USER MOD reduce.3.24.130724 H: found=0, std=0, add=461, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 461 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 112 SER OG : rot -163:sc= 1.71 USER MOD Set 1.2: A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 CYS SG : rot 20:sc= 0.324 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 GLN : amide:sc= -4.78! C(o=-4.8!,f=-6.4!) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot -54:sc= -4.45! USER MOD Single : A 109 TYR OH : rot 1:sc= -2.7! USER MOD Single : A 114 GLN : amide:sc= -4.58! C(o=-4.6!,f=-13!) USER MOD Single : A 117 LYS NZ :NH3+ 149:sc= -0.171 (180deg=-0.99) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.015) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot -34:sc= 0.495 USER MOD Single : A 126 ASN : amide:sc= -0.404 K(o=-0.4,f=-2.8!) USER MOD Single : A 129 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 ASN :FLIP amide:sc= 0.156 F(o=-1.5!,f=0.16) USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 134 N PRO A 87 24.000 -0.246 -25.023 1.00 0.00 N ATOM 135 CA PRO A 87 24.791 -1.204 -25.853 1.00 0.00 C ATOM 136 C PRO A 87 25.079 -0.651 -27.245 1.00 0.00 C ATOM 137 O PRO A 87 24.207 -0.063 -27.885 1.00 0.00 O ATOM 138 CB PRO A 87 23.889 -2.439 -25.931 1.00 0.00 C ATOM 139 CG PRO A 87 23.014 -2.367 -24.726 1.00 0.00 C ATOM 140 CD PRO A 87 22.796 -0.876 -24.458 1.00 0.00 C ATOM 0 HA PRO A 87 25.771 -1.412 -25.423 1.00 0.00 H new ATOM 0 HB2 PRO A 87 23.298 -2.436 -26.847 1.00 0.00 H new ATOM 0 HB3 PRO A 87 24.478 -3.356 -25.935 1.00 0.00 H new ATOM 0 HG2 PRO A 87 22.066 -2.876 -24.900 1.00 0.00 H new ATOM 0 HG3 PRO A 87 23.484 -2.853 -23.871 1.00 0.00 H new ATOM 0 HD2 PRO A 87 21.889 -0.510 -24.938 1.00 0.00 H new ATOM 0 HD3 PRO A 87 22.698 -0.670 -23.392 1.00 0.00 H new ATOM 148 N CYS A 88 26.311 -0.844 -27.708 1.00 0.00 N ATOM 149 CA CYS A 88 26.708 -0.351 -29.021 1.00 0.00 C ATOM 150 C CYS A 88 26.053 -1.174 -30.124 1.00 0.00 C ATOM 151 O CYS A 88 25.802 -2.366 -29.956 1.00 0.00 O ATOM 152 CB CYS A 88 28.230 -0.418 -29.165 1.00 0.00 C ATOM 153 SG CYS A 88 28.755 -2.149 -29.215 1.00 0.00 S ATOM 0 H CYS A 88 27.045 -1.334 -27.197 1.00 0.00 H new ATOM 0 HA CYS A 88 26.380 0.684 -29.114 1.00 0.00 H new ATOM 0 HB2 CYS A 88 28.543 0.095 -30.075 1.00 0.00 H new ATOM 0 HB3 CYS A 88 28.708 0.094 -28.330 1.00 0.00 H new ATOM 0 HG CYS A 88 27.744 -2.900 -29.536 1.00 0.00 H new ATOM 159 N GLY A 89 25.783 -0.529 -31.254 1.00 0.00 N ATOM 160 CA GLY A 89 25.160 -1.210 -32.383 1.00 0.00 C ATOM 161 C GLY A 89 23.642 -1.130 -32.298 1.00 0.00 C ATOM 162 O GLY A 89 22.940 -1.444 -33.259 1.00 0.00 O ATOM 0 H GLY A 89 25.984 0.458 -31.412 1.00 0.00 H new ATOM 0 HA2 GLY A 89 25.500 -0.760 -33.316 1.00 0.00 H new ATOM 0 HA3 GLY A 89 25.472 -2.254 -32.400 1.00 0.00 H new ATOM 166 N TRP A 90 23.139 -0.703 -31.146 1.00 0.00 N ATOM 167 CA TRP A 90 21.700 -0.585 -30.942 1.00 0.00 C ATOM 168 C TRP A 90 21.295 0.876 -30.785 1.00 0.00 C ATOM 169 O TRP A 90 22.092 1.704 -30.344 1.00 0.00 O ATOM 170 CB TRP A 90 21.282 -1.370 -29.698 1.00 0.00 C ATOM 171 CG TRP A 90 21.454 -2.833 -29.951 1.00 0.00 C ATOM 172 CD1 TRP A 90 22.626 -3.503 -29.865 1.00 0.00 C ATOM 173 CD2 TRP A 90 20.446 -3.818 -30.320 1.00 0.00 C ATOM 174 NE1 TRP A 90 22.403 -4.834 -30.164 1.00 0.00 N ATOM 175 CE2 TRP A 90 21.074 -5.080 -30.450 1.00 0.00 C ATOM 176 CE3 TRP A 90 19.061 -3.740 -30.554 1.00 0.00 C ATOM 177 CZ2 TRP A 90 20.355 -6.223 -30.799 1.00 0.00 C ATOM 178 CZ3 TRP A 90 18.334 -4.890 -30.906 1.00 0.00 C ATOM 179 CH2 TRP A 90 18.980 -6.128 -31.028 1.00 0.00 C ATOM 0 H TRP A 90 23.704 -0.433 -30.341 1.00 0.00 H new ATOM 0 HA TRP A 90 21.196 -0.995 -31.817 1.00 0.00 H new ATOM 0 HB2 TRP A 90 21.885 -1.065 -28.843 1.00 0.00 H new ATOM 0 HB3 TRP A 90 20.243 -1.153 -29.450 1.00 0.00 H new ATOM 0 HD1 TRP A 90 23.580 -3.069 -29.605 1.00 0.00 H new ATOM 0 HE1 TRP A 90 23.131 -5.548 -30.172 1.00 0.00 H new ATOM 0 HE3 TRP A 90 18.554 -2.791 -30.463 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 20.857 -7.175 -30.892 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 17.271 -4.819 -31.084 1.00 0.00 H new ATOM 0 HH2 TRP A 90 18.415 -7.008 -31.299 1.00 0.00 H new ATOM 190 N GLU A 91 20.057 1.184 -31.151 1.00 0.00 N ATOM 191 CA GLU A 91 19.556 2.551 -31.043 1.00 0.00 C ATOM 192 C GLU A 91 18.432 2.628 -30.013 1.00 0.00 C ATOM 193 O GLU A 91 17.619 1.711 -29.898 1.00 0.00 O ATOM 194 CB GLU A 91 19.041 3.029 -32.400 1.00 0.00 C ATOM 195 CG GLU A 91 18.601 4.490 -32.295 1.00 0.00 C ATOM 196 CD GLU A 91 18.197 5.013 -33.669 1.00 0.00 C ATOM 197 OE1 GLU A 91 18.260 4.246 -34.615 1.00 0.00 O ATOM 198 OE2 GLU A 91 17.834 6.175 -33.756 1.00 0.00 O ATOM 0 H GLU A 91 19.385 0.513 -31.523 1.00 0.00 H new ATOM 0 HA GLU A 91 20.375 3.194 -30.721 1.00 0.00 H new ATOM 0 HB2 GLU A 91 19.822 2.927 -33.153 1.00 0.00 H new ATOM 0 HB3 GLU A 91 18.205 2.409 -32.722 1.00 0.00 H new ATOM 0 HG2 GLU A 91 17.763 4.577 -31.603 1.00 0.00 H new ATOM 0 HG3 GLU A 91 19.413 5.095 -31.891 1.00 0.00 H new ATOM 205 N ARG A 92 18.393 3.729 -29.268 1.00 0.00 N ATOM 206 CA ARG A 92 17.367 3.914 -28.248 1.00 0.00 C ATOM 207 C ARG A 92 16.530 5.154 -28.548 1.00 0.00 C ATOM 208 O ARG A 92 17.058 6.187 -28.953 1.00 0.00 O ATOM 209 CB ARG A 92 18.022 4.058 -26.872 1.00 0.00 C ATOM 210 CG ARG A 92 19.070 5.172 -26.919 1.00 0.00 C ATOM 211 CD ARG A 92 19.810 5.236 -25.582 1.00 0.00 C ATOM 212 NE ARG A 92 18.876 5.544 -24.505 1.00 0.00 N ATOM 213 CZ ARG A 92 18.488 6.792 -24.268 1.00 0.00 C ATOM 214 NH1 ARG A 92 18.940 7.768 -25.008 1.00 0.00 N ATOM 215 NH2 ARG A 92 17.652 7.044 -23.297 1.00 0.00 N ATOM 0 H ARG A 92 19.055 4.501 -29.351 1.00 0.00 H new ATOM 0 HA ARG A 92 16.715 3.041 -28.251 1.00 0.00 H new ATOM 0 HB2 ARG A 92 17.267 4.286 -26.120 1.00 0.00 H new ATOM 0 HB3 ARG A 92 18.489 3.117 -26.579 1.00 0.00 H new ATOM 0 HG2 ARG A 92 19.776 4.987 -27.729 1.00 0.00 H new ATOM 0 HG3 ARG A 92 18.590 6.128 -27.127 1.00 0.00 H new ATOM 0 HD2 ARG A 92 20.303 4.284 -25.385 1.00 0.00 H new ATOM 0 HD3 ARG A 92 20.590 5.996 -25.626 1.00 0.00 H new ATOM 0 HE ARG A 92 18.514 4.788 -23.924 1.00 0.00 H new ATOM 0 HH11 ARG A 92 19.591 7.572 -25.768 1.00 0.00 H new ATOM 0 HH12 ARG A 92 18.642 8.726 -24.826 1.00 0.00 H new ATOM 0 HH21 ARG A 92 17.296 6.282 -22.720 1.00 0.00 H new ATOM 0 HH22 ARG A 92 17.355 8.003 -23.116 1.00 0.00 H new ATOM 229 N VAL A 93 15.223 5.039 -28.346 1.00 0.00 N ATOM 230 CA VAL A 93 14.315 6.151 -28.596 1.00 0.00 C ATOM 231 C VAL A 93 13.342 6.330 -27.438 1.00 0.00 C ATOM 232 O VAL A 93 12.728 5.365 -26.981 1.00 0.00 O ATOM 233 CB VAL A 93 13.537 5.909 -29.889 1.00 0.00 C ATOM 234 CG1 VAL A 93 12.394 6.922 -29.995 1.00 0.00 C ATOM 235 CG2 VAL A 93 14.474 6.081 -31.088 1.00 0.00 C ATOM 0 H VAL A 93 14.769 4.189 -28.011 1.00 0.00 H new ATOM 0 HA VAL A 93 14.908 7.060 -28.693 1.00 0.00 H new ATOM 0 HB VAL A 93 13.131 4.898 -29.882 1.00 0.00 H new ATOM 0 HG11 VAL A 93 11.839 6.749 -30.917 1.00 0.00 H new ATOM 0 HG12 VAL A 93 11.725 6.806 -29.142 1.00 0.00 H new ATOM 0 HG13 VAL A 93 12.803 7.932 -30.001 1.00 0.00 H new ATOM 0 HG21 VAL A 93 13.920 5.909 -32.011 1.00 0.00 H new ATOM 0 HG22 VAL A 93 14.878 7.093 -31.091 1.00 0.00 H new ATOM 0 HG23 VAL A 93 15.292 5.364 -31.017 1.00 0.00 H new ATOM 245 N VAL A 94 13.205 7.566 -26.968 1.00 0.00 N ATOM 246 CA VAL A 94 12.292 7.856 -25.866 1.00 0.00 C ATOM 247 C VAL A 94 11.415 9.054 -26.206 1.00 0.00 C ATOM 248 O VAL A 94 11.906 10.174 -26.360 1.00 0.00 O ATOM 249 CB VAL A 94 13.084 8.143 -24.593 1.00 0.00 C ATOM 250 CG1 VAL A 94 13.970 6.940 -24.262 1.00 0.00 C ATOM 251 CG2 VAL A 94 13.962 9.378 -24.808 1.00 0.00 C ATOM 0 H VAL A 94 13.709 8.376 -27.328 1.00 0.00 H new ATOM 0 HA VAL A 94 11.655 6.986 -25.705 1.00 0.00 H new ATOM 0 HB VAL A 94 12.395 8.325 -23.768 1.00 0.00 H new ATOM 0 HG11 VAL A 94 14.536 7.144 -23.353 1.00 0.00 H new ATOM 0 HG12 VAL A 94 13.346 6.059 -24.111 1.00 0.00 H new ATOM 0 HG13 VAL A 94 14.660 6.759 -25.086 1.00 0.00 H new ATOM 0 HG21 VAL A 94 14.528 9.584 -23.900 1.00 0.00 H new ATOM 0 HG22 VAL A 94 14.652 9.195 -25.632 1.00 0.00 H new ATOM 0 HG23 VAL A 94 13.332 10.235 -25.046 1.00 0.00 H new ATOM 261 N LYS A 95 10.112 8.817 -26.320 1.00 0.00 N ATOM 262 CA LYS A 95 9.176 9.888 -26.645 1.00 0.00 C ATOM 263 C LYS A 95 7.905 9.769 -25.808 1.00 0.00 C ATOM 264 O LYS A 95 7.316 8.692 -25.707 1.00 0.00 O ATOM 265 CB LYS A 95 8.812 9.824 -28.134 1.00 0.00 C ATOM 266 CG LYS A 95 9.989 10.329 -28.971 1.00 0.00 C ATOM 267 CD LYS A 95 9.918 11.853 -29.084 1.00 0.00 C ATOM 268 CE LYS A 95 9.150 12.236 -30.350 1.00 0.00 C ATOM 269 NZ LYS A 95 9.095 13.721 -30.469 1.00 0.00 N ATOM 0 H LYS A 95 9.683 7.901 -26.193 1.00 0.00 H new ATOM 0 HA LYS A 95 9.655 10.842 -26.422 1.00 0.00 H new ATOM 0 HB2 LYS A 95 8.565 8.800 -28.415 1.00 0.00 H new ATOM 0 HB3 LYS A 95 7.927 10.430 -28.329 1.00 0.00 H new ATOM 0 HG2 LYS A 95 10.931 10.031 -28.510 1.00 0.00 H new ATOM 0 HG3 LYS A 95 9.963 9.879 -29.963 1.00 0.00 H new ATOM 0 HD2 LYS A 95 9.425 12.271 -28.206 1.00 0.00 H new ATOM 0 HD3 LYS A 95 10.923 12.273 -29.115 1.00 0.00 H new ATOM 0 HE2 LYS A 95 9.637 11.808 -31.227 1.00 0.00 H new ATOM 0 HE3 LYS A 95 8.141 11.826 -30.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 8.573 13.981 -31.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 8.612 14.118 -29.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 10.062 14.101 -30.522 1.00 0.00 H new ATOM 283 N GLN A 96 7.494 10.880 -25.208 1.00 0.00 N ATOM 284 CA GLN A 96 6.287 10.890 -24.387 1.00 0.00 C ATOM 285 C GLN A 96 5.045 10.891 -25.272 1.00 0.00 C ATOM 286 O GLN A 96 5.007 11.556 -26.308 1.00 0.00 O ATOM 287 CB GLN A 96 6.279 12.128 -23.489 1.00 0.00 C ATOM 288 CG GLN A 96 6.177 13.386 -24.352 1.00 0.00 C ATOM 289 CD GLN A 96 4.713 13.739 -24.592 1.00 0.00 C ATOM 290 OE1 GLN A 96 3.876 13.556 -23.708 1.00 0.00 O ATOM 291 NE2 GLN A 96 4.350 14.235 -25.743 1.00 0.00 N ATOM 0 H GLN A 96 7.973 11.778 -25.273 1.00 0.00 H new ATOM 0 HA GLN A 96 6.279 9.994 -23.767 1.00 0.00 H new ATOM 0 HB2 GLN A 96 5.439 12.081 -22.795 1.00 0.00 H new ATOM 0 HB3 GLN A 96 7.188 12.160 -22.888 1.00 0.00 H new ATOM 0 HG2 GLN A 96 6.683 14.216 -23.860 1.00 0.00 H new ATOM 0 HG3 GLN A 96 6.681 13.225 -25.305 1.00 0.00 H new ATOM 0 HE21 GLN A 96 5.044 14.386 -26.475 1.00 0.00 H new ATOM 0 HE22 GLN A 96 3.372 14.471 -25.911 1.00 0.00 H new ATOM 300 N ARG A 97 4.029 10.144 -24.856 1.00 0.00 N ATOM 301 CA ARG A 97 2.788 10.067 -25.618 1.00 0.00 C ATOM 302 C ARG A 97 2.090 11.423 -25.650 1.00 0.00 C ATOM 303 O ARG A 97 2.259 12.239 -24.744 1.00 0.00 O ATOM 304 CB ARG A 97 1.853 9.028 -24.989 1.00 0.00 C ATOM 305 CG ARG A 97 1.411 9.508 -23.604 1.00 0.00 C ATOM 306 CD ARG A 97 0.648 8.387 -22.898 1.00 0.00 C ATOM 307 NE ARG A 97 1.512 7.228 -22.710 1.00 0.00 N ATOM 308 CZ ARG A 97 1.004 6.008 -22.562 1.00 0.00 C ATOM 309 NH1 ARG A 97 -0.287 5.832 -22.584 1.00 0.00 N ATOM 310 NH2 ARG A 97 1.799 4.988 -22.390 1.00 0.00 N ATOM 0 H ARG A 97 4.039 9.587 -24.002 1.00 0.00 H new ATOM 0 HA ARG A 97 3.030 9.772 -26.639 1.00 0.00 H new ATOM 0 HB2 ARG A 97 0.983 8.874 -25.627 1.00 0.00 H new ATOM 0 HB3 ARG A 97 2.362 8.068 -24.907 1.00 0.00 H new ATOM 0 HG2 ARG A 97 2.280 9.800 -23.014 1.00 0.00 H new ATOM 0 HG3 ARG A 97 0.778 10.391 -23.698 1.00 0.00 H new ATOM 0 HD2 ARG A 97 0.283 8.738 -21.933 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -0.226 8.106 -23.486 1.00 0.00 H new ATOM 0 HE ARG A 97 2.524 7.355 -22.692 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -0.908 6.630 -22.715 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -0.676 4.896 -22.470 1.00 0.00 H new ATOM 0 HH21 ARG A 97 2.809 5.127 -22.369 1.00 0.00 H new ATOM 0 HH22 ARG A 97 1.410 4.052 -22.276 1.00 0.00 H new ATOM 324 N LEU A 98 1.307 11.656 -26.698 1.00 0.00 N ATOM 325 CA LEU A 98 0.581 12.916 -26.830 1.00 0.00 C ATOM 326 C LEU A 98 -0.375 13.103 -25.656 1.00 0.00 C ATOM 327 O LEU A 98 0.023 13.567 -24.587 1.00 0.00 O ATOM 328 CB LEU A 98 -0.210 12.925 -28.140 1.00 0.00 C ATOM 329 CG LEU A 98 0.720 13.297 -29.295 1.00 0.00 C ATOM 330 CD1 LEU A 98 1.144 14.761 -29.160 1.00 0.00 C ATOM 331 CD2 LEU A 98 1.963 12.402 -29.256 1.00 0.00 C ATOM 0 H LEU A 98 1.159 10.997 -27.462 1.00 0.00 H new ATOM 0 HA LEU A 98 1.301 13.734 -26.834 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -0.652 11.945 -28.317 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -1.031 13.639 -28.076 1.00 0.00 H new ATOM 0 HG LEU A 98 0.197 13.156 -30.241 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.807 15.025 -29.984 1.00 0.00 H new ATOM 0 HD12 LEU A 98 0.261 15.399 -29.186 1.00 0.00 H new ATOM 0 HD13 LEU A 98 1.667 14.903 -28.214 1.00 0.00 H new ATOM 0 HD21 LEU A 98 2.627 12.666 -30.079 1.00 0.00 H new ATOM 0 HD22 LEU A 98 2.484 12.544 -28.309 1.00 0.00 H new ATOM 0 HD23 LEU A 98 1.663 11.358 -29.352 1.00 0.00 H new ATOM 343 N PHE A 99 -1.637 12.741 -25.863 1.00 0.00 N ATOM 344 CA PHE A 99 -2.637 12.866 -24.808 1.00 0.00 C ATOM 345 C PHE A 99 -3.528 11.625 -24.768 1.00 0.00 C ATOM 346 O PHE A 99 -3.805 11.016 -25.802 1.00 0.00 O ATOM 347 CB PHE A 99 -3.499 14.105 -25.044 1.00 0.00 C ATOM 348 CG PHE A 99 -2.608 15.302 -25.271 1.00 0.00 C ATOM 349 CD1 PHE A 99 -1.655 15.659 -24.311 1.00 0.00 C ATOM 350 CD2 PHE A 99 -2.732 16.051 -26.448 1.00 0.00 C ATOM 351 CE1 PHE A 99 -0.828 16.768 -24.525 1.00 0.00 C ATOM 352 CE2 PHE A 99 -1.904 17.161 -26.661 1.00 0.00 C ATOM 353 CZ PHE A 99 -0.952 17.519 -25.699 1.00 0.00 C ATOM 0 H PHE A 99 -1.989 12.362 -26.742 1.00 0.00 H new ATOM 0 HA PHE A 99 -2.119 12.963 -23.854 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -4.147 13.951 -25.907 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -4.148 14.279 -24.185 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -1.557 15.079 -23.405 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -3.465 15.773 -27.191 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -0.093 17.044 -23.783 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -2.000 17.740 -27.567 1.00 0.00 H new ATOM 0 HZ PHE A 99 -0.314 18.375 -25.863 1.00 0.00 H new ATOM 363 N GLY A 100 -3.970 11.255 -23.570 1.00 0.00 N ATOM 364 CA GLY A 100 -4.826 10.087 -23.409 1.00 0.00 C ATOM 365 C GLY A 100 -5.170 9.864 -21.941 1.00 0.00 C ATOM 366 O GLY A 100 -5.062 10.776 -21.122 1.00 0.00 O ATOM 0 H GLY A 100 -3.751 11.744 -22.702 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -5.742 10.220 -23.985 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -4.324 9.205 -23.807 1.00 0.00 H new ATOM 370 N LYS A 101 -5.590 8.646 -21.615 1.00 0.00 N ATOM 371 CA LYS A 101 -5.949 8.312 -20.243 1.00 0.00 C ATOM 372 C LYS A 101 -4.709 8.315 -19.349 1.00 0.00 C ATOM 373 O LYS A 101 -4.818 8.246 -18.125 1.00 0.00 O ATOM 374 CB LYS A 101 -6.613 6.935 -20.195 1.00 0.00 C ATOM 375 CG LYS A 101 -7.575 6.875 -19.006 1.00 0.00 C ATOM 376 CD LYS A 101 -8.236 5.495 -18.951 1.00 0.00 C ATOM 377 CE LYS A 101 -7.312 4.513 -18.229 1.00 0.00 C ATOM 378 NZ LYS A 101 -8.012 3.209 -18.057 1.00 0.00 N ATOM 0 H LYS A 101 -5.690 7.878 -22.279 1.00 0.00 H new ATOM 0 HA LYS A 101 -6.649 9.063 -19.878 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -7.153 6.747 -21.123 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -5.855 6.157 -20.103 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -7.036 7.069 -18.079 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -8.335 7.650 -19.101 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -9.192 5.559 -18.432 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -8.444 5.140 -19.960 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -6.394 4.373 -18.800 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -7.024 4.915 -17.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -7.385 2.540 -17.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -8.876 3.350 -17.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -8.265 2.825 -18.990 1.00 0.00 H new ATOM 392 N THR A 102 -3.533 8.387 -19.975 1.00 0.00 N ATOM 393 CA THR A 102 -2.284 8.394 -19.228 1.00 0.00 C ATOM 394 C THR A 102 -1.468 9.639 -19.563 1.00 0.00 C ATOM 395 O THR A 102 -0.313 9.756 -19.154 1.00 0.00 O ATOM 396 CB THR A 102 -1.474 7.143 -19.552 1.00 0.00 C ATOM 397 OG1 THR A 102 -1.091 7.175 -20.915 1.00 0.00 O ATOM 398 CG2 THR A 102 -2.328 5.899 -19.290 1.00 0.00 C ATOM 0 H THR A 102 -3.424 8.441 -20.988 1.00 0.00 H new ATOM 0 HA THR A 102 -2.518 8.404 -18.163 1.00 0.00 H new ATOM 0 HB THR A 102 -0.585 7.110 -18.923 1.00 0.00 H new ATOM 0 HG1 THR A 102 -1.886 7.297 -21.475 1.00 0.00 H new ATOM 0 HG21 THR A 102 -1.749 5.005 -19.522 1.00 0.00 H new ATOM 0 HG22 THR A 102 -2.626 5.877 -18.242 1.00 0.00 H new ATOM 0 HG23 THR A 102 -3.217 5.929 -19.920 1.00 0.00 H new ATOM 406 N ALA A 103 -2.072 10.556 -20.315 1.00 0.00 N ATOM 407 CA ALA A 103 -1.388 11.784 -20.703 1.00 0.00 C ATOM 408 C ALA A 103 -0.363 12.182 -19.645 1.00 0.00 C ATOM 409 O ALA A 103 -0.721 12.559 -18.529 1.00 0.00 O ATOM 410 CB ALA A 103 -2.408 12.913 -20.868 1.00 0.00 C ATOM 0 H ALA A 103 -3.026 10.472 -20.665 1.00 0.00 H new ATOM 0 HA ALA A 103 -0.873 11.610 -21.648 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -1.893 13.829 -21.158 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -3.129 12.642 -21.639 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -2.929 13.073 -19.924 1.00 0.00 H new ATOM 416 N GLY A 104 0.913 12.085 -20.003 1.00 0.00 N ATOM 417 CA GLY A 104 1.986 12.428 -19.076 1.00 0.00 C ATOM 418 C GLY A 104 2.948 11.259 -18.896 1.00 0.00 C ATOM 419 O GLY A 104 4.023 11.412 -18.313 1.00 0.00 O ATOM 0 H GLY A 104 1.228 11.774 -20.922 1.00 0.00 H new ATOM 0 HA2 GLY A 104 2.529 13.296 -19.448 1.00 0.00 H new ATOM 0 HA3 GLY A 104 1.562 12.707 -18.111 1.00 0.00 H new ATOM 423 N ARG A 105 2.559 10.094 -19.402 1.00 0.00 N ATOM 424 CA ARG A 105 3.400 8.907 -19.302 1.00 0.00 C ATOM 425 C ARG A 105 4.550 8.980 -20.302 1.00 0.00 C ATOM 426 O ARG A 105 4.539 9.807 -21.214 1.00 0.00 O ATOM 427 CB ARG A 105 2.569 7.652 -19.566 1.00 0.00 C ATOM 428 CG ARG A 105 3.101 6.498 -18.713 1.00 0.00 C ATOM 429 CD ARG A 105 2.279 6.396 -17.427 1.00 0.00 C ATOM 430 NE ARG A 105 2.082 7.721 -16.846 1.00 0.00 N ATOM 431 CZ ARG A 105 2.931 8.211 -15.949 1.00 0.00 C ATOM 432 NH1 ARG A 105 3.964 7.507 -15.572 1.00 0.00 N ATOM 433 NH2 ARG A 105 2.734 9.399 -15.446 1.00 0.00 N ATOM 0 H ARG A 105 1.672 9.946 -19.883 1.00 0.00 H new ATOM 0 HA ARG A 105 3.812 8.861 -18.294 1.00 0.00 H new ATOM 0 HB2 ARG A 105 1.522 7.840 -19.330 1.00 0.00 H new ATOM 0 HB3 ARG A 105 2.615 7.388 -20.623 1.00 0.00 H new ATOM 0 HG2 ARG A 105 3.043 5.563 -19.270 1.00 0.00 H new ATOM 0 HG3 ARG A 105 4.152 6.662 -18.474 1.00 0.00 H new ATOM 0 HD2 ARG A 105 1.313 5.937 -17.640 1.00 0.00 H new ATOM 0 HD3 ARG A 105 2.788 5.750 -16.712 1.00 0.00 H new ATOM 0 HE ARG A 105 1.279 8.280 -17.134 1.00 0.00 H new ATOM 0 HH11 ARG A 105 4.120 6.579 -15.966 1.00 0.00 H new ATOM 0 HH12 ARG A 105 4.615 7.885 -14.883 1.00 0.00 H new ATOM 0 HH21 ARG A 105 1.929 9.951 -15.741 1.00 0.00 H new ATOM 0 HH22 ARG A 105 3.385 9.776 -14.757 1.00 0.00 H new ATOM 447 N PHE A 106 5.540 8.111 -20.123 1.00 0.00 N ATOM 448 CA PHE A 106 6.693 8.088 -21.015 1.00 0.00 C ATOM 449 C PHE A 106 6.808 6.735 -21.711 1.00 0.00 C ATOM 450 O PHE A 106 6.615 5.690 -21.088 1.00 0.00 O ATOM 451 CB PHE A 106 7.972 8.365 -20.220 1.00 0.00 C ATOM 452 CG PHE A 106 7.912 9.756 -19.636 1.00 0.00 C ATOM 453 CD1 PHE A 106 8.341 10.852 -20.395 1.00 0.00 C ATOM 454 CD2 PHE A 106 7.428 9.950 -18.338 1.00 0.00 C ATOM 455 CE1 PHE A 106 8.286 12.142 -19.855 1.00 0.00 C ATOM 456 CE2 PHE A 106 7.372 11.241 -17.797 1.00 0.00 C ATOM 457 CZ PHE A 106 7.802 12.336 -18.556 1.00 0.00 C ATOM 0 H PHE A 106 5.567 7.419 -19.374 1.00 0.00 H new ATOM 0 HA PHE A 106 6.559 8.861 -21.771 1.00 0.00 H new ATOM 0 HB2 PHE A 106 8.084 7.629 -19.423 1.00 0.00 H new ATOM 0 HB3 PHE A 106 8.843 8.269 -20.868 1.00 0.00 H new ATOM 0 HD1 PHE A 106 8.714 10.702 -21.397 1.00 0.00 H new ATOM 0 HD2 PHE A 106 7.097 9.105 -17.753 1.00 0.00 H new ATOM 0 HE1 PHE A 106 8.617 12.987 -20.440 1.00 0.00 H new ATOM 0 HE2 PHE A 106 6.997 11.391 -16.795 1.00 0.00 H new ATOM 0 HZ PHE A 106 7.760 13.331 -18.139 1.00 0.00 H new ATOM 467 N ASP A 107 7.123 6.763 -23.004 1.00 0.00 N ATOM 468 CA ASP A 107 7.267 5.533 -23.773 1.00 0.00 C ATOM 469 C ASP A 107 8.667 5.437 -24.367 1.00 0.00 C ATOM 470 O ASP A 107 9.182 6.407 -24.926 1.00 0.00 O ATOM 471 CB ASP A 107 6.227 5.492 -24.890 1.00 0.00 C ATOM 472 CG ASP A 107 4.828 5.661 -24.307 1.00 0.00 C ATOM 473 OD1 ASP A 107 4.224 4.657 -23.970 1.00 0.00 O ATOM 474 OD2 ASP A 107 4.381 6.792 -24.210 1.00 0.00 O ATOM 0 H ASP A 107 7.282 7.618 -23.537 1.00 0.00 H new ATOM 0 HA ASP A 107 7.111 4.686 -23.105 1.00 0.00 H new ATOM 0 HB2 ASP A 107 6.427 6.283 -25.613 1.00 0.00 H new ATOM 0 HB3 ASP A 107 6.294 4.545 -25.426 1.00 0.00 H new ATOM 479 N VAL A 108 9.278 4.262 -24.246 1.00 0.00 N ATOM 480 CA VAL A 108 10.620 4.059 -24.775 1.00 0.00 C ATOM 481 C VAL A 108 10.725 2.702 -25.468 1.00 0.00 C ATOM 482 O VAL A 108 10.052 1.746 -25.086 1.00 0.00 O ATOM 483 CB VAL A 108 11.640 4.121 -23.632 1.00 0.00 C ATOM 484 CG1 VAL A 108 11.406 5.389 -22.808 1.00 0.00 C ATOM 485 CG2 VAL A 108 11.481 2.893 -22.734 1.00 0.00 C ATOM 0 H VAL A 108 8.870 3.445 -23.791 1.00 0.00 H new ATOM 0 HA VAL A 108 10.828 4.845 -25.501 1.00 0.00 H new ATOM 0 HB VAL A 108 12.648 4.137 -24.047 1.00 0.00 H new ATOM 0 HG11 VAL A 108 12.131 5.434 -21.995 1.00 0.00 H new ATOM 0 HG12 VAL A 108 11.523 6.265 -23.447 1.00 0.00 H new ATOM 0 HG13 VAL A 108 10.398 5.373 -22.394 1.00 0.00 H new ATOM 0 HG21 VAL A 108 12.207 2.939 -21.922 1.00 0.00 H new ATOM 0 HG22 VAL A 108 10.473 2.874 -22.319 1.00 0.00 H new ATOM 0 HG23 VAL A 108 11.649 1.989 -23.320 1.00 0.00 H new ATOM 495 N TYR A 109 11.574 2.629 -26.487 1.00 0.00 N ATOM 496 CA TYR A 109 11.777 1.382 -27.215 1.00 0.00 C ATOM 497 C TYR A 109 13.131 1.387 -27.915 1.00 0.00 C ATOM 498 O TYR A 109 13.720 2.445 -28.137 1.00 0.00 O ATOM 499 CB TYR A 109 10.661 1.179 -28.235 1.00 0.00 C ATOM 500 CG TYR A 109 10.650 2.339 -29.199 1.00 0.00 C ATOM 501 CD1 TYR A 109 9.878 3.473 -28.917 1.00 0.00 C ATOM 502 CD2 TYR A 109 11.407 2.282 -30.375 1.00 0.00 C ATOM 503 CE1 TYR A 109 9.866 4.551 -29.811 1.00 0.00 C ATOM 504 CE2 TYR A 109 11.394 3.359 -31.269 1.00 0.00 C ATOM 505 CZ TYR A 109 10.623 4.493 -30.988 1.00 0.00 C ATOM 506 OH TYR A 109 10.610 5.554 -31.869 1.00 0.00 O ATOM 0 H TYR A 109 12.130 3.414 -26.826 1.00 0.00 H new ATOM 0 HA TYR A 109 11.757 0.558 -26.501 1.00 0.00 H new ATOM 0 HB2 TYR A 109 10.812 0.244 -28.775 1.00 0.00 H new ATOM 0 HB3 TYR A 109 9.699 1.103 -27.728 1.00 0.00 H new ATOM 0 HD1 TYR A 109 9.292 3.516 -28.011 1.00 0.00 H new ATOM 0 HD2 TYR A 109 12.001 1.407 -30.593 1.00 0.00 H new ATOM 0 HE1 TYR A 109 9.273 5.427 -29.593 1.00 0.00 H new ATOM 0 HE2 TYR A 109 11.979 3.315 -32.176 1.00 0.00 H new ATOM 0 HH TYR A 109 10.037 6.266 -31.515 1.00 0.00 H new ATOM 516 N PHE A 110 13.615 0.200 -28.270 1.00 0.00 N ATOM 517 CA PHE A 110 14.902 0.083 -28.946 1.00 0.00 C ATOM 518 C PHE A 110 14.718 -0.406 -30.375 1.00 0.00 C ATOM 519 O PHE A 110 13.888 -1.275 -30.643 1.00 0.00 O ATOM 520 CB PHE A 110 15.799 -0.896 -28.181 1.00 0.00 C ATOM 521 CG PHE A 110 15.044 -2.179 -27.925 1.00 0.00 C ATOM 522 CD1 PHE A 110 15.089 -3.217 -28.863 1.00 0.00 C ATOM 523 CD2 PHE A 110 14.298 -2.329 -26.750 1.00 0.00 C ATOM 524 CE1 PHE A 110 14.388 -4.406 -28.625 1.00 0.00 C ATOM 525 CE2 PHE A 110 13.597 -3.517 -26.512 1.00 0.00 C ATOM 526 CZ PHE A 110 13.642 -4.556 -27.450 1.00 0.00 C ATOM 0 H PHE A 110 13.140 -0.687 -28.102 1.00 0.00 H new ATOM 0 HA PHE A 110 15.370 1.067 -28.972 1.00 0.00 H new ATOM 0 HB2 PHE A 110 16.702 -1.102 -28.755 1.00 0.00 H new ATOM 0 HB3 PHE A 110 16.115 -0.453 -27.236 1.00 0.00 H new ATOM 0 HD1 PHE A 110 15.664 -3.101 -29.770 1.00 0.00 H new ATOM 0 HD2 PHE A 110 14.263 -1.528 -26.027 1.00 0.00 H new ATOM 0 HE1 PHE A 110 14.423 -5.207 -29.348 1.00 0.00 H new ATOM 0 HE2 PHE A 110 13.022 -3.632 -25.605 1.00 0.00 H new ATOM 0 HZ PHE A 110 13.101 -5.473 -27.267 1.00 0.00 H new ATOM 536 N ILE A 111 15.499 0.158 -31.293 1.00 0.00 N ATOM 537 CA ILE A 111 15.408 -0.227 -32.697 1.00 0.00 C ATOM 538 C ILE A 111 16.668 -0.977 -33.121 1.00 0.00 C ATOM 539 O ILE A 111 17.773 -0.435 -33.073 1.00 0.00 O ATOM 540 CB ILE A 111 15.236 1.017 -33.569 1.00 0.00 C ATOM 541 CG1 ILE A 111 14.078 1.858 -33.029 1.00 0.00 C ATOM 542 CG2 ILE A 111 14.921 0.591 -35.005 1.00 0.00 C ATOM 543 CD1 ILE A 111 13.969 3.154 -33.834 1.00 0.00 C ATOM 0 H ILE A 111 16.195 0.876 -31.092 1.00 0.00 H new ATOM 0 HA ILE A 111 14.545 -0.880 -32.824 1.00 0.00 H new ATOM 0 HB ILE A 111 16.155 1.603 -33.553 1.00 0.00 H new ATOM 0 HG12 ILE A 111 13.146 1.297 -33.095 1.00 0.00 H new ATOM 0 HG13 ILE A 111 14.240 2.085 -31.975 1.00 0.00 H new ATOM 0 HG21 ILE A 111 14.798 1.477 -35.629 1.00 0.00 H new ATOM 0 HG22 ILE A 111 15.740 -0.015 -35.393 1.00 0.00 H new ATOM 0 HG23 ILE A 111 14.000 0.008 -35.018 1.00 0.00 H new ATOM 0 HD11 ILE A 111 13.144 3.753 -33.449 1.00 0.00 H new ATOM 0 HD12 ILE A 111 14.898 3.717 -33.745 1.00 0.00 H new ATOM 0 HD13 ILE A 111 13.787 2.917 -34.882 1.00 0.00 H new ATOM 555 N SER A 112 16.493 -2.226 -33.539 1.00 0.00 N ATOM 556 CA SER A 112 17.622 -3.044 -33.964 1.00 0.00 C ATOM 557 C SER A 112 18.573 -2.239 -34.839 1.00 0.00 C ATOM 558 O SER A 112 18.242 -1.141 -35.286 1.00 0.00 O ATOM 559 CB SER A 112 17.125 -4.266 -34.736 1.00 0.00 C ATOM 560 OG SER A 112 17.484 -5.449 -34.033 1.00 0.00 O ATOM 0 H SER A 112 15.587 -2.691 -33.592 1.00 0.00 H new ATOM 0 HA SER A 112 18.159 -3.372 -33.074 1.00 0.00 H new ATOM 0 HB2 SER A 112 16.043 -4.217 -34.858 1.00 0.00 H new ATOM 0 HB3 SER A 112 17.558 -4.279 -35.736 1.00 0.00 H new ATOM 0 HG SER A 112 17.418 -6.220 -34.635 1.00 0.00 H new ATOM 566 N PRO A 113 19.739 -2.759 -35.078 1.00 0.00 N ATOM 567 CA PRO A 113 20.775 -2.077 -35.908 1.00 0.00 C ATOM 568 C PRO A 113 20.317 -1.864 -37.350 1.00 0.00 C ATOM 569 O PRO A 113 20.706 -0.895 -38.000 1.00 0.00 O ATOM 570 CB PRO A 113 21.974 -3.033 -35.859 1.00 0.00 C ATOM 571 CG PRO A 113 21.710 -3.948 -34.710 1.00 0.00 C ATOM 572 CD PRO A 113 20.202 -4.064 -34.593 1.00 0.00 C ATOM 0 HA PRO A 113 21.000 -1.079 -35.531 1.00 0.00 H new ATOM 0 HB2 PRO A 113 22.069 -3.591 -36.791 1.00 0.00 H new ATOM 0 HB3 PRO A 113 22.906 -2.486 -35.718 1.00 0.00 H new ATOM 0 HG2 PRO A 113 22.163 -4.925 -34.879 1.00 0.00 H new ATOM 0 HG3 PRO A 113 22.142 -3.552 -33.791 1.00 0.00 H new ATOM 0 HD2 PRO A 113 19.811 -4.882 -35.197 1.00 0.00 H new ATOM 0 HD3 PRO A 113 19.889 -4.248 -33.565 1.00 0.00 H new ATOM 580 N GLN A 114 19.487 -2.780 -37.842 1.00 0.00 N ATOM 581 CA GLN A 114 18.994 -2.696 -39.211 1.00 0.00 C ATOM 582 C GLN A 114 17.848 -1.702 -39.316 1.00 0.00 C ATOM 583 O GLN A 114 17.381 -1.393 -40.413 1.00 0.00 O ATOM 584 CB GLN A 114 18.531 -4.075 -39.684 1.00 0.00 C ATOM 585 CG GLN A 114 17.868 -4.813 -38.521 1.00 0.00 C ATOM 586 CD GLN A 114 17.114 -6.033 -39.039 1.00 0.00 C ATOM 587 OE1 GLN A 114 15.884 -6.060 -39.015 1.00 0.00 O ATOM 588 NE2 GLN A 114 17.781 -7.050 -39.512 1.00 0.00 N ATOM 0 H GLN A 114 19.144 -3.584 -37.316 1.00 0.00 H new ATOM 0 HA GLN A 114 19.808 -2.350 -39.847 1.00 0.00 H new ATOM 0 HB2 GLN A 114 17.829 -3.971 -40.511 1.00 0.00 H new ATOM 0 HB3 GLN A 114 19.380 -4.648 -40.056 1.00 0.00 H new ATOM 0 HG2 GLN A 114 18.623 -5.122 -37.798 1.00 0.00 H new ATOM 0 HG3 GLN A 114 17.182 -4.145 -38.000 1.00 0.00 H new ATOM 0 HE21 GLN A 114 18.801 -7.027 -39.531 1.00 0.00 H new ATOM 0 HE22 GLN A 114 17.283 -7.868 -39.862 1.00 0.00 H new ATOM 597 N GLY A 115 17.399 -1.202 -38.170 1.00 0.00 N ATOM 598 CA GLY A 115 16.309 -0.235 -38.148 1.00 0.00 C ATOM 599 C GLY A 115 14.984 -0.905 -37.806 1.00 0.00 C ATOM 600 O GLY A 115 13.914 -0.348 -38.050 1.00 0.00 O ATOM 0 H GLY A 115 17.769 -1.448 -37.252 1.00 0.00 H new ATOM 0 HA2 GLY A 115 16.525 0.544 -37.417 1.00 0.00 H new ATOM 0 HA3 GLY A 115 16.233 0.253 -39.120 1.00 0.00 H new ATOM 604 N LEU A 116 15.065 -2.105 -37.240 1.00 0.00 N ATOM 605 CA LEU A 116 13.863 -2.843 -36.864 1.00 0.00 C ATOM 606 C LEU A 116 13.385 -2.412 -35.479 1.00 0.00 C ATOM 607 O LEU A 116 14.137 -2.472 -34.507 1.00 0.00 O ATOM 608 CB LEU A 116 14.149 -4.344 -36.865 1.00 0.00 C ATOM 609 CG LEU A 116 13.444 -4.998 -38.053 1.00 0.00 C ATOM 610 CD1 LEU A 116 11.928 -4.862 -37.887 1.00 0.00 C ATOM 611 CD2 LEU A 116 13.880 -4.308 -39.348 1.00 0.00 C ATOM 0 H LEU A 116 15.941 -2.584 -37.033 1.00 0.00 H new ATOM 0 HA LEU A 116 13.081 -2.625 -37.591 1.00 0.00 H new ATOM 0 HB2 LEU A 116 15.223 -4.520 -36.924 1.00 0.00 H new ATOM 0 HB3 LEU A 116 13.804 -4.791 -35.933 1.00 0.00 H new ATOM 0 HG LEU A 116 13.710 -6.054 -38.096 1.00 0.00 H new ATOM 0 HD11 LEU A 116 11.426 -5.329 -38.735 1.00 0.00 H new ATOM 0 HD12 LEU A 116 11.617 -5.354 -36.965 1.00 0.00 H new ATOM 0 HD13 LEU A 116 11.660 -3.806 -37.843 1.00 0.00 H new ATOM 0 HD21 LEU A 116 13.378 -4.774 -40.196 1.00 0.00 H new ATOM 0 HD22 LEU A 116 13.614 -3.252 -39.305 1.00 0.00 H new ATOM 0 HD23 LEU A 116 14.959 -4.406 -39.467 1.00 0.00 H new ATOM 623 N LYS A 117 12.132 -1.979 -35.400 1.00 0.00 N ATOM 624 CA LYS A 117 11.567 -1.534 -34.133 1.00 0.00 C ATOM 625 C LYS A 117 11.037 -2.717 -33.330 1.00 0.00 C ATOM 626 O LYS A 117 10.420 -3.626 -33.882 1.00 0.00 O ATOM 627 CB LYS A 117 10.430 -0.542 -34.388 1.00 0.00 C ATOM 628 CG LYS A 117 10.015 0.113 -33.068 1.00 0.00 C ATOM 629 CD LYS A 117 8.983 1.209 -33.340 1.00 0.00 C ATOM 630 CE LYS A 117 7.588 0.587 -33.439 1.00 0.00 C ATOM 631 NZ LYS A 117 7.207 0.018 -32.116 1.00 0.00 N ATOM 0 H LYS A 117 11.492 -1.927 -36.193 1.00 0.00 H new ATOM 0 HA LYS A 117 12.357 -1.047 -33.560 1.00 0.00 H new ATOM 0 HB2 LYS A 117 10.751 0.220 -35.099 1.00 0.00 H new ATOM 0 HB3 LYS A 117 9.579 -1.056 -34.834 1.00 0.00 H new ATOM 0 HG2 LYS A 117 9.597 -0.635 -32.395 1.00 0.00 H new ATOM 0 HG3 LYS A 117 10.888 0.537 -32.571 1.00 0.00 H new ATOM 0 HD2 LYS A 117 9.006 1.950 -32.541 1.00 0.00 H new ATOM 0 HD3 LYS A 117 9.226 1.730 -34.266 1.00 0.00 H new ATOM 0 HE2 LYS A 117 6.863 1.340 -33.746 1.00 0.00 H new ATOM 0 HE3 LYS A 117 7.579 -0.194 -34.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 6.176 0.078 -31.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 7.504 -0.978 -32.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 7.675 0.556 -31.359 1.00 0.00 H new ATOM 645 N PHE A 118 11.288 -2.699 -32.027 1.00 0.00 N ATOM 646 CA PHE A 118 10.825 -3.769 -31.152 1.00 0.00 C ATOM 647 C PHE A 118 10.410 -3.217 -29.793 1.00 0.00 C ATOM 648 O PHE A 118 10.996 -2.250 -29.304 1.00 0.00 O ATOM 649 CB PHE A 118 11.925 -4.815 -30.969 1.00 0.00 C ATOM 650 CG PHE A 118 11.983 -5.708 -32.185 1.00 0.00 C ATOM 651 CD1 PHE A 118 10.871 -6.487 -32.533 1.00 0.00 C ATOM 652 CD2 PHE A 118 13.144 -5.760 -32.963 1.00 0.00 C ATOM 653 CE1 PHE A 118 10.922 -7.316 -33.658 1.00 0.00 C ATOM 654 CE2 PHE A 118 13.195 -6.591 -34.089 1.00 0.00 C ATOM 655 CZ PHE A 118 12.084 -7.369 -34.436 1.00 0.00 C ATOM 0 H PHE A 118 11.807 -1.959 -31.554 1.00 0.00 H new ATOM 0 HA PHE A 118 9.958 -4.236 -31.618 1.00 0.00 H new ATOM 0 HB2 PHE A 118 12.887 -4.324 -30.820 1.00 0.00 H new ATOM 0 HB3 PHE A 118 11.730 -5.410 -30.077 1.00 0.00 H new ATOM 0 HD1 PHE A 118 9.974 -6.447 -31.932 1.00 0.00 H new ATOM 0 HD2 PHE A 118 14.001 -5.160 -32.696 1.00 0.00 H new ATOM 0 HE1 PHE A 118 10.065 -7.915 -33.926 1.00 0.00 H new ATOM 0 HE2 PHE A 118 14.092 -6.632 -34.690 1.00 0.00 H new ATOM 0 HZ PHE A 118 12.124 -8.010 -35.304 1.00 0.00 H new ATOM 665 N ARG A 119 9.403 -3.833 -29.188 1.00 0.00 N ATOM 666 CA ARG A 119 8.924 -3.393 -27.882 1.00 0.00 C ATOM 667 C ARG A 119 8.449 -4.585 -27.056 1.00 0.00 C ATOM 668 O ARG A 119 7.815 -4.415 -26.014 1.00 0.00 O ATOM 669 CB ARG A 119 7.770 -2.404 -28.056 1.00 0.00 C ATOM 670 CG ARG A 119 7.030 -2.703 -29.362 1.00 0.00 C ATOM 671 CD ARG A 119 5.577 -2.240 -29.246 1.00 0.00 C ATOM 672 NE ARG A 119 4.698 -3.386 -29.045 1.00 0.00 N ATOM 673 CZ ARG A 119 3.558 -3.269 -28.370 1.00 0.00 C ATOM 674 NH1 ARG A 119 3.208 -2.113 -27.879 1.00 0.00 N ATOM 675 NH2 ARG A 119 2.787 -4.308 -28.208 1.00 0.00 N ATOM 0 H ARG A 119 8.904 -4.633 -29.576 1.00 0.00 H new ATOM 0 HA ARG A 119 9.747 -2.906 -27.360 1.00 0.00 H new ATOM 0 HB2 ARG A 119 7.084 -2.478 -27.212 1.00 0.00 H new ATOM 0 HB3 ARG A 119 8.151 -1.383 -28.068 1.00 0.00 H new ATOM 0 HG2 ARG A 119 7.519 -2.195 -30.193 1.00 0.00 H new ATOM 0 HG3 ARG A 119 7.066 -3.771 -29.576 1.00 0.00 H new ATOM 0 HD2 ARG A 119 5.475 -1.544 -28.414 1.00 0.00 H new ATOM 0 HD3 ARG A 119 5.286 -1.703 -30.149 1.00 0.00 H new ATOM 0 HE ARG A 119 4.962 -4.293 -29.429 1.00 0.00 H new ATOM 0 HH11 ARG A 119 3.808 -1.299 -28.013 1.00 0.00 H new ATOM 0 HH12 ARG A 119 2.334 -2.022 -27.361 1.00 0.00 H new ATOM 0 HH21 ARG A 119 3.058 -5.210 -28.599 1.00 0.00 H new ATOM 0 HH22 ARG A 119 1.913 -4.219 -27.690 1.00 0.00 H new ATOM 689 N SER A 120 8.763 -5.788 -27.526 1.00 0.00 N ATOM 690 CA SER A 120 8.362 -7.000 -26.823 1.00 0.00 C ATOM 691 C SER A 120 9.549 -7.941 -26.648 1.00 0.00 C ATOM 692 O SER A 120 10.378 -8.083 -27.546 1.00 0.00 O ATOM 693 CB SER A 120 7.257 -7.711 -27.605 1.00 0.00 C ATOM 694 OG SER A 120 6.129 -6.852 -27.713 1.00 0.00 O ATOM 0 H SER A 120 9.290 -5.949 -28.384 1.00 0.00 H new ATOM 0 HA SER A 120 7.991 -6.719 -25.837 1.00 0.00 H new ATOM 0 HB2 SER A 120 7.616 -7.984 -28.597 1.00 0.00 H new ATOM 0 HB3 SER A 120 6.977 -8.636 -27.101 1.00 0.00 H new ATOM 0 HG SER A 120 5.420 -7.305 -28.215 1.00 0.00 H new ATOM 700 N LYS A 121 9.623 -8.583 -25.485 1.00 0.00 N ATOM 701 CA LYS A 121 10.711 -9.512 -25.208 1.00 0.00 C ATOM 702 C LYS A 121 10.661 -10.698 -26.167 1.00 0.00 C ATOM 703 O LYS A 121 11.694 -11.151 -26.661 1.00 0.00 O ATOM 704 CB LYS A 121 10.610 -10.014 -23.767 1.00 0.00 C ATOM 705 CG LYS A 121 10.998 -8.889 -22.804 1.00 0.00 C ATOM 706 CD LYS A 121 9.846 -8.630 -21.831 1.00 0.00 C ATOM 707 CE LYS A 121 9.602 -9.878 -20.983 1.00 0.00 C ATOM 708 NZ LYS A 121 8.190 -10.326 -21.153 1.00 0.00 N ATOM 0 H LYS A 121 8.949 -8.478 -24.727 1.00 0.00 H new ATOM 0 HA LYS A 121 11.657 -8.988 -25.346 1.00 0.00 H new ATOM 0 HB2 LYS A 121 9.594 -10.351 -23.559 1.00 0.00 H new ATOM 0 HB3 LYS A 121 11.266 -10.872 -23.623 1.00 0.00 H new ATOM 0 HG2 LYS A 121 11.899 -9.161 -22.254 1.00 0.00 H new ATOM 0 HG3 LYS A 121 11.228 -7.981 -23.362 1.00 0.00 H new ATOM 0 HD2 LYS A 121 10.083 -7.782 -21.189 1.00 0.00 H new ATOM 0 HD3 LYS A 121 8.942 -8.370 -22.382 1.00 0.00 H new ATOM 0 HE2 LYS A 121 10.285 -10.673 -21.282 1.00 0.00 H new ATOM 0 HE3 LYS A 121 9.803 -9.663 -19.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 8.084 -11.290 -20.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 7.557 -9.682 -20.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 7.943 -10.319 -22.163 1.00 0.00 H new ATOM 722 N SER A 122 9.453 -11.196 -26.422 1.00 0.00 N ATOM 723 CA SER A 122 9.288 -12.337 -27.320 1.00 0.00 C ATOM 724 C SER A 122 9.766 -11.987 -28.724 1.00 0.00 C ATOM 725 O SER A 122 10.593 -12.695 -29.300 1.00 0.00 O ATOM 726 CB SER A 122 7.814 -12.740 -27.372 1.00 0.00 C ATOM 727 OG SER A 122 7.404 -13.190 -26.086 1.00 0.00 O ATOM 0 H SER A 122 8.585 -10.834 -26.026 1.00 0.00 H new ATOM 0 HA SER A 122 9.885 -13.167 -26.941 1.00 0.00 H new ATOM 0 HB2 SER A 122 7.204 -11.892 -27.685 1.00 0.00 H new ATOM 0 HB3 SER A 122 7.666 -13.528 -28.110 1.00 0.00 H new ATOM 0 HG SER A 122 6.459 -13.448 -26.115 1.00 0.00 H new ATOM 733 N SER A 123 9.261 -10.881 -29.261 1.00 0.00 N ATOM 734 CA SER A 123 9.655 -10.446 -30.597 1.00 0.00 C ATOM 735 C SER A 123 11.176 -10.368 -30.696 1.00 0.00 C ATOM 736 O SER A 123 11.757 -10.730 -31.720 1.00 0.00 O ATOM 737 CB SER A 123 9.058 -9.067 -30.888 1.00 0.00 C ATOM 738 OG SER A 123 9.548 -8.129 -29.937 1.00 0.00 O ATOM 0 H SER A 123 8.585 -10.274 -28.797 1.00 0.00 H new ATOM 0 HA SER A 123 9.284 -11.167 -31.325 1.00 0.00 H new ATOM 0 HB2 SER A 123 9.322 -8.750 -31.897 1.00 0.00 H new ATOM 0 HB3 SER A 123 7.970 -9.113 -30.843 1.00 0.00 H new ATOM 0 HG SER A 123 9.664 -8.572 -29.071 1.00 0.00 H new ATOM 744 N LEU A 124 11.815 -9.903 -29.629 1.00 0.00 N ATOM 745 CA LEU A 124 13.268 -9.797 -29.607 1.00 0.00 C ATOM 746 C LEU A 124 13.909 -11.179 -29.708 1.00 0.00 C ATOM 747 O LEU A 124 14.869 -11.376 -30.450 1.00 0.00 O ATOM 748 CB LEU A 124 13.724 -9.112 -28.317 1.00 0.00 C ATOM 749 CG LEU A 124 15.250 -9.006 -28.304 1.00 0.00 C ATOM 750 CD1 LEU A 124 15.715 -8.169 -29.499 1.00 0.00 C ATOM 751 CD2 LEU A 124 15.702 -8.332 -27.007 1.00 0.00 C ATOM 0 H LEU A 124 11.353 -9.595 -28.773 1.00 0.00 H new ATOM 0 HA LEU A 124 13.582 -9.201 -30.464 1.00 0.00 H new ATOM 0 HB2 LEU A 124 13.280 -8.119 -28.244 1.00 0.00 H new ATOM 0 HB3 LEU A 124 13.381 -9.679 -27.451 1.00 0.00 H new ATOM 0 HG LEU A 124 15.683 -10.004 -28.368 1.00 0.00 H new ATOM 0 HD11 LEU A 124 16.802 -8.094 -29.489 1.00 0.00 H new ATOM 0 HD12 LEU A 124 15.392 -8.646 -30.425 1.00 0.00 H new ATOM 0 HD13 LEU A 124 15.282 -7.171 -29.435 1.00 0.00 H new ATOM 0 HD21 LEU A 124 16.789 -8.256 -26.996 1.00 0.00 H new ATOM 0 HD22 LEU A 124 15.268 -7.334 -26.945 1.00 0.00 H new ATOM 0 HD23 LEU A 124 15.371 -8.925 -26.154 1.00 0.00 H new ATOM 763 N ALA A 125 13.373 -12.130 -28.953 1.00 0.00 N ATOM 764 CA ALA A 125 13.901 -13.489 -28.960 1.00 0.00 C ATOM 765 C ALA A 125 13.747 -14.113 -30.342 1.00 0.00 C ATOM 766 O ALA A 125 14.516 -14.996 -30.724 1.00 0.00 O ATOM 767 CB ALA A 125 13.167 -14.341 -27.924 1.00 0.00 C ATOM 0 H ALA A 125 12.577 -11.987 -28.331 1.00 0.00 H new ATOM 0 HA ALA A 125 14.961 -13.450 -28.708 1.00 0.00 H new ATOM 0 HB1 ALA A 125 13.568 -15.354 -27.936 1.00 0.00 H new ATOM 0 HB2 ALA A 125 13.305 -13.908 -26.933 1.00 0.00 H new ATOM 0 HB3 ALA A 125 12.104 -14.369 -28.163 1.00 0.00 H new ATOM 773 N ASN A 126 12.743 -13.655 -31.085 1.00 0.00 N ATOM 774 CA ASN A 126 12.495 -14.181 -32.422 1.00 0.00 C ATOM 775 C ASN A 126 13.429 -13.534 -33.439 1.00 0.00 C ATOM 776 O ASN A 126 13.961 -14.204 -34.321 1.00 0.00 O ATOM 777 CB ASN A 126 11.042 -13.918 -32.823 1.00 0.00 C ATOM 778 CG ASN A 126 10.097 -14.571 -31.819 1.00 0.00 C ATOM 779 OD1 ASN A 126 9.281 -13.889 -31.201 1.00 0.00 O ATOM 780 ND2 ASN A 126 10.161 -15.859 -31.619 1.00 0.00 N ATOM 0 H ASN A 126 12.094 -12.927 -30.787 1.00 0.00 H new ATOM 0 HA ASN A 126 12.682 -15.255 -32.409 1.00 0.00 H new ATOM 0 HB2 ASN A 126 10.856 -12.845 -32.865 1.00 0.00 H new ATOM 0 HB3 ASN A 126 10.854 -14.313 -33.821 1.00 0.00 H new ATOM 0 HD21 ASN A 126 9.533 -16.303 -30.949 1.00 0.00 H new ATOM 0 HD22 ASN A 126 10.839 -16.422 -32.133 1.00 0.00 H new ATOM 787 N TYR A 127 13.626 -12.226 -33.305 1.00 0.00 N ATOM 788 CA TYR A 127 14.509 -11.497 -34.206 1.00 0.00 C ATOM 789 C TYR A 127 15.938 -12.011 -34.090 1.00 0.00 C ATOM 790 O TYR A 127 16.605 -12.261 -35.093 1.00 0.00 O ATOM 791 CB TYR A 127 14.467 -10.003 -33.888 1.00 0.00 C ATOM 792 CG TYR A 127 15.693 -9.333 -34.462 1.00 0.00 C ATOM 793 CD1 TYR A 127 15.825 -9.175 -35.845 1.00 0.00 C ATOM 794 CD2 TYR A 127 16.699 -8.868 -33.604 1.00 0.00 C ATOM 795 CE1 TYR A 127 16.964 -8.554 -36.374 1.00 0.00 C ATOM 796 CE2 TYR A 127 17.836 -8.246 -34.132 1.00 0.00 C ATOM 797 CZ TYR A 127 17.968 -8.089 -35.517 1.00 0.00 C ATOM 798 OH TYR A 127 19.090 -7.477 -36.038 1.00 0.00 O ATOM 0 H TYR A 127 13.188 -11.652 -32.584 1.00 0.00 H new ATOM 0 HA TYR A 127 14.164 -11.655 -35.228 1.00 0.00 H new ATOM 0 HB2 TYR A 127 13.565 -9.556 -34.307 1.00 0.00 H new ATOM 0 HB3 TYR A 127 14.427 -9.851 -32.809 1.00 0.00 H new ATOM 0 HD1 TYR A 127 15.049 -9.532 -36.506 1.00 0.00 H new ATOM 0 HD2 TYR A 127 16.597 -8.990 -32.536 1.00 0.00 H new ATOM 0 HE1 TYR A 127 17.067 -8.434 -37.442 1.00 0.00 H new ATOM 0 HE2 TYR A 127 18.611 -7.887 -33.471 1.00 0.00 H new ATOM 0 HH TYR A 127 19.688 -7.213 -35.308 1.00 0.00 H new ATOM 808 N LEU A 128 16.408 -12.156 -32.854 1.00 0.00 N ATOM 809 CA LEU A 128 17.768 -12.630 -32.620 1.00 0.00 C ATOM 810 C LEU A 128 17.945 -14.042 -33.173 1.00 0.00 C ATOM 811 O LEU A 128 18.923 -14.327 -33.863 1.00 0.00 O ATOM 812 CB LEU A 128 18.059 -12.636 -31.115 1.00 0.00 C ATOM 813 CG LEU A 128 18.013 -11.203 -30.582 1.00 0.00 C ATOM 814 CD1 LEU A 128 18.151 -11.220 -29.058 1.00 0.00 C ATOM 815 CD2 LEU A 128 19.158 -10.392 -31.188 1.00 0.00 C ATOM 0 H LEU A 128 15.874 -11.955 -32.008 1.00 0.00 H new ATOM 0 HA LEU A 128 18.462 -11.961 -33.129 1.00 0.00 H new ATOM 0 HB2 LEU A 128 17.326 -13.253 -30.594 1.00 0.00 H new ATOM 0 HB3 LEU A 128 19.038 -13.075 -30.925 1.00 0.00 H new ATOM 0 HG LEU A 128 17.062 -10.747 -30.856 1.00 0.00 H new ATOM 0 HD11 LEU A 128 18.118 -10.199 -28.678 1.00 0.00 H new ATOM 0 HD12 LEU A 128 17.332 -11.795 -28.625 1.00 0.00 H new ATOM 0 HD13 LEU A 128 19.101 -11.679 -28.784 1.00 0.00 H new ATOM 0 HD21 LEU A 128 19.123 -9.372 -30.807 1.00 0.00 H new ATOM 0 HD22 LEU A 128 20.110 -10.848 -30.917 1.00 0.00 H new ATOM 0 HD23 LEU A 128 19.059 -10.377 -32.273 1.00 0.00 H new ATOM 827 N HIS A 129 16.991 -14.915 -32.876 1.00 0.00 N ATOM 828 CA HIS A 129 17.049 -16.289 -33.356 1.00 0.00 C ATOM 829 C HIS A 129 16.917 -16.334 -34.875 1.00 0.00 C ATOM 830 O HIS A 129 17.444 -17.234 -35.528 1.00 0.00 O ATOM 831 CB HIS A 129 15.928 -17.116 -32.721 1.00 0.00 C ATOM 832 CG HIS A 129 15.990 -18.528 -33.234 1.00 0.00 C ATOM 833 ND1 HIS A 129 16.968 -19.421 -32.827 1.00 0.00 N ATOM 834 CD2 HIS A 129 15.202 -19.215 -34.126 1.00 0.00 C ATOM 835 CE1 HIS A 129 16.746 -20.585 -33.465 1.00 0.00 C ATOM 836 NE2 HIS A 129 15.682 -20.513 -34.269 1.00 0.00 N ATOM 0 H HIS A 129 16.172 -14.698 -32.308 1.00 0.00 H new ATOM 0 HA HIS A 129 18.014 -16.709 -33.073 1.00 0.00 H new ATOM 0 HB2 HIS A 129 16.027 -17.108 -31.636 1.00 0.00 H new ATOM 0 HB3 HIS A 129 14.959 -16.675 -32.956 1.00 0.00 H new ATOM 0 HD2 HIS A 129 14.342 -18.809 -34.638 1.00 0.00 H new ATOM 0 HE1 HIS A 129 17.354 -21.469 -33.342 1.00 0.00 H new ATOM 0 HE2 HIS A 129 15.302 -21.252 -34.861 1.00 0.00 H new ATOM 845 N LYS A 130 16.205 -15.359 -35.429 1.00 0.00 N ATOM 846 CA LYS A 130 15.992 -15.305 -36.870 1.00 0.00 C ATOM 847 C LYS A 130 17.318 -15.166 -37.607 1.00 0.00 C ATOM 848 O LYS A 130 17.544 -15.819 -38.627 1.00 0.00 O ATOM 849 CB LYS A 130 15.081 -14.127 -37.220 1.00 0.00 C ATOM 850 CG LYS A 130 14.832 -14.105 -38.729 1.00 0.00 C ATOM 851 CD LYS A 130 13.710 -13.115 -39.049 1.00 0.00 C ATOM 852 CE LYS A 130 14.202 -11.687 -38.807 1.00 0.00 C ATOM 853 NZ LYS A 130 13.208 -10.720 -39.354 1.00 0.00 N ATOM 0 H LYS A 130 15.768 -14.600 -34.906 1.00 0.00 H new ATOM 0 HA LYS A 130 15.517 -16.235 -37.181 1.00 0.00 H new ATOM 0 HB2 LYS A 130 14.135 -14.214 -36.686 1.00 0.00 H new ATOM 0 HB3 LYS A 130 15.541 -13.191 -36.903 1.00 0.00 H new ATOM 0 HG2 LYS A 130 15.743 -13.820 -39.254 1.00 0.00 H new ATOM 0 HG3 LYS A 130 14.562 -15.102 -39.078 1.00 0.00 H new ATOM 0 HD2 LYS A 130 13.394 -13.231 -40.086 1.00 0.00 H new ATOM 0 HD3 LYS A 130 12.840 -13.321 -38.425 1.00 0.00 H new ATOM 0 HE2 LYS A 130 14.343 -11.515 -37.740 1.00 0.00 H new ATOM 0 HE3 LYS A 130 15.171 -11.539 -39.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 13.542 -9.749 -39.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 13.095 -10.879 -40.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 12.293 -10.857 -38.879 1.00 0.00 H new ATOM 867 N ASN A 131 18.190 -14.309 -37.088 1.00 0.00 N ATOM 868 CA ASN A 131 19.488 -14.086 -37.712 1.00 0.00 C ATOM 869 C ASN A 131 20.461 -15.200 -37.340 1.00 0.00 C ATOM 870 O ASN A 131 21.565 -15.278 -37.879 1.00 0.00 O ATOM 871 CB ASN A 131 20.059 -12.739 -37.260 1.00 0.00 C ATOM 872 CG ASN A 131 19.178 -11.602 -37.767 1.00 0.00 C ATOM 873 OD1 ASN A 131 18.248 -11.853 -38.647 1.00 0.00 O flip ATOM 874 ND2 ASN A 131 19.339 -10.456 -37.348 1.00 0.00 N flip ATOM 0 H ASN A 131 18.024 -13.761 -36.244 1.00 0.00 H new ATOM 0 HA ASN A 131 19.354 -14.082 -38.794 1.00 0.00 H new ATOM 0 HB2 ASN A 131 20.118 -12.707 -36.172 1.00 0.00 H new ATOM 0 HB3 ASN A 131 21.074 -12.620 -37.638 1.00 0.00 H new ATOM 0 HD21 ASN A 131 20.067 -10.262 -36.660 1.00 0.00 H new ATOM 0 HD22 ASN A 131 18.745 -9.700 -37.689 1.00 0.00 H new ATOM 881 N GLY A 132 20.042 -16.061 -36.421 1.00 0.00 N ATOM 882 CA GLY A 132 20.884 -17.169 -35.983 1.00 0.00 C ATOM 883 C GLY A 132 21.678 -16.788 -34.737 1.00 0.00 C ATOM 884 O GLY A 132 22.265 -17.646 -34.078 1.00 0.00 O ATOM 0 H GLY A 132 19.130 -16.015 -35.966 1.00 0.00 H new ATOM 0 HA2 GLY A 132 20.265 -18.041 -35.772 1.00 0.00 H new ATOM 0 HA3 GLY A 132 21.568 -17.450 -36.784 1.00 0.00 H new ATOM 888 N GLU A 133 21.686 -15.498 -34.417 1.00 0.00 N ATOM 889 CA GLU A 133 22.402 -15.016 -33.239 1.00 0.00 C ATOM 890 C GLU A 133 21.518 -15.121 -32.000 1.00 0.00 C ATOM 891 O GLU A 133 20.410 -14.589 -31.971 1.00 0.00 O ATOM 892 CB GLU A 133 22.828 -13.563 -33.445 1.00 0.00 C ATOM 893 CG GLU A 133 23.607 -13.082 -32.220 1.00 0.00 C ATOM 894 CD GLU A 133 24.151 -11.679 -32.466 1.00 0.00 C ATOM 895 OE1 GLU A 133 23.827 -11.112 -33.496 1.00 0.00 O ATOM 896 OE2 GLU A 133 24.891 -11.196 -31.624 1.00 0.00 O ATOM 0 H GLU A 133 21.209 -14.772 -34.951 1.00 0.00 H new ATOM 0 HA GLU A 133 23.288 -15.634 -33.094 1.00 0.00 H new ATOM 0 HB2 GLU A 133 23.446 -13.477 -34.339 1.00 0.00 H new ATOM 0 HB3 GLU A 133 21.951 -12.934 -33.602 1.00 0.00 H new ATOM 0 HG2 GLU A 133 22.959 -13.081 -31.344 1.00 0.00 H new ATOM 0 HG3 GLU A 133 24.428 -13.767 -32.009 1.00 0.00 H new ATOM 903 N THR A 134 22.017 -15.814 -30.980 1.00 0.00 N ATOM 904 CA THR A 134 21.260 -15.991 -29.746 1.00 0.00 C ATOM 905 C THR A 134 22.052 -15.471 -28.551 1.00 0.00 C ATOM 906 O THR A 134 21.644 -15.646 -27.402 1.00 0.00 O ATOM 907 CB THR A 134 20.934 -17.472 -29.542 1.00 0.00 C ATOM 908 OG1 THR A 134 22.137 -18.192 -29.313 1.00 0.00 O ATOM 909 CG2 THR A 134 20.242 -18.021 -30.793 1.00 0.00 C ATOM 0 H THR A 134 22.935 -16.259 -30.983 1.00 0.00 H new ATOM 0 HA THR A 134 20.333 -15.423 -29.826 1.00 0.00 H new ATOM 0 HB THR A 134 20.272 -17.584 -28.683 1.00 0.00 H new ATOM 0 HG1 THR A 134 21.930 -19.141 -29.180 1.00 0.00 H new ATOM 0 HG21 THR A 134 20.010 -19.076 -30.647 1.00 0.00 H new ATOM 0 HG22 THR A 134 19.320 -17.468 -30.971 1.00 0.00 H new ATOM 0 HG23 THR A 134 20.903 -17.910 -31.653 1.00 0.00 H new ATOM 917 N SER A 135 23.186 -14.836 -28.829 1.00 0.00 N ATOM 918 CA SER A 135 24.028 -14.297 -27.765 1.00 0.00 C ATOM 919 C SER A 135 23.258 -13.254 -26.954 1.00 0.00 C ATOM 920 O SER A 135 23.281 -13.275 -25.725 1.00 0.00 O ATOM 921 CB SER A 135 25.279 -13.657 -28.366 1.00 0.00 C ATOM 922 OG SER A 135 26.073 -14.664 -28.977 1.00 0.00 O ATOM 0 H SER A 135 23.541 -14.682 -29.773 1.00 0.00 H new ATOM 0 HA SER A 135 24.320 -15.114 -27.105 1.00 0.00 H new ATOM 0 HB2 SER A 135 24.998 -12.903 -29.101 1.00 0.00 H new ATOM 0 HB3 SER A 135 25.850 -13.148 -27.590 1.00 0.00 H new ATOM 0 HG SER A 135 26.876 -14.257 -29.365 1.00 0.00 H new ATOM 928 N LEU A 136 22.575 -12.351 -27.654 1.00 0.00 N ATOM 929 CA LEU A 136 21.794 -11.315 -26.989 1.00 0.00 C ATOM 930 C LEU A 136 20.626 -11.940 -26.232 1.00 0.00 C ATOM 931 O LEU A 136 20.071 -12.954 -26.656 1.00 0.00 O ATOM 932 CB LEU A 136 21.267 -10.317 -28.017 1.00 0.00 C ATOM 933 CG LEU A 136 22.243 -9.146 -28.138 1.00 0.00 C ATOM 934 CD1 LEU A 136 22.229 -8.331 -26.843 1.00 0.00 C ATOM 935 CD2 LEU A 136 23.656 -9.683 -28.386 1.00 0.00 C ATOM 0 H LEU A 136 22.547 -12.317 -28.673 1.00 0.00 H new ATOM 0 HA LEU A 136 22.437 -10.793 -26.280 1.00 0.00 H new ATOM 0 HB2 LEU A 136 21.146 -10.805 -28.984 1.00 0.00 H new ATOM 0 HB3 LEU A 136 20.284 -9.955 -27.717 1.00 0.00 H new ATOM 0 HG LEU A 136 21.943 -8.510 -28.971 1.00 0.00 H new ATOM 0 HD11 LEU A 136 22.925 -7.497 -26.931 1.00 0.00 H new ATOM 0 HD12 LEU A 136 21.224 -7.948 -26.665 1.00 0.00 H new ATOM 0 HD13 LEU A 136 22.528 -8.967 -26.010 1.00 0.00 H new ATOM 0 HD21 LEU A 136 24.352 -8.849 -28.472 1.00 0.00 H new ATOM 0 HD22 LEU A 136 23.954 -10.320 -27.553 1.00 0.00 H new ATOM 0 HD23 LEU A 136 23.668 -10.263 -29.309 1.00 0.00 H new ATOM 947 N LYS A 137 20.259 -11.327 -25.110 1.00 0.00 N ATOM 948 CA LYS A 137 19.166 -11.839 -24.298 1.00 0.00 C ATOM 949 C LYS A 137 18.130 -10.753 -24.039 1.00 0.00 C ATOM 950 O LYS A 137 18.460 -9.569 -23.976 1.00 0.00 O ATOM 951 CB LYS A 137 19.712 -12.355 -22.959 1.00 0.00 C ATOM 952 CG LYS A 137 20.699 -13.497 -23.216 1.00 0.00 C ATOM 953 CD LYS A 137 21.246 -14.011 -21.883 1.00 0.00 C ATOM 954 CE LYS A 137 22.223 -15.159 -22.139 1.00 0.00 C ATOM 955 NZ LYS A 137 22.764 -15.651 -20.840 1.00 0.00 N ATOM 0 H LYS A 137 20.700 -10.482 -24.747 1.00 0.00 H new ATOM 0 HA LYS A 137 18.688 -12.655 -24.840 1.00 0.00 H new ATOM 0 HB2 LYS A 137 20.207 -11.547 -22.420 1.00 0.00 H new ATOM 0 HB3 LYS A 137 18.893 -12.703 -22.330 1.00 0.00 H new ATOM 0 HG2 LYS A 137 20.204 -14.306 -23.754 1.00 0.00 H new ATOM 0 HG3 LYS A 137 21.517 -13.149 -23.847 1.00 0.00 H new ATOM 0 HD2 LYS A 137 21.749 -13.204 -21.349 1.00 0.00 H new ATOM 0 HD3 LYS A 137 20.427 -14.351 -21.249 1.00 0.00 H new ATOM 0 HE2 LYS A 137 21.719 -15.969 -22.665 1.00 0.00 H new ATOM 0 HE3 LYS A 137 23.038 -14.821 -22.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 23.429 -16.432 -21.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 23.260 -14.876 -20.355 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 21.982 -15.989 -20.244 1.00 0.00 H new ATOM 969 N PRO A 138 16.895 -11.137 -23.873 1.00 0.00 N ATOM 970 CA PRO A 138 15.786 -10.189 -23.572 1.00 0.00 C ATOM 971 C PRO A 138 16.100 -9.307 -22.365 1.00 0.00 C ATOM 972 O PRO A 138 15.445 -8.295 -22.141 1.00 0.00 O ATOM 973 CB PRO A 138 14.593 -11.104 -23.282 1.00 0.00 C ATOM 974 CG PRO A 138 14.903 -12.392 -23.964 1.00 0.00 C ATOM 975 CD PRO A 138 16.416 -12.525 -23.971 1.00 0.00 C ATOM 0 HA PRO A 138 15.605 -9.495 -24.393 1.00 0.00 H new ATOM 0 HB2 PRO A 138 14.462 -11.250 -22.210 1.00 0.00 H new ATOM 0 HB3 PRO A 138 13.666 -10.673 -23.661 1.00 0.00 H new ATOM 0 HG2 PRO A 138 14.443 -13.229 -23.439 1.00 0.00 H new ATOM 0 HG3 PRO A 138 14.509 -12.397 -24.980 1.00 0.00 H new ATOM 0 HD2 PRO A 138 16.768 -13.129 -23.134 1.00 0.00 H new ATOM 0 HD3 PRO A 138 16.770 -13.006 -24.883 1.00 0.00 H new ATOM 983 N GLU A 139 17.101 -9.709 -21.588 1.00 0.00 N ATOM 984 CA GLU A 139 17.493 -8.951 -20.407 1.00 0.00 C ATOM 985 C GLU A 139 18.570 -7.928 -20.758 1.00 0.00 C ATOM 986 O GLU A 139 18.947 -7.099 -19.929 1.00 0.00 O ATOM 987 CB GLU A 139 18.021 -9.899 -19.328 1.00 0.00 C ATOM 988 CG GLU A 139 16.867 -10.744 -18.783 1.00 0.00 C ATOM 989 CD GLU A 139 17.408 -11.830 -17.860 1.00 0.00 C ATOM 990 OE1 GLU A 139 18.611 -12.028 -17.852 1.00 0.00 O ATOM 991 OE2 GLU A 139 16.610 -12.450 -17.176 1.00 0.00 O ATOM 0 H GLU A 139 17.652 -10.551 -21.754 1.00 0.00 H new ATOM 0 HA GLU A 139 16.616 -8.424 -20.031 1.00 0.00 H new ATOM 0 HB2 GLU A 139 18.795 -10.545 -19.743 1.00 0.00 H new ATOM 0 HB3 GLU A 139 18.481 -9.329 -18.521 1.00 0.00 H new ATOM 0 HG2 GLU A 139 16.166 -10.110 -18.241 1.00 0.00 H new ATOM 0 HG3 GLU A 139 16.316 -11.197 -19.607 1.00 0.00 H new ATOM 998 N ASP A 140 19.066 -7.997 -21.990 1.00 0.00 N ATOM 999 CA ASP A 140 20.106 -7.077 -22.436 1.00 0.00 C ATOM 1000 C ASP A 140 19.521 -5.700 -22.731 1.00 0.00 C ATOM 1001 O ASP A 140 20.184 -4.680 -22.541 1.00 0.00 O ATOM 1002 CB ASP A 140 20.782 -7.628 -23.694 1.00 0.00 C ATOM 1003 CG ASP A 140 22.036 -6.819 -24.008 1.00 0.00 C ATOM 1004 OD1 ASP A 140 22.973 -6.889 -23.229 1.00 0.00 O ATOM 1005 OD2 ASP A 140 22.041 -6.140 -25.021 1.00 0.00 O ATOM 0 H ASP A 140 18.767 -8.674 -22.692 1.00 0.00 H new ATOM 0 HA ASP A 140 20.842 -6.978 -21.638 1.00 0.00 H new ATOM 0 HB2 ASP A 140 21.043 -8.676 -23.548 1.00 0.00 H new ATOM 0 HB3 ASP A 140 20.091 -7.586 -24.536 1.00 0.00 H new ATOM 1010 N PHE A 141 18.278 -5.678 -23.197 1.00 0.00 N ATOM 1011 CA PHE A 141 17.615 -4.420 -23.522 1.00 0.00 C ATOM 1012 C PHE A 141 17.638 -3.480 -22.321 1.00 0.00 C ATOM 1013 O PHE A 141 17.381 -3.893 -21.190 1.00 0.00 O ATOM 1014 CB PHE A 141 16.165 -4.687 -23.934 1.00 0.00 C ATOM 1015 CG PHE A 141 15.310 -4.854 -22.700 1.00 0.00 C ATOM 1016 CD1 PHE A 141 15.681 -5.770 -21.711 1.00 0.00 C ATOM 1017 CD2 PHE A 141 14.149 -4.087 -22.545 1.00 0.00 C ATOM 1018 CE1 PHE A 141 14.890 -5.922 -20.565 1.00 0.00 C ATOM 1019 CE2 PHE A 141 13.357 -4.240 -21.401 1.00 0.00 C ATOM 1020 CZ PHE A 141 13.727 -5.159 -20.411 1.00 0.00 C ATOM 0 H PHE A 141 17.711 -6.511 -23.358 1.00 0.00 H new ATOM 0 HA PHE A 141 18.148 -3.951 -24.349 1.00 0.00 H new ATOM 0 HB2 PHE A 141 15.790 -3.861 -24.539 1.00 0.00 H new ATOM 0 HB3 PHE A 141 16.111 -5.584 -24.550 1.00 0.00 H new ATOM 0 HD1 PHE A 141 16.577 -6.360 -21.831 1.00 0.00 H new ATOM 0 HD2 PHE A 141 13.865 -3.377 -23.308 1.00 0.00 H new ATOM 0 HE1 PHE A 141 15.178 -6.628 -19.800 1.00 0.00 H new ATOM 0 HE2 PHE A 141 12.461 -3.649 -21.282 1.00 0.00 H new ATOM 0 HZ PHE A 141 13.115 -5.279 -19.529 1.00 0.00 H new ATOM 1030 N ASP A 142 17.950 -2.213 -22.576 1.00 0.00 N ATOM 1031 CA ASP A 142 18.005 -1.220 -21.510 1.00 0.00 C ATOM 1032 C ASP A 142 16.916 -0.169 -21.701 1.00 0.00 C ATOM 1033 O ASP A 142 17.035 0.712 -22.552 1.00 0.00 O ATOM 1034 CB ASP A 142 19.376 -0.543 -21.495 1.00 0.00 C ATOM 1035 CG ASP A 142 19.449 0.461 -20.350 1.00 0.00 C ATOM 1036 OD1 ASP A 142 19.436 0.029 -19.208 1.00 0.00 O ATOM 1037 OD2 ASP A 142 19.517 1.646 -20.630 1.00 0.00 O ATOM 0 H ASP A 142 18.167 -1.852 -23.505 1.00 0.00 H new ATOM 0 HA ASP A 142 17.842 -1.726 -20.559 1.00 0.00 H new ATOM 0 HB2 ASP A 142 20.160 -1.292 -21.383 1.00 0.00 H new ATOM 0 HB3 ASP A 142 19.552 -0.038 -22.445 1.00 0.00 H new ATOM 1042 N PHE A 143 15.857 -0.267 -20.904 1.00 0.00 N ATOM 1043 CA PHE A 143 14.754 0.682 -20.997 1.00 0.00 C ATOM 1044 C PHE A 143 14.823 1.696 -19.860 1.00 0.00 C ATOM 1045 O PHE A 143 14.153 2.727 -19.894 1.00 0.00 O ATOM 1046 CB PHE A 143 13.419 -0.063 -20.938 1.00 0.00 C ATOM 1047 CG PHE A 143 13.191 -0.582 -19.538 1.00 0.00 C ATOM 1048 CD1 PHE A 143 13.751 -1.804 -19.145 1.00 0.00 C ATOM 1049 CD2 PHE A 143 12.423 0.160 -18.632 1.00 0.00 C ATOM 1050 CE1 PHE A 143 13.541 -2.284 -17.847 1.00 0.00 C ATOM 1051 CE2 PHE A 143 12.213 -0.320 -17.335 1.00 0.00 C ATOM 1052 CZ PHE A 143 12.772 -1.542 -16.941 1.00 0.00 C ATOM 0 H PHE A 143 15.740 -0.988 -20.192 1.00 0.00 H new ATOM 0 HA PHE A 143 14.833 1.212 -21.946 1.00 0.00 H new ATOM 0 HB2 PHE A 143 12.606 0.603 -21.227 1.00 0.00 H new ATOM 0 HB3 PHE A 143 13.421 -0.890 -21.648 1.00 0.00 H new ATOM 0 HD1 PHE A 143 14.345 -2.376 -19.843 1.00 0.00 H new ATOM 0 HD2 PHE A 143 11.993 1.103 -18.935 1.00 0.00 H new ATOM 0 HE1 PHE A 143 13.972 -3.227 -17.544 1.00 0.00 H new ATOM 0 HE2 PHE A 143 11.620 0.252 -16.637 1.00 0.00 H new ATOM 0 HZ PHE A 143 12.610 -1.912 -15.939 1.00 0.00 H new