= 1.26 USER MOD Set 2.1: A 303 TYR OH : rot 120:sc= 0.786 USER MOD Set 2.2: A 344 ASN : amide:sc=-0.00566 X(o=0.78,f=0.78) USER MOD Set 3.1: A 219 THR OG1 : rot -26:sc= 1.41 USER MOD Set 3.2: A 296 CYS SG : rot 39:sc= 3.03 USER MOD Set 3.3: A 300 HIS :FLIP no HE2:sc= -3.44 F(o=-2.4!,f=1) USER MOD Set 4.1: A 222 CYS SG : rot 180:sc= 0 USER MOD Set 4.2: A 224 HIS : no HE2:sc= -0.367 K(o=0.93,f=-5.7!) USER MOD Set 4.3: A 293 THR OG1 : rot 105:sc= 1.3 USER MOD Set 5.1: A 213 HIS : no HD1:sc= -0.825! C(o=-0.53!,f=-9.5!) USER MOD Set 5.2: A 214 CYS SG : rot -74:sc= 0.29 USER MOD Single : A 209 SER OG : rot 180:sc= 0 USER MOD Single : A 210 THR OG1 : rot 120:sc= -0.0749 USER MOD Single : A 217 LYS NZ :NH3+ 172:sc= 1.17 (180deg=0.808) USER MOD Single : A 232 GLN : amide:sc= -2.86! C(o=-2.9!,f=-2.8!) USER MOD Single : A 257 TYR OH : rot -159:sc= -0.265! USER MOD Single : A 259 SER OG : rot 180:sc= 0 USER MOD Single : A 263 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 266 SER OG : rot 180:sc= 0 USER MOD Single : A 267 HIS : no HE2:sc= -1.77 K(o=-1.8,f=-9.9!) USER MOD Single : A 270 SER OG : rot 180:sc= 0 USER MOD Single : A 276 SER OG : rot 24:sc= 0.102 USER MOD Single : A 279 LYS NZ :NH3+ 171:sc= 1.5 (180deg=0.792) USER MOD Single : A 281 THR OG1 : rot 180:sc= 0 USER MOD Single : A 286 THR OG1 : rot 180:sc= 0 USER MOD Single : A 297 LYS NZ :NH3+ 171:sc= -0.0154 (180deg=-0.109) USER MOD Single : A 305 LYS NZ :NH3+ -179:sc= 0.972 (180deg=0.91) USER MOD Single : A 306 ASN : amide:sc= -0.889 K(o=-0.89,f=-3!) USER MOD Single : A 307 LYS NZ :NH3+ 139:sc= -0.0571 (180deg=-0.389) USER MOD Single : A 310 SER OG : rot -170:sc= -0.308 USER MOD Single : A 313 TYR OH : rot 180:sc= 0 USER MOD Single : A 315 SER OG : rot 180:sc= 0 USER MOD Single : A 320 GLN : amide:sc= -0.381 X(o=-0.38,f=-0.11) USER MOD Single : A 321 HIS : no HD1:sc= 0.529 K(o=0.53,f=-2.7!) USER MOD Single : A 325 CYS SG : rot 52:sc= 0.366 USER MOD Single : A 326 CYS SG : rot 180:sc= 0 USER MOD Single : A 329 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 334 CYS SG : rot -14:sc= -0.898! USER MOD Single : A 339 HIS : no HD1:sc= 0.37 K(o=0.37,f=-4.2!) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 208 -9.030 -6.890 3.992 1.00 0.00 N ATOM 2 CA PRO A 208 -7.706 -6.511 4.531 1.00 0.00 C ATOM 3 C PRO A 208 -7.681 -5.036 4.900 1.00 0.00 C ATOM 4 O PRO A 208 -8.490 -4.254 4.402 1.00 0.00 O ATOM 5 CB PRO A 208 -6.647 -6.805 3.480 1.00 0.00 C ATOM 6 CG PRO A 208 -7.443 -7.201 2.285 1.00 0.00 C ATOM 7 CD PRO A 208 -8.753 -7.727 2.815 1.00 0.00 C ATOM 0 HA PRO A 208 -7.504 -7.088 5.433 1.00 0.00 H new ATOM 0 HB2 PRO A 208 -6.028 -5.931 3.278 1.00 0.00 H new ATOM 0 HB3 PRO A 208 -5.977 -7.603 3.798 1.00 0.00 H new ATOM 0 HG2 PRO A 208 -7.603 -6.350 1.623 1.00 0.00 H new ATOM 0 HG3 PRO A 208 -6.923 -7.963 1.704 1.00 0.00 H new ATOM 0 HD2 PRO A 208 -9.546 -7.643 2.071 1.00 0.00 H new ATOM 0 HD3 PRO A 208 -8.679 -8.781 3.084 1.00 0.00 H new ATOM 17 N SER A 209 -6.752 -4.658 5.766 1.00 0.00 N ATOM 18 CA SER A 209 -6.632 -3.275 6.196 1.00 0.00 C ATOM 19 C SER A 209 -5.551 -2.567 5.379 1.00 0.00 C ATOM 20 O SER A 209 -4.379 -2.547 5.758 1.00 0.00 O ATOM 21 CB SER A 209 -6.312 -3.213 7.697 1.00 0.00 C ATOM 22 OG SER A 209 -6.479 -1.900 8.213 1.00 0.00 O ATOM 0 H SER A 209 -6.070 -5.291 6.184 1.00 0.00 H new ATOM 0 HA SER A 209 -7.580 -2.765 6.029 1.00 0.00 H new ATOM 0 HB2 SER A 209 -6.961 -3.902 8.237 1.00 0.00 H new ATOM 0 HB3 SER A 209 -5.287 -3.543 7.865 1.00 0.00 H new ATOM 0 HG SER A 209 -6.269 -1.896 9.170 1.00 0.00 H new ATOM 28 N THR A 210 -5.952 -2.020 4.239 1.00 0.00 N ATOM 29 CA THR A 210 -5.040 -1.290 3.371 1.00 0.00 C ATOM 30 C THR A 210 -4.808 0.123 3.894 1.00 0.00 C ATOM 31 O THR A 210 -5.718 0.755 4.436 1.00 0.00 O ATOM 32 CB THR A 210 -5.591 -1.218 1.935 1.00 0.00 C ATOM 33 OG1 THR A 210 -6.968 -0.822 1.953 1.00 0.00 O ATOM 34 CG2 THR A 210 -5.457 -2.555 1.227 1.00 0.00 C ATOM 0 H THR A 210 -6.910 -2.069 3.893 1.00 0.00 H new ATOM 0 HA THR A 210 -4.092 -1.828 3.363 1.00 0.00 H new ATOM 0 HB THR A 210 -5.005 -0.478 1.390 1.00 0.00 H new ATOM 0 HG1 THR A 210 -7.075 0.013 1.451 1.00 0.00 H new ATOM 0 HG21 THR A 210 -5.855 -2.473 0.215 1.00 0.00 H new ATOM 0 HG22 THR A 210 -4.406 -2.839 1.182 1.00 0.00 H new ATOM 0 HG23 THR A 210 -6.015 -3.314 1.775 1.00 0.00 H new ATOM 42 N ILE A 211 -3.583 0.612 3.732 1.00 0.00 N ATOM 43 CA ILE A 211 -3.243 1.960 4.168 1.00 0.00 C ATOM 44 C ILE A 211 -3.745 2.958 3.134 1.00 0.00 C ATOM 45 O ILE A 211 -4.338 3.984 3.470 1.00 0.00 O ATOM 46 CB ILE A 211 -1.715 2.162 4.341 1.00 0.00 C ATOM 47 CG1 ILE A 211 -1.048 0.959 5.018 1.00 0.00 C ATOM 48 CG2 ILE A 211 -1.441 3.420 5.148 1.00 0.00 C ATOM 49 CD1 ILE A 211 -1.547 0.682 6.422 1.00 0.00 C ATOM 0 H ILE A 211 -2.813 0.097 3.304 1.00 0.00 H new ATOM 0 HA ILE A 211 -3.715 2.116 5.138 1.00 0.00 H new ATOM 0 HB ILE A 211 -1.287 2.263 3.344 1.00 0.00 H new ATOM 0 HG12 ILE A 211 -1.213 0.073 4.404 1.00 0.00 H new ATOM 0 HG13 ILE A 211 0.028 1.127 5.053 1.00 0.00 H new ATOM 0 HG21 ILE A 211 -0.365 3.551 5.263 1.00 0.00 H new ATOM 0 HG22 ILE A 211 -1.859 4.283 4.630 1.00 0.00 H new ATOM 0 HG23 ILE A 211 -1.903 3.329 6.131 1.00 0.00 H new ATOM 0 HD11 ILE A 211 -1.025 -0.184 6.829 1.00 0.00 H new ATOM 0 HD12 ILE A 211 -1.357 1.550 7.053 1.00 0.00 H new ATOM 0 HD13 ILE A 211 -2.618 0.480 6.394 1.00 0.00 H new ATOM 61 N TRP A 212 -3.517 2.623 1.871 1.00 0.00 N ATOM 62 CA TRP A 212 -3.947 3.445 0.748 1.00 0.00 C ATOM 63 C TRP A 212 -4.160 2.561 -0.474 1.00 0.00 C ATOM 64 O TRP A 212 -3.344 1.676 -0.750 1.00 0.00 O ATOM 65 CB TRP A 212 -2.912 4.529 0.426 1.00 0.00 C ATOM 66 CG TRP A 212 -3.258 5.320 -0.797 1.00 0.00 C ATOM 67 CD1 TRP A 212 -4.161 6.339 -0.887 1.00 0.00 C ATOM 68 CD2 TRP A 212 -2.719 5.142 -2.115 1.00 0.00 C ATOM 69 NE1 TRP A 212 -4.220 6.802 -2.179 1.00 0.00 N ATOM 70 CE2 TRP A 212 -3.342 6.085 -2.950 1.00 0.00 C ATOM 71 CE3 TRP A 212 -1.766 4.276 -2.669 1.00 0.00 C ATOM 72 CZ2 TRP A 212 -3.051 6.186 -4.308 1.00 0.00 C ATOM 73 CZ3 TRP A 212 -1.478 4.378 -4.017 1.00 0.00 C ATOM 74 CH2 TRP A 212 -2.118 5.328 -4.821 1.00 0.00 C ATOM 0 H TRP A 212 -3.027 1.771 1.596 1.00 0.00 H new ATOM 0 HA TRP A 212 -4.881 3.937 1.019 1.00 0.00 H new ATOM 0 HB2 TRP A 212 -2.824 5.205 1.277 1.00 0.00 H new ATOM 0 HB3 TRP A 212 -1.936 4.063 0.287 1.00 0.00 H new ATOM 0 HD1 TRP A 212 -4.744 6.725 -0.064 1.00 0.00 H new ATOM 0 HE1 TRP A 212 -4.820 7.557 -2.511 1.00 0.00 H new ATOM 0 HE3 TRP A 212 -1.266 3.543 -2.054 1.00 0.00 H new ATOM 0 HZ2 TRP A 212 -3.544 6.915 -4.933 1.00 0.00 H new ATOM 0 HZ3 TRP A 212 -0.748 3.714 -4.457 1.00 0.00 H new ATOM 0 HH2 TRP A 212 -1.869 5.385 -5.870 1.00 0.00 H new ATOM 85 N HIS A 213 -5.259 2.794 -1.188 1.00 0.00 N ATOM 86 CA HIS A 213 -5.581 2.029 -2.389 1.00 0.00 C ATOM 87 C HIS A 213 -5.598 0.534 -2.043 1.00 0.00 C ATOM 88 O HIS A 213 -6.133 0.139 -1.009 1.00 0.00 O ATOM 89 CB HIS A 213 -4.560 2.343 -3.513 1.00 0.00 C ATOM 90 CG HIS A 213 -4.968 1.897 -4.895 1.00 0.00 C ATOM 91 ND1 HIS A 213 -4.438 0.782 -5.521 1.00 0.00 N ATOM 92 CD2 HIS A 213 -5.859 2.420 -5.770 1.00 0.00 C ATOM 93 CE1 HIS A 213 -4.994 0.642 -6.712 1.00 0.00 C ATOM 94 NE2 HIS A 213 -5.856 1.623 -6.887 1.00 0.00 N ATOM 0 H HIS A 213 -5.945 3.511 -0.953 1.00 0.00 H new ATOM 0 HA HIS A 213 -6.568 2.311 -2.757 1.00 0.00 H new ATOM 0 HB2 HIS A 213 -4.385 3.419 -3.533 1.00 0.00 H new ATOM 0 HB3 HIS A 213 -3.611 1.870 -3.262 1.00 0.00 H new ATOM 0 HD2 HIS A 213 -6.462 3.303 -5.617 1.00 0.00 H new ATOM 0 HE1 HIS A 213 -4.778 -0.143 -7.421 1.00 0.00 H new ATOM 0 HE2 HIS A 213 -6.429 1.767 -7.719 1.00 0.00 H new ATOM 103 N CYS A 214 -5.000 -0.282 -2.888 1.00 0.00 N ATOM 104 CA CYS A 214 -4.938 -1.716 -2.676 1.00 0.00 C ATOM 105 C CYS A 214 -3.612 -2.123 -2.010 1.00 0.00 C ATOM 106 O CYS A 214 -3.168 -3.265 -2.135 1.00 0.00 O ATOM 107 CB CYS A 214 -5.079 -2.410 -4.032 1.00 0.00 C ATOM 108 SG CYS A 214 -3.598 -2.304 -5.070 1.00 0.00 S ATOM 0 H CYS A 214 -4.542 0.031 -3.744 1.00 0.00 H new ATOM 0 HA CYS A 214 -5.746 -2.016 -2.009 1.00 0.00 H new ATOM 0 HB2 CYS A 214 -5.321 -3.460 -3.868 1.00 0.00 H new ATOM 0 HB3 CYS A 214 -5.919 -1.969 -4.569 1.00 0.00 H new ATOM 0 HG CYS A 214 -3.487 -1.099 -5.546 1.00 0.00 H new ATOM 114 N PHE A 215 -2.976 -1.192 -1.302 1.00 0.00 N ATOM 115 CA PHE A 215 -1.647 -1.442 -0.756 1.00 0.00 C ATOM 116 C PHE A 215 -1.674 -1.603 0.757 1.00 0.00 C ATOM 117 O PHE A 215 -2.382 -0.883 1.466 1.00 0.00 O ATOM 118 CB PHE A 215 -0.684 -0.325 -1.156 1.00 0.00 C ATOM 119 CG PHE A 215 -0.486 -0.226 -2.639 1.00 0.00 C ATOM 120 CD1 PHE A 215 0.138 -1.248 -3.334 1.00 0.00 C ATOM 121 CD2 PHE A 215 -0.939 0.876 -3.337 1.00 0.00 C ATOM 122 CE1 PHE A 215 0.310 -1.166 -4.701 1.00 0.00 C ATOM 123 CE2 PHE A 215 -0.771 0.963 -4.705 1.00 0.00 C ATOM 124 CZ PHE A 215 -0.146 -0.061 -5.388 1.00 0.00 C ATOM 0 H PHE A 215 -3.355 -0.268 -1.095 1.00 0.00 H new ATOM 0 HA PHE A 215 -1.294 -2.383 -1.179 1.00 0.00 H new ATOM 0 HB2 PHE A 215 -1.063 0.626 -0.781 1.00 0.00 H new ATOM 0 HB3 PHE A 215 0.280 -0.495 -0.677 1.00 0.00 H new ATOM 0 HD1 PHE A 215 0.494 -2.118 -2.801 1.00 0.00 H new ATOM 0 HD2 PHE A 215 -1.430 1.679 -2.807 1.00 0.00 H new ATOM 0 HE1 PHE A 215 0.802 -1.967 -5.232 1.00 0.00 H new ATOM 0 HE2 PHE A 215 -1.128 1.831 -5.240 1.00 0.00 H new ATOM 0 HZ PHE A 215 -0.015 0.003 -6.458 1.00 0.00 H new ATOM 134 N LEU A 216 -0.879 -2.550 1.236 1.00 0.00 N ATOM 135 CA LEU A 216 -0.840 -2.901 2.647 1.00 0.00 C ATOM 136 C LEU A 216 0.333 -2.222 3.340 1.00 0.00 C ATOM 137 O LEU A 216 1.126 -1.523 2.705 1.00 0.00 O ATOM 138 CB LEU A 216 -0.721 -4.424 2.831 1.00 0.00 C ATOM 139 CG LEU A 216 -1.956 -5.258 2.458 1.00 0.00 C ATOM 140 CD1 LEU A 216 -3.200 -4.713 3.139 1.00 0.00 C ATOM 141 CD2 LEU A 216 -2.149 -5.322 0.951 1.00 0.00 C ATOM 0 H LEU A 216 -0.243 -3.096 0.656 1.00 0.00 H new ATOM 0 HA LEU A 216 -1.772 -2.558 3.096 1.00 0.00 H new ATOM 0 HB2 LEU A 216 0.121 -4.775 2.234 1.00 0.00 H new ATOM 0 HB3 LEU A 216 -0.477 -4.624 3.874 1.00 0.00 H new ATOM 0 HG LEU A 216 -1.788 -6.275 2.813 1.00 0.00 H new ATOM 0 HD11 LEU A 216 -4.062 -5.319 2.861 1.00 0.00 H new ATOM 0 HD12 LEU A 216 -3.067 -4.746 4.220 1.00 0.00 H new ATOM 0 HD13 LEU A 216 -3.364 -3.682 2.825 1.00 0.00 H new ATOM 0 HD21 LEU A 216 -3.031 -5.920 0.722 1.00 0.00 H new ATOM 0 HD22 LEU A 216 -2.282 -4.314 0.558 1.00 0.00 H new ATOM 0 HD23 LEU A 216 -1.273 -5.778 0.491 1.00 0.00 H new ATOM 153 N LYS A 217 0.440 -2.454 4.636 1.00 0.00 N ATOM 154 CA LYS A 217 1.515 -1.903 5.447 1.00 0.00 C ATOM 155 C LYS A 217 2.851 -2.514 5.030 1.00 0.00 C ATOM 156 O LYS A 217 2.967 -3.732 4.886 1.00 0.00 O ATOM 157 CB LYS A 217 1.228 -2.208 6.921 1.00 0.00 C ATOM 158 CG LYS A 217 2.086 -1.446 7.908 1.00 0.00 C ATOM 159 CD LYS A 217 1.876 -1.979 9.314 1.00 0.00 C ATOM 160 CE LYS A 217 2.580 -1.132 10.358 1.00 0.00 C ATOM 161 NZ LYS A 217 1.925 0.186 10.547 1.00 0.00 N ATOM 0 H LYS A 217 -0.218 -3.032 5.159 1.00 0.00 H new ATOM 0 HA LYS A 217 1.572 -0.824 5.302 1.00 0.00 H new ATOM 0 HB2 LYS A 217 0.181 -1.986 7.126 1.00 0.00 H new ATOM 0 HB3 LYS A 217 1.367 -3.276 7.090 1.00 0.00 H new ATOM 0 HG2 LYS A 217 3.136 -1.536 7.631 1.00 0.00 H new ATOM 0 HG3 LYS A 217 1.837 -0.385 7.873 1.00 0.00 H new ATOM 0 HD2 LYS A 217 0.809 -2.011 9.533 1.00 0.00 H new ATOM 0 HD3 LYS A 217 2.244 -3.004 9.371 1.00 0.00 H new ATOM 0 HE2 LYS A 217 2.595 -1.667 11.307 1.00 0.00 H new ATOM 0 HE3 LYS A 217 3.618 -0.981 10.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 217 2.354 0.674 11.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 217 2.052 0.763 9.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 217 0.910 0.047 10.724 1.00 0.00 H new ATOM 175 N GLY A 218 3.853 -1.672 4.830 1.00 0.00 N ATOM 176 CA GLY A 218 5.148 -2.163 4.401 1.00 0.00 C ATOM 177 C GLY A 218 5.350 -2.007 2.912 1.00 0.00 C ATOM 178 O GLY A 218 6.202 -2.666 2.315 1.00 0.00 O ATOM 0 H GLY A 218 3.795 -0.661 4.956 1.00 0.00 H new ATOM 0 HA2 GLY A 218 5.933 -1.624 4.931 1.00 0.00 H new ATOM 0 HA3 GLY A 218 5.244 -3.215 4.671 1.00 0.00 H new ATOM 182 N THR A 219 4.542 -1.156 2.304 1.00 0.00 N ATOM 183 CA THR A 219 4.697 -0.840 0.899 1.00 0.00 C ATOM 184 C THR A 219 5.249 0.576 0.752 1.00 0.00 C ATOM 185 O THR A 219 4.974 1.441 1.587 1.00 0.00 O ATOM 186 CB THR A 219 3.349 -0.956 0.159 1.00 0.00 C ATOM 187 OG1 THR A 219 2.733 -2.223 0.436 1.00 0.00 O ATOM 188 CG2 THR A 219 3.535 -0.793 -1.338 1.00 0.00 C ATOM 0 H THR A 219 3.771 -0.672 2.764 1.00 0.00 H new ATOM 0 HA THR A 219 5.393 -1.552 0.456 1.00 0.00 H new ATOM 0 HB THR A 219 2.701 -0.157 0.518 1.00 0.00 H new ATOM 0 HG1 THR A 219 3.424 -2.881 0.658 1.00 0.00 H new ATOM 0 HG21 THR A 219 2.569 -0.879 -1.836 1.00 0.00 H new ATOM 0 HG22 THR A 219 3.965 0.187 -1.547 1.00 0.00 H new ATOM 0 HG23 THR A 219 4.205 -1.569 -1.708 1.00 0.00 H new ATOM 196 N ARG A 220 6.042 0.812 -0.277 1.00 0.00 N ATOM 197 CA ARG A 220 6.553 2.149 -0.529 1.00 0.00 C ATOM 198 C ARG A 220 5.917 2.727 -1.786 1.00 0.00 C ATOM 199 O ARG A 220 5.657 2.005 -2.748 1.00 0.00 O ATOM 200 CB ARG A 220 8.079 2.148 -0.650 1.00 0.00 C ATOM 201 CG ARG A 220 8.790 1.614 0.581 1.00 0.00 C ATOM 202 CD ARG A 220 9.140 0.145 0.426 1.00 0.00 C ATOM 203 NE ARG A 220 9.862 -0.374 1.584 1.00 0.00 N ATOM 204 CZ ARG A 220 11.122 -0.808 1.541 1.00 0.00 C ATOM 205 NH1 ARG A 220 11.821 -0.712 0.415 1.00 0.00 N ATOM 206 NH2 ARG A 220 11.690 -1.316 2.626 1.00 0.00 N ATOM 0 H ARG A 220 6.344 0.104 -0.946 1.00 0.00 H new ATOM 0 HA ARG A 220 6.288 2.778 0.321 1.00 0.00 H new ATOM 0 HB2 ARG A 220 8.366 1.547 -1.513 1.00 0.00 H new ATOM 0 HB3 ARG A 220 8.420 3.165 -0.843 1.00 0.00 H new ATOM 0 HG2 ARG A 220 9.699 2.189 0.756 1.00 0.00 H new ATOM 0 HG3 ARG A 220 8.155 1.748 1.456 1.00 0.00 H new ATOM 0 HD2 ARG A 220 8.226 -0.431 0.281 1.00 0.00 H new ATOM 0 HD3 ARG A 220 9.747 0.010 -0.469 1.00 0.00 H new ATOM 0 HE ARG A 220 9.374 -0.407 2.479 1.00 0.00 H new ATOM 0 HH11 ARG A 220 11.394 -0.306 -0.417 1.00 0.00 H new ATOM 0 HH12 ARG A 220 12.785 -1.044 0.383 1.00 0.00 H new ATOM 0 HH21 ARG A 220 11.163 -1.376 3.497 1.00 0.00 H new ATOM 0 HH22 ARG A 220 12.654 -1.647 2.589 1.00 0.00 H new ATOM 220 N LEU A 221 5.672 4.030 -1.762 1.00 0.00 N ATOM 221 CA LEU A 221 4.993 4.715 -2.851 1.00 0.00 C ATOM 222 C LEU A 221 5.907 5.757 -3.493 1.00 0.00 C ATOM 223 O LEU A 221 6.718 6.388 -2.813 1.00 0.00 O ATOM 224 CB LEU A 221 3.720 5.402 -2.329 1.00 0.00 C ATOM 225 CG LEU A 221 2.602 4.475 -1.847 1.00 0.00 C ATOM 226 CD1 LEU A 221 1.395 5.295 -1.415 1.00 0.00 C ATOM 227 CD2 LEU A 221 2.208 3.481 -2.926 1.00 0.00 C ATOM 0 H LEU A 221 5.938 4.640 -0.989 1.00 0.00 H new ATOM 0 HA LEU A 221 4.725 3.973 -3.604 1.00 0.00 H new ATOM 0 HB2 LEU A 221 3.999 6.060 -1.506 1.00 0.00 H new ATOM 0 HB3 LEU A 221 3.322 6.035 -3.122 1.00 0.00 H new ATOM 0 HG LEU A 221 2.973 3.910 -0.992 1.00 0.00 H new ATOM 0 HD11 LEU A 221 0.604 4.627 -1.074 1.00 0.00 H new ATOM 0 HD12 LEU A 221 1.681 5.963 -0.603 1.00 0.00 H new ATOM 0 HD13 LEU A 221 1.034 5.883 -2.259 1.00 0.00 H new ATOM 0 HD21 LEU A 221 1.412 2.836 -2.554 1.00 0.00 H new ATOM 0 HD22 LEU A 221 1.857 4.020 -3.806 1.00 0.00 H new ATOM 0 HD23 LEU A 221 3.072 2.873 -3.193 1.00 0.00 H new ATOM 239 N CYS A 222 5.784 5.916 -4.803 1.00 0.00 N ATOM 240 CA CYS A 222 6.496 6.960 -5.525 1.00 0.00 C ATOM 241 C CYS A 222 5.733 7.347 -6.787 1.00 0.00 C ATOM 242 O CYS A 222 5.840 6.688 -7.824 1.00 0.00 O ATOM 243 CB CYS A 222 7.918 6.504 -5.880 1.00 0.00 C ATOM 244 SG CYS A 222 8.799 7.611 -7.006 1.00 0.00 S ATOM 0 H CYS A 222 5.192 5.330 -5.392 1.00 0.00 H new ATOM 0 HA CYS A 222 6.569 7.834 -4.878 1.00 0.00 H new ATOM 0 HB2 CYS A 222 8.495 6.406 -4.961 1.00 0.00 H new ATOM 0 HB3 CYS A 222 7.867 5.513 -6.331 1.00 0.00 H new ATOM 0 HG CYS A 222 9.987 7.137 -7.240 1.00 0.00 H new ATOM 250 N PHE A 223 4.931 8.398 -6.684 1.00 0.00 N ATOM 251 CA PHE A 223 4.202 8.914 -7.827 1.00 0.00 C ATOM 252 C PHE A 223 5.087 9.893 -8.587 1.00 0.00 C ATOM 253 O PHE A 223 5.474 10.926 -8.046 1.00 0.00 O ATOM 254 CB PHE A 223 2.920 9.650 -7.402 1.00 0.00 C ATOM 255 CG PHE A 223 2.032 8.926 -6.433 1.00 0.00 C ATOM 256 CD1 PHE A 223 2.239 9.035 -5.065 1.00 0.00 C ATOM 257 CD2 PHE A 223 0.973 8.162 -6.887 1.00 0.00 C ATOM 258 CE1 PHE A 223 1.409 8.386 -4.172 1.00 0.00 C ATOM 259 CE2 PHE A 223 0.139 7.517 -6.000 1.00 0.00 C ATOM 260 CZ PHE A 223 0.357 7.627 -4.642 1.00 0.00 C ATOM 0 H PHE A 223 4.771 8.909 -5.816 1.00 0.00 H new ATOM 0 HA PHE A 223 3.925 8.066 -8.453 1.00 0.00 H new ATOM 0 HB2 PHE A 223 3.204 10.605 -6.959 1.00 0.00 H new ATOM 0 HB3 PHE A 223 2.340 9.873 -8.297 1.00 0.00 H new ATOM 0 HD1 PHE A 223 3.058 9.634 -4.695 1.00 0.00 H new ATOM 0 HD2 PHE A 223 0.798 8.070 -7.949 1.00 0.00 H new ATOM 0 HE1 PHE A 223 1.583 8.472 -3.110 1.00 0.00 H new ATOM 0 HE2 PHE A 223 -0.686 6.925 -6.368 1.00 0.00 H new ATOM 0 HZ PHE A 223 -0.296 7.119 -3.947 1.00 0.00 H new ATOM 270 N HIS A 224 5.386 9.580 -9.838 1.00 0.00 N ATOM 271 CA HIS A 224 6.195 10.465 -10.678 1.00 0.00 C ATOM 272 C HIS A 224 5.366 11.683 -11.073 1.00 0.00 C ATOM 273 O HIS A 224 5.872 12.639 -11.655 1.00 0.00 O ATOM 274 CB HIS A 224 6.685 9.741 -11.943 1.00 0.00 C ATOM 275 CG HIS A 224 7.493 8.499 -11.690 1.00 0.00 C ATOM 276 ND1 HIS A 224 8.111 7.791 -12.698 1.00 0.00 N ATOM 277 CD2 HIS A 224 7.745 7.811 -10.549 1.00 0.00 C ATOM 278 CE1 HIS A 224 8.695 6.722 -12.191 1.00 0.00 C ATOM 279 NE2 HIS A 224 8.491 6.710 -10.888 1.00 0.00 N ATOM 0 H HIS A 224 5.083 8.722 -10.299 1.00 0.00 H new ATOM 0 HA HIS A 224 7.070 10.776 -10.107 1.00 0.00 H new ATOM 0 HB2 HIS A 224 5.820 9.476 -12.550 1.00 0.00 H new ATOM 0 HB3 HIS A 224 7.287 10.435 -12.531 1.00 0.00 H new ATOM 0 HD1 HIS A 224 8.116 8.053 -13.684 1.00 0.00 H new ATOM 0 HD2 HIS A 224 7.418 8.080 -9.555 1.00 0.00 H new ATOM 0 HE1 HIS A 224 9.248 5.981 -12.749 1.00 0.00 H new ATOM 387 N TRP A 231 11.582 7.172 -2.204 1.00 0.00 N ATOM 388 CA TRP A 231 10.624 6.242 -1.620 1.00 0.00 C ATOM 389 C TRP A 231 9.996 6.747 -0.324 1.00 0.00 C ATOM 390 O TRP A 231 10.674 6.954 0.683 1.00 0.00 O ATOM 391 CB TRP A 231 11.279 4.885 -1.385 1.00 0.00 C ATOM 392 CG TRP A 231 11.492 4.118 -2.652 1.00 0.00 C ATOM 393 CD1 TRP A 231 12.683 3.747 -3.209 1.00 0.00 C ATOM 394 CD2 TRP A 231 10.469 3.641 -3.530 1.00 0.00 C ATOM 395 NE1 TRP A 231 12.456 3.057 -4.377 1.00 0.00 N ATOM 396 CE2 TRP A 231 11.106 2.980 -4.594 1.00 0.00 C ATOM 397 CE3 TRP A 231 9.074 3.703 -3.513 1.00 0.00 C ATOM 398 CZ2 TRP A 231 10.393 2.391 -5.634 1.00 0.00 C ATOM 399 CZ3 TRP A 231 8.370 3.117 -4.543 1.00 0.00 C ATOM 400 CH2 TRP A 231 9.030 2.467 -5.590 1.00 0.00 C ATOM 0 HA TRP A 231 9.814 6.147 -2.343 1.00 0.00 H new ATOM 0 HB2 TRP A 231 12.238 5.031 -0.888 1.00 0.00 H new ATOM 0 HB3 TRP A 231 10.656 4.298 -0.710 1.00 0.00 H new ATOM 0 HD1 TRP A 231 13.657 3.963 -2.794 1.00 0.00 H new ATOM 0 HE1 TRP A 231 13.177 2.666 -4.984 1.00 0.00 H new ATOM 0 HE3 TRP A 231 8.556 4.201 -2.707 1.00 0.00 H new ATOM 0 HZ2 TRP A 231 10.899 1.892 -6.447 1.00 0.00 H new ATOM 0 HZ3 TRP A 231 7.291 3.161 -4.541 1.00 0.00 H new ATOM 0 HH2 TRP A 231 8.450 2.015 -6.381 1.00 0.00 H new ATOM 411 N GLN A 232 8.683 6.918 -0.378 1.00 0.00 N ATOM 412 CA GLN A 232 7.873 7.238 0.792 1.00 0.00 C ATOM 413 C GLN A 232 7.079 5.994 1.183 1.00 0.00 C ATOM 414 O GLN A 232 6.980 5.058 0.397 1.00 0.00 O ATOM 415 CB GLN A 232 6.913 8.392 0.468 1.00 0.00 C ATOM 416 CG GLN A 232 5.742 7.990 -0.410 1.00 0.00 C ATOM 417 CD GLN A 232 4.989 9.172 -0.984 1.00 0.00 C ATOM 418 OE1 GLN A 232 5.539 10.251 -1.165 1.00 0.00 O ATOM 419 NE2 GLN A 232 3.723 8.963 -1.302 1.00 0.00 N ATOM 0 H GLN A 232 8.144 6.838 -1.241 1.00 0.00 H new ATOM 0 HA GLN A 232 8.516 7.546 1.617 1.00 0.00 H new ATOM 0 HB2 GLN A 232 6.530 8.806 1.401 1.00 0.00 H new ATOM 0 HB3 GLN A 232 7.470 9.187 -0.028 1.00 0.00 H new ATOM 0 HG2 GLN A 232 6.107 7.369 -1.228 1.00 0.00 H new ATOM 0 HG3 GLN A 232 5.054 7.378 0.173 1.00 0.00 H new ATOM 0 HE21 GLN A 232 3.300 8.050 -1.136 1.00 0.00 H new ATOM 0 HE22 GLN A 232 3.170 9.715 -1.713 1.00 0.00 H new ATOM 428 N ASP A 233 6.525 5.962 2.383 1.00 0.00 N ATOM 429 CA ASP A 233 5.685 4.839 2.783 1.00 0.00 C ATOM 430 C ASP A 233 4.239 5.104 2.409 1.00 0.00 C ATOM 431 O ASP A 233 3.852 6.254 2.191 1.00 0.00 O ATOM 432 CB ASP A 233 5.753 4.585 4.290 1.00 0.00 C ATOM 433 CG ASP A 233 7.151 4.298 4.788 1.00 0.00 C ATOM 434 OD1 ASP A 233 7.905 5.255 5.039 1.00 0.00 O ATOM 435 OD2 ASP A 233 7.499 3.110 4.945 1.00 0.00 O ATOM 0 H ASP A 233 6.637 6.688 3.091 1.00 0.00 H new ATOM 0 HA ASP A 233 6.061 3.960 2.259 1.00 0.00 H new ATOM 0 HB2 ASP A 233 5.360 5.455 4.816 1.00 0.00 H new ATOM 0 HB3 ASP A 233 5.107 3.743 4.539 1.00 0.00 H new ATOM 440 N VAL A 234 3.438 4.053 2.338 1.00 0.00 N ATOM 441 CA VAL A 234 1.997 4.225 2.188 1.00 0.00 C ATOM 442 C VAL A 234 1.483 5.004 3.372 1.00 0.00 C ATOM 443 O VAL A 234 0.745 5.975 3.235 1.00 0.00 O ATOM 444 CB VAL A 234 1.229 2.901 2.177 1.00 0.00 C ATOM 445 CG1 VAL A 234 -0.083 3.048 1.436 1.00 0.00 C ATOM 446 CG2 VAL A 234 2.042 1.782 1.600 1.00 0.00 C ATOM 0 H VAL A 234 3.752 3.084 2.381 1.00 0.00 H new ATOM 0 HA VAL A 234 1.840 4.729 1.235 1.00 0.00 H new ATOM 0 HB VAL A 234 1.017 2.643 3.215 1.00 0.00 H new ATOM 0 HG11 VAL A 234 -0.612 2.095 1.441 1.00 0.00 H new ATOM 0 HG12 VAL A 234 -0.695 3.805 1.926 1.00 0.00 H new ATOM 0 HG13 VAL A 234 0.112 3.350 0.407 1.00 0.00 H new ATOM 0 HG21 VAL A 234 1.456 0.863 1.613 1.00 0.00 H new ATOM 0 HG22 VAL A 234 2.316 2.023 0.573 1.00 0.00 H new ATOM 0 HG23 VAL A 234 2.946 1.645 2.194 1.00 0.00 H new ATOM 456 N GLU A 235 1.925 4.559 4.538 1.00 0.00 N ATOM 457 CA GLU A 235 1.552 5.147 5.812 1.00 0.00 C ATOM 458 C GLU A 235 1.949 6.610 5.862 1.00 0.00 C ATOM 459 O GLU A 235 1.402 7.384 6.641 1.00 0.00 O ATOM 460 CB GLU A 235 2.239 4.384 6.942 1.00 0.00 C ATOM 461 CG GLU A 235 1.929 2.898 6.944 1.00 0.00 C ATOM 462 CD GLU A 235 2.894 2.109 7.798 1.00 0.00 C ATOM 463 OE1 GLU A 235 2.758 2.135 9.036 1.00 0.00 O ATOM 464 OE2 GLU A 235 3.795 1.459 7.234 1.00 0.00 O ATOM 0 H GLU A 235 2.562 3.767 4.625 1.00 0.00 H new ATOM 0 HA GLU A 235 0.470 5.080 5.929 1.00 0.00 H new ATOM 0 HB2 GLU A 235 3.317 4.522 6.860 1.00 0.00 H new ATOM 0 HB3 GLU A 235 1.934 4.812 7.897 1.00 0.00 H new ATOM 0 HG2 GLU A 235 0.914 2.742 7.309 1.00 0.00 H new ATOM 0 HG3 GLU A 235 1.961 2.522 5.922 1.00 0.00 H new ATOM 471 N ASP A 236 2.916 6.973 5.031 1.00 0.00 N ATOM 472 CA ASP A 236 3.403 8.345 4.987 1.00 0.00 C ATOM 473 C ASP A 236 2.477 9.204 4.130 1.00 0.00 C ATOM 474 O ASP A 236 2.065 10.292 4.535 1.00 0.00 O ATOM 475 CB ASP A 236 4.826 8.389 4.433 1.00 0.00 C ATOM 476 CG ASP A 236 5.484 9.738 4.640 1.00 0.00 C ATOM 477 OD1 ASP A 236 6.049 9.963 5.734 1.00 0.00 O ATOM 478 OD2 ASP A 236 5.466 10.563 3.709 1.00 0.00 O ATOM 0 H ASP A 236 3.378 6.338 4.380 1.00 0.00 H new ATOM 0 HA ASP A 236 3.414 8.743 6.002 1.00 0.00 H new ATOM 0 HB2 ASP A 236 5.425 7.617 4.916 1.00 0.00 H new ATOM 0 HB3 ASP A 236 4.806 8.157 3.368 1.00 0.00 H new ATOM 483 N PHE A 237 2.139 8.694 2.949 1.00 0.00 N ATOM 484 CA PHE A 237 1.238 9.391 2.035 1.00 0.00 C ATOM 485 C PHE A 237 -0.182 9.402 2.574 1.00 0.00 C ATOM 486 O PHE A 237 -0.833 10.438 2.603 1.00 0.00 O ATOM 487 CB PHE A 237 1.248 8.725 0.660 1.00 0.00 C ATOM 488 CG PHE A 237 0.263 9.330 -0.305 1.00 0.00 C ATOM 489 CD1 PHE A 237 0.389 10.651 -0.714 1.00 0.00 C ATOM 490 CD2 PHE A 237 -0.800 8.583 -0.792 1.00 0.00 C ATOM 491 CE1 PHE A 237 -0.517 11.208 -1.593 1.00 0.00 C ATOM 492 CE2 PHE A 237 -1.708 9.138 -1.672 1.00 0.00 C ATOM 493 CZ PHE A 237 -1.568 10.452 -2.071 1.00 0.00 C ATOM 0 H PHE A 237 2.477 7.797 2.601 1.00 0.00 H new ATOM 0 HA PHE A 237 1.591 10.418 1.943 1.00 0.00 H new ATOM 0 HB2 PHE A 237 2.250 8.796 0.237 1.00 0.00 H new ATOM 0 HB3 PHE A 237 1.026 7.664 0.777 1.00 0.00 H new ATOM 0 HD1 PHE A 237 1.206 11.250 -0.340 1.00 0.00 H new ATOM 0 HD2 PHE A 237 -0.919 7.556 -0.479 1.00 0.00 H new ATOM 0 HE1 PHE A 237 -0.404 12.235 -1.907 1.00 0.00 H new ATOM 0 HE2 PHE A 237 -2.528 8.544 -2.048 1.00 0.00 H new ATOM 0 HZ PHE A 237 -2.280 10.888 -2.756 1.00 0.00 H new ATOM 503 N ALA A 238 -0.651 8.237 2.990 1.00 0.00 N ATOM 504 CA ALA A 238 -2.008 8.087 3.519 1.00 0.00 C ATOM 505 C ALA A 238 -2.224 8.972 4.747 1.00 0.00 C ATOM 506 O ALA A 238 -3.330 9.449 4.996 1.00 0.00 O ATOM 507 CB ALA A 238 -2.277 6.634 3.868 1.00 0.00 C ATOM 0 H ALA A 238 -0.111 7.372 2.973 1.00 0.00 H new ATOM 0 HA ALA A 238 -2.708 8.404 2.746 1.00 0.00 H new ATOM 0 HB1 ALA A 238 -3.289 6.535 4.260 1.00 0.00 H new ATOM 0 HB2 ALA A 238 -2.173 6.020 2.974 1.00 0.00 H new ATOM 0 HB3 ALA A 238 -1.562 6.302 4.621 1.00 0.00 H new ATOM 513 N ARG A 239 -1.157 9.188 5.507 1.00 0.00 N ATOM 514 CA ARG A 239 -1.199 10.052 6.677 1.00 0.00 C ATOM 515 C ARG A 239 -1.383 11.499 6.236 1.00 0.00 C ATOM 516 O ARG A 239 -2.106 12.276 6.859 1.00 0.00 O ATOM 517 CB ARG A 239 0.104 9.896 7.456 1.00 0.00 C ATOM 518 CG ARG A 239 0.058 10.449 8.864 1.00 0.00 C ATOM 519 CD ARG A 239 1.376 10.212 9.587 1.00 0.00 C ATOM 520 NE ARG A 239 1.784 8.805 9.523 1.00 0.00 N ATOM 521 CZ ARG A 239 2.722 8.259 10.296 1.00 0.00 C ATOM 522 NH1 ARG A 239 3.360 9.002 11.192 1.00 0.00 N ATOM 523 NH2 ARG A 239 3.027 6.972 10.166 1.00 0.00 N ATOM 0 H ARG A 239 -0.243 8.771 5.330 1.00 0.00 H new ATOM 0 HA ARG A 239 -2.036 9.774 7.317 1.00 0.00 H new ATOM 0 HB2 ARG A 239 0.362 8.838 7.502 1.00 0.00 H new ATOM 0 HB3 ARG A 239 0.903 10.395 6.908 1.00 0.00 H new ATOM 0 HG2 ARG A 239 -0.156 11.517 8.832 1.00 0.00 H new ATOM 0 HG3 ARG A 239 -0.754 9.977 9.417 1.00 0.00 H new ATOM 0 HD2 ARG A 239 2.152 10.836 9.144 1.00 0.00 H new ATOM 0 HD3 ARG A 239 1.279 10.516 10.629 1.00 0.00 H new ATOM 0 HE ARG A 239 1.319 8.205 8.842 1.00 0.00 H new ATOM 0 HH11 ARG A 239 3.132 9.992 11.289 1.00 0.00 H new ATOM 0 HH12 ARG A 239 4.078 8.583 11.783 1.00 0.00 H new ATOM 0 HH21 ARG A 239 2.543 6.401 9.474 1.00 0.00 H new ATOM 0 HH22 ARG A 239 3.745 6.556 10.759 1.00 0.00 H new ATOM 771 N TYR A 257 -5.362 9.558 -7.718 1.00 0.00 N ATOM 772 CA TYR A 257 -4.548 8.756 -8.610 1.00 0.00 C ATOM 773 C TYR A 257 -4.770 7.274 -8.310 1.00 0.00 C ATOM 774 O TYR A 257 -4.328 6.766 -7.280 1.00 0.00 O ATOM 775 CB TYR A 257 -3.058 9.128 -8.477 1.00 0.00 C ATOM 776 CG TYR A 257 -2.156 8.382 -9.438 1.00 0.00 C ATOM 777 CD1 TYR A 257 -1.899 7.028 -9.266 1.00 0.00 C ATOM 778 CD2 TYR A 257 -1.568 9.027 -10.517 1.00 0.00 C ATOM 779 CE1 TYR A 257 -1.085 6.339 -10.133 1.00 0.00 C ATOM 780 CE2 TYR A 257 -0.746 8.344 -11.391 1.00 0.00 C ATOM 781 CZ TYR A 257 -0.512 6.998 -11.196 1.00 0.00 C ATOM 782 OH TYR A 257 0.305 6.312 -12.062 1.00 0.00 O ATOM 0 HA TYR A 257 -4.846 8.957 -9.639 1.00 0.00 H new ATOM 0 HB2 TYR A 257 -2.944 10.199 -8.643 1.00 0.00 H new ATOM 0 HB3 TYR A 257 -2.732 8.927 -7.456 1.00 0.00 H new ATOM 0 HD1 TYR A 257 -2.348 6.506 -8.434 1.00 0.00 H new ATOM 0 HD2 TYR A 257 -1.756 10.079 -10.675 1.00 0.00 H new ATOM 0 HE1 TYR A 257 -0.896 5.287 -9.981 1.00 0.00 H new ATOM 0 HE2 TYR A 257 -0.289 8.860 -12.222 1.00 0.00 H new ATOM 0 HH TYR A 257 0.883 6.945 -12.537 1.00 0.00 H new ATOM 792 N GLY A 258 -5.480 6.591 -9.200 1.00 0.00 N ATOM 793 CA GLY A 258 -5.673 5.163 -9.045 1.00 0.00 C ATOM 794 C GLY A 258 -7.043 4.796 -8.527 1.00 0.00 C ATOM 795 O GLY A 258 -7.280 3.642 -8.164 1.00 0.00 O ATOM 0 H GLY A 258 -5.924 6.999 -10.023 1.00 0.00 H new ATOM 0 HA2 GLY A 258 -5.514 4.676 -10.007 1.00 0.00 H new ATOM 0 HA3 GLY A 258 -4.918 4.774 -8.362 1.00 0.00 H new ATOM 799 N SER A 259 -7.956 5.756 -8.520 1.00 0.00 N ATOM 800 CA SER A 259 -9.284 5.540 -7.963 1.00 0.00 C ATOM 801 C SER A 259 -10.103 4.571 -8.812 1.00 0.00 C ATOM 802 O SER A 259 -11.141 4.067 -8.373 1.00 0.00 O ATOM 803 CB SER A 259 -10.021 6.872 -7.825 1.00 0.00 C ATOM 804 OG SER A 259 -9.279 7.782 -7.035 1.00 0.00 O ATOM 0 H SER A 259 -7.802 6.692 -8.894 1.00 0.00 H new ATOM 0 HA SER A 259 -9.160 5.092 -6.977 1.00 0.00 H new ATOM 0 HB2 SER A 259 -10.195 7.300 -8.812 1.00 0.00 H new ATOM 0 HB3 SER A 259 -10.999 6.706 -7.373 1.00 0.00 H new ATOM 0 HG SER A 259 -9.769 8.627 -6.962 1.00 0.00 H new ATOM 810 N ASP A 260 -9.638 4.301 -10.020 1.00 0.00 N ATOM 811 CA ASP A 260 -10.314 3.356 -10.888 1.00 0.00 C ATOM 812 C ASP A 260 -9.505 2.079 -11.006 1.00 0.00 C ATOM 813 O ASP A 260 -10.061 0.991 -11.152 1.00 0.00 O ATOM 814 CB ASP A 260 -10.563 3.951 -12.272 1.00 0.00 C ATOM 815 CG ASP A 260 -11.223 2.955 -13.202 1.00 0.00 C ATOM 816 OD1 ASP A 260 -12.276 2.388 -12.824 1.00 0.00 O ATOM 817 OD2 ASP A 260 -10.688 2.724 -14.308 1.00 0.00 O ATOM 0 H ASP A 260 -8.799 4.721 -10.419 1.00 0.00 H new ATOM 0 HA ASP A 260 -11.282 3.126 -10.442 1.00 0.00 H new ATOM 0 HB2 ASP A 260 -11.194 4.835 -12.179 1.00 0.00 H new ATOM 0 HB3 ASP A 260 -9.617 4.278 -12.702 1.00 0.00 H new ATOM 822 N GLY A 261 -8.193 2.210 -10.897 1.00 0.00 N ATOM 823 CA GLY A 261 -7.331 1.061 -11.039 1.00 0.00 C ATOM 824 C GLY A 261 -5.900 1.430 -11.371 1.00 0.00 C ATOM 825 O GLY A 261 -5.623 2.521 -11.866 1.00 0.00 O ATOM 0 H GLY A 261 -7.712 3.090 -10.713 1.00 0.00 H new ATOM 0 HA2 GLY A 261 -7.346 0.486 -10.113 1.00 0.00 H new ATOM 0 HA3 GLY A 261 -7.724 0.414 -11.823 1.00 0.00 H new ATOM 829 N LEU A 262 -5.002 0.508 -11.068 1.00 0.00 N ATOM 830 CA LEU A 262 -3.575 0.656 -11.343 1.00 0.00 C ATOM 831 C LEU A 262 -3.080 -0.487 -12.217 1.00 0.00 C ATOM 832 O LEU A 262 -2.919 -1.601 -11.735 1.00 0.00 O ATOM 833 CB LEU A 262 -2.795 0.633 -10.035 1.00 0.00 C ATOM 834 CG LEU A 262 -2.212 1.963 -9.583 1.00 0.00 C ATOM 835 CD1 LEU A 262 -3.268 3.046 -9.558 1.00 0.00 C ATOM 836 CD2 LEU A 262 -1.588 1.801 -8.214 1.00 0.00 C ATOM 0 H LEU A 262 -5.242 -0.376 -10.619 1.00 0.00 H new ATOM 0 HA LEU A 262 -3.423 1.604 -11.859 1.00 0.00 H new ATOM 0 HB2 LEU A 262 -3.453 0.261 -9.249 1.00 0.00 H new ATOM 0 HB3 LEU A 262 -1.980 -0.084 -10.134 1.00 0.00 H new ATOM 0 HG LEU A 262 -1.447 2.267 -10.297 1.00 0.00 H new ATOM 0 HD11 LEU A 262 -2.819 3.984 -9.231 1.00 0.00 H new ATOM 0 HD12 LEU A 262 -3.684 3.172 -10.558 1.00 0.00 H new ATOM 0 HD13 LEU A 262 -4.063 2.764 -8.867 1.00 0.00 H new ATOM 0 HD21 LEU A 262 -1.170 2.754 -7.890 1.00 0.00 H new ATOM 0 HD22 LEU A 262 -2.349 1.478 -7.503 1.00 0.00 H new ATOM 0 HD23 LEU A 262 -0.795 1.054 -8.262 1.00 0.00 H new ATOM 848 N LYS A 263 -2.829 -0.217 -13.484 1.00 0.00 N ATOM 849 CA LYS A 263 -2.438 -1.269 -14.408 1.00 0.00 C ATOM 850 C LYS A 263 -0.923 -1.429 -14.443 1.00 0.00 C ATOM 851 O LYS A 263 -0.190 -0.484 -14.731 1.00 0.00 O ATOM 852 CB LYS A 263 -3.000 -0.970 -15.793 1.00 0.00 C ATOM 853 CG LYS A 263 -2.821 -2.092 -16.801 1.00 0.00 C ATOM 854 CD LYS A 263 -3.968 -2.102 -17.797 1.00 0.00 C ATOM 855 CE LYS A 263 -4.049 -0.800 -18.582 1.00 0.00 C ATOM 856 NZ LYS A 263 -5.335 -0.678 -19.319 1.00 0.00 N ATOM 0 H LYS A 263 -2.888 0.714 -13.896 1.00 0.00 H new ATOM 0 HA LYS A 263 -2.853 -2.216 -14.064 1.00 0.00 H new ATOM 0 HB2 LYS A 263 -4.063 -0.749 -15.700 1.00 0.00 H new ATOM 0 HB3 LYS A 263 -2.520 -0.071 -16.180 1.00 0.00 H new ATOM 0 HG2 LYS A 263 -1.875 -1.967 -17.328 1.00 0.00 H new ATOM 0 HG3 LYS A 263 -2.773 -3.050 -16.283 1.00 0.00 H new ATOM 0 HD2 LYS A 263 -3.842 -2.935 -18.488 1.00 0.00 H new ATOM 0 HD3 LYS A 263 -4.907 -2.266 -17.268 1.00 0.00 H new ATOM 0 HE2 LYS A 263 -3.940 0.043 -17.900 1.00 0.00 H new ATOM 0 HE3 LYS A 263 -3.220 -0.749 -19.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 263 -5.352 0.221 -19.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 263 -5.428 -1.469 -19.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 263 -6.126 -0.701 -18.644 1.00 0.00 H new ATOM 870 N LEU A 264 -0.478 -2.632 -14.115 1.00 0.00 N ATOM 871 CA LEU A 264 0.929 -2.985 -14.079 1.00 0.00 C ATOM 872 C LEU A 264 1.523 -2.898 -15.486 1.00 0.00 C ATOM 873 O LEU A 264 1.241 -3.730 -16.342 1.00 0.00 O ATOM 874 CB LEU A 264 1.037 -4.409 -13.509 1.00 0.00 C ATOM 875 CG LEU A 264 2.407 -4.866 -12.995 1.00 0.00 C ATOM 876 CD1 LEU A 264 2.306 -6.267 -12.418 1.00 0.00 C ATOM 877 CD2 LEU A 264 3.463 -4.839 -14.082 1.00 0.00 C ATOM 0 H LEU A 264 -1.097 -3.402 -13.862 1.00 0.00 H new ATOM 0 HA LEU A 264 1.491 -2.297 -13.448 1.00 0.00 H new ATOM 0 HB2 LEU A 264 0.324 -4.498 -12.689 1.00 0.00 H new ATOM 0 HB3 LEU A 264 0.719 -5.106 -14.284 1.00 0.00 H new ATOM 0 HG LEU A 264 2.712 -4.165 -12.218 1.00 0.00 H new ATOM 0 HD11 LEU A 264 3.284 -6.583 -12.056 1.00 0.00 H new ATOM 0 HD12 LEU A 264 1.595 -6.270 -11.592 1.00 0.00 H new ATOM 0 HD13 LEU A 264 1.966 -6.956 -13.192 1.00 0.00 H new ATOM 0 HD21 LEU A 264 4.417 -5.171 -13.671 1.00 0.00 H new ATOM 0 HD22 LEU A 264 3.167 -5.504 -14.894 1.00 0.00 H new ATOM 0 HD23 LEU A 264 3.566 -3.823 -14.464 1.00 0.00 H new ATOM 889 N LEU A 265 2.335 -1.881 -15.719 1.00 0.00 N ATOM 890 CA LEU A 265 2.974 -1.690 -17.011 1.00 0.00 C ATOM 891 C LEU A 265 4.228 -2.556 -17.120 1.00 0.00 C ATOM 892 O LEU A 265 4.489 -3.156 -18.162 1.00 0.00 O ATOM 893 CB LEU A 265 3.343 -0.215 -17.211 1.00 0.00 C ATOM 894 CG LEU A 265 2.205 0.797 -17.026 1.00 0.00 C ATOM 895 CD1 LEU A 265 2.751 2.209 -17.168 1.00 0.00 C ATOM 896 CD2 LEU A 265 1.077 0.550 -18.023 1.00 0.00 C ATOM 0 H LEU A 265 2.569 -1.170 -15.026 1.00 0.00 H new ATOM 0 HA LEU A 265 2.270 -1.988 -17.788 1.00 0.00 H new ATOM 0 HB2 LEU A 265 4.142 0.036 -16.514 1.00 0.00 H new ATOM 0 HB3 LEU A 265 3.748 -0.096 -18.216 1.00 0.00 H new ATOM 0 HG LEU A 265 1.788 0.674 -16.026 1.00 0.00 H new ATOM 0 HD11 LEU A 265 1.942 2.927 -17.036 1.00 0.00 H new ATOM 0 HD12 LEU A 265 3.516 2.381 -16.411 1.00 0.00 H new ATOM 0 HD13 LEU A 265 3.188 2.332 -18.159 1.00 0.00 H new ATOM 0 HD21 LEU A 265 0.286 1.283 -17.866 1.00 0.00 H new ATOM 0 HD22 LEU A 265 1.462 0.643 -19.038 1.00 0.00 H new ATOM 0 HD23 LEU A 265 0.676 -0.453 -17.878 1.00 0.00 H new ATOM 908 N SER A 266 5.000 -2.626 -16.036 1.00 0.00 N ATOM 909 CA SER A 266 6.241 -3.397 -16.027 1.00 0.00 C ATOM 910 C SER A 266 6.645 -3.758 -14.598 1.00 0.00 C ATOM 911 O SER A 266 6.172 -3.142 -13.636 1.00 0.00 O ATOM 912 CB SER A 266 7.359 -2.596 -16.695 1.00 0.00 C ATOM 913 OG SER A 266 8.508 -3.398 -16.910 1.00 0.00 O ATOM 0 H SER A 266 4.788 -2.159 -15.155 1.00 0.00 H new ATOM 0 HA SER A 266 6.076 -4.319 -16.584 1.00 0.00 H new ATOM 0 HB2 SER A 266 7.006 -2.199 -17.647 1.00 0.00 H new ATOM 0 HB3 SER A 266 7.621 -1.742 -16.071 1.00 0.00 H new ATOM 0 HG SER A 266 9.206 -2.861 -17.340 1.00 0.00 H new ATOM 919 N HIS A 267 7.528 -4.742 -14.464 1.00 0.00 N ATOM 920 CA HIS A 267 7.920 -5.247 -13.157 1.00 0.00 C ATOM 921 C HIS A 267 9.413 -5.565 -13.105 1.00 0.00 C ATOM 922 O HIS A 267 9.989 -6.068 -14.066 1.00 0.00 O ATOM 923 CB HIS A 267 7.091 -6.496 -12.825 1.00 0.00 C ATOM 924 CG HIS A 267 7.500 -7.228 -11.576 1.00 0.00 C ATOM 925 ND1 HIS A 267 7.955 -6.608 -10.431 1.00 0.00 N ATOM 926 CD2 HIS A 267 7.506 -8.546 -11.301 1.00 0.00 C ATOM 927 CE1 HIS A 267 8.222 -7.517 -9.515 1.00 0.00 C ATOM 928 NE2 HIS A 267 7.958 -8.704 -10.015 1.00 0.00 N ATOM 0 H HIS A 267 7.986 -5.206 -15.249 1.00 0.00 H new ATOM 0 HA HIS A 267 7.727 -4.473 -12.414 1.00 0.00 H new ATOM 0 HB2 HIS A 267 6.046 -6.202 -12.728 1.00 0.00 H new ATOM 0 HB3 HIS A 267 7.152 -7.186 -13.667 1.00 0.00 H new ATOM 0 HD1 HIS A 267 8.067 -5.601 -10.312 1.00 0.00 H new ATOM 0 HD2 HIS A 267 7.208 -9.338 -11.973 1.00 0.00 H new ATOM 0 HE1 HIS A 267 8.595 -7.320 -8.521 1.00 0.00 H new ATOM 937 N GLU A 268 10.019 -5.234 -11.974 1.00 0.00 N ATOM 938 CA GLU A 268 11.397 -5.600 -11.679 1.00 0.00 C ATOM 939 C GLU A 268 11.476 -6.162 -10.262 1.00 0.00 C ATOM 940 O GLU A 268 10.799 -5.660 -9.362 1.00 0.00 O ATOM 941 CB GLU A 268 12.311 -4.375 -11.799 1.00 0.00 C ATOM 942 CG GLU A 268 13.740 -4.630 -11.342 1.00 0.00 C ATOM 943 CD GLU A 268 14.574 -3.366 -11.275 1.00 0.00 C ATOM 944 OE1 GLU A 268 14.405 -2.586 -10.312 1.00 0.00 O ATOM 945 OE2 GLU A 268 15.401 -3.145 -12.183 1.00 0.00 O ATOM 0 H GLU A 268 9.566 -4.701 -11.231 1.00 0.00 H new ATOM 0 HA GLU A 268 11.727 -6.354 -12.394 1.00 0.00 H new ATOM 0 HB2 GLU A 268 12.325 -4.044 -12.837 1.00 0.00 H new ATOM 0 HB3 GLU A 268 11.891 -3.560 -11.210 1.00 0.00 H new ATOM 0 HG2 GLU A 268 13.723 -5.100 -10.359 1.00 0.00 H new ATOM 0 HG3 GLU A 268 14.214 -5.336 -12.025 1.00 0.00 H new ATOM 952 N GLU A 269 12.261 -7.209 -10.061 1.00 0.00 N ATOM 953 CA GLU A 269 12.505 -7.713 -8.718 1.00 0.00 C ATOM 954 C GLU A 269 13.814 -7.143 -8.183 1.00 0.00 C ATOM 955 O GLU A 269 14.901 -7.543 -8.600 1.00 0.00 O ATOM 956 CB GLU A 269 12.525 -9.245 -8.682 1.00 0.00 C ATOM 957 CG GLU A 269 11.161 -9.884 -8.929 1.00 0.00 C ATOM 958 CD GLU A 269 10.905 -10.201 -10.390 1.00 0.00 C ATOM 959 OE1 GLU A 269 10.539 -9.286 -11.150 1.00 0.00 O ATOM 960 OE2 GLU A 269 11.041 -11.381 -10.773 1.00 0.00 O ATOM 0 H GLU A 269 12.736 -7.723 -10.803 1.00 0.00 H new ATOM 0 HA GLU A 269 11.685 -7.387 -8.079 1.00 0.00 H new ATOM 0 HB2 GLU A 269 13.227 -9.608 -9.433 1.00 0.00 H new ATOM 0 HB3 GLU A 269 12.899 -9.572 -7.712 1.00 0.00 H new ATOM 0 HG2 GLU A 269 11.086 -10.802 -8.346 1.00 0.00 H new ATOM 0 HG3 GLU A 269 10.382 -9.213 -8.568 1.00 0.00 H new ATOM 967 N SER A 270 13.693 -6.203 -7.261 1.00 0.00 N ATOM 968 CA SER A 270 14.839 -5.477 -6.741 1.00 0.00 C ATOM 969 C SER A 270 15.103 -5.898 -5.301 1.00 0.00 C ATOM 970 O SER A 270 14.401 -6.752 -4.762 1.00 0.00 O ATOM 971 CB SER A 270 14.574 -3.969 -6.832 1.00 0.00 C ATOM 972 OG SER A 270 15.703 -3.204 -6.437 1.00 0.00 O ATOM 0 H SER A 270 12.801 -5.922 -6.853 1.00 0.00 H new ATOM 0 HA SER A 270 15.724 -5.709 -7.334 1.00 0.00 H new ATOM 0 HB2 SER A 270 14.301 -3.710 -7.855 1.00 0.00 H new ATOM 0 HB3 SER A 270 13.723 -3.712 -6.201 1.00 0.00 H new ATOM 0 HG SER A 270 15.494 -2.250 -6.511 1.00 0.00 H new ATOM 1047 N SER A 276 14.316 -8.665 -0.599 1.00 0.00 N ATOM 1048 CA SER A 276 13.842 -8.650 -1.975 1.00 0.00 C ATOM 1049 C SER A 276 12.480 -7.966 -2.044 1.00 0.00 C ATOM 1050 O SER A 276 11.627 -8.181 -1.182 1.00 0.00 O ATOM 1051 CB SER A 276 13.745 -10.078 -2.521 1.00 0.00 C ATOM 1052 OG SER A 276 14.982 -10.763 -2.397 1.00 0.00 O ATOM 0 HA SER A 276 14.552 -8.094 -2.587 1.00 0.00 H new ATOM 0 HB2 SER A 276 12.969 -10.623 -1.983 1.00 0.00 H new ATOM 0 HB3 SER A 276 13.446 -10.049 -3.569 1.00 0.00 H new ATOM 0 HG SER A 276 15.509 -10.359 -1.676 1.00 0.00 H new ATOM 1058 N VAL A 277 12.280 -7.131 -3.054 1.00 0.00 N ATOM 1059 CA VAL A 277 11.025 -6.420 -3.203 1.00 0.00 C ATOM 1060 C VAL A 277 10.457 -6.565 -4.602 1.00 0.00 C ATOM 1061 O VAL A 277 11.180 -6.797 -5.577 1.00 0.00 O ATOM 1062 CB VAL A 277 11.146 -4.911 -2.894 1.00 0.00 C ATOM 1063 CG1 VAL A 277 11.350 -4.671 -1.408 1.00 0.00 C ATOM 1064 CG2 VAL A 277 12.273 -4.279 -3.692 1.00 0.00 C ATOM 0 H VAL A 277 12.970 -6.932 -3.778 1.00 0.00 H new ATOM 0 HA VAL A 277 10.356 -6.879 -2.475 1.00 0.00 H new ATOM 0 HB VAL A 277 10.210 -4.439 -3.191 1.00 0.00 H new ATOM 0 HG11 VAL A 277 11.432 -3.600 -1.220 1.00 0.00 H new ATOM 0 HG12 VAL A 277 10.501 -5.073 -0.855 1.00 0.00 H new ATOM 0 HG13 VAL A 277 12.264 -5.168 -1.081 1.00 0.00 H new ATOM 0 HG21 VAL A 277 12.335 -3.217 -3.455 1.00 0.00 H new ATOM 0 HG22 VAL A 277 13.215 -4.764 -3.437 1.00 0.00 H new ATOM 0 HG23 VAL A 277 12.078 -4.402 -4.757 1.00 0.00 H new ATOM 1074 N LEU A 278 9.151 -6.419 -4.679 1.00 0.00 N ATOM 1075 CA LEU A 278 8.436 -6.447 -5.934 1.00 0.00 C ATOM 1076 C LEU A 278 8.229 -5.023 -6.435 1.00 0.00 C ATOM 1077 O LEU A 278 7.462 -4.262 -5.847 1.00 0.00 O ATOM 1078 CB LEU A 278 7.088 -7.143 -5.745 1.00 0.00 C ATOM 1079 CG LEU A 278 7.163 -8.607 -5.308 1.00 0.00 C ATOM 1080 CD1 LEU A 278 5.764 -9.157 -5.067 1.00 0.00 C ATOM 1081 CD2 LEU A 278 7.890 -9.441 -6.357 1.00 0.00 C ATOM 0 H LEU A 278 8.553 -6.277 -3.865 1.00 0.00 H new ATOM 0 HA LEU A 278 9.017 -7.001 -6.671 1.00 0.00 H new ATOM 0 HB2 LEU A 278 6.513 -6.589 -5.003 1.00 0.00 H new ATOM 0 HB3 LEU A 278 6.535 -7.089 -6.683 1.00 0.00 H new ATOM 0 HG LEU A 278 7.725 -8.663 -4.376 1.00 0.00 H new ATOM 0 HD11 LEU A 278 5.831 -10.200 -4.757 1.00 0.00 H new ATOM 0 HD12 LEU A 278 5.275 -8.576 -4.285 1.00 0.00 H new ATOM 0 HD13 LEU A 278 5.183 -9.089 -5.987 1.00 0.00 H new ATOM 0 HD21 LEU A 278 7.934 -10.480 -6.029 1.00 0.00 H new ATOM 0 HD22 LEU A 278 7.354 -9.382 -7.304 1.00 0.00 H new ATOM 0 HD23 LEU A 278 8.902 -9.059 -6.488 1.00 0.00 H new ATOM 1093 N LYS A 279 8.912 -4.664 -7.515 1.00 0.00 N ATOM 1094 CA LYS A 279 8.804 -3.317 -8.064 1.00 0.00 C ATOM 1095 C LYS A 279 7.826 -3.323 -9.219 1.00 0.00 C ATOM 1096 O LYS A 279 8.100 -3.911 -10.268 1.00 0.00 O ATOM 1097 CB LYS A 279 10.160 -2.776 -8.557 1.00 0.00 C ATOM 1098 CG LYS A 279 10.062 -1.352 -9.093 1.00 0.00 C ATOM 1099 CD LYS A 279 11.299 -0.923 -9.888 1.00 0.00 C ATOM 1100 CE LYS A 279 12.440 -0.373 -9.024 1.00 0.00 C ATOM 1101 NZ LYS A 279 13.129 -1.424 -8.232 1.00 0.00 N ATOM 0 H LYS A 279 9.543 -5.282 -8.026 1.00 0.00 H new ATOM 0 HA LYS A 279 8.455 -2.664 -7.264 1.00 0.00 H new ATOM 0 HB2 LYS A 279 10.878 -2.803 -7.737 1.00 0.00 H new ATOM 0 HB3 LYS A 279 10.545 -3.429 -9.340 1.00 0.00 H new ATOM 0 HG2 LYS A 279 9.181 -1.270 -9.730 1.00 0.00 H new ATOM 0 HG3 LYS A 279 9.917 -0.665 -8.259 1.00 0.00 H new ATOM 0 HD2 LYS A 279 11.667 -1.778 -10.455 1.00 0.00 H new ATOM 0 HD3 LYS A 279 11.007 -0.162 -10.612 1.00 0.00 H new ATOM 0 HE2 LYS A 279 13.167 0.125 -9.666 1.00 0.00 H new ATOM 0 HE3 LYS A 279 12.043 0.383 -8.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 279 13.980 -1.023 -7.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 279 12.488 -1.778 -7.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 279 13.401 -2.208 -8.858 1.00 0.00 H new ATOM 1115 N LEU A 280 6.684 -2.699 -9.021 1.00 0.00 N ATOM 1116 CA LEU A 280 5.681 -2.611 -10.065 1.00 0.00 C ATOM 1117 C LEU A 280 5.512 -1.163 -10.509 1.00 0.00 C ATOM 1118 O LEU A 280 5.376 -0.266 -9.678 1.00 0.00 O ATOM 1119 CB LEU A 280 4.330 -3.162 -9.582 1.00 0.00 C ATOM 1120 CG LEU A 280 4.311 -4.623 -9.100 1.00 0.00 C ATOM 1121 CD1 LEU A 280 2.885 -5.145 -9.013 1.00 0.00 C ATOM 1122 CD2 LEU A 280 5.151 -5.508 -10.002 1.00 0.00 C ATOM 0 H LEU A 280 6.425 -2.244 -8.146 1.00 0.00 H new ATOM 0 HA LEU A 280 6.020 -3.214 -10.908 1.00 0.00 H new ATOM 0 HB2 LEU A 280 3.977 -2.530 -8.767 1.00 0.00 H new ATOM 0 HB3 LEU A 280 3.612 -3.063 -10.396 1.00 0.00 H new ATOM 0 HG LEU A 280 4.747 -4.650 -8.101 1.00 0.00 H new ATOM 0 HD11 LEU A 280 2.897 -6.180 -8.670 1.00 0.00 H new ATOM 0 HD12 LEU A 280 2.317 -4.536 -8.310 1.00 0.00 H new ATOM 0 HD13 LEU A 280 2.418 -5.094 -9.997 1.00 0.00 H new ATOM 0 HD21 LEU A 280 5.119 -6.535 -9.637 1.00 0.00 H new ATOM 0 HD22 LEU A 280 4.756 -5.471 -11.017 1.00 0.00 H new ATOM 0 HD23 LEU A 280 6.182 -5.155 -10.001 1.00 0.00 H new ATOM 1134 N THR A 281 5.562 -0.934 -11.814 1.00 0.00 N ATOM 1135 CA THR A 281 5.254 0.377 -12.365 1.00 0.00 C ATOM 1136 C THR A 281 3.808 0.390 -12.846 1.00 0.00 C ATOM 1137 O THR A 281 3.439 -0.381 -13.728 1.00 0.00 O ATOM 1138 CB THR A 281 6.205 0.735 -13.525 1.00 0.00 C ATOM 1139 OG1 THR A 281 7.564 0.609 -13.082 1.00 0.00 O ATOM 1140 CG2 THR A 281 5.957 2.155 -14.012 1.00 0.00 C ATOM 0 H THR A 281 5.812 -1.638 -12.509 1.00 0.00 H new ATOM 0 HA THR A 281 5.391 1.125 -11.584 1.00 0.00 H new ATOM 0 HB THR A 281 6.018 0.050 -14.352 1.00 0.00 H new ATOM 0 HG1 THR A 281 8.170 0.834 -13.818 1.00 0.00 H new ATOM 0 HG21 THR A 281 6.640 2.384 -14.830 1.00 0.00 H new ATOM 0 HG22 THR A 281 4.929 2.245 -14.362 1.00 0.00 H new ATOM 0 HG23 THR A 281 6.124 2.855 -13.193 1.00 0.00 H new ATOM 1148 N PHE A 282 2.995 1.247 -12.254 1.00 0.00 N ATOM 1149 CA PHE A 282 1.557 1.224 -12.485 1.00 0.00 C ATOM 1150 C PHE A 282 1.091 2.380 -13.357 1.00 0.00 C ATOM 1151 O PHE A 282 1.812 3.361 -13.560 1.00 0.00 O ATOM 1152 CB PHE A 282 0.818 1.280 -11.154 1.00 0.00 C ATOM 1153 CG PHE A 282 0.971 0.053 -10.305 1.00 0.00 C ATOM 1154 CD1 PHE A 282 0.296 -1.114 -10.622 1.00 0.00 C ATOM 1155 CD2 PHE A 282 1.777 0.073 -9.180 1.00 0.00 C ATOM 1156 CE1 PHE A 282 0.419 -2.238 -9.829 1.00 0.00 C ATOM 1157 CE2 PHE A 282 1.907 -1.047 -8.385 1.00 0.00 C ATOM 1158 CZ PHE A 282 1.228 -2.203 -8.710 1.00 0.00 C ATOM 0 H PHE A 282 3.306 1.971 -11.607 1.00 0.00 H new ATOM 0 HA PHE A 282 1.333 0.295 -13.010 1.00 0.00 H new ATOM 0 HB2 PHE A 282 1.175 2.143 -10.591 1.00 0.00 H new ATOM 0 HB3 PHE A 282 -0.242 1.442 -11.348 1.00 0.00 H new ATOM 0 HD1 PHE A 282 -0.334 -1.145 -11.499 1.00 0.00 H new ATOM 0 HD2 PHE A 282 2.310 0.976 -8.922 1.00 0.00 H new ATOM 0 HE1 PHE A 282 -0.116 -3.141 -10.083 1.00 0.00 H new ATOM 0 HE2 PHE A 282 2.539 -1.019 -7.510 1.00 0.00 H new ATOM 0 HZ PHE A 282 1.329 -3.081 -8.089 1.00 0.00 H new ATOM 1168 N ASP A 283 -0.128 2.239 -13.860 1.00 0.00 N ATOM 1169 CA ASP A 283 -0.788 3.267 -14.648 1.00 0.00 C ATOM 1170 C ASP A 283 -2.194 3.481 -14.111 1.00 0.00 C ATOM 1171 O ASP A 283 -2.907 2.515 -13.841 1.00 0.00 O ATOM 1172 CB ASP A 283 -0.869 2.822 -16.104 1.00 0.00 C ATOM 1173 CG ASP A 283 -1.362 3.909 -17.038 1.00 0.00 C ATOM 1174 OD1 ASP A 283 -0.534 4.695 -17.538 1.00 0.00 O ATOM 1175 OD2 ASP A 283 -2.579 3.963 -17.300 1.00 0.00 O ATOM 0 H ASP A 283 -0.691 1.398 -13.730 1.00 0.00 H new ATOM 0 HA ASP A 283 -0.221 4.196 -14.583 1.00 0.00 H new ATOM 0 HB2 ASP A 283 0.117 2.492 -16.431 1.00 0.00 H new ATOM 0 HB3 ASP A 283 -1.534 1.961 -16.177 1.00 0.00 H new ATOM 1180 N PRO A 284 -2.626 4.733 -13.948 1.00 0.00 N ATOM 1181 CA PRO A 284 -3.944 5.035 -13.407 1.00 0.00 C ATOM 1182 C PRO A 284 -5.031 4.999 -14.475 1.00 0.00 C ATOM 1183 O PRO A 284 -6.188 5.328 -14.206 1.00 0.00 O ATOM 1184 CB PRO A 284 -3.776 6.452 -12.871 1.00 0.00 C ATOM 1185 CG PRO A 284 -2.726 7.076 -13.733 1.00 0.00 C ATOM 1186 CD PRO A 284 -1.871 5.954 -14.275 1.00 0.00 C ATOM 0 HA PRO A 284 -4.258 4.308 -12.658 1.00 0.00 H new ATOM 0 HB2 PRO A 284 -4.712 7.007 -12.927 1.00 0.00 H new ATOM 0 HB3 PRO A 284 -3.472 6.443 -11.824 1.00 0.00 H new ATOM 0 HG2 PRO A 284 -3.181 7.641 -14.547 1.00 0.00 H new ATOM 0 HG3 PRO A 284 -2.122 7.777 -13.157 1.00 0.00 H new ATOM 0 HD2 PRO A 284 -1.720 6.053 -15.350 1.00 0.00 H new ATOM 0 HD3 PRO A 284 -0.884 5.947 -13.813 1.00 0.00 H new ATOM 1194 N GLY A 285 -4.660 4.596 -15.684 1.00 0.00 N ATOM 1195 CA GLY A 285 -5.594 4.623 -16.786 1.00 0.00 C ATOM 1196 C GLY A 285 -5.224 5.684 -17.799 1.00 0.00 C ATOM 1197 O GLY A 285 -5.664 5.644 -18.945 1.00 0.00 O ATOM 0 H GLY A 285 -3.729 4.252 -15.918 1.00 0.00 H new ATOM 0 HA2 GLY A 285 -5.615 3.647 -17.271 1.00 0.00 H new ATOM 0 HA3 GLY A 285 -6.599 4.813 -16.409 1.00 0.00 H new ATOM 1201 N THR A 286 -4.407 6.636 -17.372 1.00 0.00 N ATOM 1202 CA THR A 286 -3.928 7.682 -18.253 1.00 0.00 C ATOM 1203 C THR A 286 -2.477 8.014 -17.929 1.00 0.00 C ATOM 1204 O THR A 286 -2.127 8.290 -16.780 1.00 0.00 O ATOM 1205 CB THR A 286 -4.805 8.957 -18.177 1.00 0.00 C ATOM 1206 OG1 THR A 286 -4.240 9.995 -18.988 1.00 0.00 O ATOM 1207 CG2 THR A 286 -4.955 9.451 -16.744 1.00 0.00 C ATOM 0 H THR A 286 -4.062 6.702 -16.414 1.00 0.00 H new ATOM 0 HA THR A 286 -3.994 7.307 -19.274 1.00 0.00 H new ATOM 0 HB THR A 286 -5.795 8.698 -18.552 1.00 0.00 H new ATOM 0 HG1 THR A 286 -4.803 10.795 -18.934 1.00 0.00 H new ATOM 0 HG21 THR A 286 -5.576 10.346 -16.731 1.00 0.00 H new ATOM 0 HG22 THR A 286 -5.424 8.675 -16.139 1.00 0.00 H new ATOM 0 HG23 THR A 286 -3.972 9.685 -16.335 1.00 0.00 H new ATOM 1215 N VAL A 287 -1.633 7.969 -18.948 1.00 0.00 N ATOM 1216 CA VAL A 287 -0.207 8.197 -18.770 1.00 0.00 C ATOM 1217 C VAL A 287 0.104 9.687 -18.604 1.00 0.00 C ATOM 1218 O VAL A 287 1.236 10.067 -18.293 1.00 0.00 O ATOM 1219 CB VAL A 287 0.591 7.613 -19.956 1.00 0.00 C ATOM 1220 CG1 VAL A 287 0.416 8.453 -21.215 1.00 0.00 C ATOM 1221 CG2 VAL A 287 2.062 7.456 -19.599 1.00 0.00 C ATOM 0 H VAL A 287 -1.912 7.776 -19.910 1.00 0.00 H new ATOM 0 HA VAL A 287 0.097 7.685 -17.857 1.00 0.00 H new ATOM 0 HB VAL A 287 0.189 6.622 -20.167 1.00 0.00 H new ATOM 0 HG11 VAL A 287 0.992 8.013 -22.029 1.00 0.00 H new ATOM 0 HG12 VAL A 287 -0.638 8.481 -21.490 1.00 0.00 H new ATOM 0 HG13 VAL A 287 0.770 9.467 -21.028 1.00 0.00 H new ATOM 0 HG21 VAL A 287 2.601 7.043 -20.451 1.00 0.00 H new ATOM 0 HG22 VAL A 287 2.480 8.429 -19.342 1.00 0.00 H new ATOM 0 HG23 VAL A 287 2.160 6.783 -18.747 1.00 0.00 H new ATOM 1231 N GLU A 288 -0.905 10.527 -18.812 1.00 0.00 N ATOM 1232 CA GLU A 288 -0.738 11.971 -18.677 1.00 0.00 C ATOM 1233 C GLU A 288 -0.429 12.354 -17.232 1.00 0.00 C ATOM 1234 O GLU A 288 0.394 13.236 -16.977 1.00 0.00 O ATOM 1235 CB GLU A 288 -1.991 12.719 -19.137 1.00 0.00 C ATOM 1236 CG GLU A 288 -2.377 12.455 -20.580 1.00 0.00 C ATOM 1237 CD GLU A 288 -3.392 13.455 -21.091 1.00 0.00 C ATOM 1238 OE1 GLU A 288 -4.452 13.618 -20.452 1.00 0.00 O ATOM 1239 OE2 GLU A 288 -3.120 14.106 -22.119 1.00 0.00 O ATOM 0 H GLU A 288 -1.846 10.234 -19.074 1.00 0.00 H new ATOM 0 HA GLU A 288 0.100 12.257 -19.312 1.00 0.00 H new ATOM 0 HB2 GLU A 288 -2.825 12.440 -18.493 1.00 0.00 H new ATOM 0 HB3 GLU A 288 -1.831 13.789 -19.005 1.00 0.00 H new ATOM 0 HG2 GLU A 288 -1.485 12.492 -21.206 1.00 0.00 H new ATOM 0 HG3 GLU A 288 -2.785 11.448 -20.667 1.00 0.00 H new ATOM 1246 N ASP A 289 -1.094 11.693 -16.290 1.00 0.00 N ATOM 1247 CA ASP A 289 -0.910 12.003 -14.879 1.00 0.00 C ATOM 1248 C ASP A 289 0.505 11.681 -14.430 1.00 0.00 C ATOM 1249 O ASP A 289 1.161 12.495 -13.784 1.00 0.00 O ATOM 1250 CB ASP A 289 -1.923 11.251 -14.012 1.00 0.00 C ATOM 1251 CG ASP A 289 -3.203 12.033 -13.809 1.00 0.00 C ATOM 1252 OD1 ASP A 289 -3.186 13.029 -13.054 1.00 0.00 O ATOM 1253 OD2 ASP A 289 -4.229 11.662 -14.410 1.00 0.00 O ATOM 0 H ASP A 289 -1.761 10.944 -16.477 1.00 0.00 H new ATOM 0 HA ASP A 289 -1.077 13.073 -14.754 1.00 0.00 H new ATOM 0 HB2 ASP A 289 -2.156 10.293 -14.478 1.00 0.00 H new ATOM 0 HB3 ASP A 289 -1.476 11.033 -13.042 1.00 0.00 H new ATOM 1258 N GLY A 290 0.983 10.508 -14.798 1.00 0.00 N ATOM 1259 CA GLY A 290 2.336 10.129 -14.463 1.00 0.00 C ATOM 1260 C GLY A 290 2.435 8.694 -14.009 1.00 0.00 C ATOM 1261 O GLY A 290 1.422 8.045 -13.762 1.00 0.00 O ATOM 0 H GLY A 290 0.458 9.809 -15.324 1.00 0.00 H new ATOM 0 HA2 GLY A 290 2.978 10.278 -15.331 1.00 0.00 H new ATOM 0 HA3 GLY A 290 2.709 10.783 -13.675 1.00 0.00 H new ATOM 1265 N LEU A 291 3.655 8.203 -13.901 1.00 0.00 N ATOM 1266 CA LEU A 291 3.898 6.825 -13.497 1.00 0.00 C ATOM 1267 C LEU A 291 3.908 6.706 -11.977 1.00 0.00 C ATOM 1268 O LEU A 291 4.380 7.602 -11.280 1.00 0.00 O ATOM 1269 CB LEU A 291 5.244 6.356 -14.054 1.00 0.00 C ATOM 1270 CG LEU A 291 5.421 6.499 -15.568 1.00 0.00 C ATOM 1271 CD1 LEU A 291 6.882 6.741 -15.901 1.00 0.00 C ATOM 1272 CD2 LEU A 291 4.929 5.254 -16.284 1.00 0.00 C ATOM 0 H LEU A 291 4.501 8.740 -14.088 1.00 0.00 H new ATOM 0 HA LEU A 291 3.098 6.200 -13.893 1.00 0.00 H new ATOM 0 HB2 LEU A 291 6.037 6.917 -13.559 1.00 0.00 H new ATOM 0 HB3 LEU A 291 5.381 5.308 -13.788 1.00 0.00 H new ATOM 0 HG LEU A 291 4.830 7.351 -15.905 1.00 0.00 H new ATOM 0 HD11 LEU A 291 6.997 6.841 -16.980 1.00 0.00 H new ATOM 0 HD12 LEU A 291 7.220 7.655 -15.413 1.00 0.00 H new ATOM 0 HD13 LEU A 291 7.480 5.900 -15.549 1.00 0.00 H new ATOM 0 HD21 LEU A 291 5.063 5.375 -17.359 1.00 0.00 H new ATOM 0 HD22 LEU A 291 5.498 4.389 -15.943 1.00 0.00 H new ATOM 0 HD23 LEU A 291 3.872 5.102 -16.065 1.00 0.00 H new ATOM 1284 N LEU A 292 3.383 5.608 -11.471 1.00 0.00 N ATOM 1285 CA LEU A 292 3.404 5.331 -10.041 1.00 0.00 C ATOM 1286 C LEU A 292 4.213 4.068 -9.794 1.00 0.00 C ATOM 1287 O LEU A 292 3.882 3.002 -10.308 1.00 0.00 O ATOM 1288 CB LEU A 292 1.960 5.195 -9.527 1.00 0.00 C ATOM 1289 CG LEU A 292 1.735 4.886 -8.030 1.00 0.00 C ATOM 1290 CD1 LEU A 292 1.561 3.400 -7.812 1.00 0.00 C ATOM 1291 CD2 LEU A 292 2.863 5.410 -7.153 1.00 0.00 C ATOM 0 H LEU A 292 2.932 4.885 -12.031 1.00 0.00 H new ATOM 0 HA LEU A 292 3.876 6.149 -9.497 1.00 0.00 H new ATOM 0 HB2 LEU A 292 1.438 6.124 -9.755 1.00 0.00 H new ATOM 0 HB3 LEU A 292 1.476 4.407 -10.104 1.00 0.00 H new ATOM 0 HG LEU A 292 0.822 5.405 -7.736 1.00 0.00 H new ATOM 0 HD11 LEU A 292 1.404 3.204 -6.751 1.00 0.00 H new ATOM 0 HD12 LEU A 292 0.699 3.048 -8.378 1.00 0.00 H new ATOM 0 HD13 LEU A 292 2.455 2.876 -8.149 1.00 0.00 H new ATOM 0 HD21 LEU A 292 2.656 5.167 -6.111 1.00 0.00 H new ATOM 0 HD22 LEU A 292 3.803 4.947 -7.454 1.00 0.00 H new ATOM 0 HD23 LEU A 292 2.939 6.492 -7.265 1.00 0.00 H new ATOM 1303 N THR A 293 5.283 4.193 -9.031 1.00 0.00 N ATOM 1304 CA THR A 293 6.150 3.063 -8.783 1.00 0.00 C ATOM 1305 C THR A 293 5.949 2.576 -7.361 1.00 0.00 C ATOM 1306 O THR A 293 5.854 3.381 -6.430 1.00 0.00 O ATOM 1307 CB THR A 293 7.634 3.413 -9.010 1.00 0.00 C ATOM 1308 OG1 THR A 293 7.780 4.155 -10.230 1.00 0.00 O ATOM 1309 CG2 THR A 293 8.471 2.145 -9.091 1.00 0.00 C ATOM 0 H THR A 293 5.569 5.060 -8.576 1.00 0.00 H new ATOM 0 HA THR A 293 5.887 2.277 -9.491 1.00 0.00 H new ATOM 0 HB THR A 293 7.979 4.017 -8.171 1.00 0.00 H new ATOM 0 HG1 THR A 293 7.933 5.100 -10.022 1.00 0.00 H new ATOM 0 HG21 THR A 293 9.516 2.409 -9.251 1.00 0.00 H new ATOM 0 HG22 THR A 293 8.376 1.587 -8.160 1.00 0.00 H new ATOM 0 HG23 THR A 293 8.121 1.530 -9.920 1.00 0.00 H new ATOM 1317 N VAL A 294 5.847 1.270 -7.201 1.00 0.00 N ATOM 1318 CA VAL A 294 5.597 0.683 -5.902 1.00 0.00 C ATOM 1319 C VAL A 294 6.519 -0.499 -5.639 1.00 0.00 C ATOM 1320 O VAL A 294 6.734 -1.338 -6.517 1.00 0.00 O ATOM 1321 CB VAL A 294 4.131 0.223 -5.788 1.00 0.00 C ATOM 1322 CG1 VAL A 294 3.916 -0.558 -4.521 1.00 0.00 C ATOM 1323 CG2 VAL A 294 3.199 1.417 -5.825 1.00 0.00 C ATOM 0 H VAL A 294 5.934 0.594 -7.960 1.00 0.00 H new ATOM 0 HA VAL A 294 5.796 1.452 -5.155 1.00 0.00 H new ATOM 0 HB VAL A 294 3.910 -0.424 -6.637 1.00 0.00 H new ATOM 0 HG11 VAL A 294 2.874 -0.873 -4.460 1.00 0.00 H new ATOM 0 HG12 VAL A 294 4.562 -1.436 -4.521 1.00 0.00 H new ATOM 0 HG13 VAL A 294 4.156 0.069 -3.662 1.00 0.00 H new ATOM 0 HG21 VAL A 294 2.167 1.076 -5.743 1.00 0.00 H new ATOM 0 HG22 VAL A 294 3.428 2.083 -4.993 1.00 0.00 H new ATOM 0 HG23 VAL A 294 3.331 1.952 -6.765 1.00 0.00 H new ATOM 1333 N GLU A 295 7.078 -0.543 -4.437 1.00 0.00 N ATOM 1334 CA GLU A 295 7.865 -1.683 -4.001 1.00 0.00 C ATOM 1335 C GLU A 295 7.356 -2.210 -2.670 1.00 0.00 C ATOM 1336 O GLU A 295 7.178 -1.454 -1.711 1.00 0.00 O ATOM 1337 CB GLU A 295 9.345 -1.318 -3.894 1.00 0.00 C ATOM 1338 CG GLU A 295 10.008 -1.153 -5.245 1.00 0.00 C ATOM 1339 CD GLU A 295 11.517 -1.089 -5.170 1.00 0.00 C ATOM 1340 OE1 GLU A 295 12.053 -0.226 -4.447 1.00 0.00 O ATOM 1341 OE2 GLU A 295 12.180 -1.903 -5.845 1.00 0.00 O ATOM 0 H GLU A 295 6.999 0.203 -3.745 1.00 0.00 H new ATOM 0 HA GLU A 295 7.759 -2.468 -4.750 1.00 0.00 H new ATOM 0 HB2 GLU A 295 9.446 -0.391 -3.329 1.00 0.00 H new ATOM 0 HB3 GLU A 295 9.866 -2.093 -3.331 1.00 0.00 H new ATOM 0 HG2 GLU A 295 9.719 -1.985 -5.887 1.00 0.00 H new ATOM 0 HG3 GLU A 295 9.636 -0.243 -5.715 1.00 0.00 H new ATOM 1348 N CYS A 296 7.091 -3.504 -2.630 1.00 0.00 N ATOM 1349 CA CYS A 296 6.696 -4.164 -1.398 1.00 0.00 C ATOM 1350 C CYS A 296 7.342 -5.540 -1.321 1.00 0.00 C ATOM 1351 O CYS A 296 8.145 -5.902 -2.177 1.00 0.00 O ATOM 1352 CB CYS A 296 5.178 -4.299 -1.298 1.00 0.00 C ATOM 1353 SG CYS A 296 4.584 -4.667 0.374 1.00 0.00 S ATOM 0 H CYS A 296 7.143 -4.121 -3.441 1.00 0.00 H new ATOM 0 HA CYS A 296 7.035 -3.551 -0.563 1.00 0.00 H new ATOM 0 HB2 CYS A 296 4.717 -3.373 -1.641 1.00 0.00 H new ATOM 0 HB3 CYS A 296 4.848 -5.089 -1.973 1.00 0.00 H new ATOM 0 HG CYS A 296 5.280 -3.992 1.240 1.00 0.00 H new ATOM 1359 N LYS A 297 6.982 -6.297 -0.304 1.00 0.00 N ATOM 1360 CA LYS A 297 7.507 -7.640 -0.127 1.00 0.00 C ATOM 1361 C LYS A 297 6.840 -8.607 -1.099 1.00 0.00 C ATOM 1362 O LYS A 297 5.887 -8.255 -1.801 1.00 0.00 O ATOM 1363 CB LYS A 297 7.306 -8.097 1.323 1.00 0.00 C ATOM 1364 CG LYS A 297 7.859 -7.121 2.361 1.00 0.00 C ATOM 1365 CD LYS A 297 9.347 -6.821 2.128 1.00 0.00 C ATOM 1366 CE LYS A 297 9.952 -5.879 3.179 1.00 0.00 C ATOM 1367 NZ LYS A 297 9.813 -6.402 4.565 1.00 0.00 N ATOM 0 H LYS A 297 6.324 -6.004 0.418 1.00 0.00 H new ATOM 0 HA LYS A 297 8.576 -7.631 -0.341 1.00 0.00 H new ATOM 0 HB2 LYS A 297 6.241 -8.240 1.504 1.00 0.00 H new ATOM 0 HB3 LYS A 297 7.786 -9.066 1.458 1.00 0.00 H new ATOM 0 HG2 LYS A 297 7.291 -6.191 2.324 1.00 0.00 H new ATOM 0 HG3 LYS A 297 7.724 -7.538 3.359 1.00 0.00 H new ATOM 0 HD2 LYS A 297 9.903 -7.758 2.128 1.00 0.00 H new ATOM 0 HD3 LYS A 297 9.470 -6.378 1.140 1.00 0.00 H new ATOM 0 HE2 LYS A 297 11.008 -5.724 2.957 1.00 0.00 H new ATOM 0 HE3 LYS A 297 9.466 -4.906 3.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 297 10.367 -5.810 5.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 297 8.812 -6.382 4.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 297 10.164 -7.380 4.604 1.00 0.00 H new ATOM 1381 N LEU A 298 7.351 -9.830 -1.124 1.00 0.00 N ATOM 1382 CA LEU A 298 7.001 -10.808 -2.147 1.00 0.00 C ATOM 1383 C LEU A 298 5.605 -11.378 -1.916 1.00 0.00 C ATOM 1384 O LEU A 298 5.055 -12.066 -2.776 1.00 0.00 O ATOM 1385 CB LEU A 298 8.020 -11.960 -2.166 1.00 0.00 C ATOM 1386 CG LEU A 298 9.495 -11.578 -2.389 1.00 0.00 C ATOM 1387 CD1 LEU A 298 9.651 -10.657 -3.587 1.00 0.00 C ATOM 1388 CD2 LEU A 298 10.095 -10.946 -1.143 1.00 0.00 C ATOM 0 H LEU A 298 8.021 -10.173 -0.435 1.00 0.00 H new ATOM 0 HA LEU A 298 7.015 -10.292 -3.107 1.00 0.00 H new ATOM 0 HB2 LEU A 298 7.947 -12.494 -1.219 1.00 0.00 H new ATOM 0 HB3 LEU A 298 7.728 -12.659 -2.949 1.00 0.00 H new ATOM 0 HG LEU A 298 10.042 -12.497 -2.598 1.00 0.00 H new ATOM 0 HD11 LEU A 298 10.703 -10.405 -3.718 1.00 0.00 H new ATOM 0 HD12 LEU A 298 9.284 -11.159 -4.482 1.00 0.00 H new ATOM 0 HD13 LEU A 298 9.078 -9.745 -3.422 1.00 0.00 H new ATOM 0 HD21 LEU A 298 11.137 -10.687 -1.332 1.00 0.00 H new ATOM 0 HD22 LEU A 298 9.538 -10.045 -0.888 1.00 0.00 H new ATOM 0 HD23 LEU A 298 10.041 -11.652 -0.315 1.00 0.00 H new ATOM 1400 N ASP A 299 5.037 -11.085 -0.757 1.00 0.00 N ATOM 1401 CA ASP A 299 3.755 -11.649 -0.364 1.00 0.00 C ATOM 1402 C ASP A 299 2.626 -10.634 -0.502 1.00 0.00 C ATOM 1403 O ASP A 299 1.547 -10.823 0.065 1.00 0.00 O ATOM 1404 CB ASP A 299 3.821 -12.139 1.083 1.00 0.00 C ATOM 1405 CG ASP A 299 4.215 -11.038 2.052 1.00 0.00 C ATOM 1406 OD1 ASP A 299 5.429 -10.830 2.254 1.00 0.00 O ATOM 1407 OD2 ASP A 299 3.313 -10.381 2.618 1.00 0.00 O ATOM 0 H ASP A 299 5.447 -10.455 -0.067 1.00 0.00 H new ATOM 0 HA ASP A 299 3.545 -12.485 -1.032 1.00 0.00 H new ATOM 0 HB2 ASP A 299 2.850 -12.542 1.371 1.00 0.00 H new ATOM 0 HB3 ASP A 299 4.539 -12.956 1.154 1.00 0.00 H new ATOM 1412 N HIS A 300 2.856 -9.567 -1.258 1.00 0.00 N ATOM 1413 CA HIS A 300 1.851 -8.520 -1.383 1.00 0.00 C ATOM 1414 C HIS A 300 0.722 -8.969 -2.309 1.00 0.00 C ATOM 1415 O HIS A 300 0.949 -9.228 -3.486 1.00 0.00 O ATOM 1416 CB HIS A 300 2.476 -7.231 -1.922 1.00 0.00 C ATOM 1417 CG HIS A 300 1.572 -6.036 -1.833 1.00 0.00 C ATOM 1418 ND1 HIS A 300 1.692 -4.891 -1.123 1.00 0.00 N flip ATOM 1419 CD2 HIS A 300 0.392 -5.922 -2.532 1.00 0.00 C flip ATOM 1420 CE1 HIS A 300 0.599 -4.112 -1.405 1.00 0.00 C flip ATOM 1421 NE2 HIS A 300 -0.170 -4.763 -2.259 1.00 0.00 N flip ATOM 0 H HIS A 300 3.714 -9.405 -1.785 1.00 0.00 H new ATOM 0 HA HIS A 300 1.443 -8.326 -0.391 1.00 0.00 H new ATOM 0 HB2 HIS A 300 3.392 -7.024 -1.369 1.00 0.00 H new ATOM 0 HB3 HIS A 300 2.760 -7.384 -2.963 1.00 0.00 H new ATOM 0 HD1 HIS A 300 2.457 -4.651 -0.492 1.00 0.00 H new ATOM 0 HD2 HIS A 300 -0.011 -6.668 -3.201 1.00 0.00 H new ATOM 0 HE1 HIS A 300 0.401 -3.132 -0.998 1.00 0.00 H new ATOM 1430 N PRO A 301 -0.509 -9.061 -1.788 1.00 0.00 N ATOM 1431 CA PRO A 301 -1.674 -9.402 -2.601 1.00 0.00 C ATOM 1432 C PRO A 301 -2.128 -8.225 -3.463 1.00 0.00 C ATOM 1433 O PRO A 301 -2.179 -7.084 -3.001 1.00 0.00 O ATOM 1434 CB PRO A 301 -2.739 -9.763 -1.565 1.00 0.00 C ATOM 1435 CG PRO A 301 -2.359 -9.000 -0.343 1.00 0.00 C ATOM 1436 CD PRO A 301 -0.859 -8.858 -0.370 1.00 0.00 C ATOM 0 HA PRO A 301 -1.468 -10.208 -3.305 1.00 0.00 H new ATOM 0 HB2 PRO A 301 -3.735 -9.486 -1.910 1.00 0.00 H new ATOM 0 HB3 PRO A 301 -2.755 -10.836 -1.372 1.00 0.00 H new ATOM 0 HG2 PRO A 301 -2.840 -8.022 -0.332 1.00 0.00 H new ATOM 0 HG3 PRO A 301 -2.682 -9.524 0.557 1.00 0.00 H new ATOM 0 HD2 PRO A 301 -0.544 -7.876 -0.017 1.00 0.00 H new ATOM 0 HD3 PRO A 301 -0.376 -9.596 0.270 1.00 0.00 H new ATOM 1444 N PHE A 302 -2.418 -8.503 -4.719 1.00 0.00 N ATOM 1445 CA PHE A 302 -2.897 -7.491 -5.648 1.00 0.00 C ATOM 1446 C PHE A 302 -4.260 -7.906 -6.185 1.00 0.00 C ATOM 1447 O PHE A 302 -4.415 -9.016 -6.691 1.00 0.00 O ATOM 1448 CB PHE A 302 -1.912 -7.322 -6.813 1.00 0.00 C ATOM 1449 CG PHE A 302 -0.532 -6.874 -6.406 1.00 0.00 C ATOM 1450 CD1 PHE A 302 -0.276 -5.543 -6.117 1.00 0.00 C ATOM 1451 CD2 PHE A 302 0.507 -7.787 -6.322 1.00 0.00 C ATOM 1452 CE1 PHE A 302 0.994 -5.131 -5.753 1.00 0.00 C ATOM 1453 CE2 PHE A 302 1.778 -7.381 -5.959 1.00 0.00 C ATOM 1454 CZ PHE A 302 2.021 -6.052 -5.672 1.00 0.00 C ATOM 0 H PHE A 302 -2.329 -9.434 -5.126 1.00 0.00 H new ATOM 0 HA PHE A 302 -2.981 -6.539 -5.123 1.00 0.00 H new ATOM 0 HB2 PHE A 302 -1.830 -8.271 -7.343 1.00 0.00 H new ATOM 0 HB3 PHE A 302 -2.322 -6.598 -7.517 1.00 0.00 H new ATOM 0 HD1 PHE A 302 -1.076 -4.820 -6.176 1.00 0.00 H new ATOM 0 HD2 PHE A 302 0.322 -8.828 -6.543 1.00 0.00 H new ATOM 0 HE1 PHE A 302 1.182 -4.091 -5.532 1.00 0.00 H new ATOM 0 HE2 PHE A 302 2.580 -8.102 -5.900 1.00 0.00 H new ATOM 0 HZ PHE A 302 3.012 -5.733 -5.385 1.00 0.00 H new ATOM 1464 N TYR A 303 -5.256 -7.042 -6.057 1.00 0.00 N ATOM 1465 CA TYR A 303 -6.573 -7.364 -6.576 1.00 0.00 C ATOM 1466 C TYR A 303 -6.618 -7.072 -8.066 1.00 0.00 C ATOM 1467 O TYR A 303 -6.937 -5.959 -8.489 1.00 0.00 O ATOM 1468 CB TYR A 303 -7.678 -6.598 -5.847 1.00 0.00 C ATOM 1469 CG TYR A 303 -9.045 -7.226 -6.028 1.00 0.00 C ATOM 1470 CD1 TYR A 303 -9.723 -7.144 -7.238 1.00 0.00 C ATOM 1471 CD2 TYR A 303 -9.652 -7.911 -4.986 1.00 0.00 C ATOM 1472 CE1 TYR A 303 -10.963 -7.730 -7.403 1.00 0.00 C ATOM 1473 CE2 TYR A 303 -10.892 -8.498 -5.143 1.00 0.00 C ATOM 1474 CZ TYR A 303 -11.543 -8.405 -6.350 1.00 0.00 C ATOM 1475 OH TYR A 303 -12.780 -8.988 -6.505 1.00 0.00 O ATOM 0 H TYR A 303 -5.179 -6.130 -5.607 1.00 0.00 H new ATOM 0 HA TYR A 303 -6.753 -8.425 -6.406 1.00 0.00 H new ATOM 0 HB2 TYR A 303 -7.442 -6.553 -4.784 1.00 0.00 H new ATOM 0 HB3 TYR A 303 -7.704 -5.571 -6.212 1.00 0.00 H new ATOM 0 HD1 TYR A 303 -9.273 -6.613 -8.064 1.00 0.00 H new ATOM 0 HD2 TYR A 303 -9.146 -7.987 -4.035 1.00 0.00 H new ATOM 0 HE1 TYR A 303 -11.475 -7.660 -8.351 1.00 0.00 H new ATOM 0 HE2 TYR A 303 -11.349 -9.028 -4.320 1.00 0.00 H new ATOM 0 HH TYR A 303 -12.709 -9.953 -6.347 1.00 0.00 H new ATOM 1485 N VAL A 304 -6.287 -8.085 -8.843 1.00 0.00 N ATOM 1486 CA VAL A 304 -6.242 -7.978 -10.287 1.00 0.00 C ATOM 1487 C VAL A 304 -7.645 -7.912 -10.874 1.00 0.00 C ATOM 1488 O VAL A 304 -8.476 -8.788 -10.626 1.00 0.00 O ATOM 1489 CB VAL A 304 -5.467 -9.169 -10.896 1.00 0.00 C ATOM 1490 CG1 VAL A 304 -5.590 -9.185 -12.414 1.00 0.00 C ATOM 1491 CG2 VAL A 304 -4.010 -9.096 -10.482 1.00 0.00 C ATOM 0 H VAL A 304 -6.041 -9.009 -8.488 1.00 0.00 H new ATOM 0 HA VAL A 304 -5.721 -7.054 -10.538 1.00 0.00 H new ATOM 0 HB VAL A 304 -5.901 -10.095 -10.518 1.00 0.00 H new ATOM 0 HG11 VAL A 304 -5.035 -10.033 -12.815 1.00 0.00 H new ATOM 0 HG12 VAL A 304 -6.640 -9.274 -12.693 1.00 0.00 H new ATOM 0 HG13 VAL A 304 -5.183 -8.260 -12.822 1.00 0.00 H new ATOM 0 HG21 VAL A 304 -3.467 -9.937 -10.913 1.00 0.00 H new ATOM 0 HG22 VAL A 304 -3.576 -8.162 -10.840 1.00 0.00 H new ATOM 0 HG23 VAL A 304 -3.938 -9.136 -9.395 1.00 0.00 H new ATOM 1501 N LYS A 305 -7.906 -6.858 -11.635 1.00 0.00 N ATOM 1502 CA LYS A 305 -9.177 -6.694 -12.316 1.00 0.00 C ATOM 1503 C LYS A 305 -9.461 -7.899 -13.209 1.00 0.00 C ATOM 1504 O LYS A 305 -8.548 -8.428 -13.845 1.00 0.00 O ATOM 1505 CB LYS A 305 -9.138 -5.413 -13.145 1.00 0.00 C ATOM 1506 CG LYS A 305 -10.401 -5.125 -13.930 1.00 0.00 C ATOM 1507 CD LYS A 305 -10.233 -3.880 -14.780 1.00 0.00 C ATOM 1508 CE LYS A 305 -11.500 -3.541 -15.536 1.00 0.00 C ATOM 1509 NZ LYS A 305 -12.604 -3.159 -14.617 1.00 0.00 N ATOM 0 H LYS A 305 -7.245 -6.098 -11.795 1.00 0.00 H new ATOM 0 HA LYS A 305 -9.977 -6.623 -11.579 1.00 0.00 H new ATOM 0 HB2 LYS A 305 -8.941 -4.572 -12.480 1.00 0.00 H new ATOM 0 HB3 LYS A 305 -8.301 -5.472 -13.840 1.00 0.00 H new ATOM 0 HG2 LYS A 305 -10.641 -5.976 -14.567 1.00 0.00 H new ATOM 0 HG3 LYS A 305 -11.239 -4.993 -13.245 1.00 0.00 H new ATOM 0 HD2 LYS A 305 -9.954 -3.040 -14.144 1.00 0.00 H new ATOM 0 HD3 LYS A 305 -9.417 -4.030 -15.487 1.00 0.00 H new ATOM 0 HE2 LYS A 305 -11.303 -2.722 -16.228 1.00 0.00 H new ATOM 0 HE3 LYS A 305 -11.806 -4.398 -16.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 305 -13.460 -2.950 -15.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 305 -12.798 -3.943 -13.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 305 -12.328 -2.316 -14.075 1.00 0.00 H new ATOM 1523 N ASN A 306 -10.724 -8.334 -13.220 1.00 0.00 N ATOM 1524 CA ASN A 306 -11.176 -9.473 -14.036 1.00 0.00 C ATOM 1525 C ASN A 306 -10.772 -10.815 -13.425 1.00 0.00 C ATOM 1526 O ASN A 306 -11.211 -11.865 -13.888 1.00 0.00 O ATOM 1527 CB ASN A 306 -10.647 -9.386 -15.477 1.00 0.00 C ATOM 1528 CG ASN A 306 -11.342 -8.306 -16.304 1.00 0.00 C ATOM 1529 OD1 ASN A 306 -11.941 -7.381 -15.757 1.00 0.00 O ATOM 1530 ND2 ASN A 306 -11.238 -8.377 -17.630 1.00 0.00 N ATOM 0 H ASN A 306 -11.466 -7.908 -12.664 1.00 0.00 H new ATOM 0 HA ASN A 306 -12.264 -9.416 -14.056 1.00 0.00 H new ATOM 0 HB2 ASN A 306 -9.576 -9.185 -15.453 1.00 0.00 H new ATOM 0 HB3 ASN A 306 -10.779 -10.351 -15.966 1.00 0.00 H new ATOM 0 HD21 ASN A 306 -11.660 -7.655 -18.214 1.00 0.00 H new ATOM 0 HD22 ASN A 306 -10.736 -9.153 -18.061 1.00 0.00 H new ATOM 1537 N LYS A 307 -9.947 -10.789 -12.386 1.00 0.00 N ATOM 1538 CA LYS A 307 -9.489 -12.025 -11.758 1.00 0.00 C ATOM 1539 C LYS A 307 -9.906 -12.108 -10.297 1.00 0.00 C ATOM 1540 O LYS A 307 -10.531 -13.082 -9.871 1.00 0.00 O ATOM 1541 CB LYS A 307 -7.965 -12.154 -11.864 1.00 0.00 C ATOM 1542 CG LYS A 307 -7.509 -13.108 -12.955 1.00 0.00 C ATOM 1543 CD LYS A 307 -6.002 -13.336 -12.897 1.00 0.00 C ATOM 1544 CE LYS A 307 -5.503 -14.187 -14.058 1.00 0.00 C ATOM 1545 NZ LYS A 307 -5.867 -13.608 -15.377 1.00 0.00 N ATOM 0 H LYS A 307 -9.583 -9.935 -11.962 1.00 0.00 H new ATOM 0 HA LYS A 307 -9.962 -12.848 -12.294 1.00 0.00 H new ATOM 0 HB2 LYS A 307 -7.538 -11.169 -12.053 1.00 0.00 H new ATOM 0 HB3 LYS A 307 -7.570 -12.495 -10.907 1.00 0.00 H new ATOM 0 HG2 LYS A 307 -8.028 -14.061 -12.848 1.00 0.00 H new ATOM 0 HG3 LYS A 307 -7.781 -12.705 -13.931 1.00 0.00 H new ATOM 0 HD2 LYS A 307 -5.490 -12.374 -12.908 1.00 0.00 H new ATOM 0 HD3 LYS A 307 -5.746 -13.823 -11.956 1.00 0.00 H new ATOM 0 HE2 LYS A 307 -4.419 -14.286 -13.994 1.00 0.00 H new ATOM 0 HE3 LYS A 307 -5.921 -15.190 -13.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 307 -5.065 -13.705 -16.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 307 -6.692 -14.112 -15.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 307 -6.100 -12.601 -15.262 1.00 0.00 H new ATOM 1559 N GLY A 308 -9.560 -11.085 -9.540 1.00 0.00 N ATOM 1560 CA GLY A 308 -9.773 -11.105 -8.112 1.00 0.00 C ATOM 1561 C GLY A 308 -8.457 -10.978 -7.380 1.00 0.00 C ATOM 1562 O GLY A 308 -7.523 -10.367 -7.895 1.00 0.00 O ATOM 0 H GLY A 308 -9.130 -10.230 -9.893 1.00 0.00 H new ATOM 0 HA2 GLY A 308 -10.436 -10.288 -7.826 1.00 0.00 H new ATOM 0 HA3 GLY A 308 -10.268 -12.033 -7.825 1.00 0.00 H new ATOM 1566 N TRP A 309 -8.364 -11.564 -6.202 1.00 0.00 N ATOM 1567 CA TRP A 309 -7.121 -11.535 -5.448 1.00 0.00 C ATOM 1568 C TRP A 309 -6.060 -12.354 -6.154 1.00 0.00 C ATOM 1569 O TRP A 309 -6.245 -13.543 -6.393 1.00 0.00 O ATOM 1570 CB TRP A 309 -7.327 -12.067 -4.033 1.00 0.00 C ATOM 1571 CG TRP A 309 -8.190 -11.181 -3.202 1.00 0.00 C ATOM 1572 CD1 TRP A 309 -9.485 -11.398 -2.835 1.00 0.00 C ATOM 1573 CD2 TRP A 309 -7.816 -9.924 -2.640 1.00 0.00 C ATOM 1574 NE1 TRP A 309 -9.938 -10.349 -2.079 1.00 0.00 N ATOM 1575 CE2 TRP A 309 -8.932 -9.431 -1.945 1.00 0.00 C ATOM 1576 CE3 TRP A 309 -6.644 -9.167 -2.659 1.00 0.00 C ATOM 1577 CZ2 TRP A 309 -8.911 -8.217 -1.274 1.00 0.00 C ATOM 1578 CZ3 TRP A 309 -6.623 -7.960 -1.993 1.00 0.00 C ATOM 1579 CH2 TRP A 309 -7.749 -7.494 -1.309 1.00 0.00 C ATOM 0 H TRP A 309 -9.128 -12.064 -5.747 1.00 0.00 H new ATOM 0 HA TRP A 309 -6.791 -10.498 -5.383 1.00 0.00 H new ATOM 0 HB2 TRP A 309 -7.776 -13.059 -4.085 1.00 0.00 H new ATOM 0 HB3 TRP A 309 -6.358 -12.181 -3.548 1.00 0.00 H new ATOM 0 HD1 TRP A 309 -10.067 -12.268 -3.101 1.00 0.00 H new ATOM 0 HE1 TRP A 309 -10.873 -10.266 -1.681 1.00 0.00 H new ATOM 0 HE3 TRP A 309 -5.770 -9.520 -3.186 1.00 0.00 H new ATOM 0 HZ2 TRP A 309 -9.779 -7.856 -0.743 1.00 0.00 H new ATOM 0 HZ3 TRP A 309 -5.722 -7.365 -2.000 1.00 0.00 H new ATOM 0 HH2 TRP A 309 -7.702 -6.544 -0.797 1.00 0.00 H new ATOM 1590 N SER A 310 -4.964 -11.708 -6.505 1.00 0.00 N ATOM 1591 CA SER A 310 -3.873 -12.371 -7.185 1.00 0.00 C ATOM 1592 C SER A 310 -2.535 -11.970 -6.561 1.00 0.00 C ATOM 1593 O SER A 310 -2.476 -11.065 -5.729 1.00 0.00 O ATOM 1594 CB SER A 310 -3.905 -12.035 -8.674 1.00 0.00 C ATOM 1595 OG SER A 310 -5.181 -12.310 -9.232 1.00 0.00 O ATOM 0 H SER A 310 -4.808 -10.716 -6.327 1.00 0.00 H new ATOM 0 HA SER A 310 -3.987 -13.449 -7.073 1.00 0.00 H new ATOM 0 HB2 SER A 310 -3.661 -10.983 -8.818 1.00 0.00 H new ATOM 0 HB3 SER A 310 -3.143 -12.613 -9.197 1.00 0.00 H new ATOM 0 HG SER A 310 -5.133 -12.239 -10.208 1.00 0.00 H new ATOM 1601 N SER A 311 -1.475 -12.661 -6.945 1.00 0.00 N ATOM 1602 CA SER A 311 -0.151 -12.419 -6.396 1.00 0.00 C ATOM 1603 C SER A 311 0.931 -12.986 -7.318 1.00 0.00 C ATOM 1604 O SER A 311 0.632 -13.669 -8.301 1.00 0.00 O ATOM 1605 CB SER A 311 -0.035 -13.058 -5.003 1.00 0.00 C ATOM 1606 OG SER A 311 1.260 -12.881 -4.452 1.00 0.00 O ATOM 0 H SER A 311 -1.507 -13.403 -7.644 1.00 0.00 H new ATOM 0 HA SER A 311 -0.006 -11.342 -6.313 1.00 0.00 H new ATOM 0 HB2 SER A 311 -0.777 -12.617 -4.337 1.00 0.00 H new ATOM 0 HB3 SER A 311 -0.260 -14.122 -5.071 1.00 0.00 H new ATOM 0 HG SER A 311 1.203 -12.891 -3.474 1.00 0.00 H new ATOM 1612 N PHE A 312 2.183 -12.680 -6.997 1.00 0.00 N ATOM 1613 CA PHE A 312 3.330 -13.268 -7.678 1.00 0.00 C ATOM 1614 C PHE A 312 3.713 -14.585 -7.011 1.00 0.00 C ATOM 1615 O PHE A 312 4.245 -15.489 -7.652 1.00 0.00 O ATOM 1616 CB PHE A 312 4.521 -12.306 -7.652 1.00 0.00 C ATOM 1617 CG PHE A 312 4.314 -11.070 -8.480 1.00 0.00 C ATOM 1618 CD1 PHE A 312 3.622 -9.985 -7.969 1.00 0.00 C ATOM 1619 CD2 PHE A 312 4.808 -10.998 -9.771 1.00 0.00 C ATOM 1620 CE1 PHE A 312 3.423 -8.852 -8.733 1.00 0.00 C ATOM 1621 CE2 PHE A 312 4.614 -9.866 -10.539 1.00 0.00 C ATOM 1622 CZ PHE A 312 3.921 -8.792 -10.019 1.00 0.00 C ATOM 0 H PHE A 312 2.431 -12.020 -6.260 1.00 0.00 H new ATOM 0 HA PHE A 312 3.057 -13.457 -8.716 1.00 0.00 H new ATOM 0 HB2 PHE A 312 4.719 -12.013 -6.621 1.00 0.00 H new ATOM 0 HB3 PHE A 312 5.408 -12.829 -8.010 1.00 0.00 H new ATOM 0 HD1 PHE A 312 3.234 -10.025 -6.962 1.00 0.00 H new ATOM 0 HD2 PHE A 312 5.351 -11.836 -10.183 1.00 0.00 H new ATOM 0 HE1 PHE A 312 2.878 -8.014 -8.325 1.00 0.00 H new ATOM 0 HE2 PHE A 312 5.004 -9.822 -11.545 1.00 0.00 H new ATOM 0 HZ PHE A 312 3.768 -7.906 -10.617 1.00 0.00 H new ATOM 1632 N TYR A 313 3.433 -14.680 -5.714 1.00 0.00 N ATOM 1633 CA TYR A 313 3.698 -15.894 -4.953 1.00 0.00 C ATOM 1634 C TYR A 313 2.455 -16.285 -4.160 1.00 0.00 C ATOM 1635 O TYR A 313 2.388 -16.075 -2.950 1.00 0.00 O ATOM 1636 CB TYR A 313 4.883 -15.692 -4.000 1.00 0.00 C ATOM 1637 CG TYR A 313 6.168 -15.301 -4.700 1.00 0.00 C ATOM 1638 CD1 TYR A 313 7.023 -16.263 -5.220 1.00 0.00 C ATOM 1639 CD2 TYR A 313 6.521 -13.967 -4.842 1.00 0.00 C ATOM 1640 CE1 TYR A 313 8.193 -15.904 -5.863 1.00 0.00 C ATOM 1641 CE2 TYR A 313 7.688 -13.601 -5.482 1.00 0.00 C ATOM 1642 CZ TYR A 313 8.520 -14.572 -5.990 1.00 0.00 C ATOM 1643 OH TYR A 313 9.683 -14.210 -6.634 1.00 0.00 O ATOM 0 H TYR A 313 3.020 -13.925 -5.167 1.00 0.00 H new ATOM 0 HA TYR A 313 3.951 -16.693 -5.650 1.00 0.00 H new ATOM 0 HB2 TYR A 313 4.626 -14.921 -3.274 1.00 0.00 H new ATOM 0 HB3 TYR A 313 5.050 -16.613 -3.442 1.00 0.00 H new ATOM 0 HD1 TYR A 313 6.770 -17.308 -5.121 1.00 0.00 H new ATOM 0 HD2 TYR A 313 5.871 -13.201 -4.445 1.00 0.00 H new ATOM 0 HE1 TYR A 313 8.847 -16.664 -6.264 1.00 0.00 H new ATOM 0 HE2 TYR A 313 7.947 -12.557 -5.584 1.00 0.00 H new ATOM 0 HH TYR A 313 9.764 -13.233 -6.638 1.00 0.00 H new ATOM 1653 N PRO A 314 1.449 -16.861 -4.839 1.00 0.00 N ATOM 1654 CA PRO A 314 0.163 -17.219 -4.220 1.00 0.00 C ATOM 1655 C PRO A 314 0.316 -18.112 -2.996 1.00 0.00 C ATOM 1656 O PRO A 314 -0.341 -17.899 -1.977 1.00 0.00 O ATOM 1657 CB PRO A 314 -0.568 -17.959 -5.342 1.00 0.00 C ATOM 1658 CG PRO A 314 0.028 -17.413 -6.590 1.00 0.00 C ATOM 1659 CD PRO A 314 1.479 -17.206 -6.273 1.00 0.00 C ATOM 0 HA PRO A 314 -0.365 -16.341 -3.848 1.00 0.00 H new ATOM 0 HB2 PRO A 314 -0.421 -19.037 -5.269 1.00 0.00 H new ATOM 0 HB3 PRO A 314 -1.642 -17.780 -5.303 1.00 0.00 H new ATOM 0 HG2 PRO A 314 -0.099 -18.105 -7.423 1.00 0.00 H new ATOM 0 HG3 PRO A 314 -0.450 -16.477 -6.878 1.00 0.00 H new ATOM 0 HD2 PRO A 314 2.067 -18.104 -6.462 1.00 0.00 H new ATOM 0 HD3 PRO A 314 1.915 -16.407 -6.873 1.00 0.00 H new ATOM 1667 N SER A 315 1.210 -19.087 -3.092 1.00 0.00 N ATOM 1668 CA SER A 315 1.450 -20.026 -2.004 1.00 0.00 C ATOM 1669 C SER A 315 2.009 -19.309 -0.775 1.00 0.00 C ATOM 1670 O SER A 315 1.869 -19.779 0.352 1.00 0.00 O ATOM 1671 CB SER A 315 2.425 -21.102 -2.471 1.00 0.00 C ATOM 1672 OG SER A 315 2.039 -21.602 -3.742 1.00 0.00 O ATOM 0 H SER A 315 1.785 -19.249 -3.919 1.00 0.00 H new ATOM 0 HA SER A 315 0.503 -20.486 -1.723 1.00 0.00 H new ATOM 0 HB2 SER A 315 3.432 -20.690 -2.526 1.00 0.00 H new ATOM 0 HB3 SER A 315 2.453 -21.916 -1.746 1.00 0.00 H new ATOM 0 HG SER A 315 2.675 -22.290 -4.030 1.00 0.00 H new ATOM 1678 N LEU A 316 2.638 -18.168 -1.005 1.00 0.00 N ATOM 1679 CA LEU A 316 3.219 -17.382 0.069 1.00 0.00 C ATOM 1680 C LEU A 316 2.169 -16.433 0.648 1.00 0.00 C ATOM 1681 O LEU A 316 1.963 -16.377 1.863 1.00 0.00 O ATOM 1682 CB LEU A 316 4.427 -16.598 -0.456 1.00 0.00 C ATOM 1683 CG LEU A 316 5.206 -15.809 0.593 1.00 0.00 C ATOM 1684 CD1 LEU A 316 5.739 -16.735 1.676 1.00 0.00 C ATOM 1685 CD2 LEU A 316 6.346 -15.044 -0.060 1.00 0.00 C ATOM 0 H LEU A 316 2.759 -17.764 -1.934 1.00 0.00 H new ATOM 0 HA LEU A 316 3.556 -18.049 0.863 1.00 0.00 H new ATOM 0 HB2 LEU A 316 5.109 -17.297 -0.940 1.00 0.00 H new ATOM 0 HB3 LEU A 316 4.083 -15.906 -1.224 1.00 0.00 H new ATOM 0 HG LEU A 316 4.528 -15.094 1.058 1.00 0.00 H new ATOM 0 HD11 LEU A 316 6.291 -16.152 2.414 1.00 0.00 H new ATOM 0 HD12 LEU A 316 4.906 -17.242 2.163 1.00 0.00 H new ATOM 0 HD13 LEU A 316 6.402 -17.475 1.228 1.00 0.00 H new ATOM 0 HD21 LEU A 316 6.892 -14.486 0.700 1.00 0.00 H new ATOM 0 HD22 LEU A 316 7.021 -15.745 -0.551 1.00 0.00 H new ATOM 0 HD23 LEU A 316 5.943 -14.351 -0.799 1.00 0.00 H new ATOM 1697 N THR A 317 1.491 -15.716 -0.242 1.00 0.00 N ATOM 1698 CA THR A 317 0.479 -14.736 0.135 1.00 0.00 C ATOM 1699 C THR A 317 -0.620 -15.341 1.010 1.00 0.00 C ATOM 1700 O THR A 317 -1.016 -14.749 2.018 1.00 0.00 O ATOM 1701 CB THR A 317 -0.156 -14.120 -1.125 1.00 0.00 C ATOM 1702 OG1 THR A 317 0.868 -13.571 -1.959 1.00 0.00 O ATOM 1703 CG2 THR A 317 -1.156 -13.031 -0.768 1.00 0.00 C ATOM 0 H THR A 317 1.629 -15.799 -1.249 1.00 0.00 H new ATOM 0 HA THR A 317 0.984 -13.965 0.718 1.00 0.00 H new ATOM 0 HB THR A 317 -0.688 -14.910 -1.656 1.00 0.00 H new ATOM 0 HG1 THR A 317 1.354 -14.298 -2.402 1.00 0.00 H new ATOM 0 HG21 THR A 317 -1.585 -12.618 -1.681 1.00 0.00 H new ATOM 0 HG22 THR A 317 -1.950 -13.454 -0.153 1.00 0.00 H new ATOM 0 HG23 THR A 317 -0.650 -12.240 -0.214 1.00 0.00 H new ATOM 1711 N VAL A 318 -1.105 -16.518 0.633 1.00 0.00 N ATOM 1712 CA VAL A 318 -2.195 -17.159 1.351 1.00 0.00 C ATOM 1713 C VAL A 318 -1.780 -17.567 2.763 1.00 0.00 C ATOM 1714 O VAL A 318 -2.591 -17.557 3.682 1.00 0.00 O ATOM 1715 CB VAL A 318 -2.730 -18.385 0.582 1.00 0.00 C ATOM 1716 CG1 VAL A 318 -1.666 -19.463 0.447 1.00 0.00 C ATOM 1717 CG2 VAL A 318 -3.981 -18.931 1.251 1.00 0.00 C ATOM 0 H VAL A 318 -0.759 -17.047 -0.167 1.00 0.00 H new ATOM 0 HA VAL A 318 -2.995 -16.423 1.431 1.00 0.00 H new ATOM 0 HB VAL A 318 -2.995 -18.061 -0.425 1.00 0.00 H new ATOM 0 HG11 VAL A 318 -2.076 -20.312 -0.100 1.00 0.00 H new ATOM 0 HG12 VAL A 318 -0.809 -19.063 -0.094 1.00 0.00 H new ATOM 0 HG13 VAL A 318 -1.349 -19.788 1.438 1.00 0.00 H new ATOM 0 HG21 VAL A 318 -4.344 -19.795 0.694 1.00 0.00 H new ATOM 0 HG22 VAL A 318 -3.746 -19.230 2.273 1.00 0.00 H new ATOM 0 HG23 VAL A 318 -4.751 -18.160 1.266 1.00 0.00 H new ATOM 1727 N VAL A 319 -0.517 -17.908 2.938 1.00 0.00 N ATOM 1728 CA VAL A 319 -0.013 -18.284 4.246 1.00 0.00 C ATOM 1729 C VAL A 319 0.251 -17.039 5.088 1.00 0.00 C ATOM 1730 O VAL A 319 -0.059 -16.996 6.276 1.00 0.00 O ATOM 1731 CB VAL A 319 1.275 -19.126 4.118 1.00 0.00 C ATOM 1732 CG1 VAL A 319 1.874 -19.423 5.481 1.00 0.00 C ATOM 1733 CG2 VAL A 319 0.993 -20.423 3.373 1.00 0.00 C ATOM 0 H VAL A 319 0.178 -17.932 2.192 1.00 0.00 H new ATOM 0 HA VAL A 319 -0.770 -18.892 4.742 1.00 0.00 H new ATOM 0 HB VAL A 319 1.999 -18.544 3.549 1.00 0.00 H new ATOM 0 HG11 VAL A 319 2.780 -20.017 5.359 1.00 0.00 H new ATOM 0 HG12 VAL A 319 2.119 -18.487 5.983 1.00 0.00 H new ATOM 0 HG13 VAL A 319 1.154 -19.979 6.082 1.00 0.00 H new ATOM 0 HG21 VAL A 319 1.912 -21.003 3.292 1.00 0.00 H new ATOM 0 HG22 VAL A 319 0.246 -21.000 3.918 1.00 0.00 H new ATOM 0 HG23 VAL A 319 0.619 -20.195 2.375 1.00 0.00 H new ATOM 1743 N GLN A 320 0.794 -16.016 4.451 1.00 0.00 N ATOM 1744 CA GLN A 320 1.180 -14.799 5.147 1.00 0.00 C ATOM 1745 C GLN A 320 -0.019 -13.903 5.475 1.00 0.00 C ATOM 1746 O GLN A 320 -0.168 -13.464 6.613 1.00 0.00 O ATOM 1747 CB GLN A 320 2.200 -14.033 4.312 1.00 0.00 C ATOM 1748 CG GLN A 320 3.565 -14.701 4.263 1.00 0.00 C ATOM 1749 CD GLN A 320 4.253 -14.725 5.617 1.00 0.00 C ATOM 1750 OE1 GLN A 320 4.975 -13.794 5.974 1.00 0.00 O ATOM 1751 NE2 GLN A 320 4.030 -15.782 6.386 1.00 0.00 N ATOM 0 H GLN A 320 0.979 -16.004 3.448 1.00 0.00 H new ATOM 0 HA GLN A 320 1.624 -15.092 6.098 1.00 0.00 H new ATOM 0 HB2 GLN A 320 1.820 -13.926 3.296 1.00 0.00 H new ATOM 0 HB3 GLN A 320 2.310 -13.028 4.719 1.00 0.00 H new ATOM 0 HG2 GLN A 320 3.453 -15.722 3.899 1.00 0.00 H new ATOM 0 HG3 GLN A 320 4.197 -14.175 3.548 1.00 0.00 H new ATOM 0 HE21 GLN A 320 3.425 -16.534 6.056 1.00 0.00 H new ATOM 0 HE22 GLN A 320 4.463 -15.843 7.308 1.00 0.00 H new ATOM 1760 N HIS A 321 -0.868 -13.624 4.488 1.00 0.00 N ATOM 1761 CA HIS A 321 -1.995 -12.707 4.697 1.00 0.00 C ATOM 1762 C HIS A 321 -3.312 -13.459 4.863 1.00 0.00 C ATOM 1763 O HIS A 321 -4.337 -12.867 5.204 1.00 0.00 O ATOM 1764 CB HIS A 321 -2.124 -11.707 3.541 1.00 0.00 C ATOM 1765 CG HIS A 321 -1.027 -10.687 3.483 1.00 0.00 C ATOM 1766 ND1 HIS A 321 -1.145 -9.414 4.000 1.00 0.00 N ATOM 1767 CD2 HIS A 321 0.213 -10.758 2.950 1.00 0.00 C ATOM 1768 CE1 HIS A 321 -0.023 -8.750 3.784 1.00 0.00 C ATOM 1769 NE2 HIS A 321 0.819 -9.546 3.149 1.00 0.00 N ATOM 0 H HIS A 321 -0.802 -14.012 3.547 1.00 0.00 H new ATOM 0 HA HIS A 321 -1.785 -12.162 5.618 1.00 0.00 H new ATOM 0 HB2 HIS A 321 -2.143 -12.257 2.600 1.00 0.00 H new ATOM 0 HB3 HIS A 321 -3.080 -11.191 3.627 1.00 0.00 H new ATOM 0 HD2 HIS A 321 0.647 -11.615 2.457 1.00 0.00 H new ATOM 0 HE1 HIS A 321 0.173 -7.729 4.077 1.00 0.00 H new ATOM 0 HE2 HIS A 321 1.764 -9.299 2.856 1.00 0.00 H new ATOM 1778 N GLY A 322 -3.281 -14.761 4.613 1.00 0.00 N ATOM 1779 CA GLY A 322 -4.483 -15.570 4.738 1.00 0.00 C ATOM 1780 C GLY A 322 -5.442 -15.370 3.581 1.00 0.00 C ATOM 1781 O GLY A 322 -6.656 -15.500 3.737 1.00 0.00 O ATOM 0 H GLY A 322 -2.447 -15.274 4.326 1.00 0.00 H new ATOM 0 HA2 GLY A 322 -4.204 -16.622 4.797 1.00 0.00 H new ATOM 0 HA3 GLY A 322 -4.988 -15.322 5.671 1.00 0.00 H new ATOM 1785 N ILE A 323 -4.899 -15.049 2.416 1.00 0.00 N ATOM 1786 CA ILE A 323 -5.714 -14.819 1.232 1.00 0.00 C ATOM 1787 C ILE A 323 -5.205 -15.653 0.067 1.00 0.00 C ATOM 1788 O ILE A 323 -4.100 -15.416 -0.429 1.00 0.00 O ATOM 1789 CB ILE A 323 -5.699 -13.334 0.805 1.00 0.00 C ATOM 1790 CG1 ILE A 323 -6.023 -12.421 1.992 1.00 0.00 C ATOM 1791 CG2 ILE A 323 -6.688 -13.107 -0.332 1.00 0.00 C ATOM 1792 CD1 ILE A 323 -5.887 -10.946 1.679 1.00 0.00 C ATOM 0 H ILE A 323 -3.896 -14.942 2.265 1.00 0.00 H new ATOM 0 HA ILE A 323 -6.733 -15.106 1.490 1.00 0.00 H new ATOM 0 HB ILE A 323 -4.698 -13.085 0.454 1.00 0.00 H new ATOM 0 HG12 ILE A 323 -7.041 -12.620 2.325 1.00 0.00 H new ATOM 0 HG13 ILE A 323 -5.362 -12.670 2.822 1.00 0.00 H new ATOM 0 HG21 ILE A 323 -6.670 -12.057 -0.626 1.00 0.00 H new ATOM 0 HG22 ILE A 323 -6.411 -13.727 -1.184 1.00 0.00 H new ATOM 0 HG23 ILE A 323 -7.691 -13.374 -0.000 1.00 0.00 H new ATOM 0 HD11 ILE A 323 -6.132 -10.362 2.566 1.00 0.00 H new ATOM 0 HD12 ILE A 323 -4.863 -10.732 1.375 1.00 0.00 H new ATOM 0 HD13 ILE A 323 -6.568 -10.681 0.871 1.00 0.00 H new ATOM 1804 N PRO A 324 -5.988 -16.642 -0.383 1.00 0.00 N ATOM 1805 CA PRO A 324 -5.631 -17.459 -1.536 1.00 0.00 C ATOM 1806 C PRO A 324 -5.731 -16.655 -2.821 1.00 0.00 C ATOM 1807 O PRO A 324 -6.809 -16.199 -3.204 1.00 0.00 O ATOM 1808 CB PRO A 324 -6.645 -18.606 -1.522 1.00 0.00 C ATOM 1809 CG PRO A 324 -7.392 -18.477 -0.233 1.00 0.00 C ATOM 1810 CD PRO A 324 -7.279 -17.040 0.184 1.00 0.00 C ATOM 0 HA PRO A 324 -4.603 -17.819 -1.488 1.00 0.00 H new ATOM 0 HB2 PRO A 324 -7.322 -18.540 -2.374 1.00 0.00 H new ATOM 0 HB3 PRO A 324 -6.143 -19.572 -1.588 1.00 0.00 H new ATOM 0 HG2 PRO A 324 -8.436 -18.763 -0.360 1.00 0.00 H new ATOM 0 HG3 PRO A 324 -6.971 -19.136 0.527 1.00 0.00 H new ATOM 0 HD2 PRO A 324 -8.098 -16.438 -0.211 1.00 0.00 H new ATOM 0 HD3 PRO A 324 -7.296 -16.930 1.268 1.00 0.00 H new ATOM 1818 N CYS A 325 -4.606 -16.484 -3.484 1.00 0.00 N ATOM 1819 CA CYS A 325 -4.515 -15.556 -4.591 1.00 0.00 C ATOM 1820 C CYS A 325 -4.176 -16.267 -5.896 1.00 0.00 C ATOM 1821 O CYS A 325 -3.488 -17.285 -5.908 1.00 0.00 O ATOM 1822 CB CYS A 325 -3.464 -14.495 -4.264 1.00 0.00 C ATOM 1823 SG CYS A 325 -3.857 -13.497 -2.809 1.00 0.00 S ATOM 0 H CYS A 325 -3.739 -16.978 -3.274 1.00 0.00 H new ATOM 0 HA CYS A 325 -5.486 -15.082 -4.732 1.00 0.00 H new ATOM 0 HB2 CYS A 325 -2.503 -14.986 -4.107 1.00 0.00 H new ATOM 0 HB3 CYS A 325 -3.348 -13.835 -5.124 1.00 0.00 H new ATOM 0 HG CYS A 325 -4.118 -14.279 -1.804 1.00 0.00 H new ATOM 1829 N CYS A 326 -4.697 -15.725 -6.982 1.00 0.00 N ATOM 1830 CA CYS A 326 -4.421 -16.213 -8.321 1.00 0.00 C ATOM 1831 C CYS A 326 -3.081 -15.675 -8.795 1.00 0.00 C ATOM 1832 O CYS A 326 -2.528 -14.771 -8.190 1.00 0.00 O ATOM 1833 CB CYS A 326 -5.538 -15.756 -9.257 1.00 0.00 C ATOM 1834 SG CYS A 326 -7.173 -16.353 -8.772 1.00 0.00 S ATOM 0 H CYS A 326 -5.330 -14.926 -6.959 1.00 0.00 H new ATOM 0 HA CYS A 326 -4.377 -17.302 -8.318 1.00 0.00 H new ATOM 0 HB2 CYS A 326 -5.552 -14.667 -9.288 1.00 0.00 H new ATOM 0 HB3 CYS A 326 -5.319 -16.101 -10.267 1.00 0.00 H new ATOM 0 HG CYS A 326 -8.061 -15.919 -9.616 1.00 0.00 H new ATOM 1840 N GLU A 327 -2.535 -16.246 -9.844 1.00 0.00 N ATOM 1841 CA GLU A 327 -1.292 -15.743 -10.405 1.00 0.00 C ATOM 1842 C GLU A 327 -1.592 -14.572 -11.341 1.00 0.00 C ATOM 1843 O GLU A 327 -2.447 -14.689 -12.225 1.00 0.00 O ATOM 1844 CB GLU A 327 -0.578 -16.864 -11.157 1.00 0.00 C ATOM 1845 CG GLU A 327 0.834 -16.516 -11.591 1.00 0.00 C ATOM 1846 CD GLU A 327 1.492 -17.653 -12.336 1.00 0.00 C ATOM 1847 OE1 GLU A 327 1.327 -17.729 -13.570 1.00 0.00 O ATOM 1848 OE2 GLU A 327 2.165 -18.487 -11.694 1.00 0.00 O ATOM 0 H GLU A 327 -2.926 -17.055 -10.327 1.00 0.00 H new ATOM 0 HA GLU A 327 -0.641 -15.393 -9.604 1.00 0.00 H new ATOM 0 HB2 GLU A 327 -0.544 -17.749 -10.522 1.00 0.00 H new ATOM 0 HB3 GLU A 327 -1.163 -17.126 -12.038 1.00 0.00 H new ATOM 0 HG2 GLU A 327 0.810 -15.631 -12.227 1.00 0.00 H new ATOM 0 HG3 GLU A 327 1.431 -16.263 -10.715 1.00 0.00 H new ATOM 1855 N ILE A 328 -0.908 -13.440 -11.136 1.00 0.00 N ATOM 1856 CA ILE A 328 -1.150 -12.249 -11.957 1.00 0.00 C ATOM 1857 C ILE A 328 -0.538 -12.406 -13.344 1.00 0.00 C ATOM 1858 O ILE A 328 0.108 -13.411 -13.652 1.00 0.00 O ATOM 1859 CB ILE A 328 -0.598 -10.920 -11.337 1.00 0.00 C ATOM 1860 CG1 ILE A 328 0.903 -10.732 -11.606 1.00 0.00 C ATOM 1861 CG2 ILE A 328 -0.863 -10.830 -9.844 1.00 0.00 C ATOM 1862 CD1 ILE A 328 1.773 -11.857 -11.092 1.00 0.00 C ATOM 0 H ILE A 328 -0.192 -13.324 -10.419 1.00 0.00 H new ATOM 0 HA ILE A 328 -2.236 -12.170 -12.011 1.00 0.00 H new ATOM 0 HB ILE A 328 -1.141 -10.116 -11.834 1.00 0.00 H new ATOM 0 HG12 ILE A 328 1.058 -10.630 -12.680 1.00 0.00 H new ATOM 0 HG13 ILE A 328 1.228 -9.798 -11.147 1.00 0.00 H new ATOM 0 HG21 ILE A 328 -0.462 -9.892 -9.459 1.00 0.00 H new ATOM 0 HG22 ILE A 328 -1.937 -10.868 -9.662 1.00 0.00 H new ATOM 0 HG23 ILE A 328 -0.380 -11.666 -9.338 1.00 0.00 H new ATOM 0 HD11 ILE A 328 2.817 -11.645 -11.323 1.00 0.00 H new ATOM 0 HD12 ILE A 328 1.652 -11.947 -10.012 1.00 0.00 H new ATOM 0 HD13 ILE A 328 1.479 -12.792 -11.569 1.00 0.00 H new ATOM 1874 N HIS A 329 -0.739 -11.394 -14.162 1.00 0.00 N ATOM 1875 CA HIS A 329 -0.138 -11.325 -15.477 1.00 0.00 C ATOM 1876 C HIS A 329 0.262 -9.885 -15.738 1.00 0.00 C ATOM 1877 O HIS A 329 -0.525 -8.983 -15.465 1.00 0.00 O ATOM 1878 CB HIS A 329 -1.133 -11.807 -16.535 1.00 0.00 C ATOM 1879 CG HIS A 329 -0.546 -11.946 -17.907 1.00 0.00 C ATOM 1880 ND1 HIS A 329 -1.065 -11.319 -19.019 1.00 0.00 N ATOM 1881 CD2 HIS A 329 0.516 -12.663 -18.345 1.00 0.00 C ATOM 1882 CE1 HIS A 329 -0.349 -11.646 -20.080 1.00 0.00 C ATOM 1883 NE2 HIS A 329 0.615 -12.458 -19.697 1.00 0.00 N ATOM 0 H HIS A 329 -1.327 -10.593 -13.932 1.00 0.00 H new ATOM 0 HA HIS A 329 0.741 -11.968 -15.526 1.00 0.00 H new ATOM 0 HB2 HIS A 329 -1.538 -12.770 -16.225 1.00 0.00 H new ATOM 0 HB3 HIS A 329 -1.969 -11.108 -16.578 1.00 0.00 H new ATOM 0 HD2 HIS A 329 1.164 -13.281 -17.742 1.00 0.00 H new ATOM 0 HE1 HIS A 329 -0.524 -11.305 -21.090 1.00 0.00 H new ATOM 0 HE2 HIS A 329 1.321 -12.868 -20.308 1.00 0.00 H new ATOM 1892 N ILE A 330 1.488 -9.676 -16.220 1.00 0.00 N ATOM 1893 CA ILE A 330 1.970 -8.330 -16.530 1.00 0.00 C ATOM 1894 C ILE A 330 0.920 -7.567 -17.328 1.00 0.00 C ATOM 1895 O ILE A 330 0.579 -7.948 -18.451 1.00 0.00 O ATOM 1896 CB ILE A 330 3.300 -8.355 -17.323 1.00 0.00 C ATOM 1897 CG1 ILE A 330 4.426 -8.941 -16.466 1.00 0.00 C ATOM 1898 CG2 ILE A 330 3.673 -6.954 -17.797 1.00 0.00 C ATOM 1899 CD1 ILE A 330 4.822 -8.063 -15.293 1.00 0.00 C ATOM 0 H ILE A 330 2.163 -10.419 -16.403 1.00 0.00 H new ATOM 0 HA ILE A 330 2.154 -7.828 -15.580 1.00 0.00 H new ATOM 0 HB ILE A 330 3.161 -8.990 -18.198 1.00 0.00 H new ATOM 0 HG12 ILE A 330 4.114 -9.915 -16.090 1.00 0.00 H new ATOM 0 HG13 ILE A 330 5.300 -9.107 -17.095 1.00 0.00 H new ATOM 0 HG21 ILE A 330 4.610 -6.995 -18.352 1.00 0.00 H new ATOM 0 HG22 ILE A 330 2.885 -6.567 -18.444 1.00 0.00 H new ATOM 0 HG23 ILE A 330 3.790 -6.297 -16.935 1.00 0.00 H new ATOM 0 HD11 ILE A 330 5.624 -8.544 -14.733 1.00 0.00 H new ATOM 0 HD12 ILE A 330 5.165 -7.096 -15.662 1.00 0.00 H new ATOM 0 HD13 ILE A 330 3.961 -7.917 -14.641 1.00 0.00 H new ATOM 1911 N GLY A 331 0.402 -6.513 -16.724 1.00 0.00 N ATOM 1912 CA GLY A 331 -0.686 -5.764 -17.313 1.00 0.00 C ATOM 1913 C GLY A 331 -1.938 -5.848 -16.469 1.00 0.00 C ATOM 1914 O GLY A 331 -3.009 -5.395 -16.881 1.00 0.00 O ATOM 0 H GLY A 331 0.721 -6.158 -15.823 1.00 0.00 H new ATOM 0 HA2 GLY A 331 -0.392 -4.721 -17.426 1.00 0.00 H new ATOM 0 HA3 GLY A 331 -0.893 -6.147 -18.312 1.00 0.00 H new ATOM 1918 N ASP A 332 -1.810 -6.453 -15.292 1.00 0.00 N ATOM 1919 CA ASP A 332 -2.911 -6.532 -14.347 1.00 0.00 C ATOM 1920 C ASP A 332 -3.204 -5.159 -13.750 1.00 0.00 C ATOM 1921 O ASP A 332 -2.306 -4.451 -13.313 1.00 0.00 O ATOM 1922 CB ASP A 332 -2.580 -7.542 -13.239 1.00 0.00 C ATOM 1923 CG ASP A 332 -1.919 -6.928 -12.018 1.00 0.00 C ATOM 1924 OD1 ASP A 332 -2.644 -6.392 -11.149 1.00 0.00 O ATOM 1925 OD2 ASP A 332 -0.681 -7.008 -11.919 1.00 0.00 O ATOM 0 H ASP A 332 -0.949 -6.897 -14.972 1.00 0.00 H new ATOM 0 HA ASP A 332 -3.803 -6.870 -14.875 1.00 0.00 H new ATOM 0 HB2 ASP A 332 -3.499 -8.040 -12.930 1.00 0.00 H new ATOM 0 HB3 ASP A 332 -1.923 -8.310 -13.647 1.00 0.00 H new ATOM 1930 N VAL A 333 -4.456 -4.758 -13.794 1.00 0.00 N ATOM 1931 CA VAL A 333 -4.874 -3.534 -13.149 1.00 0.00 C ATOM 1932 C VAL A 333 -5.479 -3.814 -11.779 1.00 0.00 C ATOM 1933 O VAL A 333 -6.532 -4.436 -11.652 1.00 0.00 O ATOM 1934 CB VAL A 333 -5.842 -2.744 -14.055 1.00 0.00 C ATOM 1935 CG1 VAL A 333 -6.816 -3.673 -14.743 1.00 0.00 C ATOM 1936 CG2 VAL A 333 -6.574 -1.655 -13.283 1.00 0.00 C ATOM 0 H VAL A 333 -5.203 -5.263 -14.271 1.00 0.00 H new ATOM 0 HA VAL A 333 -3.993 -2.912 -12.988 1.00 0.00 H new ATOM 0 HB VAL A 333 -5.245 -2.251 -14.822 1.00 0.00 H new ATOM 0 HG11 VAL A 333 -7.487 -3.093 -15.376 1.00 0.00 H new ATOM 0 HG12 VAL A 333 -6.266 -4.387 -15.356 1.00 0.00 H new ATOM 0 HG13 VAL A 333 -7.397 -4.210 -13.994 1.00 0.00 H new ATOM 0 HG21 VAL A 333 -7.246 -1.121 -13.955 1.00 0.00 H new ATOM 0 HG22 VAL A 333 -7.151 -2.106 -12.476 1.00 0.00 H new ATOM 0 HG23 VAL A 333 -5.850 -0.956 -12.864 1.00 0.00 H new ATOM 1946 N CYS A 334 -4.772 -3.361 -10.759 1.00 0.00 N ATOM 1947 CA CYS A 334 -5.167 -3.568 -9.378 1.00 0.00 C ATOM 1948 C CYS A 334 -6.244 -2.576 -8.952 1.00 0.00 C ATOM 1949 O CYS A 334 -6.122 -1.366 -9.176 1.00 0.00 O ATOM 1950 CB CYS A 334 -3.954 -3.428 -8.461 1.00 0.00 C ATOM 1951 SG CYS A 334 -2.572 -4.520 -8.864 1.00 0.00 S ATOM 0 H CYS A 334 -3.904 -2.837 -10.866 1.00 0.00 H new ATOM 0 HA CYS A 334 -5.577 -4.575 -9.296 1.00 0.00 H new ATOM 0 HB2 CYS A 334 -3.606 -2.396 -8.497 1.00 0.00 H new ATOM 0 HB3 CYS A 334 -4.267 -3.624 -7.435 1.00 0.00 H new ATOM 0 HG CYS A 334 -2.973 -5.441 -9.689 1.00 0.00 H new ATOM 1957 N LEU A 335 -7.283 -3.097 -8.324 1.00 0.00 N ATOM 1958 CA LEU A 335 -8.406 -2.290 -7.867 1.00 0.00 C ATOM 1959 C LEU A 335 -8.328 -2.051 -6.362 1.00 0.00 C ATOM 1960 O LEU A 335 -7.853 -2.902 -5.614 1.00 0.00 O ATOM 1961 CB LEU A 335 -9.714 -2.995 -8.209 1.00 0.00 C ATOM 1962 CG LEU A 335 -9.887 -3.367 -9.681 1.00 0.00 C ATOM 1963 CD1 LEU A 335 -11.214 -4.070 -9.894 1.00 0.00 C ATOM 1964 CD2 LEU A 335 -9.781 -2.131 -10.561 1.00 0.00 C ATOM 0 H LEU A 335 -7.374 -4.091 -8.115 1.00 0.00 H new ATOM 0 HA LEU A 335 -8.366 -1.324 -8.371 1.00 0.00 H new ATOM 0 HB2 LEU A 335 -9.786 -3.903 -7.610 1.00 0.00 H new ATOM 0 HB3 LEU A 335 -10.543 -2.352 -7.913 1.00 0.00 H new ATOM 0 HG LEU A 335 -9.087 -4.052 -9.963 1.00 0.00 H new ATOM 0 HD11 LEU A 335 -11.324 -4.329 -10.947 1.00 0.00 H new ATOM 0 HD12 LEU A 335 -11.246 -4.978 -9.292 1.00 0.00 H new ATOM 0 HD13 LEU A 335 -12.028 -3.409 -9.596 1.00 0.00 H new ATOM 0 HD21 LEU A 335 -9.907 -2.416 -11.605 1.00 0.00 H new ATOM 0 HD22 LEU A 335 -10.558 -1.419 -10.283 1.00 0.00 H new ATOM 0 HD23 LEU A 335 -8.802 -1.671 -10.426 1.00 0.00 H new ATOM 1976 N PRO A 336 -8.777 -0.870 -5.909 1.00 0.00 N ATOM 1977 CA PRO A 336 -8.814 -0.523 -4.487 1.00 0.00 C ATOM 1978 C PRO A 336 -10.104 -0.992 -3.806 1.00 0.00 C ATOM 1979 O PRO A 336 -11.064 -1.389 -4.474 1.00 0.00 O ATOM 1980 CB PRO A 336 -8.768 1.002 -4.534 1.00 0.00 C ATOM 1981 CG PRO A 336 -9.519 1.359 -5.774 1.00 0.00 C ATOM 1982 CD PRO A 336 -9.277 0.236 -6.752 1.00 0.00 C ATOM 0 HA PRO A 336 -8.010 -0.989 -3.917 1.00 0.00 H new ATOM 0 HB2 PRO A 336 -9.230 1.441 -3.650 1.00 0.00 H new ATOM 0 HB3 PRO A 336 -7.742 1.367 -4.572 1.00 0.00 H new ATOM 0 HG2 PRO A 336 -10.583 1.471 -5.566 1.00 0.00 H new ATOM 0 HG3 PRO A 336 -9.172 2.309 -6.179 1.00 0.00 H new ATOM 0 HD2 PRO A 336 -10.192 -0.043 -7.274 1.00 0.00 H new ATOM 0 HD3 PRO A 336 -8.549 0.519 -7.513 1.00 0.00 H new ATOM 1990 N PRO A 337 -10.142 -0.935 -2.465 1.00 0.00 N ATOM 1991 CA PRO A 337 -11.312 -1.342 -1.685 1.00 0.00 C ATOM 1992 C PRO A 337 -12.485 -0.396 -1.896 1.00 0.00 C ATOM 1993 O PRO A 337 -12.356 0.821 -1.736 1.00 0.00 O ATOM 1994 CB PRO A 337 -10.822 -1.277 -0.235 1.00 0.00 C ATOM 1995 CG PRO A 337 -9.689 -0.311 -0.255 1.00 0.00 C ATOM 1996 CD PRO A 337 -9.050 -0.450 -1.605 1.00 0.00 C ATOM 0 HA PRO A 337 -11.676 -2.328 -1.973 1.00 0.00 H new ATOM 0 HB2 PRO A 337 -11.614 -0.943 0.435 1.00 0.00 H new ATOM 0 HB3 PRO A 337 -10.499 -2.257 0.117 1.00 0.00 H new ATOM 0 HG2 PRO A 337 -10.042 0.708 -0.094 1.00 0.00 H new ATOM 0 HG3 PRO A 337 -8.975 -0.531 0.539 1.00 0.00 H new ATOM 0 HD2 PRO A 337 -8.655 0.502 -1.960 1.00 0.00 H new ATOM 0 HD3 PRO A 337 -8.217 -1.153 -1.582 1.00 0.00 H new ATOM 2004 N GLY A 338 -13.625 -0.950 -2.270 1.00 0.00 N ATOM 2005 CA GLY A 338 -14.785 -0.128 -2.525 1.00 0.00 C ATOM 2006 C GLY A 338 -15.107 -0.029 -4.000 1.00 0.00 C ATOM 2007 O GLY A 338 -16.241 0.284 -4.371 1.00 0.00 O ATOM 0 H GLY A 338 -13.768 -1.951 -2.401 1.00 0.00 H new ATOM 0 HA2 GLY A 338 -15.643 -0.541 -1.995 1.00 0.00 H new ATOM 0 HA3 GLY A 338 -14.614 0.871 -2.125 1.00 0.00 H new ATOM 2011 N HIS A 339 -14.112 -0.294 -4.845 1.00 0.00 N ATOM 2012 CA HIS A 339 -14.322 -0.287 -6.289 1.00 0.00 C ATOM 2013 C HIS A 339 -15.278 -1.421 -6.642 1.00 0.00 C ATOM 2014 O HIS A 339 -14.995 -2.576 -6.351 1.00 0.00 O ATOM 2015 CB HIS A 339 -12.988 -0.454 -7.038 1.00 0.00 C ATOM 2016 CG HIS A 339 -13.044 -0.045 -8.484 1.00 0.00 C ATOM 2017 ND1 HIS A 339 -13.303 -0.922 -9.515 1.00 0.00 N ATOM 2018 CD2 HIS A 339 -12.874 1.168 -9.064 1.00 0.00 C ATOM 2019 CE1 HIS A 339 -13.295 -0.262 -10.663 1.00 0.00 C ATOM 2020 NE2 HIS A 339 -13.038 1.005 -10.417 1.00 0.00 N ATOM 0 H HIS A 339 -13.159 -0.515 -4.556 1.00 0.00 H new ATOM 0 HA HIS A 339 -14.750 0.669 -6.592 1.00 0.00 H new ATOM 0 HB2 HIS A 339 -12.223 0.136 -6.533 1.00 0.00 H new ATOM 0 HB3 HIS A 339 -12.677 -1.497 -6.978 1.00 0.00 H new ATOM 0 HD2 HIS A 339 -12.650 2.094 -8.555 1.00 0.00 H new ATOM 0 HE1 HIS A 339 -13.470 -0.692 -11.638 1.00 0.00 H new ATOM 0 HE2 HIS A 339 -12.972 1.744 -11.117 1.00 0.00 H new ATOM 2029 N PRO A 340 -16.416 -1.099 -7.278 1.00 0.00 N ATOM 2030 CA PRO A 340 -17.511 -2.060 -7.510 1.00 0.00 C ATOM 2031 C PRO A 340 -17.082 -3.268 -8.334 1.00 0.00 C ATOM 2032 O PRO A 340 -17.688 -4.335 -8.251 1.00 0.00 O ATOM 2033 CB PRO A 340 -18.562 -1.238 -8.266 1.00 0.00 C ATOM 2034 CG PRO A 340 -17.814 -0.082 -8.828 1.00 0.00 C ATOM 2035 CD PRO A 340 -16.730 0.225 -7.838 1.00 0.00 C ATOM 0 HA PRO A 340 -17.873 -2.482 -6.573 1.00 0.00 H new ATOM 0 HB2 PRO A 340 -19.031 -1.826 -9.055 1.00 0.00 H new ATOM 0 HB3 PRO A 340 -19.358 -0.907 -7.600 1.00 0.00 H new ATOM 0 HG2 PRO A 340 -17.394 -0.325 -9.804 1.00 0.00 H new ATOM 0 HG3 PRO A 340 -18.470 0.777 -8.968 1.00 0.00 H new ATOM 0 HD2 PRO A 340 -15.862 0.678 -8.316 1.00 0.00 H new ATOM 0 HD3 PRO A 340 -17.069 0.919 -7.069 1.00 0.00 H new ATOM 2043 N ASP A 341 -16.024 -3.094 -9.112 1.00 0.00 N ATOM 2044 CA ASP A 341 -15.502 -4.172 -9.952 1.00 0.00 C ATOM 2045 C ASP A 341 -14.669 -5.134 -9.102 1.00 0.00 C ATOM 2046 O ASP A 341 -14.551 -6.318 -9.412 1.00 0.00 O ATOM 2047 CB ASP A 341 -14.675 -3.590 -11.109 1.00 0.00 C ATOM 2048 CG ASP A 341 -14.268 -4.616 -12.147 1.00 0.00 C ATOM 2049 OD1 ASP A 341 -15.162 -5.278 -12.711 1.00 0.00 O ATOM 2050 OD2 ASP A 341 -13.064 -4.704 -12.455 1.00 0.00 O ATOM 0 H ASP A 341 -15.507 -2.218 -9.182 1.00 0.00 H new ATOM 0 HA ASP A 341 -16.333 -4.730 -10.383 1.00 0.00 H new ATOM 0 HB2 ASP A 341 -15.252 -2.804 -11.596 1.00 0.00 H new ATOM 0 HB3 ASP A 341 -13.778 -3.122 -10.703 1.00 0.00 H new ATOM 2055 N ALA A 342 -14.097 -4.613 -8.016 1.00 0.00 N ATOM 2056 CA ALA A 342 -13.463 -5.449 -7.006 1.00 0.00 C ATOM 2057 C ALA A 342 -14.524 -6.075 -6.106 1.00 0.00 C ATOM 2058 O ALA A 342 -14.858 -5.541 -5.047 1.00 0.00 O ATOM 2059 CB ALA A 342 -12.481 -4.635 -6.181 1.00 0.00 C ATOM 0 H ALA A 342 -14.062 -3.613 -7.816 1.00 0.00 H new ATOM 0 HA ALA A 342 -12.912 -6.245 -7.506 1.00 0.00 H new ATOM 0 HB1 ALA A 342 -12.017 -5.276 -5.431 1.00 0.00 H new ATOM 0 HB2 ALA A 342 -11.711 -4.223 -6.834 1.00 0.00 H new ATOM 0 HB3 ALA A 342 -13.010 -3.821 -5.685 1.00 0.00 H new ATOM 2065 N ILE A 343 -15.038 -7.213 -6.543 1.00 0.00 N ATOM 2066 CA ILE A 343 -16.151 -7.873 -5.874 1.00 0.00 C ATOM 2067 C ILE A 343 -15.777 -8.396 -4.486 1.00 0.00 C ATOM 2068 O ILE A 343 -16.459 -8.103 -3.502 1.00 0.00 O ATOM 2069 CB ILE A 343 -16.701 -9.031 -6.740 1.00 0.00 C ATOM 2070 CG1 ILE A 343 -17.459 -8.463 -7.943 1.00 0.00 C ATOM 2071 CG2 ILE A 343 -17.587 -9.961 -5.915 1.00 0.00 C ATOM 2072 CD1 ILE A 343 -17.946 -9.520 -8.908 1.00 0.00 C ATOM 0 H ILE A 343 -14.698 -7.705 -7.369 1.00 0.00 H new ATOM 0 HA ILE A 343 -16.925 -7.117 -5.742 1.00 0.00 H new ATOM 0 HB ILE A 343 -15.863 -9.625 -7.106 1.00 0.00 H new ATOM 0 HG12 ILE A 343 -18.314 -7.889 -7.585 1.00 0.00 H new ATOM 0 HG13 ILE A 343 -16.809 -7.769 -8.476 1.00 0.00 H new ATOM 0 HG21 ILE A 343 -17.960 -10.766 -6.549 1.00 0.00 H new ATOM 0 HG22 ILE A 343 -17.006 -10.384 -5.095 1.00 0.00 H new ATOM 0 HG23 ILE A 343 -18.428 -9.398 -5.511 1.00 0.00 H new ATOM 0 HD11 ILE A 343 -18.474 -9.043 -9.734 1.00 0.00 H new ATOM 0 HD12 ILE A 343 -17.094 -10.079 -9.296 1.00 0.00 H new ATOM 0 HD13 ILE A 343 -18.622 -10.201 -8.391 1.00 0.00 H new ATOM 2084 N ASN A 344 -14.683 -9.138 -4.395 1.00 0.00 N ATOM 2085 CA ASN A 344 -14.370 -9.872 -3.169 1.00 0.00 C ATOM 2086 C ASN A 344 -13.345 -9.123 -2.329 1.00 0.00 C ATOM 2087 O ASN A 344 -12.546 -9.728 -1.614 1.00 0.00 O ATOM 2088 CB ASN A 344 -13.856 -11.279 -3.497 1.00 0.00 C ATOM 2089 CG ASN A 344 -14.777 -12.032 -4.437 1.00 0.00 C ATOM 2090 OD1 ASN A 344 -14.650 -11.939 -5.659 1.00 0.00 O ATOM 2091 ND2 ASN A 344 -15.698 -12.796 -3.874 1.00 0.00 N ATOM 0 H ASN A 344 -14.001 -9.250 -5.145 1.00 0.00 H new ATOM 0 HA ASN A 344 -15.289 -9.960 -2.590 1.00 0.00 H new ATOM 0 HB2 ASN A 344 -12.866 -11.204 -3.947 1.00 0.00 H new ATOM 0 HB3 ASN A 344 -13.744 -11.846 -2.573 1.00 0.00 H new ATOM 0 HD21 ASN A 344 -16.337 -13.337 -4.456 1.00 0.00 H new ATOM 0 HD22 ASN A 344 -15.769 -12.844 -2.858 1.00 0.00 H new ATOM 2098 N PHE A 345 -13.383 -7.805 -2.407 1.00 0.00 N ATOM 2099 CA PHE A 345 -12.443 -6.969 -1.687 1.00 0.00 C ATOM 2100 C PHE A 345 -13.085 -6.484 -0.398 1.00 0.00 C ATOM 2101 O PHE A 345 -12.813 -7.076 0.666 1.00 0.00 O ATOM 2102 CB PHE A 345 -12.032 -5.778 -2.550 1.00 0.00 C ATOM 2103 CG PHE A 345 -10.703 -5.173 -2.186 1.00 0.00 C ATOM 2104 CD1 PHE A 345 -10.401 -4.839 -0.874 1.00 0.00 C ATOM 2105 CD2 PHE A 345 -9.759 -4.932 -3.166 1.00 0.00 C ATOM 2106 CE1 PHE A 345 -9.180 -4.280 -0.553 1.00 0.00 C ATOM 2107 CE2 PHE A 345 -8.538 -4.375 -2.852 1.00 0.00 C ATOM 2108 CZ PHE A 345 -8.246 -4.047 -1.546 1.00 0.00 C ATOM 2109 OXT PHE A 345 -13.885 -5.524 -0.458 1.00 0.00 O ATOM 0 H PHE A 345 -14.061 -7.288 -2.967 1.00 0.00 H new ATOM 0 HA PHE A 345 -11.552 -7.550 -1.450 1.00 0.00 H new ATOM 0 HB2 PHE A 345 -11.999 -6.095 -3.592 1.00 0.00 H new ATOM 0 HB3 PHE A 345 -12.800 -5.008 -2.475 1.00 0.00 H new ATOM 0 HD1 PHE A 345 -11.128 -5.018 -0.096 1.00 0.00 H new ATOM 0 HD2 PHE A 345 -9.981 -5.184 -4.193 1.00 0.00 H new ATOM 0 HE1 PHE A 345 -8.955 -4.025 0.472 1.00 0.00 H new ATOM 0 HE2 PHE A 345 -7.810 -4.196 -3.630 1.00 0.00 H new ATOM 0 HZ PHE A 345 -7.290 -3.609 -1.298 1.00 0.00 H new