USER MOD reduce.3.24.130724 H: found=0, std=0, add=364, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 365 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 Single : A 267 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00607) USER MOD Single : A 268 HIS : no HD1:sc= -2.45! K(o=-2.5!,f=-0.88) USER MOD Single : A 269 GLN : amide:sc= -3.26! C(o=-3.3!,f=-6.7!) USER MOD Single : A 274 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0125) USER MOD Single : A 276 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 279 ASN : amide:sc= -1.91! K(o=-1.9!,f=-0.048) USER MOD Single : A 280 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 281 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 285 SER OG : rot -67:sc= 0.139! USER MOD Single : A 286 ASN : amide:sc= -0.414 X(o=-0.41,f=-0.0065) USER MOD Single : A 288 GLN : amide:sc= -1.35! K(o=-1.3!,f=0.08) USER MOD Single : A 289 SER OG : rot 180:sc= -0.147 USER MOD Single : A 290 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 291 CYS SG : rot 180:sc= 0.015 USER MOD Single : A 293 SER OG : rot 180:sc= 0.237 USER MOD Single : A 294 LYS NZ :NH3+ -167:sc= -0.707 (180deg=-1.25) USER MOD Single : A 296 ASN : amide:sc= -0.249 X(o=-0.25,f=0) USER MOD Single : A 298 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 299 HIS : no HD1:sc= -0.656 K(o=-0.66,f=-1.3) USER MOD Single : A 305 SER OG : rot 74:sc= 0.93 USER MOD Single : A 307 GLN : amide:sc= -5.38! K(o=-5.4!,f=-0.87) USER MOD Single : A 310 TYR OH : rot 180:sc= 0 USER MOD Single : A 311 LYS NZ :NH3+ -161:sc= -0.0372 (180deg=-0.508) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 267 26.791 -7.054 -26.130 1.00 0.00 N ATOM 2 CA LYS A 267 27.796 -6.500 -27.025 1.00 0.00 C ATOM 3 C LYS A 267 28.199 -5.106 -26.565 1.00 0.00 C ATOM 4 O LYS A 267 29.290 -4.909 -26.031 1.00 0.00 O ATOM 5 CB LYS A 267 27.249 -6.433 -28.452 1.00 0.00 C ATOM 6 CG LYS A 267 26.978 -7.848 -28.966 1.00 0.00 C ATOM 7 CD LYS A 267 26.545 -7.786 -30.432 1.00 0.00 C ATOM 8 CE LYS A 267 26.152 -9.184 -30.911 1.00 0.00 C ATOM 9 NZ LYS A 267 24.763 -9.489 -30.465 1.00 0.00 N ATOM 0 HA LYS A 267 28.673 -7.148 -27.007 1.00 0.00 H new ATOM 0 HB2 LYS A 267 26.331 -5.846 -28.473 1.00 0.00 H new ATOM 0 HB3 LYS A 267 27.964 -5.930 -29.103 1.00 0.00 H new ATOM 0 HG2 LYS A 267 27.874 -8.460 -28.866 1.00 0.00 H new ATOM 0 HG3 LYS A 267 26.201 -8.321 -28.366 1.00 0.00 H new ATOM 0 HD2 LYS A 267 25.704 -7.102 -30.544 1.00 0.00 H new ATOM 0 HD3 LYS A 267 27.357 -7.396 -31.045 1.00 0.00 H new ATOM 0 HE2 LYS A 267 26.217 -9.240 -31.998 1.00 0.00 H new ATOM 0 HE3 LYS A 267 26.845 -9.925 -30.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 267 24.476 -10.418 -30.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 267 24.727 -9.502 -29.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 267 24.115 -8.759 -30.824 1.00 0.00 H new ATOM 23 N HIS A 268 27.309 -4.141 -26.773 1.00 0.00 N ATOM 24 CA HIS A 268 27.580 -2.766 -26.370 1.00 0.00 C ATOM 25 C HIS A 268 26.921 -2.457 -25.031 1.00 0.00 C ATOM 26 O HIS A 268 27.208 -1.439 -24.403 1.00 0.00 O ATOM 27 CB HIS A 268 27.066 -1.791 -27.429 1.00 0.00 C ATOM 28 CG HIS A 268 27.590 -0.411 -27.131 1.00 0.00 C ATOM 29 ND1 HIS A 268 27.193 0.701 -27.858 1.00 0.00 N ATOM 30 CD2 HIS A 268 28.482 0.055 -26.191 1.00 0.00 C ATOM 31 CE1 HIS A 268 27.836 1.768 -27.352 1.00 0.00 C ATOM 32 NE2 HIS A 268 28.633 1.432 -26.335 1.00 0.00 N ATOM 0 H HIS A 268 26.401 -4.284 -27.215 1.00 0.00 H new ATOM 0 HA HIS A 268 28.659 -2.650 -26.268 1.00 0.00 H new ATOM 0 HB2 HIS A 268 27.389 -2.109 -28.420 1.00 0.00 H new ATOM 0 HB3 HIS A 268 25.976 -1.785 -27.436 1.00 0.00 H new ATOM 0 HD2 HIS A 268 28.987 -0.554 -25.455 1.00 0.00 H new ATOM 0 HE1 HIS A 268 27.722 2.776 -27.724 1.00 0.00 H new ATOM 0 HE2 HIS A 268 29.226 2.051 -25.782 1.00 0.00 H new ATOM 41 N GLN A 269 26.029 -3.337 -24.598 1.00 0.00 N ATOM 42 CA GLN A 269 25.341 -3.126 -23.335 1.00 0.00 C ATOM 43 C GLN A 269 26.341 -2.917 -22.196 1.00 0.00 C ATOM 44 O GLN A 269 26.079 -2.138 -21.281 1.00 0.00 O ATOM 45 CB GLN A 269 24.403 -4.297 -23.027 1.00 0.00 C ATOM 46 CG GLN A 269 23.216 -4.250 -23.990 1.00 0.00 C ATOM 47 CD GLN A 269 23.708 -4.364 -25.429 1.00 0.00 C ATOM 48 OE1 GLN A 269 24.446 -5.292 -25.762 1.00 0.00 O ATOM 49 NE2 GLN A 269 23.342 -3.472 -26.308 1.00 0.00 N ATOM 0 H GLN A 269 25.769 -4.190 -25.094 1.00 0.00 H new ATOM 0 HA GLN A 269 24.739 -2.222 -23.425 1.00 0.00 H new ATOM 0 HB2 GLN A 269 24.935 -5.243 -23.131 1.00 0.00 H new ATOM 0 HB3 GLN A 269 24.054 -4.239 -21.996 1.00 0.00 H new ATOM 0 HG2 GLN A 269 22.524 -5.063 -23.768 1.00 0.00 H new ATOM 0 HG3 GLN A 269 22.666 -3.318 -23.858 1.00 0.00 H new ATOM 0 HE21 GLN A 269 22.731 -2.704 -26.031 1.00 0.00 H new ATOM 0 HE22 GLN A 269 23.667 -3.543 -27.272 1.00 0.00 H new ATOM 58 N PRO A 270 27.480 -3.574 -22.229 1.00 0.00 N ATOM 59 CA PRO A 270 28.489 -3.381 -21.141 1.00 0.00 C ATOM 60 C PRO A 270 29.011 -1.946 -21.092 1.00 0.00 C ATOM 61 O PRO A 270 29.724 -1.565 -20.164 1.00 0.00 O ATOM 62 CB PRO A 270 29.611 -4.373 -21.471 1.00 0.00 C ATOM 63 CG PRO A 270 28.972 -5.392 -22.347 1.00 0.00 C ATOM 64 CD PRO A 270 27.934 -4.630 -23.160 1.00 0.00 C ATOM 0 HA PRO A 270 28.057 -3.558 -20.156 1.00 0.00 H new ATOM 0 HB2 PRO A 270 30.439 -3.879 -21.978 1.00 0.00 H new ATOM 0 HB3 PRO A 270 30.016 -4.827 -20.567 1.00 0.00 H new ATOM 0 HG2 PRO A 270 29.707 -5.869 -22.996 1.00 0.00 H new ATOM 0 HG3 PRO A 270 28.507 -6.182 -21.757 1.00 0.00 H new ATOM 0 HD2 PRO A 270 28.365 -4.208 -24.068 1.00 0.00 H new ATOM 0 HD3 PRO A 270 27.111 -5.275 -23.468 1.00 0.00 H new ATOM 72 N GLY A 271 28.649 -1.156 -22.100 1.00 0.00 N ATOM 73 CA GLY A 271 29.084 0.237 -22.166 1.00 0.00 C ATOM 74 C GLY A 271 30.265 0.394 -23.116 1.00 0.00 C ATOM 75 O GLY A 271 30.830 1.480 -23.250 1.00 0.00 O ATOM 0 H GLY A 271 28.060 -1.454 -22.877 1.00 0.00 H new ATOM 0 HA2 GLY A 271 28.258 0.865 -22.500 1.00 0.00 H new ATOM 0 HA3 GLY A 271 29.364 0.582 -21.171 1.00 0.00 H new ATOM 79 N GLY A 272 30.631 -0.698 -23.777 1.00 0.00 N ATOM 80 CA GLY A 272 31.744 -0.678 -24.718 1.00 0.00 C ATOM 81 C GLY A 272 32.172 -2.098 -25.067 1.00 0.00 C ATOM 82 O GLY A 272 32.543 -2.875 -24.191 1.00 0.00 O ATOM 0 H GLY A 272 30.175 -1.605 -23.679 1.00 0.00 H new ATOM 0 HA2 GLY A 272 31.453 -0.146 -25.624 1.00 0.00 H new ATOM 0 HA3 GLY A 272 32.584 -0.134 -24.286 1.00 0.00 H new ATOM 86 N GLY A 273 32.114 -2.436 -26.350 1.00 0.00 N ATOM 87 CA GLY A 273 32.492 -3.772 -26.788 1.00 0.00 C ATOM 88 C GLY A 273 33.872 -4.152 -26.261 1.00 0.00 C ATOM 89 O GLY A 273 34.116 -5.308 -25.916 1.00 0.00 O ATOM 0 H GLY A 273 31.812 -1.810 -27.097 1.00 0.00 H new ATOM 0 HA2 GLY A 273 31.754 -4.495 -26.439 1.00 0.00 H new ATOM 0 HA3 GLY A 273 32.491 -3.815 -27.877 1.00 0.00 H new ATOM 93 N LYS A 274 34.770 -3.175 -26.201 1.00 0.00 N ATOM 94 CA LYS A 274 36.120 -3.427 -25.711 1.00 0.00 C ATOM 95 C LYS A 274 36.093 -3.905 -24.263 1.00 0.00 C ATOM 96 O LYS A 274 36.910 -4.733 -23.859 1.00 0.00 O ATOM 97 CB LYS A 274 36.957 -2.154 -25.817 1.00 0.00 C ATOM 98 CG LYS A 274 37.112 -1.774 -27.290 1.00 0.00 C ATOM 99 CD LYS A 274 38.045 -0.567 -27.413 1.00 0.00 C ATOM 100 CE LYS A 274 38.103 -0.115 -28.873 1.00 0.00 C ATOM 101 NZ LYS A 274 38.964 -1.051 -29.650 1.00 0.00 N ATOM 0 H LYS A 274 34.591 -2.211 -26.482 1.00 0.00 H new ATOM 0 HA LYS A 274 36.566 -4.209 -26.325 1.00 0.00 H new ATOM 0 HB2 LYS A 274 36.478 -1.343 -25.269 1.00 0.00 H new ATOM 0 HB3 LYS A 274 37.936 -2.310 -25.364 1.00 0.00 H new ATOM 0 HG2 LYS A 274 37.514 -2.616 -27.853 1.00 0.00 H new ATOM 0 HG3 LYS A 274 36.138 -1.539 -27.720 1.00 0.00 H new ATOM 0 HD2 LYS A 274 37.688 0.248 -26.783 1.00 0.00 H new ATOM 0 HD3 LYS A 274 39.043 -0.828 -27.062 1.00 0.00 H new ATOM 0 HE2 LYS A 274 37.099 -0.091 -29.297 1.00 0.00 H new ATOM 0 HE3 LYS A 274 38.500 0.898 -28.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 274 39.072 -0.697 -30.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 274 39.899 -1.118 -29.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 274 38.522 -1.992 -29.671 1.00 0.00 H new ATOM 115 N VAL A 275 35.144 -3.388 -23.486 1.00 0.00 N ATOM 116 CA VAL A 275 35.016 -3.779 -22.085 1.00 0.00 C ATOM 117 C VAL A 275 33.739 -4.585 -21.891 1.00 0.00 C ATOM 118 O VAL A 275 32.664 -4.168 -22.315 1.00 0.00 O ATOM 119 CB VAL A 275 34.976 -2.534 -21.196 1.00 0.00 C ATOM 120 CG1 VAL A 275 34.981 -2.952 -19.725 1.00 0.00 C ATOM 121 CG2 VAL A 275 36.203 -1.665 -21.483 1.00 0.00 C ATOM 0 H VAL A 275 34.457 -2.702 -23.800 1.00 0.00 H new ATOM 0 HA VAL A 275 35.875 -4.389 -21.807 1.00 0.00 H new ATOM 0 HB VAL A 275 34.069 -1.967 -21.407 1.00 0.00 H new ATOM 0 HG11 VAL A 275 34.952 -2.064 -19.094 1.00 0.00 H new ATOM 0 HG12 VAL A 275 34.108 -3.571 -19.520 1.00 0.00 H new ATOM 0 HG13 VAL A 275 35.887 -3.520 -19.511 1.00 0.00 H new ATOM 0 HG21 VAL A 275 36.176 -0.778 -20.851 1.00 0.00 H new ATOM 0 HG22 VAL A 275 37.109 -2.234 -21.272 1.00 0.00 H new ATOM 0 HG23 VAL A 275 36.199 -1.364 -22.531 1.00 0.00 H new ATOM 131 N GLN A 276 33.857 -5.745 -21.254 1.00 0.00 N ATOM 132 CA GLN A 276 32.691 -6.595 -21.028 1.00 0.00 C ATOM 133 C GLN A 276 32.435 -6.787 -19.539 1.00 0.00 C ATOM 134 O GLN A 276 33.348 -7.100 -18.775 1.00 0.00 O ATOM 135 CB GLN A 276 32.918 -7.949 -21.698 1.00 0.00 C ATOM 136 CG GLN A 276 33.221 -7.720 -23.179 1.00 0.00 C ATOM 137 CD GLN A 276 33.519 -9.044 -23.873 1.00 0.00 C ATOM 138 OE1 GLN A 276 33.360 -10.109 -23.278 1.00 0.00 O ATOM 139 NE2 GLN A 276 33.956 -9.036 -25.103 1.00 0.00 N ATOM 0 H GLN A 276 34.734 -6.116 -20.889 1.00 0.00 H new ATOM 0 HA GLN A 276 31.815 -6.111 -21.460 1.00 0.00 H new ATOM 0 HB2 GLN A 276 33.746 -8.473 -21.220 1.00 0.00 H new ATOM 0 HB3 GLN A 276 32.035 -8.578 -21.586 1.00 0.00 H new ATOM 0 HG2 GLN A 276 32.372 -7.234 -23.659 1.00 0.00 H new ATOM 0 HG3 GLN A 276 34.073 -7.048 -23.282 1.00 0.00 H new ATOM 0 HE21 GLN A 276 34.086 -8.150 -25.592 1.00 0.00 H new ATOM 0 HE22 GLN A 276 34.167 -9.915 -25.575 1.00 0.00 H new ATOM 148 N ILE A 277 31.182 -6.606 -19.139 1.00 0.00 N ATOM 149 CA ILE A 277 30.795 -6.771 -17.744 1.00 0.00 C ATOM 150 C ILE A 277 30.158 -8.140 -17.542 1.00 0.00 C ATOM 151 O ILE A 277 29.613 -8.430 -16.479 1.00 0.00 O ATOM 152 CB ILE A 277 29.808 -5.673 -17.339 1.00 0.00 C ATOM 153 CG1 ILE A 277 30.465 -4.304 -17.540 1.00 0.00 C ATOM 154 CG2 ILE A 277 29.419 -5.846 -15.866 1.00 0.00 C ATOM 155 CD1 ILE A 277 29.427 -3.200 -17.325 1.00 0.00 C ATOM 0 H ILE A 277 30.417 -6.345 -19.761 1.00 0.00 H new ATOM 0 HA ILE A 277 31.685 -6.695 -17.119 1.00 0.00 H new ATOM 0 HB ILE A 277 28.912 -5.743 -17.956 1.00 0.00 H new ATOM 0 HG12 ILE A 277 31.292 -4.180 -16.841 1.00 0.00 H new ATOM 0 HG13 ILE A 277 30.883 -4.234 -18.544 1.00 0.00 H new ATOM 0 HG21 ILE A 277 28.716 -5.063 -15.581 1.00 0.00 H new ATOM 0 HG22 ILE A 277 28.953 -6.821 -15.725 1.00 0.00 H new ATOM 0 HG23 ILE A 277 30.311 -5.777 -15.244 1.00 0.00 H new ATOM 0 HD11 ILE A 277 29.896 -2.227 -17.468 1.00 0.00 H new ATOM 0 HD12 ILE A 277 28.614 -3.320 -18.041 1.00 0.00 H new ATOM 0 HD13 ILE A 277 29.030 -3.266 -16.312 1.00 0.00 H new ATOM 167 N ILE A 278 30.222 -8.965 -18.587 1.00 0.00 N ATOM 168 CA ILE A 278 29.641 -10.305 -18.551 1.00 0.00 C ATOM 169 C ILE A 278 28.118 -10.221 -18.541 1.00 0.00 C ATOM 170 O ILE A 278 27.433 -11.148 -18.969 1.00 0.00 O ATOM 171 CB ILE A 278 30.138 -11.071 -17.322 1.00 0.00 C ATOM 172 CG1 ILE A 278 31.660 -10.940 -17.228 1.00 0.00 C ATOM 173 CG2 ILE A 278 29.766 -12.549 -17.461 1.00 0.00 C ATOM 174 CD1 ILE A 278 32.291 -11.317 -18.570 1.00 0.00 C ATOM 0 H ILE A 278 30.672 -8.727 -19.471 1.00 0.00 H new ATOM 0 HA ILE A 278 29.956 -10.843 -19.445 1.00 0.00 H new ATOM 0 HB ILE A 278 29.677 -10.661 -16.423 1.00 0.00 H new ATOM 0 HG12 ILE A 278 31.931 -9.919 -16.961 1.00 0.00 H new ATOM 0 HG13 ILE A 278 32.043 -11.588 -16.440 1.00 0.00 H new ATOM 0 HG21 ILE A 278 30.119 -13.097 -16.587 1.00 0.00 H new ATOM 0 HG22 ILE A 278 28.683 -12.646 -17.537 1.00 0.00 H new ATOM 0 HG23 ILE A 278 30.231 -12.958 -18.358 1.00 0.00 H new ATOM 0 HD11 ILE A 278 33.375 -11.223 -18.502 1.00 0.00 H new ATOM 0 HD12 ILE A 278 32.031 -12.346 -18.818 1.00 0.00 H new ATOM 0 HD13 ILE A 278 31.918 -10.651 -19.348 1.00 0.00 H new ATOM 186 N ASN A 279 27.593 -9.096 -18.071 1.00 0.00 N ATOM 187 CA ASN A 279 26.150 -8.896 -18.036 1.00 0.00 C ATOM 188 C ASN A 279 25.566 -9.061 -19.435 1.00 0.00 C ATOM 189 O ASN A 279 24.376 -9.335 -19.593 1.00 0.00 O ATOM 190 CB ASN A 279 25.822 -7.504 -17.496 1.00 0.00 C ATOM 191 CG ASN A 279 26.204 -7.418 -16.023 1.00 0.00 C ATOM 192 OD1 ASN A 279 26.045 -6.369 -15.398 1.00 0.00 O ATOM 193 ND2 ASN A 279 26.700 -8.468 -15.426 1.00 0.00 N ATOM 0 H ASN A 279 28.140 -8.314 -17.711 1.00 0.00 H new ATOM 0 HA ASN A 279 25.709 -9.643 -17.376 1.00 0.00 H new ATOM 0 HB2 ASN A 279 26.361 -6.747 -18.066 1.00 0.00 H new ATOM 0 HB3 ASN A 279 24.759 -7.298 -17.618 1.00 0.00 H new ATOM 0 HD21 ASN A 279 26.957 -8.420 -14.440 1.00 0.00 H new ATOM 0 HD22 ASN A 279 26.831 -9.336 -15.946 1.00 0.00 H new ATOM 200 N LYS A 280 26.412 -8.887 -20.446 1.00 0.00 N ATOM 201 CA LYS A 280 25.972 -9.014 -21.831 1.00 0.00 C ATOM 202 C LYS A 280 25.180 -10.297 -22.032 1.00 0.00 C ATOM 203 O LYS A 280 24.153 -10.303 -22.711 1.00 0.00 O ATOM 204 CB LYS A 280 27.191 -9.030 -22.755 1.00 0.00 C ATOM 205 CG LYS A 280 26.740 -9.251 -24.201 1.00 0.00 C ATOM 206 CD LYS A 280 27.954 -9.169 -25.129 1.00 0.00 C ATOM 207 CE LYS A 280 28.907 -10.325 -24.821 1.00 0.00 C ATOM 208 NZ LYS A 280 29.747 -10.613 -26.018 1.00 0.00 N ATOM 0 H LYS A 280 27.400 -8.659 -20.333 1.00 0.00 H new ATOM 0 HA LYS A 280 25.332 -8.164 -22.067 1.00 0.00 H new ATOM 0 HB2 LYS A 280 27.734 -8.088 -22.673 1.00 0.00 H new ATOM 0 HB3 LYS A 280 27.878 -9.821 -22.453 1.00 0.00 H new ATOM 0 HG2 LYS A 280 26.258 -10.224 -24.299 1.00 0.00 H new ATOM 0 HG3 LYS A 280 26.002 -8.500 -24.482 1.00 0.00 H new ATOM 0 HD2 LYS A 280 27.634 -9.214 -26.170 1.00 0.00 H new ATOM 0 HD3 LYS A 280 28.465 -8.216 -24.994 1.00 0.00 H new ATOM 0 HE2 LYS A 280 29.541 -10.070 -23.972 1.00 0.00 H new ATOM 0 HE3 LYS A 280 28.340 -11.212 -24.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 280 30.394 -11.399 -25.807 1.00 0.00 H new ATOM 0 HZ2 LYS A 280 29.135 -10.874 -26.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 280 30.299 -9.767 -26.266 1.00 0.00 H new ATOM 222 N LYS A 281 25.654 -11.380 -21.434 1.00 0.00 N ATOM 223 CA LYS A 281 24.970 -12.656 -21.557 1.00 0.00 C ATOM 224 C LYS A 281 23.548 -12.534 -21.030 1.00 0.00 C ATOM 225 O LYS A 281 22.612 -13.097 -21.599 1.00 0.00 O ATOM 226 CB LYS A 281 25.745 -13.723 -20.779 1.00 0.00 C ATOM 227 CG LYS A 281 27.085 -14.013 -21.491 1.00 0.00 C ATOM 228 CD LYS A 281 28.240 -13.986 -20.482 1.00 0.00 C ATOM 229 CE LYS A 281 28.095 -15.148 -19.497 1.00 0.00 C ATOM 230 NZ LYS A 281 28.769 -16.356 -20.053 1.00 0.00 N ATOM 0 H LYS A 281 26.500 -11.401 -20.865 1.00 0.00 H new ATOM 0 HA LYS A 281 24.923 -12.948 -22.606 1.00 0.00 H new ATOM 0 HB2 LYS A 281 25.929 -13.382 -19.760 1.00 0.00 H new ATOM 0 HB3 LYS A 281 25.154 -14.636 -20.708 1.00 0.00 H new ATOM 0 HG2 LYS A 281 27.042 -14.987 -21.979 1.00 0.00 H new ATOM 0 HG3 LYS A 281 27.258 -13.272 -22.272 1.00 0.00 H new ATOM 0 HD2 LYS A 281 29.194 -14.057 -21.005 1.00 0.00 H new ATOM 0 HD3 LYS A 281 28.242 -13.039 -19.943 1.00 0.00 H new ATOM 0 HE2 LYS A 281 28.536 -14.882 -18.536 1.00 0.00 H new ATOM 0 HE3 LYS A 281 27.040 -15.357 -19.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 281 28.671 -17.147 -19.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 281 28.329 -16.613 -20.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 281 29.778 -16.152 -20.203 1.00 0.00 H new ATOM 244 N LEU A 282 23.389 -11.772 -19.952 1.00 0.00 N ATOM 245 CA LEU A 282 22.070 -11.559 -19.375 1.00 0.00 C ATOM 246 C LEU A 282 21.243 -10.666 -20.297 1.00 0.00 C ATOM 247 O LEU A 282 20.031 -10.837 -20.428 1.00 0.00 O ATOM 248 CB LEU A 282 22.199 -10.894 -18.002 1.00 0.00 C ATOM 249 CG LEU A 282 23.107 -11.736 -17.104 1.00 0.00 C ATOM 250 CD1 LEU A 282 23.152 -11.121 -15.703 1.00 0.00 C ATOM 251 CD2 LEU A 282 22.558 -13.162 -17.013 1.00 0.00 C ATOM 0 H LEU A 282 24.150 -11.297 -19.466 1.00 0.00 H new ATOM 0 HA LEU A 282 21.574 -12.523 -19.261 1.00 0.00 H new ATOM 0 HB2 LEU A 282 22.609 -9.890 -18.111 1.00 0.00 H new ATOM 0 HB3 LEU A 282 21.215 -10.789 -17.544 1.00 0.00 H new ATOM 0 HG LEU A 282 24.112 -11.758 -17.526 1.00 0.00 H new ATOM 0 HD11 LEU A 282 23.799 -11.721 -15.063 1.00 0.00 H new ATOM 0 HD12 LEU A 282 23.543 -10.105 -15.764 1.00 0.00 H new ATOM 0 HD13 LEU A 282 22.146 -11.098 -15.283 1.00 0.00 H new ATOM 0 HD21 LEU A 282 23.206 -13.761 -16.373 1.00 0.00 H new ATOM 0 HD22 LEU A 282 21.553 -13.139 -16.592 1.00 0.00 H new ATOM 0 HD23 LEU A 282 22.524 -13.603 -18.009 1.00 0.00 H new ATOM 263 N ASP A 283 21.921 -9.713 -20.933 1.00 0.00 N ATOM 264 CA ASP A 283 21.260 -8.786 -21.845 1.00 0.00 C ATOM 265 C ASP A 283 21.029 -9.430 -23.207 1.00 0.00 C ATOM 266 O ASP A 283 21.890 -10.144 -23.720 1.00 0.00 O ATOM 267 CB ASP A 283 22.113 -7.527 -22.021 1.00 0.00 C ATOM 268 CG ASP A 283 22.208 -6.772 -20.700 1.00 0.00 C ATOM 269 OD1 ASP A 283 21.429 -7.075 -19.811 1.00 0.00 O ATOM 270 OD2 ASP A 283 23.058 -5.903 -20.596 1.00 0.00 O ATOM 0 H ASP A 283 22.925 -9.564 -20.833 1.00 0.00 H new ATOM 0 HA ASP A 283 20.295 -8.521 -21.414 1.00 0.00 H new ATOM 0 HB2 ASP A 283 23.110 -7.799 -22.366 1.00 0.00 H new ATOM 0 HB3 ASP A 283 21.675 -6.885 -22.785 1.00 0.00 H new ATOM 275 N LEU A 284 19.872 -9.155 -23.797 1.00 0.00 N ATOM 276 CA LEU A 284 19.551 -9.693 -25.108 1.00 0.00 C ATOM 277 C LEU A 284 20.448 -9.052 -26.154 1.00 0.00 C ATOM 278 O LEU A 284 20.704 -9.633 -27.207 1.00 0.00 O ATOM 279 CB LEU A 284 18.090 -9.405 -25.450 1.00 0.00 C ATOM 280 CG LEU A 284 17.190 -9.928 -24.332 1.00 0.00 C ATOM 281 CD1 LEU A 284 15.725 -9.743 -24.733 1.00 0.00 C ATOM 282 CD2 LEU A 284 17.478 -11.413 -24.104 1.00 0.00 C ATOM 0 H LEU A 284 19.146 -8.566 -23.389 1.00 0.00 H new ATOM 0 HA LEU A 284 19.711 -10.771 -25.097 1.00 0.00 H new ATOM 0 HB2 LEU A 284 17.941 -8.333 -25.580 1.00 0.00 H new ATOM 0 HB3 LEU A 284 17.827 -9.880 -26.395 1.00 0.00 H new ATOM 0 HG LEU A 284 17.386 -9.376 -23.413 1.00 0.00 H new ATOM 0 HD11 LEU A 284 15.080 -10.115 -23.937 1.00 0.00 H new ATOM 0 HD12 LEU A 284 15.524 -8.684 -24.898 1.00 0.00 H new ATOM 0 HD13 LEU A 284 15.526 -10.297 -25.650 1.00 0.00 H new ATOM 0 HD21 LEU A 284 16.837 -11.790 -23.307 1.00 0.00 H new ATOM 0 HD22 LEU A 284 17.279 -11.967 -25.021 1.00 0.00 H new ATOM 0 HD23 LEU A 284 18.523 -11.542 -23.821 1.00 0.00 H new ATOM 294 N SER A 285 20.896 -7.836 -25.838 1.00 0.00 N ATOM 295 CA SER A 285 21.758 -7.054 -26.721 1.00 0.00 C ATOM 296 C SER A 285 20.928 -6.015 -27.461 1.00 0.00 C ATOM 297 O SER A 285 20.096 -5.332 -26.865 1.00 0.00 O ATOM 298 CB SER A 285 22.491 -7.945 -27.728 1.00 0.00 C ATOM 299 OG SER A 285 21.614 -8.266 -28.799 1.00 0.00 O ATOM 0 H SER A 285 20.670 -7.366 -24.961 1.00 0.00 H new ATOM 0 HA SER A 285 22.508 -6.558 -26.105 1.00 0.00 H new ATOM 0 HB2 SER A 285 23.375 -7.433 -28.108 1.00 0.00 H new ATOM 0 HB3 SER A 285 22.836 -8.857 -27.240 1.00 0.00 H new ATOM 0 HG SER A 285 20.892 -8.842 -28.470 1.00 0.00 H new ATOM 305 N ASN A 286 21.157 -5.901 -28.759 1.00 0.00 N ATOM 306 CA ASN A 286 20.420 -4.940 -29.569 1.00 0.00 C ATOM 307 C ASN A 286 18.922 -5.216 -29.501 1.00 0.00 C ATOM 308 O ASN A 286 18.109 -4.294 -29.570 1.00 0.00 O ATOM 309 CB ASN A 286 20.890 -5.010 -31.024 1.00 0.00 C ATOM 310 CG ASN A 286 22.376 -4.677 -31.108 1.00 0.00 C ATOM 311 OD1 ASN A 286 23.124 -5.347 -31.821 1.00 0.00 O ATOM 312 ND2 ASN A 286 22.850 -3.678 -30.417 1.00 0.00 N ATOM 0 H ASN A 286 21.841 -6.456 -29.273 1.00 0.00 H new ATOM 0 HA ASN A 286 20.611 -3.942 -29.175 1.00 0.00 H new ATOM 0 HB2 ASN A 286 20.709 -6.007 -31.426 1.00 0.00 H new ATOM 0 HB3 ASN A 286 20.317 -4.312 -31.634 1.00 0.00 H new ATOM 0 HD21 ASN A 286 23.843 -3.450 -30.466 1.00 0.00 H new ATOM 0 HD22 ASN A 286 22.228 -3.125 -29.827 1.00 0.00 H new ATOM 319 N VAL A 287 18.562 -6.488 -29.362 1.00 0.00 N ATOM 320 CA VAL A 287 17.157 -6.862 -29.282 1.00 0.00 C ATOM 321 C VAL A 287 16.499 -6.174 -28.095 1.00 0.00 C ATOM 322 O VAL A 287 15.330 -5.795 -28.149 1.00 0.00 O ATOM 323 CB VAL A 287 17.026 -8.379 -29.136 1.00 0.00 C ATOM 324 CG1 VAL A 287 15.565 -8.746 -28.875 1.00 0.00 C ATOM 325 CG2 VAL A 287 17.498 -9.057 -30.425 1.00 0.00 C ATOM 0 H VAL A 287 19.216 -7.268 -29.303 1.00 0.00 H new ATOM 0 HA VAL A 287 16.658 -6.546 -30.198 1.00 0.00 H new ATOM 0 HB VAL A 287 17.639 -8.716 -28.300 1.00 0.00 H new ATOM 0 HG11 VAL A 287 15.474 -9.827 -28.771 1.00 0.00 H new ATOM 0 HG12 VAL A 287 15.227 -8.264 -27.958 1.00 0.00 H new ATOM 0 HG13 VAL A 287 14.950 -8.409 -29.710 1.00 0.00 H new ATOM 0 HG21 VAL A 287 17.405 -10.138 -30.322 1.00 0.00 H new ATOM 0 HG22 VAL A 287 16.885 -8.718 -31.260 1.00 0.00 H new ATOM 0 HG23 VAL A 287 18.540 -8.798 -30.612 1.00 0.00 H new ATOM 335 N GLN A 288 17.267 -6.015 -27.023 1.00 0.00 N ATOM 336 CA GLN A 288 16.763 -5.371 -25.819 1.00 0.00 C ATOM 337 C GLN A 288 16.262 -3.962 -26.117 1.00 0.00 C ATOM 338 O GLN A 288 15.282 -3.514 -25.526 1.00 0.00 O ATOM 339 CB GLN A 288 17.864 -5.312 -24.761 1.00 0.00 C ATOM 340 CG GLN A 288 17.321 -4.640 -23.502 1.00 0.00 C ATOM 341 CD GLN A 288 18.379 -4.653 -22.405 1.00 0.00 C ATOM 342 OE1 GLN A 288 18.183 -4.057 -21.346 1.00 0.00 O ATOM 343 NE2 GLN A 288 19.494 -5.302 -22.596 1.00 0.00 N ATOM 0 H GLN A 288 18.238 -6.323 -26.964 1.00 0.00 H new ATOM 0 HA GLN A 288 15.926 -5.961 -25.445 1.00 0.00 H new ATOM 0 HB2 GLN A 288 18.214 -6.318 -24.528 1.00 0.00 H new ATOM 0 HB3 GLN A 288 18.721 -4.757 -25.142 1.00 0.00 H new ATOM 0 HG2 GLN A 288 17.029 -3.614 -23.725 1.00 0.00 H new ATOM 0 HG3 GLN A 288 16.425 -5.159 -23.161 1.00 0.00 H new ATOM 0 HE21 GLN A 288 19.653 -5.795 -23.475 1.00 0.00 H new ATOM 0 HE22 GLN A 288 20.207 -5.317 -21.867 1.00 0.00 H new ATOM 352 N SER A 289 16.943 -3.271 -27.030 1.00 0.00 N ATOM 353 CA SER A 289 16.565 -1.905 -27.396 1.00 0.00 C ATOM 354 C SER A 289 15.985 -1.159 -26.195 1.00 0.00 C ATOM 355 O SER A 289 16.702 -0.452 -25.488 1.00 0.00 O ATOM 356 CB SER A 289 15.532 -1.936 -28.523 1.00 0.00 C ATOM 357 OG SER A 289 14.882 -0.674 -28.600 1.00 0.00 O ATOM 0 H SER A 289 17.756 -3.632 -27.529 1.00 0.00 H new ATOM 0 HA SER A 289 17.460 -1.382 -27.732 1.00 0.00 H new ATOM 0 HB2 SER A 289 16.018 -2.166 -29.471 1.00 0.00 H new ATOM 0 HB3 SER A 289 14.801 -2.724 -28.340 1.00 0.00 H new ATOM 0 HG SER A 289 14.220 -0.690 -29.323 1.00 0.00 H new ATOM 363 N LYS A 290 14.687 -1.329 -25.970 1.00 0.00 N ATOM 364 CA LYS A 290 14.017 -0.677 -24.850 1.00 0.00 C ATOM 365 C LYS A 290 14.646 -1.112 -23.531 1.00 0.00 C ATOM 366 O LYS A 290 15.395 -2.085 -23.484 1.00 0.00 O ATOM 367 CB LYS A 290 12.537 -1.053 -24.848 1.00 0.00 C ATOM 368 CG LYS A 290 11.882 -0.560 -26.136 1.00 0.00 C ATOM 369 CD LYS A 290 10.390 -0.889 -26.098 1.00 0.00 C ATOM 370 CE LYS A 290 9.745 -0.513 -27.435 1.00 0.00 C ATOM 371 NZ LYS A 290 8.304 -0.202 -27.218 1.00 0.00 N ATOM 0 H LYS A 290 14.079 -1.911 -26.546 1.00 0.00 H new ATOM 0 HA LYS A 290 14.124 0.402 -24.959 1.00 0.00 H new ATOM 0 HB2 LYS A 290 12.426 -2.134 -24.762 1.00 0.00 H new ATOM 0 HB3 LYS A 290 12.040 -0.612 -23.984 1.00 0.00 H new ATOM 0 HG2 LYS A 290 12.027 0.515 -26.244 1.00 0.00 H new ATOM 0 HG3 LYS A 290 12.349 -1.033 -27.000 1.00 0.00 H new ATOM 0 HD2 LYS A 290 10.247 -1.951 -25.900 1.00 0.00 H new ATOM 0 HD3 LYS A 290 9.908 -0.346 -25.285 1.00 0.00 H new ATOM 0 HE2 LYS A 290 10.253 0.349 -27.867 1.00 0.00 H new ATOM 0 HE3 LYS A 290 9.849 -1.333 -28.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 290 7.864 0.054 -28.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 290 7.824 -1.036 -26.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 290 8.217 0.594 -26.554 1.00 0.00 H new ATOM 385 N CYS A 291 14.336 -0.390 -22.459 1.00 0.00 N ATOM 386 CA CYS A 291 14.882 -0.726 -21.150 1.00 0.00 C ATOM 387 C CYS A 291 14.645 -2.199 -20.843 1.00 0.00 C ATOM 388 O CYS A 291 15.446 -2.842 -20.165 1.00 0.00 O ATOM 389 CB CYS A 291 14.211 0.122 -20.071 1.00 0.00 C ATOM 390 SG CYS A 291 14.598 1.870 -20.347 1.00 0.00 S ATOM 0 H CYS A 291 13.718 0.421 -22.470 1.00 0.00 H new ATOM 0 HA CYS A 291 15.953 -0.526 -21.161 1.00 0.00 H new ATOM 0 HB2 CYS A 291 13.132 -0.030 -20.093 1.00 0.00 H new ATOM 0 HB3 CYS A 291 14.556 -0.186 -19.084 1.00 0.00 H new ATOM 0 HG CYS A 291 14.025 2.591 -19.430 1.00 0.00 H new ATOM 396 N GLY A 292 13.537 -2.727 -21.353 1.00 0.00 N ATOM 397 CA GLY A 292 13.190 -4.128 -21.142 1.00 0.00 C ATOM 398 C GLY A 292 12.895 -4.811 -22.470 1.00 0.00 C ATOM 399 O GLY A 292 12.992 -4.194 -23.531 1.00 0.00 O ATOM 0 H GLY A 292 12.864 -2.206 -21.915 1.00 0.00 H new ATOM 0 HA2 GLY A 292 14.010 -4.640 -20.638 1.00 0.00 H new ATOM 0 HA3 GLY A 292 12.320 -4.199 -20.489 1.00 0.00 H new ATOM 403 N SER A 293 12.529 -6.082 -22.404 1.00 0.00 N ATOM 404 CA SER A 293 12.216 -6.840 -23.611 1.00 0.00 C ATOM 405 C SER A 293 10.931 -6.323 -24.241 1.00 0.00 C ATOM 406 O SER A 293 10.398 -5.292 -23.830 1.00 0.00 O ATOM 407 CB SER A 293 12.073 -8.327 -23.290 1.00 0.00 C ATOM 408 OG SER A 293 12.183 -9.077 -24.492 1.00 0.00 O ATOM 0 H SER A 293 12.441 -6.609 -21.535 1.00 0.00 H new ATOM 0 HA SER A 293 13.036 -6.711 -24.317 1.00 0.00 H new ATOM 0 HB2 SER A 293 12.844 -8.635 -22.583 1.00 0.00 H new ATOM 0 HB3 SER A 293 11.111 -8.518 -22.815 1.00 0.00 H new ATOM 0 HG SER A 293 12.094 -10.032 -24.291 1.00 0.00 H new ATOM 414 N LYS A 294 10.446 -7.033 -25.251 1.00 0.00 N ATOM 415 CA LYS A 294 9.233 -6.621 -25.943 1.00 0.00 C ATOM 416 C LYS A 294 8.050 -6.568 -24.983 1.00 0.00 C ATOM 417 O LYS A 294 7.884 -7.437 -24.127 1.00 0.00 O ATOM 418 CB LYS A 294 8.925 -7.599 -27.079 1.00 0.00 C ATOM 419 CG LYS A 294 10.174 -7.796 -27.940 1.00 0.00 C ATOM 420 CD LYS A 294 10.653 -6.443 -28.470 1.00 0.00 C ATOM 421 CE LYS A 294 11.585 -6.663 -29.664 1.00 0.00 C ATOM 422 NZ LYS A 294 12.331 -7.941 -29.483 1.00 0.00 N ATOM 0 H LYS A 294 10.870 -7.890 -25.607 1.00 0.00 H new ATOM 0 HA LYS A 294 9.395 -5.623 -26.351 1.00 0.00 H new ATOM 0 HB2 LYS A 294 8.598 -8.555 -26.670 1.00 0.00 H new ATOM 0 HB3 LYS A 294 8.107 -7.217 -27.689 1.00 0.00 H new ATOM 0 HG2 LYS A 294 10.962 -8.267 -27.352 1.00 0.00 H new ATOM 0 HG3 LYS A 294 9.953 -8.465 -28.771 1.00 0.00 H new ATOM 0 HD2 LYS A 294 9.799 -5.835 -28.769 1.00 0.00 H new ATOM 0 HD3 LYS A 294 11.174 -5.897 -27.684 1.00 0.00 H new ATOM 0 HE2 LYS A 294 11.008 -6.694 -30.588 1.00 0.00 H new ATOM 0 HE3 LYS A 294 12.284 -5.831 -29.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 294 13.113 -7.986 -30.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 294 12.713 -7.986 -28.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 294 11.688 -8.743 -29.639 1.00 0.00 H new ATOM 436 N ASP A 295 7.233 -5.533 -25.142 1.00 0.00 N ATOM 437 CA ASP A 295 6.057 -5.345 -24.299 1.00 0.00 C ATOM 438 C ASP A 295 6.450 -5.250 -22.828 1.00 0.00 C ATOM 439 O ASP A 295 5.772 -5.798 -21.959 1.00 0.00 O ATOM 440 CB ASP A 295 5.083 -6.509 -24.494 1.00 0.00 C ATOM 441 CG ASP A 295 4.548 -6.507 -25.923 1.00 0.00 C ATOM 442 OD1 ASP A 295 4.724 -5.508 -26.598 1.00 0.00 O ATOM 443 OD2 ASP A 295 3.971 -7.507 -26.319 1.00 0.00 O ATOM 0 H ASP A 295 7.364 -4.809 -25.849 1.00 0.00 H new ATOM 0 HA ASP A 295 5.575 -4.412 -24.591 1.00 0.00 H new ATOM 0 HB2 ASP A 295 5.586 -7.454 -24.286 1.00 0.00 H new ATOM 0 HB3 ASP A 295 4.257 -6.425 -23.787 1.00 0.00 H new ATOM 448 N ASN A 296 7.543 -4.546 -22.553 1.00 0.00 N ATOM 449 CA ASN A 296 8.006 -4.379 -21.183 1.00 0.00 C ATOM 450 C ASN A 296 8.159 -5.734 -20.504 1.00 0.00 C ATOM 451 O ASN A 296 7.705 -5.926 -19.378 1.00 0.00 O ATOM 452 CB ASN A 296 7.012 -3.522 -20.396 1.00 0.00 C ATOM 453 CG ASN A 296 6.794 -2.192 -21.108 1.00 0.00 C ATOM 454 OD1 ASN A 296 5.658 -1.731 -21.228 1.00 0.00 O ATOM 455 ND2 ASN A 296 7.818 -1.544 -21.590 1.00 0.00 N ATOM 0 H ASN A 296 8.120 -4.085 -23.256 1.00 0.00 H new ATOM 0 HA ASN A 296 8.976 -3.882 -21.204 1.00 0.00 H new ATOM 0 HB2 ASN A 296 6.064 -4.050 -20.295 1.00 0.00 H new ATOM 0 HB3 ASN A 296 7.388 -3.347 -19.388 1.00 0.00 H new ATOM 0 HD21 ASN A 296 7.679 -0.653 -22.068 1.00 0.00 H new ATOM 0 HD22 ASN A 296 8.758 -1.928 -21.489 1.00 0.00 H new ATOM 462 N ILE A 297 8.793 -6.678 -21.193 1.00 0.00 N ATOM 463 CA ILE A 297 8.990 -8.008 -20.631 1.00 0.00 C ATOM 464 C ILE A 297 7.672 -8.555 -20.090 1.00 0.00 C ATOM 465 O ILE A 297 7.639 -9.609 -19.454 1.00 0.00 O ATOM 466 CB ILE A 297 10.022 -7.942 -19.501 1.00 0.00 C ATOM 467 CG1 ILE A 297 11.295 -7.272 -20.022 1.00 0.00 C ATOM 468 CG2 ILE A 297 10.358 -9.360 -19.029 1.00 0.00 C ATOM 469 CD1 ILE A 297 12.242 -6.994 -18.854 1.00 0.00 C ATOM 0 H ILE A 297 9.175 -6.549 -22.130 1.00 0.00 H new ATOM 0 HA ILE A 297 9.351 -8.672 -21.416 1.00 0.00 H new ATOM 0 HB ILE A 297 9.614 -7.368 -18.669 1.00 0.00 H new ATOM 0 HG12 ILE A 297 11.783 -7.915 -20.754 1.00 0.00 H new ATOM 0 HG13 ILE A 297 11.046 -6.341 -20.531 1.00 0.00 H new ATOM 0 HG21 ILE A 297 11.092 -9.311 -18.225 1.00 0.00 H new ATOM 0 HG22 ILE A 297 9.453 -9.846 -18.665 1.00 0.00 H new ATOM 0 HG23 ILE A 297 10.768 -9.933 -19.861 1.00 0.00 H new ATOM 0 HD11 ILE A 297 13.149 -6.517 -19.226 1.00 0.00 H new ATOM 0 HD12 ILE A 297 11.752 -6.334 -18.138 1.00 0.00 H new ATOM 0 HD13 ILE A 297 12.501 -7.933 -18.364 1.00 0.00 H new ATOM 481 N LYS A 298 6.587 -7.824 -20.332 1.00 0.00 N ATOM 482 CA LYS A 298 5.279 -8.239 -19.850 1.00 0.00 C ATOM 483 C LYS A 298 5.346 -8.533 -18.358 1.00 0.00 C ATOM 484 O LYS A 298 4.522 -9.272 -17.820 1.00 0.00 O ATOM 485 CB LYS A 298 4.803 -9.484 -20.599 1.00 0.00 C ATOM 486 CG LYS A 298 4.633 -9.155 -22.082 1.00 0.00 C ATOM 487 CD LYS A 298 3.888 -10.297 -22.775 1.00 0.00 C ATOM 488 CE LYS A 298 4.753 -11.559 -22.752 1.00 0.00 C ATOM 489 NZ LYS A 298 4.240 -12.532 -23.757 1.00 0.00 N ATOM 0 H LYS A 298 6.590 -6.948 -20.855 1.00 0.00 H new ATOM 0 HA LYS A 298 4.571 -7.430 -20.028 1.00 0.00 H new ATOM 0 HB2 LYS A 298 5.523 -10.293 -20.476 1.00 0.00 H new ATOM 0 HB3 LYS A 298 3.858 -9.832 -20.183 1.00 0.00 H new ATOM 0 HG2 LYS A 298 4.080 -8.223 -22.198 1.00 0.00 H new ATOM 0 HG3 LYS A 298 5.608 -9.007 -22.547 1.00 0.00 H new ATOM 0 HD2 LYS A 298 2.939 -10.484 -22.272 1.00 0.00 H new ATOM 0 HD3 LYS A 298 3.655 -10.022 -23.804 1.00 0.00 H new ATOM 0 HE2 LYS A 298 5.790 -11.306 -22.972 1.00 0.00 H new ATOM 0 HE3 LYS A 298 4.738 -12.005 -21.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 298 4.828 -13.390 -23.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 298 3.257 -12.782 -23.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 298 4.277 -12.104 -24.704 1.00 0.00 H new ATOM 503 N HIS A 299 6.337 -7.944 -17.695 1.00 0.00 N ATOM 504 CA HIS A 299 6.507 -8.143 -16.263 1.00 0.00 C ATOM 505 C HIS A 299 5.701 -7.103 -15.491 1.00 0.00 C ATOM 506 O HIS A 299 5.837 -6.970 -14.275 1.00 0.00 O ATOM 507 CB HIS A 299 7.998 -8.078 -15.895 1.00 0.00 C ATOM 508 CG HIS A 299 8.400 -6.669 -15.564 1.00 0.00 C ATOM 509 ND1 HIS A 299 8.469 -6.221 -14.258 1.00 0.00 N ATOM 510 CD2 HIS A 299 8.758 -5.601 -16.349 1.00 0.00 C ATOM 511 CE1 HIS A 299 8.855 -4.938 -14.292 1.00 0.00 C ATOM 512 NE2 HIS A 299 9.045 -4.507 -15.541 1.00 0.00 N ATOM 0 H HIS A 299 7.029 -7.330 -18.124 1.00 0.00 H new ATOM 0 HA HIS A 299 6.134 -9.130 -15.990 1.00 0.00 H new ATOM 0 HB2 HIS A 299 8.196 -8.728 -15.043 1.00 0.00 H new ATOM 0 HB3 HIS A 299 8.600 -8.448 -16.725 1.00 0.00 H new ATOM 0 HD2 HIS A 299 8.809 -5.610 -17.428 1.00 0.00 H new ATOM 0 HE1 HIS A 299 8.996 -4.326 -13.413 1.00 0.00 H new ATOM 0 HE2 HIS A 299 9.338 -3.576 -15.838 1.00 0.00 H new ATOM 521 N VAL A 300 4.855 -6.391 -16.225 1.00 0.00 N ATOM 522 CA VAL A 300 3.993 -5.357 -15.660 1.00 0.00 C ATOM 523 C VAL A 300 3.696 -5.596 -14.179 1.00 0.00 C ATOM 524 O VAL A 300 2.977 -6.531 -13.829 1.00 0.00 O ATOM 525 CB VAL A 300 2.674 -5.370 -16.415 1.00 0.00 C ATOM 526 CG1 VAL A 300 1.707 -4.364 -15.787 1.00 0.00 C ATOM 527 CG2 VAL A 300 2.922 -5.006 -17.881 1.00 0.00 C ATOM 0 H VAL A 300 4.746 -6.514 -17.232 1.00 0.00 H new ATOM 0 HA VAL A 300 4.509 -4.401 -15.753 1.00 0.00 H new ATOM 0 HB VAL A 300 2.235 -6.366 -16.359 1.00 0.00 H new ATOM 0 HG11 VAL A 300 0.763 -4.377 -16.332 1.00 0.00 H new ATOM 0 HG12 VAL A 300 1.528 -4.632 -14.746 1.00 0.00 H new ATOM 0 HG13 VAL A 300 2.140 -3.365 -15.835 1.00 0.00 H new ATOM 0 HG21 VAL A 300 1.976 -5.015 -18.423 1.00 0.00 H new ATOM 0 HG22 VAL A 300 3.364 -4.011 -17.939 1.00 0.00 H new ATOM 0 HG23 VAL A 300 3.602 -5.732 -18.326 1.00 0.00 H new ATOM 537 N PRO A 301 4.204 -4.756 -13.313 1.00 0.00 N ATOM 538 CA PRO A 301 3.936 -4.887 -11.845 1.00 0.00 C ATOM 539 C PRO A 301 2.660 -4.157 -11.443 1.00 0.00 C ATOM 540 O PRO A 301 2.044 -4.463 -10.422 1.00 0.00 O ATOM 541 CB PRO A 301 5.157 -4.236 -11.191 1.00 0.00 C ATOM 542 CG PRO A 301 6.234 -4.363 -12.204 1.00 0.00 C ATOM 543 CD PRO A 301 5.545 -4.187 -13.549 1.00 0.00 C ATOM 0 HA PRO A 301 3.790 -5.924 -11.543 1.00 0.00 H new ATOM 0 HB2 PRO A 301 4.965 -3.192 -10.944 1.00 0.00 H new ATOM 0 HB3 PRO A 301 5.425 -4.739 -10.262 1.00 0.00 H new ATOM 0 HG2 PRO A 301 7.005 -3.607 -12.055 1.00 0.00 H new ATOM 0 HG3 PRO A 301 6.724 -5.335 -12.137 1.00 0.00 H new ATOM 0 HD2 PRO A 301 5.493 -3.138 -13.841 1.00 0.00 H new ATOM 0 HD3 PRO A 301 6.072 -4.714 -14.344 1.00 0.00 H new ATOM 551 N GLY A 302 2.282 -3.184 -12.260 1.00 0.00 N ATOM 552 CA GLY A 302 1.087 -2.392 -12.006 1.00 0.00 C ATOM 553 C GLY A 302 1.020 -1.222 -12.979 1.00 0.00 C ATOM 554 O GLY A 302 0.378 -1.309 -14.026 1.00 0.00 O ATOM 0 H GLY A 302 2.787 -2.924 -13.107 1.00 0.00 H new ATOM 0 HA2 GLY A 302 0.199 -3.015 -12.112 1.00 0.00 H new ATOM 0 HA3 GLY A 302 1.097 -2.023 -10.981 1.00 0.00 H new ATOM 558 N GLY A 303 1.699 -0.135 -12.636 1.00 0.00 N ATOM 559 CA GLY A 303 1.717 1.040 -13.496 1.00 0.00 C ATOM 560 C GLY A 303 2.074 0.649 -14.926 1.00 0.00 C ATOM 561 O GLY A 303 1.664 1.309 -15.881 1.00 0.00 O ATOM 0 H GLY A 303 2.240 -0.043 -11.776 1.00 0.00 H new ATOM 0 HA2 GLY A 303 0.742 1.526 -13.478 1.00 0.00 H new ATOM 0 HA3 GLY A 303 2.440 1.763 -13.119 1.00 0.00 H new ATOM 565 N GLY A 304 2.837 -0.431 -15.065 1.00 0.00 N ATOM 566 CA GLY A 304 3.239 -0.905 -16.386 1.00 0.00 C ATOM 567 C GLY A 304 2.021 -1.090 -17.286 1.00 0.00 C ATOM 568 O GLY A 304 2.068 -0.794 -18.480 1.00 0.00 O ATOM 0 H GLY A 304 3.187 -0.990 -14.287 1.00 0.00 H new ATOM 0 HA2 GLY A 304 3.928 -0.192 -16.840 1.00 0.00 H new ATOM 0 HA3 GLY A 304 3.774 -1.850 -16.292 1.00 0.00 H new ATOM 572 N SER A 305 0.928 -1.575 -16.702 1.00 0.00 N ATOM 573 CA SER A 305 -0.303 -1.790 -17.456 1.00 0.00 C ATOM 574 C SER A 305 -1.347 -2.490 -16.588 1.00 0.00 C ATOM 575 O SER A 305 -2.489 -2.683 -17.006 1.00 0.00 O ATOM 576 CB SER A 305 -0.017 -2.628 -18.705 1.00 0.00 C ATOM 577 OG SER A 305 0.378 -1.768 -19.765 1.00 0.00 O ATOM 0 H SER A 305 0.870 -1.825 -15.715 1.00 0.00 H new ATOM 0 HA SER A 305 -0.695 -0.820 -17.760 1.00 0.00 H new ATOM 0 HB2 SER A 305 0.769 -3.354 -18.498 1.00 0.00 H new ATOM 0 HB3 SER A 305 -0.905 -3.192 -18.990 1.00 0.00 H new ATOM 0 HG SER A 305 1.290 -1.448 -19.604 1.00 0.00 H new ATOM 583 N VAL A 306 -0.945 -2.870 -15.379 1.00 0.00 N ATOM 584 CA VAL A 306 -1.849 -3.552 -14.457 1.00 0.00 C ATOM 585 C VAL A 306 -2.517 -4.740 -15.135 1.00 0.00 C ATOM 586 O VAL A 306 -3.656 -4.650 -15.595 1.00 0.00 O ATOM 587 CB VAL A 306 -2.926 -2.587 -13.956 1.00 0.00 C ATOM 588 CG1 VAL A 306 -3.622 -3.189 -12.734 1.00 0.00 C ATOM 589 CG2 VAL A 306 -2.286 -1.253 -13.568 1.00 0.00 C ATOM 0 H VAL A 306 -0.004 -2.719 -15.016 1.00 0.00 H new ATOM 0 HA VAL A 306 -1.259 -3.909 -13.613 1.00 0.00 H new ATOM 0 HB VAL A 306 -3.655 -2.421 -14.749 1.00 0.00 H new ATOM 0 HG11 VAL A 306 -4.389 -2.502 -12.377 1.00 0.00 H new ATOM 0 HG12 VAL A 306 -4.084 -4.137 -13.009 1.00 0.00 H new ATOM 0 HG13 VAL A 306 -2.890 -3.357 -11.944 1.00 0.00 H new ATOM 0 HG21 VAL A 306 -3.057 -0.570 -13.212 1.00 0.00 H new ATOM 0 HG22 VAL A 306 -1.553 -1.417 -12.778 1.00 0.00 H new ATOM 0 HG23 VAL A 306 -1.791 -0.820 -14.437 1.00 0.00 H new ATOM 599 N GLN A 307 -1.800 -5.854 -15.186 1.00 0.00 N ATOM 600 CA GLN A 307 -2.320 -7.069 -15.801 1.00 0.00 C ATOM 601 C GLN A 307 -1.964 -8.263 -14.928 1.00 0.00 C ATOM 602 O GLN A 307 -2.799 -8.789 -14.192 1.00 0.00 O ATOM 603 CB GLN A 307 -1.697 -7.236 -17.187 1.00 0.00 C ATOM 604 CG GLN A 307 -1.802 -5.910 -17.936 1.00 0.00 C ATOM 605 CD GLN A 307 -1.157 -6.031 -19.311 1.00 0.00 C ATOM 606 OE1 GLN A 307 -1.740 -6.616 -20.223 1.00 0.00 O ATOM 607 NE2 GLN A 307 0.021 -5.506 -19.512 1.00 0.00 N ATOM 0 H GLN A 307 -0.856 -5.942 -14.809 1.00 0.00 H new ATOM 0 HA GLN A 307 -3.404 -7.003 -15.898 1.00 0.00 H new ATOM 0 HB2 GLN A 307 -0.653 -7.538 -17.098 1.00 0.00 H new ATOM 0 HB3 GLN A 307 -2.210 -8.023 -17.739 1.00 0.00 H new ATOM 0 HG2 GLN A 307 -2.849 -5.625 -18.041 1.00 0.00 H new ATOM 0 HG3 GLN A 307 -1.313 -5.121 -17.365 1.00 0.00 H new ATOM 0 HE21 GLN A 307 0.500 -5.022 -18.753 1.00 0.00 H new ATOM 0 HE22 GLN A 307 0.463 -5.580 -20.429 1.00 0.00 H new ATOM 616 N ILE A 308 -0.700 -8.654 -14.997 1.00 0.00 N ATOM 617 CA ILE A 308 -0.187 -9.754 -14.200 1.00 0.00 C ATOM 618 C ILE A 308 -0.123 -9.331 -12.738 1.00 0.00 C ATOM 619 O ILE A 308 -0.205 -10.153 -11.826 1.00 0.00 O ATOM 620 CB ILE A 308 1.214 -10.084 -14.689 1.00 0.00 C ATOM 621 CG1 ILE A 308 2.085 -8.842 -14.485 1.00 0.00 C ATOM 622 CG2 ILE A 308 1.167 -10.442 -16.177 1.00 0.00 C ATOM 623 CD1 ILE A 308 3.458 -9.028 -15.132 1.00 0.00 C ATOM 0 H ILE A 308 -0.006 -8.219 -15.604 1.00 0.00 H new ATOM 0 HA ILE A 308 -0.836 -10.624 -14.295 1.00 0.00 H new ATOM 0 HB ILE A 308 1.623 -10.931 -14.138 1.00 0.00 H new ATOM 0 HG12 ILE A 308 1.590 -7.971 -14.915 1.00 0.00 H new ATOM 0 HG13 ILE A 308 2.204 -8.647 -13.419 1.00 0.00 H new ATOM 0 HG21 ILE A 308 2.172 -10.678 -16.526 1.00 0.00 H new ATOM 0 HG22 ILE A 308 0.519 -11.307 -16.323 1.00 0.00 H new ATOM 0 HG23 ILE A 308 0.776 -9.596 -16.743 1.00 0.00 H new ATOM 0 HD11 ILE A 308 4.059 -8.133 -14.974 1.00 0.00 H new ATOM 0 HD12 ILE A 308 3.959 -9.885 -14.682 1.00 0.00 H new ATOM 0 HD13 ILE A 308 3.336 -9.199 -16.202 1.00 0.00 H new ATOM 635 N VAL A 309 0.033 -8.026 -12.546 1.00 0.00 N ATOM 636 CA VAL A 309 0.119 -7.439 -11.217 1.00 0.00 C ATOM 637 C VAL A 309 0.902 -8.329 -10.249 1.00 0.00 C ATOM 638 O VAL A 309 0.515 -8.476 -9.090 1.00 0.00 O ATOM 639 CB VAL A 309 -1.286 -7.187 -10.662 1.00 0.00 C ATOM 640 CG1 VAL A 309 -2.026 -6.208 -11.575 1.00 0.00 C ATOM 641 CG2 VAL A 309 -2.065 -8.504 -10.595 1.00 0.00 C ATOM 0 H VAL A 309 0.103 -7.349 -13.305 1.00 0.00 H new ATOM 0 HA VAL A 309 0.654 -6.494 -11.311 1.00 0.00 H new ATOM 0 HB VAL A 309 -1.204 -6.766 -9.660 1.00 0.00 H new ATOM 0 HG11 VAL A 309 -3.026 -6.028 -11.181 1.00 0.00 H new ATOM 0 HG12 VAL A 309 -1.478 -5.267 -11.619 1.00 0.00 H new ATOM 0 HG13 VAL A 309 -2.102 -6.631 -12.577 1.00 0.00 H new ATOM 0 HG21 VAL A 309 -3.063 -8.317 -10.199 1.00 0.00 H new ATOM 0 HG22 VAL A 309 -2.145 -8.931 -11.595 1.00 0.00 H new ATOM 0 HG23 VAL A 309 -1.542 -9.203 -9.943 1.00 0.00 H new ATOM 651 N TYR A 310 2.010 -8.909 -10.714 1.00 0.00 N ATOM 652 CA TYR A 310 2.822 -9.759 -9.842 1.00 0.00 C ATOM 653 C TYR A 310 4.298 -9.710 -10.233 1.00 0.00 C ATOM 654 O TYR A 310 4.950 -10.739 -10.411 1.00 0.00 O ATOM 655 CB TYR A 310 2.276 -11.199 -9.838 1.00 0.00 C ATOM 656 CG TYR A 310 2.884 -12.035 -10.946 1.00 0.00 C ATOM 657 CD1 TYR A 310 3.238 -11.455 -12.171 1.00 0.00 C ATOM 658 CD2 TYR A 310 3.082 -13.408 -10.743 1.00 0.00 C ATOM 659 CE1 TYR A 310 3.786 -12.245 -13.187 1.00 0.00 C ATOM 660 CE2 TYR A 310 3.633 -14.196 -11.759 1.00 0.00 C ATOM 661 CZ TYR A 310 3.984 -13.615 -12.981 1.00 0.00 C ATOM 662 OH TYR A 310 4.525 -14.393 -13.985 1.00 0.00 O ATOM 0 H TYR A 310 2.360 -8.810 -11.667 1.00 0.00 H new ATOM 0 HA TYR A 310 2.754 -9.373 -8.825 1.00 0.00 H new ATOM 0 HB2 TYR A 310 2.486 -11.664 -8.875 1.00 0.00 H new ATOM 0 HB3 TYR A 310 1.192 -11.177 -9.952 1.00 0.00 H new ATOM 0 HD1 TYR A 310 3.088 -10.398 -12.331 1.00 0.00 H new ATOM 0 HD2 TYR A 310 2.809 -13.858 -9.800 1.00 0.00 H new ATOM 0 HE1 TYR A 310 4.057 -11.797 -14.132 1.00 0.00 H new ATOM 0 HE2 TYR A 310 3.787 -15.253 -11.599 1.00 0.00 H new ATOM 0 HH TYR A 310 4.596 -15.321 -13.678 1.00 0.00 H new ATOM 672 N LYS A 311 4.804 -8.481 -10.340 1.00 0.00 N ATOM 673 CA LYS A 311 6.202 -8.210 -10.687 1.00 0.00 C ATOM 674 C LYS A 311 7.058 -9.480 -10.690 1.00 0.00 C ATOM 675 O LYS A 311 7.379 -10.021 -9.632 1.00 0.00 O ATOM 676 CB LYS A 311 6.804 -7.209 -9.672 1.00 0.00 C ATOM 677 CG LYS A 311 5.785 -6.898 -8.570 1.00 0.00 C ATOM 678 CD LYS A 311 6.345 -5.814 -7.648 1.00 0.00 C ATOM 679 CE LYS A 311 5.506 -5.745 -6.370 1.00 0.00 C ATOM 680 NZ LYS A 311 4.063 -5.634 -6.730 1.00 0.00 N ATOM 0 H LYS A 311 4.251 -7.637 -10.187 1.00 0.00 H new ATOM 0 HA LYS A 311 6.209 -7.795 -11.695 1.00 0.00 H new ATOM 0 HB2 LYS A 311 7.710 -7.626 -9.233 1.00 0.00 H new ATOM 0 HB3 LYS A 311 7.091 -6.290 -10.183 1.00 0.00 H new ATOM 0 HG2 LYS A 311 4.846 -6.565 -9.012 1.00 0.00 H new ATOM 0 HG3 LYS A 311 5.566 -7.799 -7.998 1.00 0.00 H new ATOM 0 HD2 LYS A 311 7.384 -6.033 -7.402 1.00 0.00 H new ATOM 0 HD3 LYS A 311 6.334 -4.849 -8.155 1.00 0.00 H new ATOM 0 HE2 LYS A 311 5.673 -6.635 -5.763 1.00 0.00 H new ATOM 0 HE3 LYS A 311 5.809 -4.888 -5.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 311 3.529 -5.270 -5.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 311 3.955 -4.983 -7.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 311 3.698 -6.572 -6.992 1.00 0.00 H new ATOM 694 N PRO A 312 7.461 -9.937 -11.844 1.00 0.00 N ATOM 695 CA PRO A 312 8.332 -11.140 -11.945 1.00 0.00 C ATOM 696 C PRO A 312 9.755 -10.870 -11.463 1.00 0.00 C ATOM 697 O PRO A 312 10.163 -11.503 -10.503 1.00 0.00 O ATOM 698 CB PRO A 312 8.298 -11.424 -13.436 1.00 0.00 C ATOM 699 CG PRO A 312 6.892 -11.139 -13.810 1.00 0.00 C ATOM 700 CD PRO A 312 6.467 -9.943 -12.944 1.00 0.00 C ATOM 701 OXT PRO A 312 10.414 -10.036 -12.060 1.00 0.00 O ATOM 0 HA PRO A 312 7.995 -11.969 -11.323 1.00 0.00 H new ATOM 0 HB2 PRO A 312 8.995 -10.788 -13.982 1.00 0.00 H new ATOM 0 HB3 PRO A 312 8.570 -12.457 -13.654 1.00 0.00 H new ATOM 0 HG2 PRO A 312 6.809 -10.904 -14.871 1.00 0.00 H new ATOM 0 HG3 PRO A 312 6.254 -12.003 -13.624 1.00 0.00 H new ATOM 0 HD2 PRO A 312 6.489 -9.011 -13.509 1.00 0.00 H new ATOM 0 HD3 PRO A 312 5.452 -10.063 -12.566 1.00 0.00 H new TER 709 PRO A 312