USER MOD reduce.3.24.130724 H: found=0, std=0, add=1151, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1144 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 108 THR OG1 : rot -106:sc= 1.26 USER MOD Set 1.2: A 110 SER OG : rot -71:sc= 0.574 USER MOD Single : A 15 SER OG : rot 180:sc= -0.661 USER MOD Single : A 24 GLN : amide:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 31 HIS : no HE2:sc= -5.56! C(o=-5.6!,f=-7!) USER MOD Single : A 36 HIS : no HE2:sc= 0.104 K(o=0.1,f=-0.41) USER MOD Single : A 41 ASN : amide:sc= -0.79 K(o=-0.79,f=-5.3!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 130:sc= -1.62! USER MOD Single : A 49 GLN :FLIP amide:sc= -2.69! C(o=-5.8!,f=-2.7!) USER MOD Single : A 51 MET CE :methyl 152:sc= -4.18! (180deg=-6.57!) USER MOD Single : A 52 MET CE :methyl 176:sc= -2.24 (180deg=-2.48) USER MOD Single : A 55 SER OG : rot 140:sc= -0.0217 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 GLN :FLIP amide:sc= -1.44 F(o=-2,f=-1.4) USER MOD Single : A 68 SER OG : rot 180:sc= 0.151 USER MOD Single : A 70 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 GLN : amide:sc= -0.0683 K(o=-0.068,f=-1.8!) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 81 HIS : no HE2:sc= -2.62 K(o=-2.6,f=-4.8!) USER MOD Single : A 86 THR OG1 : rot -1:sc= -4.39! USER MOD Single : A 91 THR OG1 : rot 100:sc= 0.883 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 HIS : no HD1:sc= -0.521 K(o=-0.52,f=-1.5) USER MOD Single : A 103 ASN : amide:sc= -1.01! C(o=-1!,f=-4.9!) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 114 HIS : no HD1:sc= -2.24 K(o=-2.2,f=-4.4!) USER MOD Single : A 121 HIS : no HD1:sc= -1.53 K(o=-1.5,f=-3.1!) USER MOD Single : A 122 SER OG : rot 180:sc= -0.273 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot -69:sc= 0.499 USER MOD Single : A 132 SER OG : rot 101:sc= -2.04! USER MOD Single : A 135 HIS : no HD1:sc= -0.599 X(o=-0.6,f=-0.17) USER MOD Single : A 136 HIS : no HE2:sc= -2.2! C(o=-2.2!,f=-4.7!) USER MOD Single : A 140 SER OG : rot 180:sc= -0.338 USER MOD Single : A 143 THR OG1 : rot 180:sc= -1.78! USER MOD Single : A 150 GLN : amide:sc= -0.544 X(o=-0.54,f=-0.079) USER MOD Single : A 154 GLN : amide:sc= -1.01 X(o=-1,f=-0.53) USER MOD Single : A 155 ASN : amide:sc= -11.3! C(o=-11!,f=-12!) USER MOD Single : A 157 MET CE :methyl -160:sc= -0.112 (180deg=-1.23) USER MOD Single : A 161 GLN : amide:sc= -1.37 K(o=-1.4,f=-6.8!) USER MOD Single : A 163 HIS : no HD1:sc= -0.499 X(o=-0.5,f=-0.32) USER MOD Single : A 164 MET CE :methyl -140:sc= -4.89! (180deg=-6.34!) USER MOD ----------------------------------------------------------------- ATOM 133 N VAL A 10 -23.723 -4.450 -1.415 1.00 0.00 N ATOM 134 CA VAL A 10 -23.009 -3.188 -1.270 1.00 0.00 C ATOM 135 C VAL A 10 -21.502 -3.414 -1.269 1.00 0.00 C ATOM 136 O VAL A 10 -20.723 -2.484 -1.476 1.00 0.00 O ATOM 137 CB VAL A 10 -23.408 -2.463 0.029 1.00 0.00 C ATOM 138 CG1 VAL A 10 -23.028 -3.295 1.243 1.00 0.00 C ATOM 139 CG2 VAL A 10 -22.765 -1.086 0.091 1.00 0.00 C ATOM 0 HA VAL A 10 -23.284 -2.566 -2.122 1.00 0.00 H new ATOM 0 HB VAL A 10 -24.490 -2.332 0.034 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -23.318 -2.767 2.151 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -23.543 -4.255 1.202 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -21.951 -3.461 1.248 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -23.058 -0.589 1.016 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -21.680 -1.189 0.063 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -23.095 -0.492 -0.761 1.00 0.00 H new ATOM 149 N GLY A 11 -21.098 -4.658 -1.035 1.00 0.00 N ATOM 150 CA GLY A 11 -19.686 -4.989 -1.010 1.00 0.00 C ATOM 151 C GLY A 11 -18.932 -4.397 -2.184 1.00 0.00 C ATOM 152 O GLY A 11 -17.974 -3.646 -2.001 1.00 0.00 O ATOM 0 H GLY A 11 -21.725 -5.444 -0.862 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -19.247 -4.627 -0.080 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -19.570 -6.073 -1.016 1.00 0.00 H new ATOM 156 N ASP A 12 -19.365 -4.736 -3.394 1.00 0.00 N ATOM 157 CA ASP A 12 -18.724 -4.234 -4.603 1.00 0.00 C ATOM 158 C ASP A 12 -19.266 -2.856 -4.973 1.00 0.00 C ATOM 159 O ASP A 12 -19.736 -2.643 -6.090 1.00 0.00 O ATOM 160 CB ASP A 12 -18.940 -5.210 -5.761 1.00 0.00 C ATOM 161 CG ASP A 12 -20.031 -6.222 -5.469 1.00 0.00 C ATOM 162 OD1 ASP A 12 -20.065 -6.748 -4.337 1.00 0.00 O ATOM 163 OD2 ASP A 12 -20.850 -6.488 -6.373 1.00 0.00 O ATOM 0 H ASP A 12 -20.157 -5.356 -3.563 1.00 0.00 H new ATOM 0 HA ASP A 12 -17.655 -4.143 -4.409 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -19.198 -4.651 -6.660 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -18.008 -5.735 -5.969 1.00 0.00 H new ATOM 168 N ARG A 13 -19.199 -1.926 -4.026 1.00 0.00 N ATOM 169 CA ARG A 13 -19.684 -0.569 -4.251 1.00 0.00 C ATOM 170 C ARG A 13 -18.617 0.459 -3.890 1.00 0.00 C ATOM 171 O ARG A 13 -18.108 1.172 -4.755 1.00 0.00 O ATOM 172 CB ARG A 13 -20.949 -0.315 -3.430 1.00 0.00 C ATOM 173 CG ARG A 13 -21.602 1.027 -3.719 1.00 0.00 C ATOM 174 CD ARG A 13 -22.920 0.859 -4.456 1.00 0.00 C ATOM 175 NE ARG A 13 -23.941 0.239 -3.617 1.00 0.00 N ATOM 176 CZ ARG A 13 -24.508 0.845 -2.579 1.00 0.00 C ATOM 177 NH1 ARG A 13 -24.150 2.079 -2.254 1.00 0.00 N ATOM 178 NH2 ARG A 13 -25.436 0.218 -1.868 1.00 0.00 N ATOM 0 H ARG A 13 -18.814 -2.087 -3.095 1.00 0.00 H new ATOM 0 HA ARG A 13 -19.918 -0.466 -5.311 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -21.668 -1.110 -3.630 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -20.701 -0.368 -2.370 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -21.773 1.559 -2.783 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -20.926 1.640 -4.315 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -23.272 1.833 -4.795 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -22.763 0.249 -5.346 1.00 0.00 H new ATOM 0 HE ARG A 13 -24.236 -0.712 -3.840 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -23.439 2.564 -2.801 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -24.586 2.543 -1.457 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -25.715 -0.731 -2.118 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -25.870 0.685 -1.072 1.00 0.00 H new ATOM 192 N LEU A 14 -18.284 0.531 -2.605 1.00 0.00 N ATOM 193 CA LEU A 14 -17.278 1.473 -2.127 1.00 0.00 C ATOM 194 C LEU A 14 -15.894 1.109 -2.654 1.00 0.00 C ATOM 195 O LEU A 14 -15.072 1.983 -2.924 1.00 0.00 O ATOM 196 CB LEU A 14 -17.262 1.501 -0.597 1.00 0.00 C ATOM 197 CG LEU A 14 -16.089 2.261 0.024 1.00 0.00 C ATOM 198 CD1 LEU A 14 -16.238 3.756 -0.214 1.00 0.00 C ATOM 199 CD2 LEU A 14 -15.988 1.962 1.512 1.00 0.00 C ATOM 0 H LEU A 14 -18.696 -0.052 -1.876 1.00 0.00 H new ATOM 0 HA LEU A 14 -17.539 2.463 -2.500 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -18.192 1.950 -0.247 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -17.245 0.475 -0.230 1.00 0.00 H new ATOM 0 HG LEU A 14 -15.169 1.927 -0.455 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -15.395 4.282 0.234 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -16.260 3.953 -1.286 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -17.166 4.106 0.239 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -15.148 2.511 1.937 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -16.909 2.267 2.008 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -15.834 0.893 1.659 1.00 0.00 H new ATOM 211 N SER A 15 -15.645 -0.188 -2.800 1.00 0.00 N ATOM 212 CA SER A 15 -14.361 -0.667 -3.294 1.00 0.00 C ATOM 213 C SER A 15 -14.099 -0.164 -4.710 1.00 0.00 C ATOM 214 O SER A 15 -12.973 0.195 -5.053 1.00 0.00 O ATOM 215 CB SER A 15 -14.316 -2.196 -3.268 1.00 0.00 C ATOM 216 OG SER A 15 -13.692 -2.710 -4.431 1.00 0.00 O ATOM 0 H SER A 15 -16.316 -0.925 -2.583 1.00 0.00 H new ATOM 0 HA SER A 15 -13.582 -0.277 -2.639 1.00 0.00 H new ATOM 0 HB2 SER A 15 -13.775 -2.531 -2.383 1.00 0.00 H new ATOM 0 HB3 SER A 15 -15.329 -2.591 -3.191 1.00 0.00 H new ATOM 0 HG SER A 15 -13.675 -3.689 -4.388 1.00 0.00 H new ATOM 222 N GLY A 16 -15.146 -0.141 -5.529 1.00 0.00 N ATOM 223 CA GLY A 16 -15.007 0.319 -6.898 1.00 0.00 C ATOM 224 C GLY A 16 -14.715 1.804 -6.987 1.00 0.00 C ATOM 225 O GLY A 16 -14.028 2.254 -7.903 1.00 0.00 O ATOM 0 H GLY A 16 -16.088 -0.433 -5.269 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -14.204 -0.235 -7.384 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -15.923 0.099 -7.446 1.00 0.00 H new ATOM 229 N ALA A 17 -15.238 2.567 -6.032 1.00 0.00 N ATOM 230 CA ALA A 17 -15.028 4.009 -6.007 1.00 0.00 C ATOM 231 C ALA A 17 -13.601 4.350 -5.593 1.00 0.00 C ATOM 232 O ALA A 17 -12.861 4.989 -6.342 1.00 0.00 O ATOM 233 CB ALA A 17 -16.025 4.671 -5.070 1.00 0.00 C ATOM 0 H ALA A 17 -15.810 2.210 -5.266 1.00 0.00 H new ATOM 0 HA ALA A 17 -15.186 4.391 -7.016 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -15.856 5.748 -5.061 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -17.039 4.465 -5.413 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -15.896 4.275 -4.063 1.00 0.00 H new ATOM 239 N ALA A 18 -13.219 3.920 -4.395 1.00 0.00 N ATOM 240 CA ALA A 18 -11.881 4.179 -3.880 1.00 0.00 C ATOM 241 C ALA A 18 -10.815 3.698 -4.857 1.00 0.00 C ATOM 242 O ALA A 18 -9.876 4.427 -5.178 1.00 0.00 O ATOM 243 CB ALA A 18 -11.699 3.511 -2.526 1.00 0.00 C ATOM 0 H ALA A 18 -13.819 3.390 -3.763 1.00 0.00 H new ATOM 0 HA ALA A 18 -11.766 5.256 -3.760 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -10.695 3.713 -2.153 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -12.433 3.906 -1.824 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -11.838 2.435 -2.630 1.00 0.00 H new ATOM 249 N ALA A 19 -10.966 2.465 -5.329 1.00 0.00 N ATOM 250 CA ALA A 19 -10.015 1.886 -6.271 1.00 0.00 C ATOM 251 C ALA A 19 -10.017 2.650 -7.590 1.00 0.00 C ATOM 252 O ALA A 19 -9.010 2.689 -8.298 1.00 0.00 O ATOM 253 CB ALA A 19 -10.335 0.418 -6.509 1.00 0.00 C ATOM 0 H ALA A 19 -11.737 1.848 -5.075 1.00 0.00 H new ATOM 0 HA ALA A 19 -9.018 1.963 -5.837 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -9.617 -0.001 -7.214 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -10.276 -0.125 -5.566 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -11.341 0.327 -6.918 1.00 0.00 H new ATOM 259 N ARG A 20 -11.152 3.261 -7.914 1.00 0.00 N ATOM 260 CA ARG A 20 -11.282 4.026 -9.148 1.00 0.00 C ATOM 261 C ARG A 20 -10.509 5.338 -9.056 1.00 0.00 C ATOM 262 O ARG A 20 -9.903 5.783 -10.031 1.00 0.00 O ATOM 263 CB ARG A 20 -12.756 4.307 -9.448 1.00 0.00 C ATOM 264 CG ARG A 20 -13.391 3.289 -10.381 1.00 0.00 C ATOM 265 CD ARG A 20 -14.907 3.402 -10.382 1.00 0.00 C ATOM 266 NE ARG A 20 -15.551 2.121 -10.654 1.00 0.00 N ATOM 267 CZ ARG A 20 -15.463 1.484 -11.818 1.00 0.00 C ATOM 268 NH1 ARG A 20 -14.756 2.008 -12.810 1.00 0.00 N ATOM 269 NH2 ARG A 20 -16.078 0.322 -11.989 1.00 0.00 N ATOM 0 H ARG A 20 -11.994 3.241 -7.339 1.00 0.00 H new ATOM 0 HA ARG A 20 -10.862 3.433 -9.960 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -13.312 4.325 -8.511 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -12.845 5.299 -9.891 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -13.014 3.437 -11.393 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -13.100 2.284 -10.076 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -15.243 3.779 -9.416 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -15.216 4.130 -11.133 1.00 0.00 H new ATOM 0 HE ARG A 20 -16.099 1.690 -9.910 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -14.279 2.900 -12.681 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -14.689 1.519 -13.702 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -16.620 -0.085 -11.227 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -16.009 -0.165 -12.883 1.00 0.00 H new ATOM 283 N GLY A 21 -10.531 5.952 -7.878 1.00 0.00 N ATOM 284 CA GLY A 21 -9.826 7.204 -7.680 1.00 0.00 C ATOM 285 C GLY A 21 -10.738 8.411 -7.780 1.00 0.00 C ATOM 286 O GLY A 21 -10.700 9.146 -8.767 1.00 0.00 O ATOM 0 H GLY A 21 -11.025 5.604 -7.056 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -9.347 7.196 -6.701 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -9.032 7.291 -8.422 1.00 0.00 H new ATOM 290 N ASP A 22 -11.559 8.620 -6.755 1.00 0.00 N ATOM 291 CA ASP A 22 -12.480 9.748 -6.733 1.00 0.00 C ATOM 292 C ASP A 22 -12.536 10.371 -5.342 1.00 0.00 C ATOM 293 O ASP A 22 -13.422 10.057 -4.547 1.00 0.00 O ATOM 294 CB ASP A 22 -13.877 9.302 -7.164 1.00 0.00 C ATOM 295 CG ASP A 22 -14.522 10.275 -8.132 1.00 0.00 C ATOM 296 OD1 ASP A 22 -13.883 11.295 -8.463 1.00 0.00 O ATOM 297 OD2 ASP A 22 -15.668 10.017 -8.558 1.00 0.00 O ATOM 0 H ASP A 22 -11.604 8.022 -5.930 1.00 0.00 H new ATOM 0 HA ASP A 22 -12.117 10.499 -7.435 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -13.814 8.319 -7.630 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -14.510 9.197 -6.283 1.00 0.00 H new ATOM 302 N VAL A 23 -11.585 11.254 -5.055 1.00 0.00 N ATOM 303 CA VAL A 23 -11.531 11.918 -3.760 1.00 0.00 C ATOM 304 C VAL A 23 -12.868 12.567 -3.426 1.00 0.00 C ATOM 305 O VAL A 23 -13.180 12.808 -2.262 1.00 0.00 O ATOM 306 CB VAL A 23 -10.427 12.992 -3.723 1.00 0.00 C ATOM 307 CG1 VAL A 23 -10.646 14.022 -4.821 1.00 0.00 C ATOM 308 CG2 VAL A 23 -10.375 13.659 -2.357 1.00 0.00 C ATOM 0 H VAL A 23 -10.843 11.525 -5.701 1.00 0.00 H new ATOM 0 HA VAL A 23 -11.303 11.152 -3.019 1.00 0.00 H new ATOM 0 HB VAL A 23 -9.467 12.506 -3.900 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -9.856 14.772 -4.779 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -10.626 13.528 -5.792 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -11.613 14.505 -4.679 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -9.589 14.414 -2.351 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -11.334 14.132 -2.146 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -10.164 12.910 -1.594 1.00 0.00 H new ATOM 318 N GLN A 24 -13.655 12.844 -4.458 1.00 0.00 N ATOM 319 CA GLN A 24 -14.963 13.461 -4.276 1.00 0.00 C ATOM 320 C GLN A 24 -15.968 12.455 -3.719 1.00 0.00 C ATOM 321 O GLN A 24 -16.670 12.736 -2.748 1.00 0.00 O ATOM 322 CB GLN A 24 -15.472 14.024 -5.604 1.00 0.00 C ATOM 323 CG GLN A 24 -15.190 15.507 -5.785 1.00 0.00 C ATOM 324 CD GLN A 24 -15.222 15.933 -7.239 1.00 0.00 C ATOM 325 OE1 GLN A 24 -14.419 15.473 -8.050 1.00 0.00 O ATOM 326 NE2 GLN A 24 -16.152 16.819 -7.576 1.00 0.00 N ATOM 0 H GLN A 24 -13.411 12.651 -5.429 1.00 0.00 H new ATOM 0 HA GLN A 24 -14.856 14.275 -3.559 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -15.011 13.472 -6.423 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -16.547 13.856 -5.672 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -15.926 16.084 -5.225 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -14.213 15.741 -5.363 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -16.798 17.174 -6.871 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -16.221 17.144 -8.540 1.00 0.00 H new ATOM 335 N GLU A 25 -16.035 11.285 -4.350 1.00 0.00 N ATOM 336 CA GLU A 25 -16.960 10.237 -3.929 1.00 0.00 C ATOM 337 C GLU A 25 -16.501 9.558 -2.642 1.00 0.00 C ATOM 338 O GLU A 25 -17.317 9.032 -1.885 1.00 0.00 O ATOM 339 CB GLU A 25 -17.111 9.192 -5.036 1.00 0.00 C ATOM 340 CG GLU A 25 -17.766 9.732 -6.298 1.00 0.00 C ATOM 341 CD GLU A 25 -19.155 10.282 -6.045 1.00 0.00 C ATOM 342 OE1 GLU A 25 -19.641 10.162 -4.901 1.00 0.00 O ATOM 343 OE2 GLU A 25 -19.756 10.833 -6.991 1.00 0.00 O ATOM 0 H GLU A 25 -15.459 11.039 -5.155 1.00 0.00 H new ATOM 0 HA GLU A 25 -17.923 10.710 -3.735 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -16.127 8.797 -5.288 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -17.702 8.358 -4.658 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -17.140 10.518 -6.720 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -17.824 8.937 -7.041 1.00 0.00 H new ATOM 350 N VAL A 26 -15.193 9.557 -2.404 1.00 0.00 N ATOM 351 CA VAL A 26 -14.638 8.925 -1.211 1.00 0.00 C ATOM 352 C VAL A 26 -15.318 9.431 0.059 1.00 0.00 C ATOM 353 O VAL A 26 -15.767 8.643 0.890 1.00 0.00 O ATOM 354 CB VAL A 26 -13.109 9.144 -1.111 1.00 0.00 C ATOM 355 CG1 VAL A 26 -12.778 10.421 -0.346 1.00 0.00 C ATOM 356 CG2 VAL A 26 -12.443 7.942 -0.460 1.00 0.00 C ATOM 0 H VAL A 26 -14.500 9.985 -3.018 1.00 0.00 H new ATOM 0 HA VAL A 26 -14.829 7.856 -1.304 1.00 0.00 H new ATOM 0 HB VAL A 26 -12.720 9.255 -2.123 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -11.696 10.544 -0.294 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -13.217 11.277 -0.859 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -13.184 10.356 0.663 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -11.368 8.111 -0.397 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -12.847 7.800 0.542 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -12.635 7.051 -1.058 1.00 0.00 H new ATOM 366 N ARG A 27 -15.384 10.749 0.209 1.00 0.00 N ATOM 367 CA ARG A 27 -16.000 11.355 1.381 1.00 0.00 C ATOM 368 C ARG A 27 -17.522 11.227 1.339 1.00 0.00 C ATOM 369 O ARG A 27 -18.155 10.922 2.349 1.00 0.00 O ATOM 370 CB ARG A 27 -15.605 12.829 1.487 1.00 0.00 C ATOM 371 CG ARG A 27 -14.357 13.193 0.697 1.00 0.00 C ATOM 372 CD ARG A 27 -13.867 14.589 1.046 1.00 0.00 C ATOM 373 NE ARG A 27 -14.457 15.607 0.181 1.00 0.00 N ATOM 374 CZ ARG A 27 -14.068 16.878 0.170 1.00 0.00 C ATOM 375 NH1 ARG A 27 -13.094 17.284 0.973 1.00 0.00 N ATOM 376 NH2 ARG A 27 -14.654 17.746 -0.645 1.00 0.00 N ATOM 0 H ARG A 27 -15.018 11.418 -0.468 1.00 0.00 H new ATOM 0 HA ARG A 27 -15.638 10.821 2.260 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -16.435 13.443 1.138 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -15.444 13.077 2.536 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -13.570 12.468 0.903 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -14.571 13.137 -0.370 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -14.111 14.810 2.085 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -12.781 14.624 0.959 1.00 0.00 H new ATOM 0 HE ARG A 27 -15.209 15.327 -0.449 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -12.641 16.620 1.601 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -12.798 18.260 0.962 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -15.404 17.438 -1.264 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -14.354 18.721 -0.652 1.00 0.00 H new ATOM 390 N ARG A 28 -18.102 11.471 0.169 1.00 0.00 N ATOM 391 CA ARG A 28 -19.549 11.392 0.002 1.00 0.00 C ATOM 392 C ARG A 28 -20.057 9.976 0.242 1.00 0.00 C ATOM 393 O ARG A 28 -21.159 9.779 0.753 1.00 0.00 O ATOM 394 CB ARG A 28 -19.946 11.854 -1.401 1.00 0.00 C ATOM 395 CG ARG A 28 -19.508 13.273 -1.719 1.00 0.00 C ATOM 396 CD ARG A 28 -20.642 14.264 -1.513 1.00 0.00 C ATOM 397 NE ARG A 28 -20.276 15.611 -1.937 1.00 0.00 N ATOM 398 CZ ARG A 28 -21.129 16.629 -1.969 1.00 0.00 C ATOM 399 NH1 ARG A 28 -22.391 16.449 -1.602 1.00 0.00 N ATOM 400 NH2 ARG A 28 -20.723 17.827 -2.368 1.00 0.00 N ATOM 0 H ARG A 28 -17.593 11.725 -0.678 1.00 0.00 H new ATOM 0 HA ARG A 28 -20.006 12.049 0.742 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -19.511 11.175 -2.135 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -21.029 11.785 -1.505 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -18.665 13.546 -1.084 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -19.160 13.325 -2.751 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -21.518 13.934 -2.072 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -20.923 14.279 -0.460 1.00 0.00 H new ATOM 0 HE ARG A 28 -19.312 15.781 -2.225 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -22.707 15.529 -1.295 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -23.046 17.231 -1.627 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -19.753 17.969 -2.651 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -21.380 18.607 -2.391 1.00 0.00 H new ATOM 414 N LEU A 29 -19.251 8.992 -0.133 1.00 0.00 N ATOM 415 CA LEU A 29 -19.625 7.596 0.039 1.00 0.00 C ATOM 416 C LEU A 29 -20.023 7.302 1.483 1.00 0.00 C ATOM 417 O LEU A 29 -21.195 7.080 1.782 1.00 0.00 O ATOM 418 CB LEU A 29 -18.469 6.682 -0.384 1.00 0.00 C ATOM 419 CG LEU A 29 -18.276 6.510 -1.898 1.00 0.00 C ATOM 420 CD1 LEU A 29 -18.401 5.044 -2.283 1.00 0.00 C ATOM 421 CD2 LEU A 29 -19.273 7.354 -2.682 1.00 0.00 C ATOM 0 H LEU A 29 -18.335 9.135 -0.558 1.00 0.00 H new ATOM 0 HA LEU A 29 -20.489 7.400 -0.596 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -17.545 7.076 0.039 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -18.628 5.698 0.058 1.00 0.00 H new ATOM 0 HG LEU A 29 -17.274 6.856 -2.151 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -18.262 4.937 -3.359 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -17.641 4.464 -1.760 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -19.390 4.678 -2.007 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -19.111 7.210 -3.750 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -20.288 7.050 -2.425 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -19.135 8.406 -2.432 1.00 0.00 H new ATOM 433 N LEU A 30 -19.037 7.289 2.372 1.00 0.00 N ATOM 434 CA LEU A 30 -19.280 7.006 3.781 1.00 0.00 C ATOM 435 C LEU A 30 -20.044 8.137 4.469 1.00 0.00 C ATOM 436 O LEU A 30 -21.027 7.893 5.170 1.00 0.00 O ATOM 437 CB LEU A 30 -17.953 6.766 4.502 1.00 0.00 C ATOM 438 CG LEU A 30 -16.858 6.115 3.650 1.00 0.00 C ATOM 439 CD1 LEU A 30 -17.463 5.174 2.617 1.00 0.00 C ATOM 440 CD2 LEU A 30 -16.001 7.175 2.977 1.00 0.00 C ATOM 0 H LEU A 30 -18.060 7.471 2.141 1.00 0.00 H new ATOM 0 HA LEU A 30 -19.897 6.109 3.833 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -17.582 7.721 4.875 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -18.139 6.135 5.371 1.00 0.00 H new ATOM 0 HG LEU A 30 -16.219 5.527 4.309 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -16.667 4.724 2.024 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -18.025 4.390 3.124 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -18.131 5.734 1.962 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -15.230 6.692 2.377 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -16.626 7.794 2.334 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -15.532 7.800 3.737 1.00 0.00 H new ATOM 452 N HIS A 31 -19.578 9.367 4.285 1.00 0.00 N ATOM 453 CA HIS A 31 -20.213 10.525 4.910 1.00 0.00 C ATOM 454 C HIS A 31 -21.616 10.779 4.352 1.00 0.00 C ATOM 455 O HIS A 31 -22.459 11.364 5.031 1.00 0.00 O ATOM 456 CB HIS A 31 -19.321 11.770 4.752 1.00 0.00 C ATOM 457 CG HIS A 31 -19.868 12.826 3.834 1.00 0.00 C ATOM 458 ND1 HIS A 31 -21.113 13.372 4.031 1.00 0.00 N ATOM 459 CD2 HIS A 31 -19.301 13.401 2.745 1.00 0.00 C ATOM 460 CE1 HIS A 31 -21.277 14.259 3.067 1.00 0.00 C ATOM 461 NE2 HIS A 31 -20.205 14.312 2.262 1.00 0.00 N ATOM 0 H HIS A 31 -18.765 9.589 3.710 1.00 0.00 H new ATOM 0 HA HIS A 31 -20.329 10.309 5.972 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -19.160 12.212 5.736 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -18.346 11.456 4.381 1.00 0.00 H new ATOM 0 HD1 HIS A 31 -21.775 13.140 4.771 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -18.325 13.183 2.337 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -22.162 14.865 2.942 1.00 0.00 H new ATOM 469 N ARG A 32 -21.864 10.346 3.120 1.00 0.00 N ATOM 470 CA ARG A 32 -23.170 10.549 2.501 1.00 0.00 C ATOM 471 C ARG A 32 -23.818 9.223 2.111 1.00 0.00 C ATOM 472 O ARG A 32 -24.915 8.903 2.566 1.00 0.00 O ATOM 473 CB ARG A 32 -23.043 11.446 1.268 1.00 0.00 C ATOM 474 CG ARG A 32 -23.808 12.749 1.386 1.00 0.00 C ATOM 475 CD ARG A 32 -25.274 12.573 1.026 1.00 0.00 C ATOM 476 NE ARG A 32 -26.090 12.260 2.195 1.00 0.00 N ATOM 477 CZ ARG A 32 -27.315 11.747 2.123 1.00 0.00 C ATOM 478 NH1 ARG A 32 -27.860 11.490 0.942 1.00 0.00 N ATOM 479 NH2 ARG A 32 -27.994 11.491 3.233 1.00 0.00 N ATOM 0 H ARG A 32 -21.186 9.857 2.535 1.00 0.00 H new ATOM 0 HA ARG A 32 -23.809 11.036 3.237 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -21.990 11.667 1.096 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -23.401 10.902 0.394 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -23.726 13.128 2.405 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -23.359 13.495 0.731 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -25.645 13.485 0.559 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -25.373 11.775 0.290 1.00 0.00 H new ATOM 0 HE ARG A 32 -25.699 12.445 3.119 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -27.340 11.686 0.087 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -28.800 11.097 0.889 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -27.577 11.688 4.143 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -28.933 11.098 3.177 1.00 0.00 H new ATOM 493 N GLU A 33 -23.136 8.458 1.266 1.00 0.00 N ATOM 494 CA GLU A 33 -23.655 7.170 0.816 1.00 0.00 C ATOM 495 C GLU A 33 -23.708 6.168 1.966 1.00 0.00 C ATOM 496 O GLU A 33 -24.236 5.066 1.815 1.00 0.00 O ATOM 497 CB GLU A 33 -22.793 6.618 -0.321 1.00 0.00 C ATOM 498 CG GLU A 33 -23.537 5.662 -1.238 1.00 0.00 C ATOM 499 CD GLU A 33 -24.716 6.317 -1.932 1.00 0.00 C ATOM 500 OE1 GLU A 33 -25.770 6.482 -1.282 1.00 0.00 O ATOM 501 OE2 GLU A 33 -24.585 6.666 -3.124 1.00 0.00 O ATOM 0 H GLU A 33 -22.225 8.706 0.879 1.00 0.00 H new ATOM 0 HA GLU A 33 -24.670 7.325 0.450 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -22.409 7.450 -0.911 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -21.931 6.104 0.104 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -22.848 5.274 -1.989 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -23.890 4.809 -0.658 1.00 0.00 H new ATOM 508 N LEU A 34 -23.157 6.553 3.113 1.00 0.00 N ATOM 509 CA LEU A 34 -23.145 5.683 4.282 1.00 0.00 C ATOM 510 C LEU A 34 -22.803 4.252 3.885 1.00 0.00 C ATOM 511 O LEU A 34 -23.220 3.297 4.541 1.00 0.00 O ATOM 512 CB LEU A 34 -24.502 5.720 4.988 1.00 0.00 C ATOM 513 CG LEU A 34 -25.328 6.981 4.730 1.00 0.00 C ATOM 514 CD1 LEU A 34 -26.759 6.789 5.209 1.00 0.00 C ATOM 515 CD2 LEU A 34 -24.691 8.184 5.411 1.00 0.00 C ATOM 0 H LEU A 34 -22.714 7.460 3.257 1.00 0.00 H new ATOM 0 HA LEU A 34 -22.380 6.046 4.968 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -25.082 4.853 4.674 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -24.339 5.623 6.061 1.00 0.00 H new ATOM 0 HG LEU A 34 -25.349 7.166 3.656 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -27.332 7.696 5.017 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -27.213 5.954 4.675 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -26.760 6.579 6.279 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -25.292 9.072 5.217 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -24.639 8.009 6.486 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -23.685 8.334 5.019 1.00 0.00 H new ATOM 527 N VAL A 35 -22.042 4.112 2.805 1.00 0.00 N ATOM 528 CA VAL A 35 -21.643 2.798 2.317 1.00 0.00 C ATOM 529 C VAL A 35 -20.705 2.109 3.302 1.00 0.00 C ATOM 530 O VAL A 35 -19.939 2.766 4.007 1.00 0.00 O ATOM 531 CB VAL A 35 -20.949 2.894 0.946 1.00 0.00 C ATOM 532 CG1 VAL A 35 -19.676 3.720 1.049 1.00 0.00 C ATOM 533 CG2 VAL A 35 -20.654 1.507 0.398 1.00 0.00 C ATOM 0 H VAL A 35 -21.689 4.893 2.251 1.00 0.00 H new ATOM 0 HA VAL A 35 -22.554 2.209 2.213 1.00 0.00 H new ATOM 0 HB VAL A 35 -21.623 3.395 0.252 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -19.199 3.777 0.071 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -19.921 4.725 1.392 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -18.994 3.251 1.758 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -20.164 1.596 -0.571 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -20.000 0.975 1.088 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -21.587 0.955 0.284 1.00 0.00 H new ATOM 543 N HIS A 36 -20.772 0.784 3.345 1.00 0.00 N ATOM 544 CA HIS A 36 -19.928 0.006 4.244 1.00 0.00 C ATOM 545 C HIS A 36 -18.463 0.095 3.831 1.00 0.00 C ATOM 546 O HIS A 36 -18.123 -0.096 2.664 1.00 0.00 O ATOM 547 CB HIS A 36 -20.378 -1.455 4.263 1.00 0.00 C ATOM 548 CG HIS A 36 -21.175 -1.822 5.477 1.00 0.00 C ATOM 549 ND1 HIS A 36 -20.574 -2.346 6.595 1.00 0.00 N ATOM 550 CD2 HIS A 36 -22.509 -1.724 5.696 1.00 0.00 C ATOM 551 CE1 HIS A 36 -21.546 -2.553 7.465 1.00 0.00 C ATOM 552 NE2 HIS A 36 -22.737 -2.192 6.964 1.00 0.00 N ATOM 0 H HIS A 36 -21.402 0.226 2.768 1.00 0.00 H new ATOM 0 HA HIS A 36 -20.028 0.423 5.246 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -20.975 -1.654 3.373 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -19.499 -2.098 4.208 1.00 0.00 H new ATOM 0 HD1 HIS A 36 -19.581 -2.536 6.727 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -23.249 -1.349 5.005 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -21.400 -2.961 8.454 1.00 0.00 H new ATOM 560 N PRO A 37 -17.575 0.388 4.793 1.00 0.00 N ATOM 561 CA PRO A 37 -16.135 0.505 4.538 1.00 0.00 C ATOM 562 C PRO A 37 -15.486 -0.844 4.252 1.00 0.00 C ATOM 563 O PRO A 37 -14.424 -0.915 3.633 1.00 0.00 O ATOM 564 CB PRO A 37 -15.593 1.094 5.841 1.00 0.00 C ATOM 565 CG PRO A 37 -16.566 0.661 6.882 1.00 0.00 C ATOM 566 CD PRO A 37 -17.909 0.628 6.207 1.00 0.00 C ATOM 0 HA PRO A 37 -15.924 1.113 3.658 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -14.591 0.724 6.057 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -15.527 2.181 5.788 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -16.304 -0.321 7.277 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -16.570 1.353 7.724 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -18.542 -0.163 6.610 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -18.448 1.566 6.339 1.00 0.00 H new ATOM 574 N ASP A 38 -16.130 -1.914 4.708 1.00 0.00 N ATOM 575 CA ASP A 38 -15.613 -3.263 4.500 1.00 0.00 C ATOM 576 C ASP A 38 -16.318 -3.941 3.330 1.00 0.00 C ATOM 577 O ASP A 38 -16.289 -5.165 3.198 1.00 0.00 O ATOM 578 CB ASP A 38 -15.787 -4.099 5.769 1.00 0.00 C ATOM 579 CG ASP A 38 -17.179 -3.972 6.358 1.00 0.00 C ATOM 580 OD1 ASP A 38 -18.139 -3.788 5.580 1.00 0.00 O ATOM 581 OD2 ASP A 38 -17.309 -4.057 7.598 1.00 0.00 O ATOM 0 H ASP A 38 -17.009 -1.874 5.223 1.00 0.00 H new ATOM 0 HA ASP A 38 -14.551 -3.187 4.266 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -15.586 -5.146 5.542 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -15.052 -3.787 6.510 1.00 0.00 H new ATOM 586 N ALA A 39 -16.953 -3.138 2.482 1.00 0.00 N ATOM 587 CA ALA A 39 -17.666 -3.658 1.322 1.00 0.00 C ATOM 588 C ALA A 39 -16.715 -4.371 0.367 1.00 0.00 C ATOM 589 O ALA A 39 -15.918 -3.734 -0.321 1.00 0.00 O ATOM 590 CB ALA A 39 -18.393 -2.531 0.603 1.00 0.00 C ATOM 0 H ALA A 39 -16.988 -2.123 2.577 1.00 0.00 H new ATOM 0 HA ALA A 39 -18.399 -4.385 1.672 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -18.922 -2.932 -0.262 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -19.108 -2.067 1.283 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -17.671 -1.785 0.272 1.00 0.00 H new ATOM 596 N LEU A 40 -16.806 -5.696 0.329 1.00 0.00 N ATOM 597 CA LEU A 40 -15.954 -6.495 -0.543 1.00 0.00 C ATOM 598 C LEU A 40 -16.606 -6.693 -1.908 1.00 0.00 C ATOM 599 O LEU A 40 -17.827 -6.810 -2.014 1.00 0.00 O ATOM 600 CB LEU A 40 -15.662 -7.853 0.098 1.00 0.00 C ATOM 601 CG LEU A 40 -15.057 -7.789 1.502 1.00 0.00 C ATOM 602 CD1 LEU A 40 -16.025 -8.363 2.526 1.00 0.00 C ATOM 603 CD2 LEU A 40 -13.729 -8.530 1.544 1.00 0.00 C ATOM 0 H LEU A 40 -17.461 -6.239 0.892 1.00 0.00 H new ATOM 0 HA LEU A 40 -15.016 -5.959 -0.683 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -16.590 -8.423 0.144 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -14.981 -8.405 -0.550 1.00 0.00 H new ATOM 0 HG LEU A 40 -14.874 -6.744 1.752 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -15.578 -8.309 3.519 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -16.951 -7.788 2.513 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -16.240 -9.403 2.280 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -13.313 -8.474 2.550 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -13.886 -9.574 1.274 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -13.035 -8.073 0.838 1.00 0.00 H new ATOM 615 N ASN A 41 -15.782 -6.728 -2.950 1.00 0.00 N ATOM 616 CA ASN A 41 -16.276 -6.909 -4.310 1.00 0.00 C ATOM 617 C ASN A 41 -16.551 -8.382 -4.599 1.00 0.00 C ATOM 618 O ASN A 41 -16.504 -9.221 -3.699 1.00 0.00 O ATOM 619 CB ASN A 41 -15.264 -6.361 -5.318 1.00 0.00 C ATOM 620 CG ASN A 41 -13.923 -7.064 -5.232 1.00 0.00 C ATOM 621 OD1 ASN A 41 -13.802 -8.121 -4.612 1.00 0.00 O ATOM 622 ND2 ASN A 41 -12.907 -6.478 -5.855 1.00 0.00 N ATOM 0 H ASN A 41 -14.769 -6.633 -2.879 1.00 0.00 H new ATOM 0 HA ASN A 41 -17.212 -6.358 -4.406 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -15.664 -6.470 -6.326 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -15.124 -5.294 -5.144 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -11.980 -6.904 -5.832 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -13.053 -5.602 -6.357 1.00 0.00 H new ATOM 629 N ARG A 42 -16.835 -8.688 -5.861 1.00 0.00 N ATOM 630 CA ARG A 42 -17.116 -10.059 -6.271 1.00 0.00 C ATOM 631 C ARG A 42 -15.852 -10.910 -6.224 1.00 0.00 C ATOM 632 O ARG A 42 -15.439 -11.482 -7.234 1.00 0.00 O ATOM 633 CB ARG A 42 -17.709 -10.082 -7.681 1.00 0.00 C ATOM 634 CG ARG A 42 -18.841 -11.081 -7.848 1.00 0.00 C ATOM 635 CD ARG A 42 -18.344 -12.513 -7.733 1.00 0.00 C ATOM 636 NE ARG A 42 -18.638 -13.293 -8.931 1.00 0.00 N ATOM 637 CZ ARG A 42 -18.699 -14.621 -8.948 1.00 0.00 C ATOM 638 NH1 ARG A 42 -18.484 -15.311 -7.836 1.00 0.00 N ATOM 639 NH2 ARG A 42 -18.973 -15.259 -10.077 1.00 0.00 N ATOM 0 H ARG A 42 -16.877 -8.005 -6.617 1.00 0.00 H new ATOM 0 HA ARG A 42 -17.841 -10.479 -5.574 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -18.075 -9.086 -7.928 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -16.919 -10.318 -8.395 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -19.604 -10.898 -7.091 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -19.315 -10.936 -8.819 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -17.268 -12.510 -7.558 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -18.807 -12.989 -6.868 1.00 0.00 H new ATOM 0 HE ARG A 42 -18.806 -12.792 -9.803 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -18.271 -14.823 -6.966 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -18.531 -16.330 -7.851 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -19.137 -14.731 -10.934 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -19.019 -16.278 -10.089 1.00 0.00 H new ATOM 653 N PHE A 43 -15.242 -10.991 -5.046 1.00 0.00 N ATOM 654 CA PHE A 43 -14.024 -11.772 -4.868 1.00 0.00 C ATOM 655 C PHE A 43 -13.639 -11.846 -3.394 1.00 0.00 C ATOM 656 O PHE A 43 -13.264 -12.907 -2.893 1.00 0.00 O ATOM 657 CB PHE A 43 -12.878 -11.162 -5.676 1.00 0.00 C ATOM 658 CG PHE A 43 -12.523 -11.949 -6.905 1.00 0.00 C ATOM 659 CD1 PHE A 43 -11.961 -13.216 -6.796 1.00 0.00 C ATOM 660 CD2 PHE A 43 -12.752 -11.423 -8.172 1.00 0.00 C ATOM 661 CE1 PHE A 43 -11.634 -13.946 -7.929 1.00 0.00 C ATOM 662 CE2 PHE A 43 -12.425 -12.148 -9.309 1.00 0.00 C ATOM 663 CZ PHE A 43 -11.863 -13.411 -9.184 1.00 0.00 C ATOM 0 H PHE A 43 -15.572 -10.525 -4.201 1.00 0.00 H new ATOM 0 HA PHE A 43 -14.214 -12.783 -5.228 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -13.151 -10.149 -5.970 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -11.997 -11.083 -5.039 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -11.777 -13.636 -5.818 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -13.189 -10.440 -8.272 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -11.201 -14.931 -7.832 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -12.607 -11.731 -10.288 1.00 0.00 H new ATOM 0 HZ PHE A 43 -11.604 -13.976 -10.067 1.00 0.00 H new ATOM 673 N GLY A 44 -13.736 -10.715 -2.705 1.00 0.00 N ATOM 674 CA GLY A 44 -13.394 -10.673 -1.296 1.00 0.00 C ATOM 675 C GLY A 44 -12.200 -9.784 -1.013 1.00 0.00 C ATOM 676 O GLY A 44 -11.182 -10.246 -0.496 1.00 0.00 O ATOM 0 H GLY A 44 -14.046 -9.826 -3.097 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -14.252 -10.314 -0.728 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -13.181 -11.683 -0.947 1.00 0.00 H new ATOM 680 N LYS A 45 -12.323 -8.505 -1.351 1.00 0.00 N ATOM 681 CA LYS A 45 -11.245 -7.549 -1.130 1.00 0.00 C ATOM 682 C LYS A 45 -11.795 -6.203 -0.670 1.00 0.00 C ATOM 683 O LYS A 45 -12.876 -5.789 -1.089 1.00 0.00 O ATOM 684 CB LYS A 45 -10.424 -7.369 -2.408 1.00 0.00 C ATOM 685 CG LYS A 45 -10.164 -8.670 -3.150 1.00 0.00 C ATOM 686 CD LYS A 45 -9.463 -8.425 -4.477 1.00 0.00 C ATOM 687 CE LYS A 45 -7.990 -8.110 -4.279 1.00 0.00 C ATOM 688 NZ LYS A 45 -7.176 -8.487 -5.467 1.00 0.00 N ATOM 0 H LYS A 45 -13.159 -8.107 -1.779 1.00 0.00 H new ATOM 0 HA LYS A 45 -10.600 -7.943 -0.345 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -10.946 -6.680 -3.072 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -9.470 -6.907 -2.155 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -9.553 -9.327 -2.531 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -11.109 -9.185 -3.326 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -9.566 -9.305 -5.112 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -9.946 -7.598 -4.998 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -7.870 -7.045 -4.080 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -7.620 -8.641 -3.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -6.177 -8.256 -5.291 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -7.269 -9.508 -5.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -7.512 -7.961 -6.299 1.00 0.00 H new ATOM 702 N THR A 46 -11.046 -5.527 0.193 1.00 0.00 N ATOM 703 CA THR A 46 -11.460 -4.228 0.711 1.00 0.00 C ATOM 704 C THR A 46 -11.042 -3.107 -0.236 1.00 0.00 C ATOM 705 O THR A 46 -10.100 -3.256 -1.014 1.00 0.00 O ATOM 706 CB THR A 46 -10.856 -3.994 2.096 1.00 0.00 C ATOM 707 OG1 THR A 46 -9.468 -4.277 2.093 1.00 0.00 O ATOM 708 CG2 THR A 46 -11.494 -4.839 3.177 1.00 0.00 C ATOM 0 H THR A 46 -10.149 -5.857 0.549 1.00 0.00 H new ATOM 0 HA THR A 46 -12.547 -4.225 0.791 1.00 0.00 H new ATOM 0 HB THR A 46 -11.044 -2.944 2.319 1.00 0.00 H new ATOM 0 HG1 THR A 46 -8.980 -3.527 2.493 1.00 0.00 H new ATOM 0 HG21 THR A 46 -11.019 -4.624 4.134 1.00 0.00 H new ATOM 0 HG22 THR A 46 -12.557 -4.608 3.239 1.00 0.00 H new ATOM 0 HG23 THR A 46 -11.366 -5.894 2.937 1.00 0.00 H new ATOM 716 N ALA A 47 -11.751 -1.985 -0.163 1.00 0.00 N ATOM 717 CA ALA A 47 -11.455 -0.839 -1.013 1.00 0.00 C ATOM 718 C ALA A 47 -10.000 -0.407 -0.865 1.00 0.00 C ATOM 719 O ALA A 47 -9.430 0.209 -1.765 1.00 0.00 O ATOM 720 CB ALA A 47 -12.386 0.318 -0.680 1.00 0.00 C ATOM 0 H ALA A 47 -12.534 -1.846 0.476 1.00 0.00 H new ATOM 0 HA ALA A 47 -11.616 -1.135 -2.050 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -12.154 1.168 -1.322 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -13.419 0.012 -0.842 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -12.252 0.604 0.363 1.00 0.00 H new ATOM 726 N LEU A 48 -9.405 -0.737 0.277 1.00 0.00 N ATOM 727 CA LEU A 48 -8.017 -0.384 0.545 1.00 0.00 C ATOM 728 C LEU A 48 -7.068 -1.245 -0.282 1.00 0.00 C ATOM 729 O LEU A 48 -6.164 -0.731 -0.943 1.00 0.00 O ATOM 730 CB LEU A 48 -7.709 -0.549 2.032 1.00 0.00 C ATOM 731 CG LEU A 48 -7.614 0.758 2.822 1.00 0.00 C ATOM 732 CD1 LEU A 48 -7.528 0.473 4.314 1.00 0.00 C ATOM 733 CD2 LEU A 48 -6.416 1.572 2.361 1.00 0.00 C ATOM 0 H LEU A 48 -9.863 -1.248 1.031 1.00 0.00 H new ATOM 0 HA LEU A 48 -7.870 0.659 0.263 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -8.483 -1.172 2.481 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -6.767 -1.087 2.135 1.00 0.00 H new ATOM 0 HG LEU A 48 -8.516 1.341 2.636 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -7.461 1.414 4.861 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -8.418 -0.069 4.633 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -6.643 -0.130 4.519 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -6.364 2.498 2.933 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -5.503 0.997 2.517 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -6.521 1.806 1.301 1.00 0.00 H new ATOM 745 N GLN A 49 -7.280 -2.555 -0.242 1.00 0.00 N ATOM 746 CA GLN A 49 -6.444 -3.489 -0.989 1.00 0.00 C ATOM 747 C GLN A 49 -6.586 -3.255 -2.492 1.00 0.00 C ATOM 748 O GLN A 49 -5.663 -3.520 -3.261 1.00 0.00 O ATOM 749 CB GLN A 49 -6.818 -4.933 -0.637 1.00 0.00 C ATOM 750 CG GLN A 49 -6.531 -5.936 -1.744 1.00 0.00 C ATOM 751 CD GLN A 49 -5.051 -6.068 -2.045 1.00 0.00 C ATOM 752 OE1 GLN A 49 -4.326 -6.743 -1.161 1.00 0.00 O flip ATOM 753 NE2 GLN A 49 -4.566 -5.571 -3.061 1.00 0.00 N flip ATOM 0 H GLN A 49 -8.024 -2.995 0.300 1.00 0.00 H new ATOM 0 HA GLN A 49 -5.404 -3.319 -0.712 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -6.272 -5.230 0.259 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -7.879 -4.973 -0.392 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -6.928 -6.910 -1.458 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -7.056 -5.632 -2.649 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -5.161 -5.060 -3.713 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -3.569 -5.670 -3.251 1.00 0.00 H new ATOM 762 N VAL A 50 -7.747 -2.756 -2.900 1.00 0.00 N ATOM 763 CA VAL A 50 -8.011 -2.485 -4.308 1.00 0.00 C ATOM 764 C VAL A 50 -7.743 -1.022 -4.642 1.00 0.00 C ATOM 765 O VAL A 50 -7.654 -0.649 -5.812 1.00 0.00 O ATOM 766 CB VAL A 50 -9.463 -2.829 -4.684 1.00 0.00 C ATOM 767 CG1 VAL A 50 -9.722 -4.318 -4.506 1.00 0.00 C ATOM 768 CG2 VAL A 50 -10.438 -2.006 -3.856 1.00 0.00 C ATOM 0 H VAL A 50 -8.521 -2.531 -2.275 1.00 0.00 H new ATOM 0 HA VAL A 50 -7.337 -3.118 -4.885 1.00 0.00 H new ATOM 0 HB VAL A 50 -9.616 -2.581 -5.734 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -10.754 -4.543 -4.777 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -9.047 -4.884 -5.148 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -9.551 -4.595 -3.466 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -11.460 -2.263 -4.136 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -10.287 -2.219 -2.798 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -10.267 -0.945 -4.040 1.00 0.00 H new ATOM 778 N MET A 51 -7.615 -0.198 -3.607 1.00 0.00 N ATOM 779 CA MET A 51 -7.357 1.225 -3.790 1.00 0.00 C ATOM 780 C MET A 51 -6.280 1.451 -4.845 1.00 0.00 C ATOM 781 O MET A 51 -5.443 0.581 -5.087 1.00 0.00 O ATOM 782 CB MET A 51 -6.931 1.862 -2.466 1.00 0.00 C ATOM 783 CG MET A 51 -7.597 3.200 -2.192 1.00 0.00 C ATOM 784 SD MET A 51 -6.969 3.994 -0.700 1.00 0.00 S ATOM 785 CE MET A 51 -5.228 3.583 -0.804 1.00 0.00 C ATOM 0 H MET A 51 -7.686 -0.492 -2.633 1.00 0.00 H new ATOM 0 HA MET A 51 -8.279 1.695 -4.131 1.00 0.00 H new ATOM 0 HB2 MET A 51 -7.164 1.176 -1.651 1.00 0.00 H new ATOM 0 HB3 MET A 51 -5.850 1.998 -2.469 1.00 0.00 H new ATOM 0 HG2 MET A 51 -7.440 3.861 -3.044 1.00 0.00 H new ATOM 0 HG3 MET A 51 -8.673 3.053 -2.096 1.00 0.00 H new ATOM 0 HE1 MET A 51 -4.642 4.351 -0.300 1.00 0.00 H new ATOM 0 HE2 MET A 51 -5.052 2.620 -0.325 1.00 0.00 H new ATOM 0 HE3 MET A 51 -4.929 3.527 -1.851 1.00 0.00 H new ATOM 795 N MET A 52 -6.307 2.622 -5.471 1.00 0.00 N ATOM 796 CA MET A 52 -5.333 2.961 -6.502 1.00 0.00 C ATOM 797 C MET A 52 -4.369 4.035 -6.009 1.00 0.00 C ATOM 798 O MET A 52 -3.771 4.760 -6.806 1.00 0.00 O ATOM 799 CB MET A 52 -6.047 3.439 -7.768 1.00 0.00 C ATOM 800 CG MET A 52 -6.480 4.895 -7.710 1.00 0.00 C ATOM 801 SD MET A 52 -5.427 5.973 -8.700 1.00 0.00 S ATOM 802 CE MET A 52 -6.588 7.259 -9.152 1.00 0.00 C ATOM 0 H MET A 52 -6.993 3.353 -5.283 1.00 0.00 H new ATOM 0 HA MET A 52 -4.758 2.064 -6.734 1.00 0.00 H new ATOM 0 HB2 MET A 52 -5.385 3.299 -8.623 1.00 0.00 H new ATOM 0 HB3 MET A 52 -6.924 2.814 -7.938 1.00 0.00 H new ATOM 0 HG2 MET A 52 -7.509 4.978 -8.060 1.00 0.00 H new ATOM 0 HG3 MET A 52 -6.467 5.233 -6.674 1.00 0.00 H new ATOM 0 HE1 MET A 52 -6.068 8.039 -9.708 1.00 0.00 H new ATOM 0 HE2 MET A 52 -7.377 6.835 -9.773 1.00 0.00 H new ATOM 0 HE3 MET A 52 -7.026 7.687 -8.250 1.00 0.00 H new ATOM 812 N PHE A 53 -4.223 4.134 -4.691 1.00 0.00 N ATOM 813 CA PHE A 53 -3.331 5.120 -4.090 1.00 0.00 C ATOM 814 C PHE A 53 -3.337 6.420 -4.889 1.00 0.00 C ATOM 815 O PHE A 53 -2.333 7.131 -4.944 1.00 0.00 O ATOM 816 CB PHE A 53 -1.906 4.568 -4.004 1.00 0.00 C ATOM 817 CG PHE A 53 -1.741 3.478 -2.984 1.00 0.00 C ATOM 818 CD1 PHE A 53 -2.501 2.316 -3.062 1.00 0.00 C ATOM 819 CD2 PHE A 53 -0.824 3.611 -1.945 1.00 0.00 C ATOM 820 CE1 PHE A 53 -2.350 1.307 -2.123 1.00 0.00 C ATOM 821 CE2 PHE A 53 -0.670 2.604 -1.004 1.00 0.00 C ATOM 822 CZ PHE A 53 -1.434 1.451 -1.094 1.00 0.00 C ATOM 0 H PHE A 53 -4.711 3.543 -4.018 1.00 0.00 H new ATOM 0 HA PHE A 53 -3.692 5.331 -3.084 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -1.615 4.185 -4.982 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -1.224 5.384 -3.765 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -3.216 2.198 -3.862 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -0.226 4.508 -1.871 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -2.946 0.409 -2.194 1.00 0.00 H new ATOM 0 HE2 PHE A 53 0.044 2.718 -0.202 1.00 0.00 H new ATOM 0 HZ PHE A 53 -1.315 0.665 -0.362 1.00 0.00 H new ATOM 832 N GLY A 54 -4.474 6.727 -5.506 1.00 0.00 N ATOM 833 CA GLY A 54 -4.588 7.941 -6.293 1.00 0.00 C ATOM 834 C GLY A 54 -4.640 9.185 -5.428 1.00 0.00 C ATOM 835 O GLY A 54 -3.614 9.814 -5.172 1.00 0.00 O ATOM 0 H GLY A 54 -5.319 6.156 -5.475 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -3.740 8.010 -6.975 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -5.487 7.890 -6.907 1.00 0.00 H new ATOM 839 N SER A 55 -5.839 9.538 -4.977 1.00 0.00 N ATOM 840 CA SER A 55 -6.021 10.713 -4.134 1.00 0.00 C ATOM 841 C SER A 55 -5.599 10.419 -2.699 1.00 0.00 C ATOM 842 O SER A 55 -6.146 9.529 -2.050 1.00 0.00 O ATOM 843 CB SER A 55 -7.482 11.169 -4.165 1.00 0.00 C ATOM 844 OG SER A 55 -7.883 11.506 -5.481 1.00 0.00 O ATOM 0 H SER A 55 -6.698 9.028 -5.181 1.00 0.00 H new ATOM 0 HA SER A 55 -5.391 11.512 -4.525 1.00 0.00 H new ATOM 0 HB2 SER A 55 -8.122 10.376 -3.778 1.00 0.00 H new ATOM 0 HB3 SER A 55 -7.611 12.031 -3.510 1.00 0.00 H new ATOM 0 HG SER A 55 -8.795 11.183 -5.638 1.00 0.00 H new ATOM 850 N PRO A 56 -4.616 11.167 -2.182 1.00 0.00 N ATOM 851 CA PRO A 56 -4.125 10.984 -0.815 1.00 0.00 C ATOM 852 C PRO A 56 -5.258 10.979 0.205 1.00 0.00 C ATOM 853 O PRO A 56 -5.282 10.156 1.119 1.00 0.00 O ATOM 854 CB PRO A 56 -3.213 12.193 -0.600 1.00 0.00 C ATOM 855 CG PRO A 56 -2.764 12.575 -1.968 1.00 0.00 C ATOM 856 CD PRO A 56 -3.911 12.253 -2.886 1.00 0.00 C ATOM 0 HA PRO A 56 -3.619 10.027 -0.685 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -3.747 13.011 -0.116 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -2.366 11.942 0.039 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -2.513 13.635 -2.014 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -1.869 12.022 -2.253 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -4.557 13.117 -3.041 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -3.562 11.935 -3.869 1.00 0.00 H new ATOM 864 N ALA A 57 -6.194 11.907 0.040 1.00 0.00 N ATOM 865 CA ALA A 57 -7.333 12.016 0.944 1.00 0.00 C ATOM 866 C ALA A 57 -8.213 10.773 0.889 1.00 0.00 C ATOM 867 O ALA A 57 -8.865 10.425 1.872 1.00 0.00 O ATOM 868 CB ALA A 57 -8.147 13.258 0.619 1.00 0.00 C ATOM 0 H ALA A 57 -6.186 12.596 -0.712 1.00 0.00 H new ATOM 0 HA ALA A 57 -6.946 12.102 1.959 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -8.994 13.327 1.302 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -7.520 14.143 0.728 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -8.511 13.196 -0.406 1.00 0.00 H new ATOM 874 N VAL A 58 -8.227 10.100 -0.257 1.00 0.00 N ATOM 875 CA VAL A 58 -9.024 8.900 -0.414 1.00 0.00 C ATOM 876 C VAL A 58 -8.545 7.829 0.559 1.00 0.00 C ATOM 877 O VAL A 58 -9.348 7.134 1.181 1.00 0.00 O ATOM 878 CB VAL A 58 -8.955 8.374 -1.865 1.00 0.00 C ATOM 879 CG1 VAL A 58 -9.255 6.887 -1.924 1.00 0.00 C ATOM 880 CG2 VAL A 58 -9.908 9.150 -2.759 1.00 0.00 C ATOM 0 H VAL A 58 -7.696 10.368 -1.085 1.00 0.00 H new ATOM 0 HA VAL A 58 -10.063 9.146 -0.194 1.00 0.00 H new ATOM 0 HB VAL A 58 -7.939 8.524 -2.230 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -9.199 6.545 -2.958 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -8.526 6.345 -1.322 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -10.256 6.702 -1.534 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -9.846 8.766 -3.777 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -10.927 9.036 -2.390 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -9.635 10.205 -2.752 1.00 0.00 H new ATOM 890 N ALA A 59 -7.228 7.713 0.692 1.00 0.00 N ATOM 891 CA ALA A 59 -6.638 6.741 1.599 1.00 0.00 C ATOM 892 C ALA A 59 -7.017 7.053 3.041 1.00 0.00 C ATOM 893 O ALA A 59 -7.480 6.183 3.777 1.00 0.00 O ATOM 894 CB ALA A 59 -5.126 6.715 1.439 1.00 0.00 C ATOM 0 H ALA A 59 -6.551 8.281 0.183 1.00 0.00 H new ATOM 0 HA ALA A 59 -7.029 5.755 1.348 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -4.700 5.983 2.125 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -4.873 6.443 0.414 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -4.719 7.701 1.663 1.00 0.00 H new ATOM 900 N LEU A 60 -6.819 8.307 3.435 1.00 0.00 N ATOM 901 CA LEU A 60 -7.142 8.746 4.785 1.00 0.00 C ATOM 902 C LEU A 60 -8.639 8.619 5.050 1.00 0.00 C ATOM 903 O LEU A 60 -9.055 8.215 6.136 1.00 0.00 O ATOM 904 CB LEU A 60 -6.694 10.195 4.991 1.00 0.00 C ATOM 905 CG LEU A 60 -6.794 10.708 6.429 1.00 0.00 C ATOM 906 CD1 LEU A 60 -6.614 9.567 7.418 1.00 0.00 C ATOM 907 CD2 LEU A 60 -5.767 11.801 6.678 1.00 0.00 C ATOM 0 H LEU A 60 -6.435 9.038 2.836 1.00 0.00 H new ATOM 0 HA LEU A 60 -6.611 8.106 5.490 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -5.660 10.290 4.659 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -7.295 10.839 4.349 1.00 0.00 H new ATOM 0 HG LEU A 60 -7.788 11.132 6.574 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -6.688 9.952 8.435 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -7.390 8.819 7.256 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -5.634 9.111 7.273 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -5.853 12.154 7.706 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -4.765 11.404 6.513 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -5.945 12.630 5.994 1.00 0.00 H new ATOM 919 N GLU A 61 -9.443 8.965 4.049 1.00 0.00 N ATOM 920 CA GLU A 61 -10.894 8.888 4.171 1.00 0.00 C ATOM 921 C GLU A 61 -11.345 7.448 4.387 1.00 0.00 C ATOM 922 O GLU A 61 -12.207 7.175 5.223 1.00 0.00 O ATOM 923 CB GLU A 61 -11.565 9.460 2.920 1.00 0.00 C ATOM 924 CG GLU A 61 -12.342 10.741 3.178 1.00 0.00 C ATOM 925 CD GLU A 61 -11.653 11.651 4.176 1.00 0.00 C ATOM 926 OE1 GLU A 61 -10.809 12.468 3.750 1.00 0.00 O ATOM 927 OE2 GLU A 61 -11.956 11.548 5.383 1.00 0.00 O ATOM 0 H GLU A 61 -9.114 9.301 3.144 1.00 0.00 H new ATOM 0 HA GLU A 61 -11.192 9.479 5.037 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -10.803 9.653 2.165 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -12.241 8.712 2.506 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -12.477 11.275 2.238 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -13.336 10.490 3.547 1.00 0.00 H new ATOM 934 N LEU A 62 -10.755 6.527 3.632 1.00 0.00 N ATOM 935 CA LEU A 62 -11.097 5.114 3.744 1.00 0.00 C ATOM 936 C LEU A 62 -10.757 4.589 5.134 1.00 0.00 C ATOM 937 O LEU A 62 -11.620 4.069 5.841 1.00 0.00 O ATOM 938 CB LEU A 62 -10.356 4.299 2.681 1.00 0.00 C ATOM 939 CG LEU A 62 -11.171 3.983 1.424 1.00 0.00 C ATOM 940 CD1 LEU A 62 -10.487 2.904 0.600 1.00 0.00 C ATOM 941 CD2 LEU A 62 -12.583 3.558 1.799 1.00 0.00 C ATOM 0 H LEU A 62 -10.038 6.734 2.936 1.00 0.00 H new ATOM 0 HA LEU A 62 -12.170 5.009 3.584 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -9.459 4.844 2.387 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -10.027 3.361 3.128 1.00 0.00 H new ATOM 0 HG LEU A 62 -11.234 4.886 0.817 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -11.081 2.693 -0.289 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -9.497 3.247 0.301 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -10.392 1.996 1.196 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -13.149 3.337 0.894 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -12.540 2.668 2.427 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -13.073 4.364 2.345 1.00 0.00 H new ATOM 953 N LEU A 63 -9.494 4.730 5.521 1.00 0.00 N ATOM 954 CA LEU A 63 -9.040 4.276 6.829 1.00 0.00 C ATOM 955 C LEU A 63 -9.745 5.042 7.943 1.00 0.00 C ATOM 956 O LEU A 63 -9.975 4.509 9.029 1.00 0.00 O ATOM 957 CB LEU A 63 -7.526 4.446 6.954 1.00 0.00 C ATOM 958 CG LEU A 63 -6.694 3.376 6.244 1.00 0.00 C ATOM 959 CD1 LEU A 63 -5.399 3.972 5.713 1.00 0.00 C ATOM 960 CD2 LEU A 63 -6.403 2.216 7.184 1.00 0.00 C ATOM 0 H LEU A 63 -8.766 5.155 4.947 1.00 0.00 H new ATOM 0 HA LEU A 63 -9.287 3.219 6.926 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -7.251 5.422 6.555 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -7.262 4.448 8.012 1.00 0.00 H new ATOM 0 HG LEU A 63 -7.269 2.997 5.399 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -4.820 3.196 5.211 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -5.628 4.769 5.005 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -4.819 4.379 6.541 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -5.810 1.465 6.662 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -5.848 2.579 8.049 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -7.342 1.772 7.515 1.00 0.00 H new ATOM 972 N LYS A 64 -10.085 6.298 7.667 1.00 0.00 N ATOM 973 CA LYS A 64 -10.762 7.142 8.641 1.00 0.00 C ATOM 974 C LYS A 64 -12.135 6.577 8.991 1.00 0.00 C ATOM 975 O LYS A 64 -12.504 6.497 10.164 1.00 0.00 O ATOM 976 CB LYS A 64 -10.905 8.561 8.091 1.00 0.00 C ATOM 977 CG LYS A 64 -9.769 9.488 8.496 1.00 0.00 C ATOM 978 CD LYS A 64 -10.154 10.355 9.684 1.00 0.00 C ATOM 979 CE LYS A 64 -9.629 11.773 9.530 1.00 0.00 C ATOM 980 NZ LYS A 64 -10.304 12.720 10.461 1.00 0.00 N ATOM 0 H LYS A 64 -9.901 6.753 6.773 1.00 0.00 H new ATOM 0 HA LYS A 64 -10.161 7.167 9.550 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -10.956 8.517 7.003 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -11.848 8.983 8.438 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -8.888 8.897 8.746 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -9.498 10.124 7.653 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -11.239 10.376 9.784 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -9.758 9.916 10.600 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -8.555 11.785 9.716 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -9.778 12.106 8.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -9.918 13.676 10.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -11.326 12.729 10.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -10.141 12.418 11.443 1.00 0.00 H new ATOM 994 N GLN A 65 -12.889 6.188 7.968 1.00 0.00 N ATOM 995 CA GLN A 65 -14.223 5.631 8.168 1.00 0.00 C ATOM 996 C GLN A 65 -14.175 4.418 9.089 1.00 0.00 C ATOM 997 O GLN A 65 -15.151 4.106 9.772 1.00 0.00 O ATOM 998 CB GLN A 65 -14.842 5.240 6.824 1.00 0.00 C ATOM 999 CG GLN A 65 -16.093 4.387 6.955 1.00 0.00 C ATOM 1000 CD GLN A 65 -17.131 5.011 7.866 1.00 0.00 C ATOM 1001 OE1 GLN A 65 -17.447 6.278 7.622 1.00 0.00 O flip ATOM 1002 NE2 GLN A 65 -17.643 4.363 8.779 1.00 0.00 N flip ATOM 0 H GLN A 65 -12.599 6.248 6.992 1.00 0.00 H new ATOM 0 HA GLN A 65 -14.841 6.396 8.637 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -15.087 6.146 6.269 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -14.102 4.696 6.237 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -16.528 4.232 5.968 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -15.820 3.405 7.341 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -17.370 3.392 8.930 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -18.340 4.797 9.384 1.00 0.00 H new ATOM 1011 N GLY A 66 -13.035 3.736 9.102 1.00 0.00 N ATOM 1012 CA GLY A 66 -12.882 2.563 9.943 1.00 0.00 C ATOM 1013 C GLY A 66 -12.613 1.307 9.140 1.00 0.00 C ATOM 1014 O GLY A 66 -13.244 0.273 9.361 1.00 0.00 O ATOM 0 H GLY A 66 -12.214 3.974 8.545 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -12.062 2.726 10.643 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -13.786 2.425 10.537 1.00 0.00 H new ATOM 1018 N ALA A 67 -11.673 1.394 8.206 1.00 0.00 N ATOM 1019 CA ALA A 67 -11.321 0.256 7.366 1.00 0.00 C ATOM 1020 C ALA A 67 -9.942 -0.285 7.727 1.00 0.00 C ATOM 1021 O ALA A 67 -8.952 0.444 7.705 1.00 0.00 O ATOM 1022 CB ALA A 67 -11.369 0.649 5.899 1.00 0.00 C ATOM 0 H ALA A 67 -11.141 2.242 8.011 1.00 0.00 H new ATOM 0 HA ALA A 67 -12.050 -0.535 7.542 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -11.104 -0.210 5.283 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -12.375 0.981 5.644 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -10.662 1.458 5.716 1.00 0.00 H new ATOM 1028 N SER A 68 -9.886 -1.571 8.059 1.00 0.00 N ATOM 1029 CA SER A 68 -8.629 -2.211 8.426 1.00 0.00 C ATOM 1030 C SER A 68 -7.637 -2.166 7.267 1.00 0.00 C ATOM 1031 O SER A 68 -7.937 -2.617 6.161 1.00 0.00 O ATOM 1032 CB SER A 68 -8.875 -3.662 8.844 1.00 0.00 C ATOM 1033 OG SER A 68 -10.261 -3.956 8.879 1.00 0.00 O ATOM 0 H SER A 68 -10.697 -2.190 8.081 1.00 0.00 H new ATOM 0 HA SER A 68 -8.203 -1.664 9.267 1.00 0.00 H new ATOM 0 HB2 SER A 68 -8.375 -4.334 8.146 1.00 0.00 H new ATOM 0 HB3 SER A 68 -8.438 -3.840 9.827 1.00 0.00 H new ATOM 0 HG SER A 68 -10.391 -4.890 9.147 1.00 0.00 H new ATOM 1039 N PRO A 69 -6.437 -1.618 7.510 1.00 0.00 N ATOM 1040 CA PRO A 69 -5.393 -1.511 6.487 1.00 0.00 C ATOM 1041 C PRO A 69 -4.762 -2.860 6.161 1.00 0.00 C ATOM 1042 O PRO A 69 -4.456 -3.151 5.004 1.00 0.00 O ATOM 1043 CB PRO A 69 -4.365 -0.580 7.128 1.00 0.00 C ATOM 1044 CG PRO A 69 -4.542 -0.775 8.594 1.00 0.00 C ATOM 1045 CD PRO A 69 -6.005 -1.059 8.804 1.00 0.00 C ATOM 0 HA PRO A 69 -5.786 -1.145 5.538 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -3.352 -0.832 6.814 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -4.538 0.458 6.843 1.00 0.00 H new ATOM 0 HG2 PRO A 69 -3.929 -1.601 8.954 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -4.235 0.114 9.145 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -6.164 -1.765 9.619 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -6.558 -0.153 9.054 1.00 0.00 H new ATOM 1053 N ASN A 70 -4.569 -3.681 7.188 1.00 0.00 N ATOM 1054 CA ASN A 70 -3.974 -5.000 7.008 1.00 0.00 C ATOM 1055 C ASN A 70 -4.940 -5.939 6.295 1.00 0.00 C ATOM 1056 O ASN A 70 -5.868 -6.471 6.904 1.00 0.00 O ATOM 1057 CB ASN A 70 -3.574 -5.593 8.361 1.00 0.00 C ATOM 1058 CG ASN A 70 -2.449 -6.600 8.240 1.00 0.00 C ATOM 1059 OD1 ASN A 70 -2.677 -7.771 7.935 1.00 0.00 O ATOM 1060 ND2 ASN A 70 -1.223 -6.149 8.481 1.00 0.00 N ATOM 0 H ASN A 70 -4.816 -3.457 8.152 1.00 0.00 H new ATOM 0 HA ASN A 70 -3.082 -4.887 6.391 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -3.268 -4.789 9.031 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -4.441 -6.073 8.815 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -0.425 -6.781 8.416 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -1.079 -5.171 8.731 1.00 0.00 H new ATOM 1067 N VAL A 71 -4.716 -6.137 5.001 1.00 0.00 N ATOM 1068 CA VAL A 71 -5.568 -7.011 4.204 1.00 0.00 C ATOM 1069 C VAL A 71 -4.743 -7.851 3.235 1.00 0.00 C ATOM 1070 O VAL A 71 -3.867 -7.334 2.541 1.00 0.00 O ATOM 1071 CB VAL A 71 -6.610 -6.204 3.407 1.00 0.00 C ATOM 1072 CG1 VAL A 71 -7.679 -5.649 4.335 1.00 0.00 C ATOM 1073 CG2 VAL A 71 -5.935 -5.086 2.628 1.00 0.00 C ATOM 0 H VAL A 71 -3.952 -5.704 4.482 1.00 0.00 H new ATOM 0 HA VAL A 71 -6.085 -7.670 4.902 1.00 0.00 H new ATOM 0 HB VAL A 71 -7.094 -6.872 2.694 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -8.406 -5.082 3.754 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -8.182 -6.471 4.843 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -7.216 -4.995 5.074 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -6.686 -4.526 2.071 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -5.424 -4.417 3.320 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -5.211 -5.512 1.934 1.00 0.00 H new ATOM 1083 N GLN A 72 -5.028 -9.147 3.192 1.00 0.00 N ATOM 1084 CA GLN A 72 -4.313 -10.059 2.308 1.00 0.00 C ATOM 1085 C GLN A 72 -5.245 -11.144 1.780 1.00 0.00 C ATOM 1086 O GLN A 72 -5.983 -11.768 2.542 1.00 0.00 O ATOM 1087 CB GLN A 72 -3.133 -10.695 3.044 1.00 0.00 C ATOM 1088 CG GLN A 72 -2.197 -9.680 3.680 1.00 0.00 C ATOM 1089 CD GLN A 72 -1.366 -10.275 4.800 1.00 0.00 C ATOM 1090 OE1 GLN A 72 -1.764 -11.253 5.433 1.00 0.00 O ATOM 1091 NE2 GLN A 72 -0.203 -9.685 5.050 1.00 0.00 N ATOM 0 H GLN A 72 -5.750 -9.590 3.760 1.00 0.00 H new ATOM 0 HA GLN A 72 -3.936 -9.486 1.461 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -3.514 -11.361 3.818 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -2.568 -11.310 2.344 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -1.533 -9.275 2.916 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -2.781 -8.846 4.070 1.00 0.00 H new ATOM 0 HE21 GLN A 72 0.087 -8.876 4.500 1.00 0.00 H new ATOM 0 HE22 GLN A 72 0.400 -10.040 5.792 1.00 0.00 H new ATOM 1133 N GLY A 76 -0.419 -13.379 -0.069 1.00 0.00 N ATOM 1134 CA GLY A 76 -0.042 -12.395 0.929 1.00 0.00 C ATOM 1135 C GLY A 76 0.299 -11.048 0.320 1.00 0.00 C ATOM 1136 O GLY A 76 1.449 -10.614 0.363 1.00 0.00 O ATOM 0 HA2 GLY A 76 -0.859 -12.272 1.640 1.00 0.00 H new ATOM 0 HA3 GLY A 76 0.816 -12.763 1.491 1.00 0.00 H new ATOM 1140 N THR A 77 -0.703 -10.387 -0.248 1.00 0.00 N ATOM 1141 CA THR A 77 -0.499 -9.082 -0.868 1.00 0.00 C ATOM 1142 C THR A 77 -1.446 -8.041 -0.282 1.00 0.00 C ATOM 1143 O THR A 77 -2.589 -8.347 0.058 1.00 0.00 O ATOM 1144 CB THR A 77 -0.700 -9.178 -2.381 1.00 0.00 C ATOM 1145 OG1 THR A 77 0.295 -9.996 -2.969 1.00 0.00 O ATOM 1146 CG2 THR A 77 -0.658 -7.834 -3.076 1.00 0.00 C ATOM 0 H THR A 77 -1.662 -10.731 -0.292 1.00 0.00 H new ATOM 0 HA THR A 77 0.524 -8.768 -0.662 1.00 0.00 H new ATOM 0 HB THR A 77 -1.693 -9.608 -2.513 1.00 0.00 H new ATOM 0 HG1 THR A 77 0.148 -10.046 -3.937 1.00 0.00 H new ATOM 0 HG21 THR A 77 -0.807 -7.973 -4.147 1.00 0.00 H new ATOM 0 HG22 THR A 77 -1.447 -7.195 -2.680 1.00 0.00 H new ATOM 0 HG23 THR A 77 0.310 -7.365 -2.903 1.00 0.00 H new ATOM 1154 N SER A 78 -0.961 -6.809 -0.166 1.00 0.00 N ATOM 1155 CA SER A 78 -1.761 -5.718 0.378 1.00 0.00 C ATOM 1156 C SER A 78 -1.441 -4.406 -0.331 1.00 0.00 C ATOM 1157 O SER A 78 -0.576 -4.356 -1.207 1.00 0.00 O ATOM 1158 CB SER A 78 -1.513 -5.574 1.881 1.00 0.00 C ATOM 1159 OG SER A 78 -0.880 -6.727 2.407 1.00 0.00 O ATOM 0 H SER A 78 -0.016 -6.541 -0.442 1.00 0.00 H new ATOM 0 HA SER A 78 -2.812 -5.953 0.213 1.00 0.00 H new ATOM 0 HB2 SER A 78 -0.892 -4.698 2.068 1.00 0.00 H new ATOM 0 HB3 SER A 78 -2.460 -5.409 2.395 1.00 0.00 H new ATOM 0 HG SER A 78 -0.732 -6.609 3.368 1.00 0.00 H new ATOM 1165 N PRO A 79 -2.137 -3.323 0.042 1.00 0.00 N ATOM 1166 CA PRO A 79 -1.927 -2.003 -0.558 1.00 0.00 C ATOM 1167 C PRO A 79 -0.454 -1.611 -0.592 1.00 0.00 C ATOM 1168 O PRO A 79 0.056 -1.161 -1.617 1.00 0.00 O ATOM 1169 CB PRO A 79 -2.710 -1.068 0.364 1.00 0.00 C ATOM 1170 CG PRO A 79 -3.775 -1.925 0.958 1.00 0.00 C ATOM 1171 CD PRO A 79 -3.182 -3.303 1.081 1.00 0.00 C ATOM 0 HA PRO A 79 -2.253 -1.969 -1.598 1.00 0.00 H new ATOM 0 HB2 PRO A 79 -2.067 -0.643 1.135 1.00 0.00 H new ATOM 0 HB3 PRO A 79 -3.138 -0.232 -0.190 1.00 0.00 H new ATOM 0 HG2 PRO A 79 -4.083 -1.545 1.932 1.00 0.00 H new ATOM 0 HG3 PRO A 79 -4.663 -1.938 0.326 1.00 0.00 H new ATOM 0 HD2 PRO A 79 -2.764 -3.473 2.073 1.00 0.00 H new ATOM 0 HD3 PRO A 79 -3.930 -4.078 0.913 1.00 0.00 H new ATOM 1179 N VAL A 80 0.225 -1.786 0.537 1.00 0.00 N ATOM 1180 CA VAL A 80 1.638 -1.452 0.643 1.00 0.00 C ATOM 1181 C VAL A 80 2.446 -2.118 -0.472 1.00 0.00 C ATOM 1182 O VAL A 80 3.374 -1.523 -1.021 1.00 0.00 O ATOM 1183 CB VAL A 80 2.193 -1.858 2.036 1.00 0.00 C ATOM 1184 CG1 VAL A 80 3.161 -3.036 1.957 1.00 0.00 C ATOM 1185 CG2 VAL A 80 2.851 -0.665 2.705 1.00 0.00 C ATOM 0 H VAL A 80 -0.184 -2.159 1.394 1.00 0.00 H new ATOM 0 HA VAL A 80 1.737 -0.372 0.532 1.00 0.00 H new ATOM 0 HB VAL A 80 1.347 -2.186 2.640 1.00 0.00 H new ATOM 0 HG11 VAL A 80 3.520 -3.280 2.957 1.00 0.00 H new ATOM 0 HG12 VAL A 80 2.649 -3.900 1.535 1.00 0.00 H new ATOM 0 HG13 VAL A 80 4.007 -2.770 1.323 1.00 0.00 H new ATOM 0 HG21 VAL A 80 3.236 -0.962 3.681 1.00 0.00 H new ATOM 0 HG22 VAL A 80 3.672 -0.307 2.084 1.00 0.00 H new ATOM 0 HG23 VAL A 80 2.118 0.131 2.831 1.00 0.00 H new ATOM 1195 N HIS A 81 2.088 -3.355 -0.794 1.00 0.00 N ATOM 1196 CA HIS A 81 2.779 -4.105 -1.836 1.00 0.00 C ATOM 1197 C HIS A 81 2.705 -3.383 -3.176 1.00 0.00 C ATOM 1198 O HIS A 81 3.707 -2.870 -3.676 1.00 0.00 O ATOM 1199 CB HIS A 81 2.176 -5.504 -1.966 1.00 0.00 C ATOM 1200 CG HIS A 81 3.033 -6.578 -1.376 1.00 0.00 C ATOM 1201 ND1 HIS A 81 2.816 -7.050 -0.107 1.00 0.00 N ATOM 1202 CD2 HIS A 81 4.094 -7.226 -1.915 1.00 0.00 C ATOM 1203 CE1 HIS A 81 3.742 -7.969 0.100 1.00 0.00 C ATOM 1204 NE2 HIS A 81 4.542 -8.111 -0.969 1.00 0.00 N ATOM 0 H HIS A 81 1.322 -3.861 -0.348 1.00 0.00 H new ATOM 0 HA HIS A 81 3.828 -4.189 -1.550 1.00 0.00 H new ATOM 0 HB2 HIS A 81 1.201 -5.518 -1.478 1.00 0.00 H new ATOM 0 HB3 HIS A 81 2.008 -5.722 -3.021 1.00 0.00 H new ATOM 0 HD1 HIS A 81 2.089 -6.753 0.544 1.00 0.00 H new ATOM 0 HD2 HIS A 81 4.507 -7.074 -2.901 1.00 0.00 H new ATOM 0 HE1 HIS A 81 3.843 -8.535 1.014 1.00 0.00 H new ATOM 1212 N ASP A 82 1.511 -3.351 -3.757 1.00 0.00 N ATOM 1213 CA ASP A 82 1.303 -2.699 -5.045 1.00 0.00 C ATOM 1214 C ASP A 82 1.706 -1.229 -4.992 1.00 0.00 C ATOM 1215 O ASP A 82 2.184 -0.674 -5.979 1.00 0.00 O ATOM 1216 CB ASP A 82 -0.162 -2.822 -5.467 1.00 0.00 C ATOM 1217 CG ASP A 82 -0.321 -3.542 -6.792 1.00 0.00 C ATOM 1218 OD1 ASP A 82 0.066 -2.967 -7.831 1.00 0.00 O ATOM 1219 OD2 ASP A 82 -0.832 -4.681 -6.790 1.00 0.00 O ATOM 0 H ASP A 82 0.671 -3.769 -3.356 1.00 0.00 H new ATOM 0 HA ASP A 82 1.934 -3.199 -5.780 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -0.716 -3.358 -4.696 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -0.601 -1.827 -5.542 1.00 0.00 H new ATOM 1224 N ALA A 83 1.509 -0.602 -3.836 1.00 0.00 N ATOM 1225 CA ALA A 83 1.849 0.806 -3.665 1.00 0.00 C ATOM 1226 C ALA A 83 3.292 1.085 -4.078 1.00 0.00 C ATOM 1227 O ALA A 83 3.555 1.982 -4.879 1.00 0.00 O ATOM 1228 CB ALA A 83 1.623 1.233 -2.221 1.00 0.00 C ATOM 0 H ALA A 83 1.117 -1.046 -3.006 1.00 0.00 H new ATOM 0 HA ALA A 83 1.196 1.388 -4.315 1.00 0.00 H new ATOM 0 HB1 ALA A 83 1.881 2.286 -2.108 1.00 0.00 H new ATOM 0 HB2 ALA A 83 0.576 1.086 -1.958 1.00 0.00 H new ATOM 0 HB3 ALA A 83 2.251 0.633 -1.562 1.00 0.00 H new ATOM 1234 N ALA A 84 4.222 0.316 -3.524 1.00 0.00 N ATOM 1235 CA ALA A 84 5.639 0.485 -3.833 1.00 0.00 C ATOM 1236 C ALA A 84 5.933 0.165 -5.296 1.00 0.00 C ATOM 1237 O ALA A 84 6.635 0.914 -5.976 1.00 0.00 O ATOM 1238 CB ALA A 84 6.484 -0.391 -2.919 1.00 0.00 C ATOM 0 H ALA A 84 4.022 -0.431 -2.859 1.00 0.00 H new ATOM 0 HA ALA A 84 5.897 1.530 -3.663 1.00 0.00 H new ATOM 0 HB1 ALA A 84 7.539 -0.256 -3.159 1.00 0.00 H new ATOM 0 HB2 ALA A 84 6.309 -0.109 -1.881 1.00 0.00 H new ATOM 0 HB3 ALA A 84 6.210 -1.436 -3.062 1.00 0.00 H new ATOM 1244 N ARG A 85 5.398 -0.955 -5.772 1.00 0.00 N ATOM 1245 CA ARG A 85 5.609 -1.378 -7.152 1.00 0.00 C ATOM 1246 C ARG A 85 4.831 -0.499 -8.128 1.00 0.00 C ATOM 1247 O ARG A 85 5.193 -0.385 -9.299 1.00 0.00 O ATOM 1248 CB ARG A 85 5.190 -2.841 -7.322 1.00 0.00 C ATOM 1249 CG ARG A 85 5.217 -3.321 -8.764 1.00 0.00 C ATOM 1250 CD ARG A 85 6.370 -4.282 -9.011 1.00 0.00 C ATOM 1251 NE ARG A 85 6.069 -5.235 -10.074 1.00 0.00 N ATOM 1252 CZ ARG A 85 5.246 -6.267 -9.926 1.00 0.00 C ATOM 1253 NH1 ARG A 85 4.650 -6.480 -8.761 1.00 0.00 N ATOM 1254 NH2 ARG A 85 5.018 -7.087 -10.943 1.00 0.00 N ATOM 0 H ARG A 85 4.815 -1.586 -5.222 1.00 0.00 H new ATOM 0 HA ARG A 85 6.671 -1.275 -7.376 1.00 0.00 H new ATOM 0 HB2 ARG A 85 5.851 -3.471 -6.726 1.00 0.00 H new ATOM 0 HB3 ARG A 85 4.183 -2.970 -6.924 1.00 0.00 H new ATOM 0 HG2 ARG A 85 4.274 -3.814 -9.002 1.00 0.00 H new ATOM 0 HG3 ARG A 85 5.307 -2.464 -9.432 1.00 0.00 H new ATOM 0 HD2 ARG A 85 7.264 -3.716 -9.274 1.00 0.00 H new ATOM 0 HD3 ARG A 85 6.594 -4.823 -8.092 1.00 0.00 H new ATOM 0 HE ARG A 85 6.515 -5.101 -10.981 1.00 0.00 H new ATOM 0 HH11 ARG A 85 4.823 -5.851 -7.977 1.00 0.00 H new ATOM 0 HH12 ARG A 85 4.018 -7.273 -8.649 1.00 0.00 H new ATOM 0 HH21 ARG A 85 5.475 -6.926 -11.841 1.00 0.00 H new ATOM 0 HH22 ARG A 85 4.386 -7.879 -10.828 1.00 0.00 H new ATOM 1268 N THR A 86 3.760 0.121 -7.643 1.00 0.00 N ATOM 1269 CA THR A 86 2.934 0.985 -8.479 1.00 0.00 C ATOM 1270 C THR A 86 3.642 2.302 -8.776 1.00 0.00 C ATOM 1271 O THR A 86 4.105 2.532 -9.894 1.00 0.00 O ATOM 1272 CB THR A 86 1.594 1.262 -7.797 1.00 0.00 C ATOM 1273 OG1 THR A 86 1.782 1.574 -6.428 1.00 0.00 O ATOM 1274 CG2 THR A 86 0.632 0.097 -7.876 1.00 0.00 C ATOM 0 H THR A 86 3.444 0.041 -6.676 1.00 0.00 H new ATOM 0 HA THR A 86 2.758 0.467 -9.422 1.00 0.00 H new ATOM 0 HB THR A 86 1.163 2.105 -8.337 1.00 0.00 H new ATOM 0 HG1 THR A 86 2.736 1.524 -6.209 1.00 0.00 H new ATOM 0 HG21 THR A 86 -0.299 0.359 -7.373 1.00 0.00 H new ATOM 0 HG22 THR A 86 0.427 -0.135 -8.921 1.00 0.00 H new ATOM 0 HG23 THR A 86 1.074 -0.773 -7.391 1.00 0.00 H new ATOM 1282 N GLY A 87 3.714 3.164 -7.771 1.00 0.00 N ATOM 1283 CA GLY A 87 4.358 4.452 -7.941 1.00 0.00 C ATOM 1284 C GLY A 87 3.458 5.596 -7.522 1.00 0.00 C ATOM 1285 O GLY A 87 3.080 6.432 -8.342 1.00 0.00 O ATOM 0 H GLY A 87 3.337 2.994 -6.839 1.00 0.00 H new ATOM 0 HA2 GLY A 87 5.276 4.479 -7.354 1.00 0.00 H new ATOM 0 HA3 GLY A 87 4.644 4.579 -8.985 1.00 0.00 H new ATOM 1289 N PHE A 88 3.113 5.629 -6.241 1.00 0.00 N ATOM 1290 CA PHE A 88 2.249 6.673 -5.706 1.00 0.00 C ATOM 1291 C PHE A 88 2.605 6.974 -4.256 1.00 0.00 C ATOM 1292 O PHE A 88 1.764 6.869 -3.363 1.00 0.00 O ATOM 1293 CB PHE A 88 0.781 6.254 -5.809 1.00 0.00 C ATOM 1294 CG PHE A 88 0.243 6.287 -7.210 1.00 0.00 C ATOM 1295 CD1 PHE A 88 -0.217 7.477 -7.763 1.00 0.00 C ATOM 1296 CD2 PHE A 88 0.200 5.129 -7.979 1.00 0.00 C ATOM 1297 CE1 PHE A 88 -0.713 7.511 -9.057 1.00 0.00 C ATOM 1298 CE2 PHE A 88 -0.295 5.157 -9.274 1.00 0.00 C ATOM 1299 CZ PHE A 88 -0.752 6.349 -9.813 1.00 0.00 C ATOM 0 H PHE A 88 3.419 4.942 -5.552 1.00 0.00 H new ATOM 0 HA PHE A 88 2.400 7.577 -6.296 1.00 0.00 H new ATOM 0 HB2 PHE A 88 0.671 5.246 -5.410 1.00 0.00 H new ATOM 0 HB3 PHE A 88 0.179 6.912 -5.182 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -0.188 8.384 -7.178 1.00 0.00 H new ATOM 0 HD2 PHE A 88 0.556 4.198 -7.563 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -1.068 8.441 -9.476 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -0.324 4.251 -9.862 1.00 0.00 H new ATOM 0 HZ PHE A 88 -1.138 6.373 -10.821 1.00 0.00 H new ATOM 1309 N LEU A 89 3.859 7.344 -4.033 1.00 0.00 N ATOM 1310 CA LEU A 89 4.338 7.659 -2.691 1.00 0.00 C ATOM 1311 C LEU A 89 3.434 8.683 -2.009 1.00 0.00 C ATOM 1312 O LEU A 89 3.450 8.819 -0.786 1.00 0.00 O ATOM 1313 CB LEU A 89 5.771 8.191 -2.752 1.00 0.00 C ATOM 1314 CG LEU A 89 6.418 8.460 -1.393 1.00 0.00 C ATOM 1315 CD1 LEU A 89 6.051 9.850 -0.895 1.00 0.00 C ATOM 1316 CD2 LEU A 89 5.997 7.401 -0.385 1.00 0.00 C ATOM 0 H LEU A 89 4.565 7.434 -4.764 1.00 0.00 H new ATOM 0 HA LEU A 89 4.319 6.741 -2.104 1.00 0.00 H new ATOM 0 HB2 LEU A 89 6.386 7.474 -3.295 1.00 0.00 H new ATOM 0 HB3 LEU A 89 5.775 9.116 -3.329 1.00 0.00 H new ATOM 0 HG LEU A 89 7.501 8.412 -1.509 1.00 0.00 H new ATOM 0 HD11 LEU A 89 6.520 10.025 0.073 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.401 10.596 -1.608 1.00 0.00 H new ATOM 0 HD13 LEU A 89 4.968 9.926 -0.793 1.00 0.00 H new ATOM 0 HD21 LEU A 89 6.466 7.607 0.577 1.00 0.00 H new ATOM 0 HD22 LEU A 89 4.913 7.418 -0.271 1.00 0.00 H new ATOM 0 HD23 LEU A 89 6.310 6.418 -0.738 1.00 0.00 H new ATOM 1328 N ASP A 90 2.647 9.400 -2.805 1.00 0.00 N ATOM 1329 CA ASP A 90 1.737 10.408 -2.270 1.00 0.00 C ATOM 1330 C ASP A 90 0.732 9.776 -1.313 1.00 0.00 C ATOM 1331 O ASP A 90 0.794 9.986 -0.102 1.00 0.00 O ATOM 1332 CB ASP A 90 1.002 11.118 -3.408 1.00 0.00 C ATOM 1333 CG ASP A 90 1.914 11.440 -4.576 1.00 0.00 C ATOM 1334 OD1 ASP A 90 2.679 12.422 -4.479 1.00 0.00 O ATOM 1335 OD2 ASP A 90 1.862 10.709 -5.587 1.00 0.00 O ATOM 0 H ASP A 90 2.621 9.303 -3.820 1.00 0.00 H new ATOM 0 HA ASP A 90 2.327 11.140 -1.718 1.00 0.00 H new ATOM 0 HB2 ASP A 90 0.181 10.490 -3.754 1.00 0.00 H new ATOM 0 HB3 ASP A 90 0.560 12.040 -3.031 1.00 0.00 H new ATOM 1340 N THR A 91 -0.196 9.002 -1.866 1.00 0.00 N ATOM 1341 CA THR A 91 -1.216 8.337 -1.061 1.00 0.00 C ATOM 1342 C THR A 91 -0.617 7.170 -0.281 1.00 0.00 C ATOM 1343 O THR A 91 -1.112 6.801 0.783 1.00 0.00 O ATOM 1344 CB THR A 91 -2.356 7.840 -1.950 1.00 0.00 C ATOM 1345 OG1 THR A 91 -2.634 8.774 -2.978 1.00 0.00 O ATOM 1346 CG2 THR A 91 -3.642 7.596 -1.192 1.00 0.00 C ATOM 0 H THR A 91 -0.263 8.819 -2.867 1.00 0.00 H new ATOM 0 HA THR A 91 -1.611 9.062 -0.350 1.00 0.00 H new ATOM 0 HB THR A 91 -2.010 6.892 -2.361 1.00 0.00 H new ATOM 0 HG1 THR A 91 -2.215 8.477 -3.812 1.00 0.00 H new ATOM 0 HG21 THR A 91 -4.410 7.245 -1.882 1.00 0.00 H new ATOM 0 HG22 THR A 91 -3.473 6.843 -0.423 1.00 0.00 H new ATOM 0 HG23 THR A 91 -3.971 8.524 -0.725 1.00 0.00 H new ATOM 1354 N LEU A 92 0.449 6.593 -0.822 1.00 0.00 N ATOM 1355 CA LEU A 92 1.118 5.465 -0.182 1.00 0.00 C ATOM 1356 C LEU A 92 1.556 5.822 1.236 1.00 0.00 C ATOM 1357 O LEU A 92 1.172 5.160 2.199 1.00 0.00 O ATOM 1358 CB LEU A 92 2.328 5.033 -1.013 1.00 0.00 C ATOM 1359 CG LEU A 92 3.247 4.009 -0.344 1.00 0.00 C ATOM 1360 CD1 LEU A 92 4.154 3.357 -1.377 1.00 0.00 C ATOM 1361 CD2 LEU A 92 4.073 4.669 0.750 1.00 0.00 C ATOM 0 H LEU A 92 0.870 6.887 -1.703 1.00 0.00 H new ATOM 0 HA LEU A 92 0.411 4.638 -0.122 1.00 0.00 H new ATOM 0 HB2 LEU A 92 1.971 4.616 -1.955 1.00 0.00 H new ATOM 0 HB3 LEU A 92 2.915 5.918 -1.258 1.00 0.00 H new ATOM 0 HG LEU A 92 2.629 3.235 0.112 1.00 0.00 H new ATOM 0 HD11 LEU A 92 4.802 2.631 -0.886 1.00 0.00 H new ATOM 0 HD12 LEU A 92 3.546 2.852 -2.128 1.00 0.00 H new ATOM 0 HD13 LEU A 92 4.765 4.121 -1.859 1.00 0.00 H new ATOM 0 HD21 LEU A 92 4.721 3.926 1.215 1.00 0.00 H new ATOM 0 HD22 LEU A 92 4.683 5.462 0.317 1.00 0.00 H new ATOM 0 HD23 LEU A 92 3.408 5.092 1.503 1.00 0.00 H new ATOM 1373 N LYS A 93 2.364 6.869 1.355 1.00 0.00 N ATOM 1374 CA LYS A 93 2.858 7.310 2.655 1.00 0.00 C ATOM 1375 C LYS A 93 1.709 7.552 3.630 1.00 0.00 C ATOM 1376 O LYS A 93 1.855 7.347 4.834 1.00 0.00 O ATOM 1377 CB LYS A 93 3.691 8.583 2.503 1.00 0.00 C ATOM 1378 CG LYS A 93 2.861 9.825 2.233 1.00 0.00 C ATOM 1379 CD LYS A 93 3.738 11.057 2.093 1.00 0.00 C ATOM 1380 CE LYS A 93 3.851 11.500 0.644 1.00 0.00 C ATOM 1381 NZ LYS A 93 3.240 12.841 0.424 1.00 0.00 N ATOM 0 H LYS A 93 2.691 7.429 0.568 1.00 0.00 H new ATOM 0 HA LYS A 93 3.487 6.517 3.060 1.00 0.00 H new ATOM 0 HB2 LYS A 93 4.274 8.736 3.411 1.00 0.00 H new ATOM 0 HB3 LYS A 93 4.401 8.447 1.688 1.00 0.00 H new ATOM 0 HG2 LYS A 93 2.279 9.685 1.322 1.00 0.00 H new ATOM 0 HG3 LYS A 93 2.150 9.973 3.046 1.00 0.00 H new ATOM 0 HD2 LYS A 93 3.324 11.869 2.691 1.00 0.00 H new ATOM 0 HD3 LYS A 93 4.731 10.844 2.488 1.00 0.00 H new ATOM 0 HE2 LYS A 93 4.901 11.527 0.354 1.00 0.00 H new ATOM 0 HE3 LYS A 93 3.362 10.768 0.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 3.338 13.107 -0.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 2.232 12.809 0.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 3.724 13.544 1.018 1.00 0.00 H new ATOM 1395 N VAL A 94 0.564 7.986 3.108 1.00 0.00 N ATOM 1396 CA VAL A 94 -0.600 8.248 3.948 1.00 0.00 C ATOM 1397 C VAL A 94 -0.997 6.997 4.726 1.00 0.00 C ATOM 1398 O VAL A 94 -0.899 6.960 5.952 1.00 0.00 O ATOM 1399 CB VAL A 94 -1.802 8.739 3.111 1.00 0.00 C ATOM 1400 CG1 VAL A 94 -3.100 8.622 3.898 1.00 0.00 C ATOM 1401 CG2 VAL A 94 -1.582 10.172 2.653 1.00 0.00 C ATOM 0 H VAL A 94 0.418 8.162 2.114 1.00 0.00 H new ATOM 0 HA VAL A 94 -0.322 9.035 4.649 1.00 0.00 H new ATOM 0 HB VAL A 94 -1.884 8.102 2.230 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -3.930 8.974 3.285 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -3.267 7.580 4.171 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -3.033 9.228 4.802 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -2.438 10.502 2.065 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -1.469 10.819 3.523 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -0.681 10.224 2.042 1.00 0.00 H new ATOM 1411 N LEU A 95 -1.439 5.971 4.006 1.00 0.00 N ATOM 1412 CA LEU A 95 -1.841 4.717 4.633 1.00 0.00 C ATOM 1413 C LEU A 95 -0.622 3.979 5.177 1.00 0.00 C ATOM 1414 O LEU A 95 -0.715 3.237 6.155 1.00 0.00 O ATOM 1415 CB LEU A 95 -2.580 3.833 3.628 1.00 0.00 C ATOM 1416 CG LEU A 95 -1.841 3.599 2.308 1.00 0.00 C ATOM 1417 CD1 LEU A 95 -1.183 2.227 2.300 1.00 0.00 C ATOM 1418 CD2 LEU A 95 -2.794 3.741 1.130 1.00 0.00 C ATOM 0 H LEU A 95 -1.528 5.983 2.990 1.00 0.00 H new ATOM 0 HA LEU A 95 -2.512 4.946 5.461 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -2.778 2.867 4.093 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -3.547 4.286 3.410 1.00 0.00 H new ATOM 0 HG LEU A 95 -1.061 4.355 2.212 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -0.663 2.079 1.354 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -0.469 2.161 3.121 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -1.945 1.457 2.419 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -2.251 3.571 0.200 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -3.596 3.009 1.221 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -3.218 4.745 1.124 1.00 0.00 H new ATOM 1430 N VAL A 96 0.520 4.191 4.531 1.00 0.00 N ATOM 1431 CA VAL A 96 1.765 3.554 4.940 1.00 0.00 C ATOM 1432 C VAL A 96 2.297 4.168 6.232 1.00 0.00 C ATOM 1433 O VAL A 96 2.794 3.462 7.109 1.00 0.00 O ATOM 1434 CB VAL A 96 2.836 3.671 3.834 1.00 0.00 C ATOM 1435 CG1 VAL A 96 4.226 3.386 4.386 1.00 0.00 C ATOM 1436 CG2 VAL A 96 2.512 2.730 2.684 1.00 0.00 C ATOM 0 H VAL A 96 0.608 4.802 3.719 1.00 0.00 H new ATOM 0 HA VAL A 96 1.549 2.500 5.113 1.00 0.00 H new ATOM 0 HB VAL A 96 2.829 4.695 3.459 1.00 0.00 H new ATOM 0 HG11 VAL A 96 4.961 3.475 3.586 1.00 0.00 H new ATOM 0 HG12 VAL A 96 4.459 4.102 5.174 1.00 0.00 H new ATOM 0 HG13 VAL A 96 4.255 2.376 4.794 1.00 0.00 H new ATOM 0 HG21 VAL A 96 3.275 2.823 1.912 1.00 0.00 H new ATOM 0 HG22 VAL A 96 2.489 1.703 3.049 1.00 0.00 H new ATOM 0 HG23 VAL A 96 1.539 2.988 2.266 1.00 0.00 H new ATOM 1446 N GLU A 97 2.190 5.488 6.341 1.00 0.00 N ATOM 1447 CA GLU A 97 2.660 6.199 7.524 1.00 0.00 C ATOM 1448 C GLU A 97 1.734 5.953 8.710 1.00 0.00 C ATOM 1449 O GLU A 97 2.149 6.045 9.865 1.00 0.00 O ATOM 1450 CB GLU A 97 2.754 7.699 7.239 1.00 0.00 C ATOM 1451 CG GLU A 97 1.401 8.385 7.145 1.00 0.00 C ATOM 1452 CD GLU A 97 0.567 7.875 5.988 1.00 0.00 C ATOM 1453 OE1 GLU A 97 1.158 7.410 4.990 1.00 0.00 O ATOM 1454 OE2 GLU A 97 -0.678 7.939 6.077 1.00 0.00 O ATOM 0 H GLU A 97 1.782 6.087 5.624 1.00 0.00 H new ATOM 0 HA GLU A 97 3.651 5.821 7.775 1.00 0.00 H new ATOM 0 HB2 GLU A 97 3.339 8.174 8.026 1.00 0.00 H new ATOM 0 HB3 GLU A 97 3.295 7.850 6.305 1.00 0.00 H new ATOM 0 HG2 GLU A 97 0.855 8.232 8.076 1.00 0.00 H new ATOM 0 HG3 GLU A 97 1.550 9.459 7.035 1.00 0.00 H new ATOM 1461 N HIS A 98 0.476 5.644 8.416 1.00 0.00 N ATOM 1462 CA HIS A 98 -0.512 5.388 9.457 1.00 0.00 C ATOM 1463 C HIS A 98 -0.105 4.196 10.318 1.00 0.00 C ATOM 1464 O HIS A 98 0.119 4.334 11.520 1.00 0.00 O ATOM 1465 CB HIS A 98 -1.887 5.135 8.837 1.00 0.00 C ATOM 1466 CG HIS A 98 -3.005 5.173 9.831 1.00 0.00 C ATOM 1467 ND1 HIS A 98 -3.062 4.285 10.877 1.00 0.00 N ATOM 1468 CD2 HIS A 98 -4.074 6.003 9.894 1.00 0.00 C ATOM 1469 CE1 HIS A 98 -4.155 4.592 11.552 1.00 0.00 C ATOM 1470 NE2 HIS A 98 -4.803 5.627 10.994 1.00 0.00 N ATOM 0 H HIS A 98 0.116 5.565 7.465 1.00 0.00 H new ATOM 0 HA HIS A 98 -0.564 6.272 10.093 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -2.072 5.882 8.065 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -1.882 4.163 8.345 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -4.307 6.806 9.210 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -4.486 4.075 12.441 1.00 0.00 H new ATOM 0 HE2 HIS A 98 -5.670 6.052 11.324 1.00 0.00 H new ATOM 1478 N GLY A 99 -0.012 3.026 9.696 1.00 0.00 N ATOM 1479 CA GLY A 99 0.364 1.829 10.422 1.00 0.00 C ATOM 1480 C GLY A 99 0.492 0.612 9.526 1.00 0.00 C ATOM 1481 O GLY A 99 1.284 -0.287 9.807 1.00 0.00 O ATOM 0 H GLY A 99 -0.191 2.886 8.702 1.00 0.00 H new ATOM 0 HA2 GLY A 99 1.313 2.001 10.930 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -0.379 1.629 11.194 1.00 0.00 H new ATOM 1485 N ALA A 100 -0.293 0.582 8.450 1.00 0.00 N ATOM 1486 CA ALA A 100 -0.269 -0.533 7.508 1.00 0.00 C ATOM 1487 C ALA A 100 1.121 -1.152 7.416 1.00 0.00 C ATOM 1488 O ALA A 100 2.082 -0.490 7.023 1.00 0.00 O ATOM 1489 CB ALA A 100 -0.734 -0.071 6.135 1.00 0.00 C ATOM 0 H ALA A 100 -0.955 1.320 8.210 1.00 0.00 H new ATOM 0 HA ALA A 100 -0.952 -1.299 7.876 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -0.712 -0.912 5.441 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -1.751 0.314 6.206 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -0.073 0.716 5.773 1.00 0.00 H new ATOM 1495 N ASP A 101 1.221 -2.426 7.783 1.00 0.00 N ATOM 1496 CA ASP A 101 2.494 -3.135 7.744 1.00 0.00 C ATOM 1497 C ASP A 101 3.277 -2.785 6.483 1.00 0.00 C ATOM 1498 O ASP A 101 2.817 -3.025 5.368 1.00 0.00 O ATOM 1499 CB ASP A 101 2.261 -4.646 7.810 1.00 0.00 C ATOM 1500 CG ASP A 101 2.921 -5.280 9.018 1.00 0.00 C ATOM 1501 OD1 ASP A 101 2.535 -4.935 10.154 1.00 0.00 O ATOM 1502 OD2 ASP A 101 3.823 -6.122 8.829 1.00 0.00 O ATOM 0 H ASP A 101 0.435 -2.988 8.111 1.00 0.00 H new ATOM 0 HA ASP A 101 3.080 -2.825 8.609 1.00 0.00 H new ATOM 0 HB2 ASP A 101 1.190 -4.845 7.839 1.00 0.00 H new ATOM 0 HB3 ASP A 101 2.647 -5.110 6.903 1.00 0.00 H new ATOM 1507 N VAL A 102 4.464 -2.216 6.670 1.00 0.00 N ATOM 1508 CA VAL A 102 5.312 -1.834 5.549 1.00 0.00 C ATOM 1509 C VAL A 102 6.553 -2.717 5.472 1.00 0.00 C ATOM 1510 O VAL A 102 7.558 -2.339 4.871 1.00 0.00 O ATOM 1511 CB VAL A 102 5.750 -0.361 5.652 1.00 0.00 C ATOM 1512 CG1 VAL A 102 6.842 -0.201 6.701 1.00 0.00 C ATOM 1513 CG2 VAL A 102 6.219 0.154 4.301 1.00 0.00 C ATOM 0 H VAL A 102 4.859 -2.010 7.587 1.00 0.00 H new ATOM 0 HA VAL A 102 4.718 -1.966 4.645 1.00 0.00 H new ATOM 0 HB VAL A 102 4.890 0.233 5.961 1.00 0.00 H new ATOM 0 HG11 VAL A 102 7.139 0.846 6.760 1.00 0.00 H new ATOM 0 HG12 VAL A 102 6.466 -0.527 7.671 1.00 0.00 H new ATOM 0 HG13 VAL A 102 7.704 -0.808 6.424 1.00 0.00 H new ATOM 0 HG21 VAL A 102 6.524 1.196 4.395 1.00 0.00 H new ATOM 0 HG22 VAL A 102 7.065 -0.442 3.958 1.00 0.00 H new ATOM 0 HG23 VAL A 102 5.405 0.078 3.580 1.00 0.00 H new ATOM 1523 N ASN A 103 6.476 -3.892 6.088 1.00 0.00 N ATOM 1524 CA ASN A 103 7.596 -4.827 6.092 1.00 0.00 C ATOM 1525 C ASN A 103 7.118 -6.253 5.833 1.00 0.00 C ATOM 1526 O ASN A 103 7.744 -7.216 6.275 1.00 0.00 O ATOM 1527 CB ASN A 103 8.347 -4.766 7.427 1.00 0.00 C ATOM 1528 CG ASN A 103 7.886 -3.619 8.308 1.00 0.00 C ATOM 1529 OD1 ASN A 103 8.655 -2.707 8.610 1.00 0.00 O ATOM 1530 ND2 ASN A 103 6.625 -3.662 8.723 1.00 0.00 N ATOM 0 H ASN A 103 5.651 -4.219 6.590 1.00 0.00 H new ATOM 0 HA ASN A 103 8.274 -4.536 5.290 1.00 0.00 H new ATOM 0 HB2 ASN A 103 8.208 -5.706 7.960 1.00 0.00 H new ATOM 0 HB3 ASN A 103 9.415 -4.664 7.234 1.00 0.00 H new ATOM 0 HD21 ASN A 103 6.258 -2.919 9.317 1.00 0.00 H new ATOM 0 HD22 ASN A 103 6.024 -4.438 8.447 1.00 0.00 H new ATOM 1537 N ALA A 104 6.008 -6.381 5.114 1.00 0.00 N ATOM 1538 CA ALA A 104 5.453 -7.691 4.798 1.00 0.00 C ATOM 1539 C ALA A 104 5.656 -8.031 3.329 1.00 0.00 C ATOM 1540 O ALA A 104 5.370 -7.223 2.445 1.00 0.00 O ATOM 1541 CB ALA A 104 3.977 -7.746 5.158 1.00 0.00 C ATOM 0 H ALA A 104 5.476 -5.595 4.740 1.00 0.00 H new ATOM 0 HA ALA A 104 5.984 -8.434 5.393 1.00 0.00 H new ATOM 0 HB1 ALA A 104 3.580 -8.732 4.915 1.00 0.00 H new ATOM 0 HB2 ALA A 104 3.855 -7.559 6.225 1.00 0.00 H new ATOM 0 HB3 ALA A 104 3.436 -6.987 4.593 1.00 0.00 H new ATOM 1547 N LEU A 105 6.164 -9.229 3.080 1.00 0.00 N ATOM 1548 CA LEU A 105 6.428 -9.688 1.728 1.00 0.00 C ATOM 1549 C LEU A 105 5.288 -10.560 1.212 1.00 0.00 C ATOM 1550 O LEU A 105 4.474 -11.059 1.989 1.00 0.00 O ATOM 1551 CB LEU A 105 7.741 -10.473 1.694 1.00 0.00 C ATOM 1552 CG LEU A 105 8.670 -10.258 2.891 1.00 0.00 C ATOM 1553 CD1 LEU A 105 8.724 -8.792 3.298 1.00 0.00 C ATOM 1554 CD2 LEU A 105 8.240 -11.134 4.049 1.00 0.00 C ATOM 0 H LEU A 105 6.403 -9.905 3.805 1.00 0.00 H new ATOM 0 HA LEU A 105 6.509 -8.815 1.080 1.00 0.00 H new ATOM 0 HB2 LEU A 105 7.507 -11.535 1.625 1.00 0.00 H new ATOM 0 HB3 LEU A 105 8.280 -10.205 0.785 1.00 0.00 H new ATOM 0 HG LEU A 105 9.679 -10.546 2.596 1.00 0.00 H new ATOM 0 HD11 LEU A 105 9.393 -8.676 4.151 1.00 0.00 H new ATOM 0 HD12 LEU A 105 9.093 -8.196 2.463 1.00 0.00 H new ATOM 0 HD13 LEU A 105 7.725 -8.453 3.572 1.00 0.00 H new ATOM 0 HD21 LEU A 105 8.908 -10.973 4.895 1.00 0.00 H new ATOM 0 HD22 LEU A 105 7.220 -10.880 4.338 1.00 0.00 H new ATOM 0 HD23 LEU A 105 8.282 -12.181 3.748 1.00 0.00 H new ATOM 1566 N ASP A 106 5.238 -10.740 -0.104 1.00 0.00 N ATOM 1567 CA ASP A 106 4.203 -11.550 -0.724 1.00 0.00 C ATOM 1568 C ASP A 106 4.596 -13.022 -0.724 1.00 0.00 C ATOM 1569 O ASP A 106 4.593 -13.677 -1.766 1.00 0.00 O ATOM 1570 CB ASP A 106 3.942 -11.076 -2.155 1.00 0.00 C ATOM 1571 CG ASP A 106 5.131 -11.307 -3.066 1.00 0.00 C ATOM 1572 OD1 ASP A 106 6.183 -11.757 -2.566 1.00 0.00 O ATOM 1573 OD2 ASP A 106 5.011 -11.037 -4.280 1.00 0.00 O ATOM 0 H ASP A 106 5.905 -10.334 -0.760 1.00 0.00 H new ATOM 0 HA ASP A 106 3.288 -11.437 -0.142 1.00 0.00 H new ATOM 0 HB2 ASP A 106 3.074 -11.599 -2.556 1.00 0.00 H new ATOM 0 HB3 ASP A 106 3.697 -10.014 -2.144 1.00 0.00 H new ATOM 1578 N SER A 107 4.942 -13.533 0.451 1.00 0.00 N ATOM 1579 CA SER A 107 5.344 -14.926 0.593 1.00 0.00 C ATOM 1580 C SER A 107 6.797 -15.109 0.176 1.00 0.00 C ATOM 1581 O SER A 107 7.642 -15.480 0.991 1.00 0.00 O ATOM 1582 CB SER A 107 4.438 -15.832 -0.244 1.00 0.00 C ATOM 1583 OG SER A 107 4.593 -17.191 0.126 1.00 0.00 O ATOM 0 H SER A 107 4.952 -13.001 1.322 1.00 0.00 H new ATOM 0 HA SER A 107 5.245 -15.205 1.642 1.00 0.00 H new ATOM 0 HB2 SER A 107 3.398 -15.533 -0.113 1.00 0.00 H new ATOM 0 HB3 SER A 107 4.674 -15.711 -1.301 1.00 0.00 H new ATOM 0 HG SER A 107 4.002 -17.749 -0.422 1.00 0.00 H new ATOM 1589 N THR A 108 7.089 -14.837 -1.092 1.00 0.00 N ATOM 1590 CA THR A 108 8.448 -14.966 -1.596 1.00 0.00 C ATOM 1591 C THR A 108 9.437 -14.411 -0.579 1.00 0.00 C ATOM 1592 O THR A 108 10.587 -14.847 -0.509 1.00 0.00 O ATOM 1593 CB THR A 108 8.599 -14.232 -2.929 1.00 0.00 C ATOM 1594 OG1 THR A 108 8.507 -12.831 -2.744 1.00 0.00 O ATOM 1595 CG2 THR A 108 7.556 -14.630 -3.952 1.00 0.00 C ATOM 0 H THR A 108 6.406 -14.528 -1.784 1.00 0.00 H new ATOM 0 HA THR A 108 8.659 -16.023 -1.757 1.00 0.00 H new ATOM 0 HB THR A 108 9.582 -14.516 -3.306 1.00 0.00 H new ATOM 0 HG1 THR A 108 7.638 -12.514 -3.069 1.00 0.00 H new ATOM 0 HG21 THR A 108 7.720 -14.073 -4.874 1.00 0.00 H new ATOM 0 HG22 THR A 108 7.634 -15.698 -4.155 1.00 0.00 H new ATOM 0 HG23 THR A 108 6.562 -14.406 -3.564 1.00 0.00 H new ATOM 1603 N GLY A 109 8.975 -13.447 0.210 1.00 0.00 N ATOM 1604 CA GLY A 109 9.820 -12.844 1.220 1.00 0.00 C ATOM 1605 C GLY A 109 10.610 -11.664 0.689 1.00 0.00 C ATOM 1606 O GLY A 109 11.724 -11.398 1.142 1.00 0.00 O ATOM 0 H GLY A 109 8.027 -13.073 0.167 1.00 0.00 H new ATOM 0 HA2 GLY A 109 9.203 -12.517 2.057 1.00 0.00 H new ATOM 0 HA3 GLY A 109 10.510 -13.594 1.607 1.00 0.00 H new ATOM 1610 N SER A 110 10.027 -10.951 -0.270 1.00 0.00 N ATOM 1611 CA SER A 110 10.678 -9.788 -0.862 1.00 0.00 C ATOM 1612 C SER A 110 10.103 -8.496 -0.290 1.00 0.00 C ATOM 1613 O SER A 110 9.062 -8.016 -0.740 1.00 0.00 O ATOM 1614 CB SER A 110 10.511 -9.805 -2.384 1.00 0.00 C ATOM 1615 OG SER A 110 9.434 -10.641 -2.769 1.00 0.00 O ATOM 0 H SER A 110 9.105 -11.159 -0.653 1.00 0.00 H new ATOM 0 HA SER A 110 11.740 -9.832 -0.619 1.00 0.00 H new ATOM 0 HB2 SER A 110 10.336 -8.792 -2.745 1.00 0.00 H new ATOM 0 HB3 SER A 110 11.432 -10.155 -2.850 1.00 0.00 H new ATOM 0 HG SER A 110 9.676 -11.578 -2.616 1.00 0.00 H new ATOM 1621 N LEU A 111 10.785 -7.941 0.708 1.00 0.00 N ATOM 1622 CA LEU A 111 10.342 -6.706 1.347 1.00 0.00 C ATOM 1623 C LEU A 111 9.685 -5.770 0.336 1.00 0.00 C ATOM 1624 O LEU A 111 10.192 -5.578 -0.770 1.00 0.00 O ATOM 1625 CB LEU A 111 11.524 -6.002 2.016 1.00 0.00 C ATOM 1626 CG LEU A 111 11.159 -5.131 3.219 1.00 0.00 C ATOM 1627 CD1 LEU A 111 10.641 -5.989 4.361 1.00 0.00 C ATOM 1628 CD2 LEU A 111 12.360 -4.312 3.667 1.00 0.00 C ATOM 0 H LEU A 111 11.647 -8.328 1.092 1.00 0.00 H new ATOM 0 HA LEU A 111 9.603 -6.966 2.105 1.00 0.00 H new ATOM 0 HB2 LEU A 111 12.243 -6.756 2.337 1.00 0.00 H new ATOM 0 HB3 LEU A 111 12.025 -5.380 1.274 1.00 0.00 H new ATOM 0 HG LEU A 111 10.367 -4.444 2.920 1.00 0.00 H new ATOM 0 HD11 LEU A 111 10.386 -5.352 5.208 1.00 0.00 H new ATOM 0 HD12 LEU A 111 9.753 -6.531 4.035 1.00 0.00 H new ATOM 0 HD13 LEU A 111 11.411 -6.700 4.660 1.00 0.00 H new ATOM 0 HD21 LEU A 111 12.083 -3.698 4.524 1.00 0.00 H new ATOM 0 HD22 LEU A 111 13.173 -4.982 3.948 1.00 0.00 H new ATOM 0 HD23 LEU A 111 12.687 -3.668 2.850 1.00 0.00 H new ATOM 1640 N PRO A 112 8.541 -5.177 0.709 1.00 0.00 N ATOM 1641 CA PRO A 112 7.806 -4.256 -0.161 1.00 0.00 C ATOM 1642 C PRO A 112 8.718 -3.231 -0.827 1.00 0.00 C ATOM 1643 O PRO A 112 8.436 -2.759 -1.928 1.00 0.00 O ATOM 1644 CB PRO A 112 6.840 -3.569 0.803 1.00 0.00 C ATOM 1645 CG PRO A 112 6.593 -4.582 1.866 1.00 0.00 C ATOM 1646 CD PRO A 112 7.877 -5.357 2.013 1.00 0.00 C ATOM 0 HA PRO A 112 7.316 -4.772 -0.987 1.00 0.00 H new ATOM 0 HB2 PRO A 112 7.272 -2.657 1.216 1.00 0.00 H new ATOM 0 HB3 PRO A 112 5.914 -3.285 0.302 1.00 0.00 H new ATOM 0 HG2 PRO A 112 6.318 -4.102 2.805 1.00 0.00 H new ATOM 0 HG3 PRO A 112 5.769 -5.241 1.592 1.00 0.00 H new ATOM 0 HD2 PRO A 112 8.487 -4.972 2.830 1.00 0.00 H new ATOM 0 HD3 PRO A 112 7.688 -6.409 2.225 1.00 0.00 H new ATOM 1654 N ILE A 113 9.812 -2.893 -0.154 1.00 0.00 N ATOM 1655 CA ILE A 113 10.765 -1.926 -0.684 1.00 0.00 C ATOM 1656 C ILE A 113 11.574 -2.524 -1.829 1.00 0.00 C ATOM 1657 O ILE A 113 11.911 -1.834 -2.792 1.00 0.00 O ATOM 1658 CB ILE A 113 11.732 -1.429 0.407 1.00 0.00 C ATOM 1659 CG1 ILE A 113 12.791 -0.505 -0.201 1.00 0.00 C ATOM 1660 CG2 ILE A 113 12.390 -2.608 1.109 1.00 0.00 C ATOM 1661 CD1 ILE A 113 13.316 0.533 0.766 1.00 0.00 C ATOM 0 H ILE A 113 10.061 -3.274 0.759 1.00 0.00 H new ATOM 0 HA ILE A 113 10.184 -1.081 -1.054 1.00 0.00 H new ATOM 0 HB ILE A 113 11.164 -0.863 1.145 1.00 0.00 H new ATOM 0 HG12 ILE A 113 13.624 -1.109 -0.561 1.00 0.00 H new ATOM 0 HG13 ILE A 113 12.366 0.000 -1.068 1.00 0.00 H new ATOM 0 HG21 ILE A 113 13.070 -2.241 1.877 1.00 0.00 H new ATOM 0 HG22 ILE A 113 11.624 -3.230 1.571 1.00 0.00 H new ATOM 0 HG23 ILE A 113 12.948 -3.199 0.383 1.00 0.00 H new ATOM 0 HD11 ILE A 113 14.062 1.151 0.267 1.00 0.00 H new ATOM 0 HD12 ILE A 113 12.493 1.161 1.107 1.00 0.00 H new ATOM 0 HD13 ILE A 113 13.772 0.035 1.622 1.00 0.00 H new ATOM 1673 N HIS A 114 11.884 -3.813 -1.720 1.00 0.00 N ATOM 1674 CA HIS A 114 12.654 -4.501 -2.748 1.00 0.00 C ATOM 1675 C HIS A 114 12.020 -4.303 -4.120 1.00 0.00 C ATOM 1676 O HIS A 114 12.719 -4.152 -5.122 1.00 0.00 O ATOM 1677 CB HIS A 114 12.755 -5.994 -2.429 1.00 0.00 C ATOM 1678 CG HIS A 114 13.489 -6.283 -1.157 1.00 0.00 C ATOM 1679 ND1 HIS A 114 13.267 -7.439 -0.448 1.00 0.00 N ATOM 1680 CD2 HIS A 114 14.423 -5.541 -0.514 1.00 0.00 C ATOM 1681 CE1 HIS A 114 14.064 -7.377 0.604 1.00 0.00 C ATOM 1682 NE2 HIS A 114 14.785 -6.245 0.607 1.00 0.00 N ATOM 0 H HIS A 114 11.614 -4.400 -0.931 1.00 0.00 H new ATOM 0 HA HIS A 114 13.657 -4.074 -2.764 1.00 0.00 H new ATOM 0 HB2 HIS A 114 11.751 -6.412 -2.363 1.00 0.00 H new ATOM 0 HB3 HIS A 114 13.258 -6.501 -3.253 1.00 0.00 H new ATOM 0 HD2 HIS A 114 14.808 -4.581 -0.824 1.00 0.00 H new ATOM 0 HE1 HIS A 114 14.127 -8.141 1.365 1.00 0.00 H new ATOM 0 HE2 HIS A 114 15.470 -5.962 1.308 1.00 0.00 H new ATOM 1690 N LEU A 115 10.691 -4.303 -4.157 1.00 0.00 N ATOM 1691 CA LEU A 115 9.964 -4.117 -5.406 1.00 0.00 C ATOM 1692 C LEU A 115 10.141 -2.695 -5.923 1.00 0.00 C ATOM 1693 O LEU A 115 10.424 -2.483 -7.101 1.00 0.00 O ATOM 1694 CB LEU A 115 8.478 -4.426 -5.211 1.00 0.00 C ATOM 1695 CG LEU A 115 8.161 -5.380 -4.057 1.00 0.00 C ATOM 1696 CD1 LEU A 115 6.759 -5.951 -4.208 1.00 0.00 C ATOM 1697 CD2 LEU A 115 9.188 -6.498 -3.989 1.00 0.00 C ATOM 0 H LEU A 115 10.097 -4.430 -3.337 1.00 0.00 H new ATOM 0 HA LEU A 115 10.371 -4.808 -6.144 1.00 0.00 H new ATOM 0 HB2 LEU A 115 7.946 -3.489 -5.044 1.00 0.00 H new ATOM 0 HB3 LEU A 115 8.087 -4.854 -6.134 1.00 0.00 H new ATOM 0 HG LEU A 115 8.206 -4.817 -3.124 1.00 0.00 H new ATOM 0 HD11 LEU A 115 6.550 -6.627 -3.379 1.00 0.00 H new ATOM 0 HD12 LEU A 115 6.033 -5.138 -4.205 1.00 0.00 H new ATOM 0 HD13 LEU A 115 6.688 -6.497 -5.149 1.00 0.00 H new ATOM 0 HD21 LEU A 115 8.945 -7.165 -3.162 1.00 0.00 H new ATOM 0 HD22 LEU A 115 9.177 -7.059 -4.923 1.00 0.00 H new ATOM 0 HD23 LEU A 115 10.179 -6.072 -3.833 1.00 0.00 H new ATOM 1709 N ALA A 116 9.982 -1.723 -5.031 1.00 0.00 N ATOM 1710 CA ALA A 116 10.136 -0.323 -5.400 1.00 0.00 C ATOM 1711 C ALA A 116 11.511 -0.087 -6.012 1.00 0.00 C ATOM 1712 O ALA A 116 11.649 0.629 -7.003 1.00 0.00 O ATOM 1713 CB ALA A 116 9.929 0.570 -4.186 1.00 0.00 C ATOM 0 H ALA A 116 9.747 -1.879 -4.051 1.00 0.00 H new ATOM 0 HA ALA A 116 9.380 -0.072 -6.144 1.00 0.00 H new ATOM 0 HB1 ALA A 116 10.047 1.614 -4.478 1.00 0.00 H new ATOM 0 HB2 ALA A 116 8.926 0.416 -3.788 1.00 0.00 H new ATOM 0 HB3 ALA A 116 10.665 0.321 -3.422 1.00 0.00 H new ATOM 1719 N ILE A 117 12.525 -0.705 -5.414 1.00 0.00 N ATOM 1720 CA ILE A 117 13.893 -0.578 -5.897 1.00 0.00 C ATOM 1721 C ILE A 117 13.993 -1.030 -7.349 1.00 0.00 C ATOM 1722 O ILE A 117 14.719 -0.438 -8.146 1.00 0.00 O ATOM 1723 CB ILE A 117 14.869 -1.410 -5.043 1.00 0.00 C ATOM 1724 CG1 ILE A 117 15.003 -0.802 -3.646 1.00 0.00 C ATOM 1725 CG2 ILE A 117 16.227 -1.499 -5.723 1.00 0.00 C ATOM 1726 CD1 ILE A 117 15.803 -1.658 -2.688 1.00 0.00 C ATOM 0 H ILE A 117 12.423 -1.300 -4.592 1.00 0.00 H new ATOM 0 HA ILE A 117 14.167 0.474 -5.821 1.00 0.00 H new ATOM 0 HB ILE A 117 14.471 -2.420 -4.942 1.00 0.00 H new ATOM 0 HG12 ILE A 117 15.476 0.176 -3.728 1.00 0.00 H new ATOM 0 HG13 ILE A 117 14.008 -0.641 -3.232 1.00 0.00 H new ATOM 0 HG21 ILE A 117 16.904 -2.090 -5.107 1.00 0.00 H new ATOM 0 HG22 ILE A 117 16.115 -1.974 -6.698 1.00 0.00 H new ATOM 0 HG23 ILE A 117 16.635 -0.497 -5.853 1.00 0.00 H new ATOM 0 HD11 ILE A 117 15.857 -1.165 -1.717 1.00 0.00 H new ATOM 0 HD12 ILE A 117 15.319 -2.628 -2.576 1.00 0.00 H new ATOM 0 HD13 ILE A 117 16.810 -1.798 -3.080 1.00 0.00 H new ATOM 1738 N ARG A 118 13.253 -2.083 -7.687 1.00 0.00 N ATOM 1739 CA ARG A 118 13.255 -2.613 -9.044 1.00 0.00 C ATOM 1740 C ARG A 118 12.644 -1.609 -10.014 1.00 0.00 C ATOM 1741 O ARG A 118 12.831 -1.708 -11.226 1.00 0.00 O ATOM 1742 CB ARG A 118 12.485 -3.933 -9.101 1.00 0.00 C ATOM 1743 CG ARG A 118 12.767 -4.854 -7.925 1.00 0.00 C ATOM 1744 CD ARG A 118 12.966 -6.291 -8.377 1.00 0.00 C ATOM 1745 NE ARG A 118 14.146 -6.441 -9.223 1.00 0.00 N ATOM 1746 CZ ARG A 118 14.826 -7.575 -9.344 1.00 0.00 C ATOM 1747 NH1 ARG A 118 14.444 -8.654 -8.675 1.00 0.00 N ATOM 1748 NH2 ARG A 118 15.891 -7.632 -10.132 1.00 0.00 N ATOM 0 H ARG A 118 12.645 -2.584 -7.039 1.00 0.00 H new ATOM 0 HA ARG A 118 14.289 -2.795 -9.338 1.00 0.00 H new ATOM 0 HB2 ARG A 118 11.417 -3.719 -9.136 1.00 0.00 H new ATOM 0 HB3 ARG A 118 12.737 -4.451 -10.026 1.00 0.00 H new ATOM 0 HG2 ARG A 118 13.657 -4.511 -7.398 1.00 0.00 H new ATOM 0 HG3 ARG A 118 11.939 -4.806 -7.217 1.00 0.00 H new ATOM 0 HD2 ARG A 118 13.062 -6.936 -7.503 1.00 0.00 H new ATOM 0 HD3 ARG A 118 12.084 -6.624 -8.923 1.00 0.00 H new ATOM 0 HE ARG A 118 14.466 -5.629 -9.751 1.00 0.00 H new ATOM 0 HH11 ARG A 118 13.627 -8.614 -8.066 1.00 0.00 H new ATOM 0 HH12 ARG A 118 14.968 -9.524 -8.769 1.00 0.00 H new ATOM 0 HH21 ARG A 118 16.189 -6.804 -10.647 1.00 0.00 H new ATOM 0 HH22 ARG A 118 16.412 -8.504 -10.223 1.00 0.00 H new ATOM 1762 N GLU A 119 11.913 -0.642 -9.470 1.00 0.00 N ATOM 1763 CA GLU A 119 11.274 0.383 -10.285 1.00 0.00 C ATOM 1764 C GLU A 119 12.104 1.664 -10.292 1.00 0.00 C ATOM 1765 O GLU A 119 12.407 2.212 -11.352 1.00 0.00 O ATOM 1766 CB GLU A 119 9.866 0.675 -9.765 1.00 0.00 C ATOM 1767 CG GLU A 119 8.915 -0.505 -9.896 1.00 0.00 C ATOM 1768 CD GLU A 119 8.326 -0.627 -11.288 1.00 0.00 C ATOM 1769 OE1 GLU A 119 8.354 0.374 -12.035 1.00 0.00 O ATOM 1770 OE2 GLU A 119 7.835 -1.723 -11.632 1.00 0.00 O ATOM 0 H GLU A 119 11.749 -0.547 -8.468 1.00 0.00 H new ATOM 0 HA GLU A 119 11.204 0.010 -11.307 1.00 0.00 H new ATOM 0 HB2 GLU A 119 9.928 0.967 -8.717 1.00 0.00 H new ATOM 0 HB3 GLU A 119 9.455 1.525 -10.309 1.00 0.00 H new ATOM 0 HG2 GLU A 119 9.446 -1.424 -9.648 1.00 0.00 H new ATOM 0 HG3 GLU A 119 8.107 -0.398 -9.172 1.00 0.00 H new ATOM 1777 N GLY A 120 12.469 2.134 -9.104 1.00 0.00 N ATOM 1778 CA GLY A 120 13.262 3.345 -9.000 1.00 0.00 C ATOM 1779 C GLY A 120 12.408 4.597 -8.977 1.00 0.00 C ATOM 1780 O GLY A 120 12.751 5.601 -9.602 1.00 0.00 O ATOM 0 H GLY A 120 12.230 1.699 -8.213 1.00 0.00 H new ATOM 0 HA2 GLY A 120 13.865 3.304 -8.093 1.00 0.00 H new ATOM 0 HA3 GLY A 120 13.954 3.396 -9.841 1.00 0.00 H new ATOM 1784 N HIS A 121 11.295 4.539 -8.254 1.00 0.00 N ATOM 1785 CA HIS A 121 10.390 5.677 -8.151 1.00 0.00 C ATOM 1786 C HIS A 121 10.989 6.770 -7.271 1.00 0.00 C ATOM 1787 O HIS A 121 10.398 7.838 -7.104 1.00 0.00 O ATOM 1788 CB HIS A 121 9.042 5.233 -7.582 1.00 0.00 C ATOM 1789 CG HIS A 121 8.069 4.784 -8.628 1.00 0.00 C ATOM 1790 ND1 HIS A 121 7.526 5.668 -9.527 1.00 0.00 N ATOM 1791 CD2 HIS A 121 7.578 3.544 -8.873 1.00 0.00 C ATOM 1792 CE1 HIS A 121 6.722 4.955 -10.295 1.00 0.00 C ATOM 1793 NE2 HIS A 121 6.720 3.662 -9.937 1.00 0.00 N ATOM 0 H HIS A 121 10.998 3.715 -7.731 1.00 0.00 H new ATOM 0 HA HIS A 121 10.240 6.081 -9.152 1.00 0.00 H new ATOM 0 HB2 HIS A 121 9.205 4.419 -6.876 1.00 0.00 H new ATOM 0 HB3 HIS A 121 8.604 6.058 -7.021 1.00 0.00 H new ATOM 0 HD2 HIS A 121 7.816 2.639 -8.335 1.00 0.00 H new ATOM 0 HE1 HIS A 121 6.140 5.362 -11.109 1.00 0.00 H new ATOM 0 HE2 HIS A 121 6.184 2.911 -10.372 1.00 0.00 H new ATOM 1801 N SER A 122 12.162 6.498 -6.708 1.00 0.00 N ATOM 1802 CA SER A 122 12.835 7.461 -5.845 1.00 0.00 C ATOM 1803 C SER A 122 12.001 7.749 -4.602 1.00 0.00 C ATOM 1804 O SER A 122 12.353 7.340 -3.497 1.00 0.00 O ATOM 1805 CB SER A 122 13.106 8.759 -6.606 1.00 0.00 C ATOM 1806 OG SER A 122 13.080 8.545 -8.006 1.00 0.00 O ATOM 0 H SER A 122 12.665 5.620 -6.834 1.00 0.00 H new ATOM 0 HA SER A 122 13.786 7.030 -5.531 1.00 0.00 H new ATOM 0 HB2 SER A 122 12.359 9.505 -6.335 1.00 0.00 H new ATOM 0 HB3 SER A 122 14.077 9.159 -6.314 1.00 0.00 H new ATOM 0 HG SER A 122 13.255 9.391 -8.469 1.00 0.00 H new ATOM 1812 N SER A 123 10.893 8.458 -4.793 1.00 0.00 N ATOM 1813 CA SER A 123 10.004 8.804 -3.690 1.00 0.00 C ATOM 1814 C SER A 123 9.543 7.556 -2.945 1.00 0.00 C ATOM 1815 O SER A 123 9.482 7.542 -1.716 1.00 0.00 O ATOM 1816 CB SER A 123 8.792 9.579 -4.209 1.00 0.00 C ATOM 1817 OG SER A 123 9.150 10.900 -4.577 1.00 0.00 O ATOM 0 H SER A 123 10.589 8.805 -5.703 1.00 0.00 H new ATOM 0 HA SER A 123 10.560 9.433 -2.995 1.00 0.00 H new ATOM 0 HB2 SER A 123 8.367 9.061 -5.069 1.00 0.00 H new ATOM 0 HB3 SER A 123 8.019 9.609 -3.441 1.00 0.00 H new ATOM 0 HG SER A 123 8.358 11.374 -4.907 1.00 0.00 H new ATOM 1823 N VAL A 124 9.220 6.508 -3.695 1.00 0.00 N ATOM 1824 CA VAL A 124 8.767 5.257 -3.101 1.00 0.00 C ATOM 1825 C VAL A 124 9.925 4.516 -2.446 1.00 0.00 C ATOM 1826 O VAL A 124 9.925 4.291 -1.236 1.00 0.00 O ATOM 1827 CB VAL A 124 8.107 4.340 -4.149 1.00 0.00 C ATOM 1828 CG1 VAL A 124 7.891 2.947 -3.581 1.00 0.00 C ATOM 1829 CG2 VAL A 124 6.794 4.938 -4.629 1.00 0.00 C ATOM 0 H VAL A 124 9.264 6.500 -4.714 1.00 0.00 H new ATOM 0 HA VAL A 124 8.026 5.514 -2.344 1.00 0.00 H new ATOM 0 HB VAL A 124 8.777 4.257 -5.005 1.00 0.00 H new ATOM 0 HG11 VAL A 124 7.424 2.315 -4.336 1.00 0.00 H new ATOM 0 HG12 VAL A 124 8.851 2.519 -3.292 1.00 0.00 H new ATOM 0 HG13 VAL A 124 7.243 3.007 -2.707 1.00 0.00 H new ATOM 0 HG21 VAL A 124 6.342 4.277 -5.369 1.00 0.00 H new ATOM 0 HG22 VAL A 124 6.116 5.054 -3.783 1.00 0.00 H new ATOM 0 HG23 VAL A 124 6.981 5.913 -5.080 1.00 0.00 H new ATOM 1839 N VAL A 125 10.914 4.145 -3.251 1.00 0.00 N ATOM 1840 CA VAL A 125 12.079 3.435 -2.742 1.00 0.00 C ATOM 1841 C VAL A 125 12.693 4.183 -1.565 1.00 0.00 C ATOM 1842 O VAL A 125 12.917 3.610 -0.498 1.00 0.00 O ATOM 1843 CB VAL A 125 13.148 3.256 -3.836 1.00 0.00 C ATOM 1844 CG1 VAL A 125 12.883 1.994 -4.640 1.00 0.00 C ATOM 1845 CG2 VAL A 125 13.193 4.473 -4.746 1.00 0.00 C ATOM 0 H VAL A 125 10.932 4.324 -4.255 1.00 0.00 H new ATOM 0 HA VAL A 125 11.740 2.452 -2.414 1.00 0.00 H new ATOM 0 HB VAL A 125 14.120 3.156 -3.353 1.00 0.00 H new ATOM 0 HG11 VAL A 125 13.649 1.884 -5.408 1.00 0.00 H new ATOM 0 HG12 VAL A 125 12.907 1.129 -3.978 1.00 0.00 H new ATOM 0 HG13 VAL A 125 11.903 2.062 -5.112 1.00 0.00 H new ATOM 0 HG21 VAL A 125 13.955 4.327 -5.512 1.00 0.00 H new ATOM 0 HG22 VAL A 125 12.221 4.608 -5.221 1.00 0.00 H new ATOM 0 HG23 VAL A 125 13.435 5.358 -4.158 1.00 0.00 H new ATOM 1855 N SER A 126 12.958 5.468 -1.766 1.00 0.00 N ATOM 1856 CA SER A 126 13.541 6.305 -0.726 1.00 0.00 C ATOM 1857 C SER A 126 12.684 6.290 0.532 1.00 0.00 C ATOM 1858 O SER A 126 13.196 6.206 1.648 1.00 0.00 O ATOM 1859 CB SER A 126 13.692 7.735 -1.231 1.00 0.00 C ATOM 1860 OG SER A 126 12.430 8.354 -1.404 1.00 0.00 O ATOM 0 H SER A 126 12.777 5.954 -2.644 1.00 0.00 H new ATOM 0 HA SER A 126 14.523 5.903 -0.477 1.00 0.00 H new ATOM 0 HB2 SER A 126 14.289 8.312 -0.524 1.00 0.00 H new ATOM 0 HB3 SER A 126 14.232 7.734 -2.178 1.00 0.00 H new ATOM 0 HG SER A 126 11.962 7.937 -2.157 1.00 0.00 H new ATOM 1866 N PHE A 127 11.377 6.376 0.339 1.00 0.00 N ATOM 1867 CA PHE A 127 10.432 6.378 1.450 1.00 0.00 C ATOM 1868 C PHE A 127 10.303 4.990 2.067 1.00 0.00 C ATOM 1869 O PHE A 127 10.172 4.849 3.283 1.00 0.00 O ATOM 1870 CB PHE A 127 9.062 6.870 0.978 1.00 0.00 C ATOM 1871 CG PHE A 127 7.974 6.695 1.998 1.00 0.00 C ATOM 1872 CD1 PHE A 127 7.868 7.567 3.076 1.00 0.00 C ATOM 1873 CD2 PHE A 127 7.056 5.657 1.882 1.00 0.00 C ATOM 1874 CE1 PHE A 127 6.864 7.406 4.020 1.00 0.00 C ATOM 1875 CE2 PHE A 127 6.051 5.491 2.824 1.00 0.00 C ATOM 1876 CZ PHE A 127 5.954 6.373 3.892 1.00 0.00 C ATOM 0 H PHE A 127 10.943 6.446 -0.581 1.00 0.00 H new ATOM 0 HA PHE A 127 10.813 7.056 2.214 1.00 0.00 H new ATOM 0 HB2 PHE A 127 9.135 7.925 0.715 1.00 0.00 H new ATOM 0 HB3 PHE A 127 8.786 6.334 0.070 1.00 0.00 H new ATOM 0 HD1 PHE A 127 8.574 8.378 3.179 1.00 0.00 H new ATOM 0 HD2 PHE A 127 7.126 4.973 1.050 1.00 0.00 H new ATOM 0 HE1 PHE A 127 6.793 8.088 4.855 1.00 0.00 H new ATOM 0 HE2 PHE A 127 5.346 4.678 2.727 1.00 0.00 H new ATOM 0 HZ PHE A 127 5.168 6.252 4.623 1.00 0.00 H new ATOM 1886 N LEU A 128 10.337 3.966 1.221 1.00 0.00 N ATOM 1887 CA LEU A 128 10.220 2.588 1.682 1.00 0.00 C ATOM 1888 C LEU A 128 11.484 2.138 2.409 1.00 0.00 C ATOM 1889 O LEU A 128 11.555 1.016 2.911 1.00 0.00 O ATOM 1890 CB LEU A 128 9.937 1.658 0.502 1.00 0.00 C ATOM 1891 CG LEU A 128 8.505 1.126 0.424 1.00 0.00 C ATOM 1892 CD1 LEU A 128 8.281 0.044 1.470 1.00 0.00 C ATOM 1893 CD2 LEU A 128 7.505 2.258 0.600 1.00 0.00 C ATOM 0 H LEU A 128 10.445 4.065 0.212 1.00 0.00 H new ATOM 0 HA LEU A 128 9.388 2.540 2.385 1.00 0.00 H new ATOM 0 HB2 LEU A 128 10.161 2.191 -0.422 1.00 0.00 H new ATOM 0 HB3 LEU A 128 10.621 0.811 0.555 1.00 0.00 H new ATOM 0 HG LEU A 128 8.353 0.686 -0.562 1.00 0.00 H new ATOM 0 HD11 LEU A 128 7.257 -0.323 1.400 1.00 0.00 H new ATOM 0 HD12 LEU A 128 8.974 -0.779 1.296 1.00 0.00 H new ATOM 0 HD13 LEU A 128 8.451 0.458 2.464 1.00 0.00 H new ATOM 0 HD21 LEU A 128 6.492 1.861 0.542 1.00 0.00 H new ATOM 0 HD22 LEU A 128 7.655 2.728 1.572 1.00 0.00 H new ATOM 0 HD23 LEU A 128 7.651 2.998 -0.187 1.00 0.00 H new ATOM 1905 N ALA A 129 12.483 3.014 2.462 1.00 0.00 N ATOM 1906 CA ALA A 129 13.740 2.694 3.128 1.00 0.00 C ATOM 1907 C ALA A 129 13.555 2.596 4.640 1.00 0.00 C ATOM 1908 O ALA A 129 13.601 1.507 5.209 1.00 0.00 O ATOM 1909 CB ALA A 129 14.801 3.730 2.787 1.00 0.00 C ATOM 0 H ALA A 129 12.446 3.948 2.053 1.00 0.00 H new ATOM 0 HA ALA A 129 14.073 1.721 2.768 1.00 0.00 H new ATOM 0 HB1 ALA A 129 15.733 3.476 3.292 1.00 0.00 H new ATOM 0 HB2 ALA A 129 14.964 3.743 1.709 1.00 0.00 H new ATOM 0 HB3 ALA A 129 14.467 4.714 3.115 1.00 0.00 H new ATOM 1915 N PRO A 130 13.342 3.740 5.311 1.00 0.00 N ATOM 1916 CA PRO A 130 13.151 3.780 6.764 1.00 0.00 C ATOM 1917 C PRO A 130 11.853 3.105 7.197 1.00 0.00 C ATOM 1918 O PRO A 130 11.866 2.166 7.993 1.00 0.00 O ATOM 1919 CB PRO A 130 13.109 5.276 7.084 1.00 0.00 C ATOM 1920 CG PRO A 130 12.707 5.932 5.807 1.00 0.00 C ATOM 1921 CD PRO A 130 13.274 5.081 4.705 1.00 0.00 C ATOM 0 HA PRO A 130 13.941 3.244 7.290 1.00 0.00 H new ATOM 0 HB2 PRO A 130 12.395 5.490 7.879 1.00 0.00 H new ATOM 0 HB3 PRO A 130 14.081 5.635 7.423 1.00 0.00 H new ATOM 0 HG2 PRO A 130 11.622 6.000 5.728 1.00 0.00 H new ATOM 0 HG3 PRO A 130 13.095 6.949 5.753 1.00 0.00 H new ATOM 0 HD2 PRO A 130 12.636 5.091 3.821 1.00 0.00 H new ATOM 0 HD3 PRO A 130 14.258 5.431 4.392 1.00 0.00 H new ATOM 1929 N GLU A 131 10.734 3.587 6.667 1.00 0.00 N ATOM 1930 CA GLU A 131 9.427 3.031 6.999 1.00 0.00 C ATOM 1931 C GLU A 131 9.495 1.510 7.101 1.00 0.00 C ATOM 1932 O GLU A 131 8.846 0.905 7.955 1.00 0.00 O ATOM 1933 CB GLU A 131 8.394 3.438 5.946 1.00 0.00 C ATOM 1934 CG GLU A 131 8.201 4.941 5.836 1.00 0.00 C ATOM 1935 CD GLU A 131 7.430 5.519 7.007 1.00 0.00 C ATOM 1936 OE1 GLU A 131 8.002 5.593 8.115 1.00 0.00 O ATOM 1937 OE2 GLU A 131 6.256 5.897 6.816 1.00 0.00 O ATOM 0 H GLU A 131 10.706 4.362 6.005 1.00 0.00 H new ATOM 0 HA GLU A 131 9.124 3.430 7.967 1.00 0.00 H new ATOM 0 HB2 GLU A 131 8.702 3.047 4.976 1.00 0.00 H new ATOM 0 HB3 GLU A 131 7.438 2.974 6.188 1.00 0.00 H new ATOM 0 HG2 GLU A 131 9.176 5.425 5.774 1.00 0.00 H new ATOM 0 HG3 GLU A 131 7.672 5.169 4.910 1.00 0.00 H new ATOM 1944 N SER A 132 10.287 0.900 6.227 1.00 0.00 N ATOM 1945 CA SER A 132 10.443 -0.549 6.217 1.00 0.00 C ATOM 1946 C SER A 132 11.686 -0.965 6.997 1.00 0.00 C ATOM 1947 O SER A 132 12.759 -0.388 6.822 1.00 0.00 O ATOM 1948 CB SER A 132 10.537 -1.063 4.779 1.00 0.00 C ATOM 1949 OG SER A 132 9.506 -0.520 3.974 1.00 0.00 O ATOM 0 H SER A 132 10.832 1.387 5.515 1.00 0.00 H new ATOM 0 HA SER A 132 9.568 -0.988 6.697 1.00 0.00 H new ATOM 0 HB2 SER A 132 11.508 -0.800 4.358 1.00 0.00 H new ATOM 0 HB3 SER A 132 10.472 -2.151 4.774 1.00 0.00 H new ATOM 0 HG SER A 132 9.865 0.214 3.433 1.00 0.00 H new ATOM 1955 N ASP A 133 11.534 -1.968 7.857 1.00 0.00 N ATOM 1956 CA ASP A 133 12.648 -2.458 8.660 1.00 0.00 C ATOM 1957 C ASP A 133 13.944 -2.414 7.860 1.00 0.00 C ATOM 1958 O ASP A 133 14.145 -3.206 6.939 1.00 0.00 O ATOM 1959 CB ASP A 133 12.373 -3.885 9.137 1.00 0.00 C ATOM 1960 CG ASP A 133 13.129 -4.920 8.329 1.00 0.00 C ATOM 1961 OD1 ASP A 133 13.822 -4.530 7.365 1.00 0.00 O ATOM 1962 OD2 ASP A 133 13.028 -6.120 8.657 1.00 0.00 O ATOM 0 H ASP A 133 10.652 -2.456 8.015 1.00 0.00 H new ATOM 0 HA ASP A 133 12.754 -1.811 9.531 1.00 0.00 H new ATOM 0 HB2 ASP A 133 12.651 -3.974 10.187 1.00 0.00 H new ATOM 0 HB3 ASP A 133 11.304 -4.087 9.072 1.00 0.00 H new ATOM 1967 N LEU A 134 14.818 -1.477 8.212 1.00 0.00 N ATOM 1968 CA LEU A 134 16.089 -1.320 7.525 1.00 0.00 C ATOM 1969 C LEU A 134 17.055 -2.447 7.883 1.00 0.00 C ATOM 1970 O LEU A 134 18.176 -2.497 7.376 1.00 0.00 O ATOM 1971 CB LEU A 134 16.701 0.034 7.880 1.00 0.00 C ATOM 1972 CG LEU A 134 16.126 1.225 7.110 1.00 0.00 C ATOM 1973 CD1 LEU A 134 16.682 2.533 7.651 1.00 0.00 C ATOM 1974 CD2 LEU A 134 16.421 1.094 5.623 1.00 0.00 C ATOM 0 H LEU A 134 14.666 -0.814 8.972 1.00 0.00 H new ATOM 0 HA LEU A 134 15.908 -1.366 6.451 1.00 0.00 H new ATOM 0 HB2 LEU A 134 16.563 0.210 8.947 1.00 0.00 H new ATOM 0 HB3 LEU A 134 17.775 -0.011 7.700 1.00 0.00 H new ATOM 0 HG LEU A 134 15.045 1.230 7.247 1.00 0.00 H new ATOM 0 HD11 LEU A 134 16.261 3.367 7.090 1.00 0.00 H new ATOM 0 HD12 LEU A 134 16.417 2.633 8.704 1.00 0.00 H new ATOM 0 HD13 LEU A 134 17.767 2.538 7.548 1.00 0.00 H new ATOM 0 HD21 LEU A 134 16.004 1.950 5.093 1.00 0.00 H new ATOM 0 HD22 LEU A 134 17.499 1.061 5.468 1.00 0.00 H new ATOM 0 HD23 LEU A 134 15.971 0.177 5.242 1.00 0.00 H new ATOM 1986 N HIS A 135 16.617 -3.349 8.754 1.00 0.00 N ATOM 1987 CA HIS A 135 17.447 -4.474 9.172 1.00 0.00 C ATOM 1988 C HIS A 135 16.881 -5.791 8.653 1.00 0.00 C ATOM 1989 O HIS A 135 17.137 -6.855 9.219 1.00 0.00 O ATOM 1990 CB HIS A 135 17.556 -4.516 10.698 1.00 0.00 C ATOM 1991 CG HIS A 135 16.455 -3.781 11.396 1.00 0.00 C ATOM 1992 ND1 HIS A 135 15.413 -4.448 11.990 1.00 0.00 N ATOM 1993 CD2 HIS A 135 16.282 -2.447 11.565 1.00 0.00 C ATOM 1994 CE1 HIS A 135 14.633 -3.516 12.505 1.00 0.00 C ATOM 1995 NE2 HIS A 135 15.118 -2.286 12.272 1.00 0.00 N ATOM 0 H HIS A 135 15.693 -3.324 9.184 1.00 0.00 H new ATOM 0 HA HIS A 135 18.442 -4.336 8.748 1.00 0.00 H new ATOM 0 HB2 HIS A 135 17.553 -5.555 11.026 1.00 0.00 H new ATOM 0 HB3 HIS A 135 18.513 -4.090 10.998 1.00 0.00 H new ATOM 0 HD2 HIS A 135 16.935 -1.663 11.211 1.00 0.00 H new ATOM 0 HE1 HIS A 135 13.720 -3.717 13.046 1.00 0.00 H new ATOM 0 HE2 HIS A 135 14.701 -1.402 12.564 1.00 0.00 H new ATOM 2003 N HIS A 136 16.111 -5.714 7.572 1.00 0.00 N ATOM 2004 CA HIS A 136 15.508 -6.902 6.976 1.00 0.00 C ATOM 2005 C HIS A 136 16.200 -7.261 5.665 1.00 0.00 C ATOM 2006 O HIS A 136 17.023 -6.500 5.158 1.00 0.00 O ATOM 2007 CB HIS A 136 14.015 -6.675 6.732 1.00 0.00 C ATOM 2008 CG HIS A 136 13.192 -7.920 6.853 1.00 0.00 C ATOM 2009 ND1 HIS A 136 12.737 -8.362 8.070 1.00 0.00 N ATOM 2010 CD2 HIS A 136 12.774 -8.774 5.886 1.00 0.00 C ATOM 2011 CE1 HIS A 136 12.057 -9.468 7.823 1.00 0.00 C ATOM 2012 NE2 HIS A 136 12.051 -9.758 6.513 1.00 0.00 N ATOM 0 H HIS A 136 15.890 -4.842 7.091 1.00 0.00 H new ATOM 0 HA HIS A 136 15.632 -7.731 7.672 1.00 0.00 H new ATOM 0 HB2 HIS A 136 13.647 -5.936 7.444 1.00 0.00 H new ATOM 0 HB3 HIS A 136 13.878 -6.254 5.736 1.00 0.00 H new ATOM 0 HD1 HIS A 136 12.892 -7.926 8.979 1.00 0.00 H new ATOM 0 HD2 HIS A 136 12.972 -8.695 4.827 1.00 0.00 H new ATOM 0 HE1 HIS A 136 11.568 -10.063 8.580 1.00 0.00 H new ATOM 2020 N ARG A 137 15.861 -8.427 5.123 1.00 0.00 N ATOM 2021 CA ARG A 137 16.450 -8.887 3.870 1.00 0.00 C ATOM 2022 C ARG A 137 15.580 -9.957 3.218 1.00 0.00 C ATOM 2023 O ARG A 137 14.796 -10.627 3.889 1.00 0.00 O ATOM 2024 CB ARG A 137 17.853 -9.448 4.115 1.00 0.00 C ATOM 2025 CG ARG A 137 18.858 -8.405 4.571 1.00 0.00 C ATOM 2026 CD ARG A 137 18.879 -8.277 6.086 1.00 0.00 C ATOM 2027 NE ARG A 137 20.027 -8.958 6.677 1.00 0.00 N ATOM 2028 CZ ARG A 137 20.346 -8.881 7.965 1.00 0.00 C ATOM 2029 NH1 ARG A 137 19.606 -8.156 8.792 1.00 0.00 N ATOM 2030 NH2 ARG A 137 21.407 -9.528 8.426 1.00 0.00 N ATOM 0 H ARG A 137 15.182 -9.070 5.531 1.00 0.00 H new ATOM 0 HA ARG A 137 16.515 -8.032 3.198 1.00 0.00 H new ATOM 0 HB2 ARG A 137 17.793 -10.235 4.867 1.00 0.00 H new ATOM 0 HB3 ARG A 137 18.215 -9.911 3.197 1.00 0.00 H new ATOM 0 HG2 ARG A 137 19.852 -8.675 4.214 1.00 0.00 H new ATOM 0 HG3 ARG A 137 18.611 -7.441 4.127 1.00 0.00 H new ATOM 0 HD2 ARG A 137 18.903 -7.222 6.360 1.00 0.00 H new ATOM 0 HD3 ARG A 137 17.959 -8.693 6.498 1.00 0.00 H new ATOM 0 HE ARG A 137 20.617 -9.524 6.068 1.00 0.00 H new ATOM 0 HH11 ARG A 137 18.790 -7.656 8.440 1.00 0.00 H new ATOM 0 HH12 ARG A 137 19.853 -8.099 9.780 1.00 0.00 H new ATOM 0 HH21 ARG A 137 21.979 -10.086 7.792 1.00 0.00 H new ATOM 0 HH22 ARG A 137 21.651 -9.468 9.415 1.00 0.00 H new ATOM 2044 N ASP A 138 15.733 -10.118 1.908 1.00 0.00 N ATOM 2045 CA ASP A 138 14.969 -11.114 1.167 1.00 0.00 C ATOM 2046 C ASP A 138 15.550 -12.504 1.388 1.00 0.00 C ATOM 2047 O ASP A 138 16.720 -12.645 1.741 1.00 0.00 O ATOM 2048 CB ASP A 138 14.972 -10.785 -0.327 1.00 0.00 C ATOM 2049 CG ASP A 138 13.706 -11.243 -1.023 1.00 0.00 C ATOM 2050 OD1 ASP A 138 13.110 -12.244 -0.573 1.00 0.00 O ATOM 2051 OD2 ASP A 138 13.312 -10.603 -2.021 1.00 0.00 O ATOM 0 H ASP A 138 16.379 -9.572 1.338 1.00 0.00 H new ATOM 0 HA ASP A 138 13.942 -11.098 1.533 1.00 0.00 H new ATOM 0 HB2 ASP A 138 15.087 -9.709 -0.459 1.00 0.00 H new ATOM 0 HB3 ASP A 138 15.834 -11.258 -0.798 1.00 0.00 H new ATOM 2056 N ALA A 139 14.735 -13.530 1.170 1.00 0.00 N ATOM 2057 CA ALA A 139 15.197 -14.900 1.340 1.00 0.00 C ATOM 2058 C ALA A 139 16.577 -15.057 0.723 1.00 0.00 C ATOM 2059 O ALA A 139 17.378 -15.889 1.146 1.00 0.00 O ATOM 2060 CB ALA A 139 14.215 -15.878 0.714 1.00 0.00 C ATOM 0 H ALA A 139 13.762 -13.440 0.878 1.00 0.00 H new ATOM 0 HA ALA A 139 15.260 -15.122 2.405 1.00 0.00 H new ATOM 0 HB1 ALA A 139 14.578 -16.896 0.852 1.00 0.00 H new ATOM 0 HB2 ALA A 139 13.241 -15.772 1.192 1.00 0.00 H new ATOM 0 HB3 ALA A 139 14.121 -15.667 -0.351 1.00 0.00 H new ATOM 2066 N SER A 140 16.838 -14.231 -0.281 1.00 0.00 N ATOM 2067 CA SER A 140 18.111 -14.235 -0.981 1.00 0.00 C ATOM 2068 C SER A 140 19.200 -13.606 -0.120 1.00 0.00 C ATOM 2069 O SER A 140 20.332 -14.086 -0.077 1.00 0.00 O ATOM 2070 CB SER A 140 17.975 -13.465 -2.290 1.00 0.00 C ATOM 2071 OG SER A 140 19.042 -12.549 -2.461 1.00 0.00 O ATOM 0 H SER A 140 16.173 -13.541 -0.631 1.00 0.00 H new ATOM 0 HA SER A 140 18.392 -15.267 -1.192 1.00 0.00 H new ATOM 0 HB2 SER A 140 17.956 -14.165 -3.126 1.00 0.00 H new ATOM 0 HB3 SER A 140 17.026 -12.928 -2.302 1.00 0.00 H new ATOM 0 HG SER A 140 18.930 -12.071 -3.309 1.00 0.00 H new ATOM 2077 N GLY A 141 18.844 -12.523 0.566 1.00 0.00 N ATOM 2078 CA GLY A 141 19.792 -11.834 1.419 1.00 0.00 C ATOM 2079 C GLY A 141 20.115 -10.441 0.916 1.00 0.00 C ATOM 2080 O GLY A 141 21.250 -9.979 1.033 1.00 0.00 O ATOM 0 H GLY A 141 17.911 -12.110 0.545 1.00 0.00 H new ATOM 0 HA2 GLY A 141 19.387 -11.768 2.429 1.00 0.00 H new ATOM 0 HA3 GLY A 141 20.711 -12.417 1.482 1.00 0.00 H new ATOM 2084 N LEU A 142 19.115 -9.772 0.351 1.00 0.00 N ATOM 2085 CA LEU A 142 19.298 -8.424 -0.175 1.00 0.00 C ATOM 2086 C LEU A 142 18.921 -7.374 0.865 1.00 0.00 C ATOM 2087 O LEU A 142 18.746 -7.688 2.043 1.00 0.00 O ATOM 2088 CB LEU A 142 18.460 -8.231 -1.440 1.00 0.00 C ATOM 2089 CG LEU A 142 18.709 -9.261 -2.542 1.00 0.00 C ATOM 2090 CD1 LEU A 142 17.759 -9.032 -3.709 1.00 0.00 C ATOM 2091 CD2 LEU A 142 20.155 -9.204 -3.009 1.00 0.00 C ATOM 0 H LEU A 142 18.170 -10.141 0.246 1.00 0.00 H new ATOM 0 HA LEU A 142 20.352 -8.298 -0.422 1.00 0.00 H new ATOM 0 HB2 LEU A 142 17.405 -8.261 -1.167 1.00 0.00 H new ATOM 0 HB3 LEU A 142 18.658 -7.237 -1.841 1.00 0.00 H new ATOM 0 HG LEU A 142 18.520 -10.254 -2.135 1.00 0.00 H new ATOM 0 HD11 LEU A 142 17.950 -9.774 -4.485 1.00 0.00 H new ATOM 0 HD12 LEU A 142 16.729 -9.125 -3.364 1.00 0.00 H new ATOM 0 HD13 LEU A 142 17.917 -8.033 -4.116 1.00 0.00 H new ATOM 0 HD21 LEU A 142 20.313 -9.944 -3.793 1.00 0.00 H new ATOM 0 HD22 LEU A 142 20.372 -8.210 -3.399 1.00 0.00 H new ATOM 0 HD23 LEU A 142 20.817 -9.417 -2.170 1.00 0.00 H new ATOM 2103 N THR A 143 18.803 -6.127 0.423 1.00 0.00 N ATOM 2104 CA THR A 143 18.452 -5.029 1.316 1.00 0.00 C ATOM 2105 C THR A 143 18.344 -3.717 0.547 1.00 0.00 C ATOM 2106 O THR A 143 18.805 -3.613 -0.590 1.00 0.00 O ATOM 2107 CB THR A 143 19.497 -4.894 2.425 1.00 0.00 C ATOM 2108 OG1 THR A 143 20.481 -5.908 2.311 1.00 0.00 O ATOM 2109 CG2 THR A 143 18.910 -4.979 3.816 1.00 0.00 C ATOM 0 H THR A 143 18.945 -5.851 -0.549 1.00 0.00 H new ATOM 0 HA THR A 143 17.482 -5.252 1.761 1.00 0.00 H new ATOM 0 HB THR A 143 19.932 -3.903 2.293 1.00 0.00 H new ATOM 0 HG1 THR A 143 21.141 -5.805 3.028 1.00 0.00 H new ATOM 0 HG21 THR A 143 19.706 -4.876 4.554 1.00 0.00 H new ATOM 0 HG22 THR A 143 18.182 -4.179 3.953 1.00 0.00 H new ATOM 0 HG23 THR A 143 18.418 -5.943 3.945 1.00 0.00 H new ATOM 2117 N PRO A 144 17.740 -2.691 1.166 1.00 0.00 N ATOM 2118 CA PRO A 144 17.580 -1.377 0.542 1.00 0.00 C ATOM 2119 C PRO A 144 18.843 -0.938 -0.190 1.00 0.00 C ATOM 2120 O PRO A 144 18.813 -0.658 -1.388 1.00 0.00 O ATOM 2121 CB PRO A 144 17.296 -0.468 1.735 1.00 0.00 C ATOM 2122 CG PRO A 144 16.595 -1.350 2.712 1.00 0.00 C ATOM 2123 CD PRO A 144 17.172 -2.731 2.526 1.00 0.00 C ATOM 0 HA PRO A 144 16.797 -1.362 -0.216 1.00 0.00 H new ATOM 0 HB2 PRO A 144 18.217 -0.063 2.154 1.00 0.00 H new ATOM 0 HB3 PRO A 144 16.675 0.381 1.449 1.00 0.00 H new ATOM 0 HG2 PRO A 144 16.748 -0.999 3.732 1.00 0.00 H new ATOM 0 HG3 PRO A 144 15.520 -1.351 2.533 1.00 0.00 H new ATOM 0 HD2 PRO A 144 17.935 -2.950 3.273 1.00 0.00 H new ATOM 0 HD3 PRO A 144 16.406 -3.501 2.618 1.00 0.00 H new ATOM 2131 N LEU A 145 19.954 -0.889 0.538 1.00 0.00 N ATOM 2132 CA LEU A 145 21.229 -0.496 -0.041 1.00 0.00 C ATOM 2133 C LEU A 145 21.761 -1.596 -0.954 1.00 0.00 C ATOM 2134 O LEU A 145 22.258 -1.324 -2.047 1.00 0.00 O ATOM 2135 CB LEU A 145 22.240 -0.199 1.067 1.00 0.00 C ATOM 2136 CG LEU A 145 22.437 1.285 1.384 1.00 0.00 C ATOM 2137 CD1 LEU A 145 23.408 1.458 2.543 1.00 0.00 C ATOM 2138 CD2 LEU A 145 22.931 2.032 0.155 1.00 0.00 C ATOM 0 H LEU A 145 19.995 -1.117 1.531 1.00 0.00 H new ATOM 0 HA LEU A 145 21.078 0.406 -0.634 1.00 0.00 H new ATOM 0 HB2 LEU A 145 21.921 -0.710 1.976 1.00 0.00 H new ATOM 0 HB3 LEU A 145 23.202 -0.625 0.783 1.00 0.00 H new ATOM 0 HG LEU A 145 21.475 1.706 1.677 1.00 0.00 H new ATOM 0 HD11 LEU A 145 23.536 2.519 2.755 1.00 0.00 H new ATOM 0 HD12 LEU A 145 23.013 0.957 3.427 1.00 0.00 H new ATOM 0 HD13 LEU A 145 24.371 1.022 2.279 1.00 0.00 H new ATOM 0 HD21 LEU A 145 23.065 3.086 0.399 1.00 0.00 H new ATOM 0 HD22 LEU A 145 23.883 1.610 -0.169 1.00 0.00 H new ATOM 0 HD23 LEU A 145 22.200 1.936 -0.647 1.00 0.00 H new ATOM 2150 N GLU A 146 21.647 -2.843 -0.499 1.00 0.00 N ATOM 2151 CA GLU A 146 22.111 -3.986 -1.278 1.00 0.00 C ATOM 2152 C GLU A 146 21.460 -3.994 -2.656 1.00 0.00 C ATOM 2153 O GLU A 146 22.120 -3.745 -3.665 1.00 0.00 O ATOM 2154 CB GLU A 146 21.798 -5.292 -0.545 1.00 0.00 C ATOM 2155 CG GLU A 146 22.131 -6.537 -1.352 1.00 0.00 C ATOM 2156 CD GLU A 146 23.570 -6.558 -1.827 1.00 0.00 C ATOM 2157 OE1 GLU A 146 24.008 -5.558 -2.435 1.00 0.00 O ATOM 2158 OE2 GLU A 146 24.259 -7.572 -1.593 1.00 0.00 O ATOM 0 H GLU A 146 21.238 -3.085 0.403 1.00 0.00 H new ATOM 0 HA GLU A 146 23.191 -3.900 -1.402 1.00 0.00 H new ATOM 0 HB2 GLU A 146 22.355 -5.316 0.391 1.00 0.00 H new ATOM 0 HB3 GLU A 146 20.739 -5.309 -0.286 1.00 0.00 H new ATOM 0 HG2 GLU A 146 21.940 -7.421 -0.744 1.00 0.00 H new ATOM 0 HG3 GLU A 146 21.467 -6.594 -2.215 1.00 0.00 H new ATOM 2165 N LEU A 147 20.160 -4.269 -2.692 1.00 0.00 N ATOM 2166 CA LEU A 147 19.423 -4.296 -3.950 1.00 0.00 C ATOM 2167 C LEU A 147 19.649 -2.998 -4.711 1.00 0.00 C ATOM 2168 O LEU A 147 19.782 -2.996 -5.935 1.00 0.00 O ATOM 2169 CB LEU A 147 17.931 -4.500 -3.688 1.00 0.00 C ATOM 2170 CG LEU A 147 17.099 -4.863 -4.920 1.00 0.00 C ATOM 2171 CD1 LEU A 147 17.540 -6.206 -5.484 1.00 0.00 C ATOM 2172 CD2 LEU A 147 15.619 -4.888 -4.574 1.00 0.00 C ATOM 0 H LEU A 147 19.597 -4.476 -1.867 1.00 0.00 H new ATOM 0 HA LEU A 147 19.786 -5.129 -4.552 1.00 0.00 H new ATOM 0 HB2 LEU A 147 17.813 -5.288 -2.944 1.00 0.00 H new ATOM 0 HB3 LEU A 147 17.526 -3.587 -3.252 1.00 0.00 H new ATOM 0 HG LEU A 147 17.260 -4.101 -5.682 1.00 0.00 H new ATOM 0 HD11 LEU A 147 16.938 -6.448 -6.360 1.00 0.00 H new ATOM 0 HD12 LEU A 147 18.591 -6.153 -5.769 1.00 0.00 H new ATOM 0 HD13 LEU A 147 17.408 -6.979 -4.727 1.00 0.00 H new ATOM 0 HD21 LEU A 147 15.042 -5.148 -5.462 1.00 0.00 H new ATOM 0 HD22 LEU A 147 15.440 -5.629 -3.795 1.00 0.00 H new ATOM 0 HD23 LEU A 147 15.312 -3.905 -4.217 1.00 0.00 H new ATOM 2184 N ALA A 148 19.706 -1.892 -3.975 1.00 0.00 N ATOM 2185 CA ALA A 148 19.933 -0.590 -4.579 1.00 0.00 C ATOM 2186 C ALA A 148 21.196 -0.622 -5.428 1.00 0.00 C ATOM 2187 O ALA A 148 21.213 -0.133 -6.558 1.00 0.00 O ATOM 2188 CB ALA A 148 20.037 0.482 -3.506 1.00 0.00 C ATOM 0 H ALA A 148 19.598 -1.875 -2.961 1.00 0.00 H new ATOM 0 HA ALA A 148 19.087 -0.348 -5.222 1.00 0.00 H new ATOM 0 HB1 ALA A 148 20.207 1.451 -3.975 1.00 0.00 H new ATOM 0 HB2 ALA A 148 19.111 0.514 -2.933 1.00 0.00 H new ATOM 0 HB3 ALA A 148 20.868 0.251 -2.840 1.00 0.00 H new ATOM 2194 N ARG A 149 22.251 -1.223 -4.880 1.00 0.00 N ATOM 2195 CA ARG A 149 23.516 -1.341 -5.592 1.00 0.00 C ATOM 2196 C ARG A 149 23.303 -2.092 -6.898 1.00 0.00 C ATOM 2197 O ARG A 149 24.071 -1.945 -7.850 1.00 0.00 O ATOM 2198 CB ARG A 149 24.549 -2.067 -4.728 1.00 0.00 C ATOM 2199 CG ARG A 149 25.850 -2.367 -5.456 1.00 0.00 C ATOM 2200 CD ARG A 149 26.943 -1.384 -5.068 1.00 0.00 C ATOM 2201 NE ARG A 149 26.857 -0.140 -5.829 1.00 0.00 N ATOM 2202 CZ ARG A 149 27.354 0.010 -7.052 1.00 0.00 C ATOM 2203 NH1 ARG A 149 27.970 -1.001 -7.649 1.00 0.00 N ATOM 2204 NH2 ARG A 149 27.237 1.173 -7.679 1.00 0.00 N ATOM 0 H ARG A 149 22.252 -1.634 -3.947 1.00 0.00 H new ATOM 0 HA ARG A 149 23.892 -0.342 -5.812 1.00 0.00 H new ATOM 0 HB2 ARG A 149 24.766 -1.460 -3.849 1.00 0.00 H new ATOM 0 HB3 ARG A 149 24.118 -3.002 -4.371 1.00 0.00 H new ATOM 0 HG2 ARG A 149 26.173 -3.382 -5.224 1.00 0.00 H new ATOM 0 HG3 ARG A 149 25.685 -2.323 -6.532 1.00 0.00 H new ATOM 0 HD2 ARG A 149 26.870 -1.163 -4.003 1.00 0.00 H new ATOM 0 HD3 ARG A 149 27.918 -1.843 -5.233 1.00 0.00 H new ATOM 0 HE ARG A 149 26.390 0.657 -5.398 1.00 0.00 H new ATOM 0 HH11 ARG A 149 28.063 -1.896 -7.169 1.00 0.00 H new ATOM 0 HH12 ARG A 149 28.351 -0.883 -8.588 1.00 0.00 H new ATOM 0 HH21 ARG A 149 26.765 1.953 -7.222 1.00 0.00 H new ATOM 0 HH22 ARG A 149 27.619 1.287 -8.618 1.00 0.00 H new ATOM 2218 N GLN A 150 22.238 -2.887 -6.936 1.00 0.00 N ATOM 2219 CA GLN A 150 21.892 -3.655 -8.121 1.00 0.00 C ATOM 2220 C GLN A 150 21.368 -2.716 -9.194 1.00 0.00 C ATOM 2221 O GLN A 150 22.074 -2.388 -10.148 1.00 0.00 O ATOM 2222 CB GLN A 150 20.834 -4.707 -7.777 1.00 0.00 C ATOM 2223 CG GLN A 150 21.197 -6.110 -8.228 1.00 0.00 C ATOM 2224 CD GLN A 150 20.051 -7.089 -8.063 1.00 0.00 C ATOM 2225 OE1 GLN A 150 19.192 -7.211 -8.937 1.00 0.00 O ATOM 2226 NE2 GLN A 150 20.032 -7.793 -6.938 1.00 0.00 N ATOM 0 H GLN A 150 21.598 -3.015 -6.152 1.00 0.00 H new ATOM 0 HA GLN A 150 22.780 -4.166 -8.492 1.00 0.00 H new ATOM 0 HB2 GLN A 150 20.676 -4.711 -6.698 1.00 0.00 H new ATOM 0 HB3 GLN A 150 19.888 -4.421 -8.236 1.00 0.00 H new ATOM 0 HG2 GLN A 150 21.501 -6.084 -9.275 1.00 0.00 H new ATOM 0 HG3 GLN A 150 22.056 -6.461 -7.656 1.00 0.00 H new ATOM 0 HE21 GLN A 150 20.764 -7.660 -6.241 1.00 0.00 H new ATOM 0 HE22 GLN A 150 19.285 -8.467 -6.771 1.00 0.00 H new ATOM 2235 N ARG A 151 20.135 -2.258 -9.014 1.00 0.00 N ATOM 2236 CA ARG A 151 19.530 -1.325 -9.946 1.00 0.00 C ATOM 2237 C ARG A 151 20.151 0.052 -9.751 1.00 0.00 C ATOM 2238 O ARG A 151 19.539 0.943 -9.163 1.00 0.00 O ATOM 2239 CB ARG A 151 18.015 -1.259 -9.735 1.00 0.00 C ATOM 2240 CG ARG A 151 17.379 -2.611 -9.453 1.00 0.00 C ATOM 2241 CD ARG A 151 17.839 -3.665 -10.448 1.00 0.00 C ATOM 2242 NE ARG A 151 16.882 -3.844 -11.537 1.00 0.00 N ATOM 2243 CZ ARG A 151 17.204 -4.344 -12.726 1.00 0.00 C ATOM 2244 NH1 ARG A 151 18.452 -4.713 -12.975 1.00 0.00 N ATOM 2245 NH2 ARG A 151 16.277 -4.476 -13.665 1.00 0.00 N ATOM 0 H ARG A 151 19.537 -2.520 -8.230 1.00 0.00 H new ATOM 0 HA ARG A 151 19.715 -1.666 -10.965 1.00 0.00 H new ATOM 0 HB2 ARG A 151 17.801 -0.586 -8.904 1.00 0.00 H new ATOM 0 HB3 ARG A 151 17.552 -0.827 -10.622 1.00 0.00 H new ATOM 0 HG2 ARG A 151 17.633 -2.929 -8.442 1.00 0.00 H new ATOM 0 HG3 ARG A 151 16.294 -2.519 -9.495 1.00 0.00 H new ATOM 0 HD2 ARG A 151 18.807 -3.378 -10.859 1.00 0.00 H new ATOM 0 HD3 ARG A 151 17.982 -4.614 -9.931 1.00 0.00 H new ATOM 0 HE ARG A 151 15.913 -3.570 -11.376 1.00 0.00 H new ATOM 0 HH11 ARG A 151 19.167 -4.614 -12.254 1.00 0.00 H new ATOM 0 HH12 ARG A 151 18.698 -5.097 -13.888 1.00 0.00 H new ATOM 0 HH21 ARG A 151 15.315 -4.194 -13.476 1.00 0.00 H new ATOM 0 HH22 ARG A 151 16.526 -4.860 -14.577 1.00 0.00 H new ATOM 2259 N GLY A 152 21.383 0.203 -10.224 1.00 0.00 N ATOM 2260 CA GLY A 152 22.106 1.455 -10.084 1.00 0.00 C ATOM 2261 C GLY A 152 21.438 2.622 -10.782 1.00 0.00 C ATOM 2262 O GLY A 152 22.053 3.294 -11.610 1.00 0.00 O ATOM 0 H GLY A 152 21.901 -0.530 -10.709 1.00 0.00 H new ATOM 0 HA2 GLY A 152 22.211 1.688 -9.024 1.00 0.00 H new ATOM 0 HA3 GLY A 152 23.112 1.331 -10.484 1.00 0.00 H new ATOM 2266 N ALA A 153 20.184 2.869 -10.437 1.00 0.00 N ATOM 2267 CA ALA A 153 19.434 3.973 -11.025 1.00 0.00 C ATOM 2268 C ALA A 153 19.975 5.314 -10.538 1.00 0.00 C ATOM 2269 O ALA A 153 19.646 6.363 -11.090 1.00 0.00 O ATOM 2270 CB ALA A 153 17.956 3.849 -10.688 1.00 0.00 C ATOM 0 H ALA A 153 19.662 2.321 -9.753 1.00 0.00 H new ATOM 0 HA ALA A 153 19.552 3.927 -12.108 1.00 0.00 H new ATOM 0 HB1 ALA A 153 17.410 4.680 -11.134 1.00 0.00 H new ATOM 0 HB2 ALA A 153 17.571 2.909 -11.082 1.00 0.00 H new ATOM 0 HB3 ALA A 153 17.827 3.869 -9.606 1.00 0.00 H new ATOM 2276 N GLN A 154 20.805 5.266 -9.496 1.00 0.00 N ATOM 2277 CA GLN A 154 21.399 6.470 -8.921 1.00 0.00 C ATOM 2278 C GLN A 154 20.497 7.066 -7.846 1.00 0.00 C ATOM 2279 O GLN A 154 20.976 7.576 -6.833 1.00 0.00 O ATOM 2280 CB GLN A 154 21.668 7.517 -10.004 1.00 0.00 C ATOM 2281 CG GLN A 154 22.587 8.635 -9.545 1.00 0.00 C ATOM 2282 CD GLN A 154 23.833 8.117 -8.857 1.00 0.00 C ATOM 2283 OE1 GLN A 154 24.270 8.663 -7.844 1.00 0.00 O ATOM 2284 NE2 GLN A 154 24.413 7.056 -9.406 1.00 0.00 N ATOM 0 H GLN A 154 21.081 4.401 -9.032 1.00 0.00 H new ATOM 0 HA GLN A 154 22.346 6.181 -8.465 1.00 0.00 H new ATOM 0 HB2 GLN A 154 22.109 7.027 -10.872 1.00 0.00 H new ATOM 0 HB3 GLN A 154 20.720 7.946 -10.328 1.00 0.00 H new ATOM 0 HG2 GLN A 154 22.876 9.240 -10.405 1.00 0.00 H new ATOM 0 HG3 GLN A 154 22.045 9.289 -8.863 1.00 0.00 H new ATOM 0 HE21 GLN A 154 24.016 6.635 -10.246 1.00 0.00 H new ATOM 0 HE22 GLN A 154 25.255 6.662 -8.987 1.00 0.00 H new ATOM 2293 N ASN A 155 19.191 7.001 -8.075 1.00 0.00 N ATOM 2294 CA ASN A 155 18.224 7.538 -7.126 1.00 0.00 C ATOM 2295 C ASN A 155 18.126 6.662 -5.881 1.00 0.00 C ATOM 2296 O ASN A 155 18.468 7.095 -4.780 1.00 0.00 O ATOM 2297 CB ASN A 155 16.847 7.667 -7.783 1.00 0.00 C ATOM 2298 CG ASN A 155 16.547 6.525 -8.734 1.00 0.00 C ATOM 2299 OD1 ASN A 155 15.964 5.514 -8.344 1.00 0.00 O ATOM 2300 ND2 ASN A 155 16.946 6.683 -9.991 1.00 0.00 N ATOM 0 H ASN A 155 18.778 6.582 -8.908 1.00 0.00 H new ATOM 0 HA ASN A 155 18.569 8.526 -6.822 1.00 0.00 H new ATOM 0 HB2 ASN A 155 16.081 7.701 -7.009 1.00 0.00 H new ATOM 0 HB3 ASN A 155 16.794 8.611 -8.326 1.00 0.00 H new ATOM 0 HD21 ASN A 155 16.772 5.949 -10.677 1.00 0.00 H new ATOM 0 HD22 ASN A 155 17.426 7.539 -10.270 1.00 0.00 H new ATOM 2307 N LEU A 156 17.655 5.433 -6.060 1.00 0.00 N ATOM 2308 CA LEU A 156 17.504 4.503 -4.944 1.00 0.00 C ATOM 2309 C LEU A 156 18.796 4.384 -4.144 1.00 0.00 C ATOM 2310 O LEU A 156 18.805 4.598 -2.931 1.00 0.00 O ATOM 2311 CB LEU A 156 17.083 3.124 -5.451 1.00 0.00 C ATOM 2312 CG LEU A 156 17.504 2.807 -6.886 1.00 0.00 C ATOM 2313 CD1 LEU A 156 18.035 1.385 -6.979 1.00 0.00 C ATOM 2314 CD2 LEU A 156 16.337 3.011 -7.837 1.00 0.00 C ATOM 0 H LEU A 156 17.371 5.057 -6.965 1.00 0.00 H new ATOM 0 HA LEU A 156 16.728 4.898 -4.288 1.00 0.00 H new ATOM 0 HB2 LEU A 156 17.503 2.366 -4.789 1.00 0.00 H new ATOM 0 HB3 LEU A 156 15.998 3.043 -5.380 1.00 0.00 H new ATOM 0 HG LEU A 156 18.303 3.490 -7.175 1.00 0.00 H new ATOM 0 HD11 LEU A 156 18.331 1.174 -8.007 1.00 0.00 H new ATOM 0 HD12 LEU A 156 18.899 1.275 -6.323 1.00 0.00 H new ATOM 0 HD13 LEU A 156 17.257 0.685 -6.674 1.00 0.00 H new ATOM 0 HD21 LEU A 156 16.653 2.781 -8.855 1.00 0.00 H new ATOM 0 HD22 LEU A 156 15.517 2.351 -7.554 1.00 0.00 H new ATOM 0 HD23 LEU A 156 16.003 4.047 -7.786 1.00 0.00 H new ATOM 2326 N MET A 157 19.886 4.050 -4.819 1.00 0.00 N ATOM 2327 CA MET A 157 21.162 3.913 -4.146 1.00 0.00 C ATOM 2328 C MET A 157 21.441 5.151 -3.310 1.00 0.00 C ATOM 2329 O MET A 157 22.134 5.086 -2.296 1.00 0.00 O ATOM 2330 CB MET A 157 22.271 3.704 -5.174 1.00 0.00 C ATOM 2331 CG MET A 157 22.557 2.242 -5.468 1.00 0.00 C ATOM 2332 SD MET A 157 23.207 1.357 -4.039 1.00 0.00 S ATOM 2333 CE MET A 157 24.776 2.190 -3.811 1.00 0.00 C ATOM 0 H MET A 157 19.910 3.871 -5.823 1.00 0.00 H new ATOM 0 HA MET A 157 21.129 3.046 -3.486 1.00 0.00 H new ATOM 0 HB2 MET A 157 21.995 4.206 -6.102 1.00 0.00 H new ATOM 0 HB3 MET A 157 23.183 4.179 -4.814 1.00 0.00 H new ATOM 0 HG2 MET A 157 21.640 1.757 -5.804 1.00 0.00 H new ATOM 0 HG3 MET A 157 23.272 2.174 -6.288 1.00 0.00 H new ATOM 0 HE1 MET A 157 25.441 1.558 -3.223 1.00 0.00 H new ATOM 0 HE2 MET A 157 25.228 2.387 -4.783 1.00 0.00 H new ATOM 0 HE3 MET A 157 24.615 3.133 -3.288 1.00 0.00 H new ATOM 2343 N ASP A 158 20.889 6.277 -3.744 1.00 0.00 N ATOM 2344 CA ASP A 158 21.066 7.536 -3.038 1.00 0.00 C ATOM 2345 C ASP A 158 20.217 7.597 -1.771 1.00 0.00 C ATOM 2346 O ASP A 158 20.740 7.553 -0.657 1.00 0.00 O ATOM 2347 CB ASP A 158 20.726 8.715 -3.951 1.00 0.00 C ATOM 2348 CG ASP A 158 21.340 10.015 -3.469 1.00 0.00 C ATOM 2349 OD1 ASP A 158 22.107 9.979 -2.484 1.00 0.00 O ATOM 2350 OD2 ASP A 158 21.054 11.068 -4.076 1.00 0.00 O ATOM 0 H ASP A 158 20.314 6.342 -4.584 1.00 0.00 H new ATOM 0 HA ASP A 158 22.114 7.600 -2.744 1.00 0.00 H new ATOM 0 HB2 ASP A 158 21.078 8.503 -4.961 1.00 0.00 H new ATOM 0 HB3 ASP A 158 19.643 8.827 -4.008 1.00 0.00 H new ATOM 2355 N ILE A 159 18.906 7.716 -1.952 1.00 0.00 N ATOM 2356 CA ILE A 159 17.980 7.804 -0.836 1.00 0.00 C ATOM 2357 C ILE A 159 18.159 6.658 0.154 1.00 0.00 C ATOM 2358 O ILE A 159 18.093 6.860 1.367 1.00 0.00 O ATOM 2359 CB ILE A 159 16.525 7.809 -1.328 1.00 0.00 C ATOM 2360 CG1 ILE A 159 16.367 6.894 -2.553 1.00 0.00 C ATOM 2361 CG2 ILE A 159 16.073 9.229 -1.626 1.00 0.00 C ATOM 2362 CD1 ILE A 159 16.145 7.620 -3.865 1.00 0.00 C ATOM 0 H ILE A 159 18.461 7.754 -2.869 1.00 0.00 H new ATOM 0 HA ILE A 159 18.203 8.742 -0.327 1.00 0.00 H new ATOM 0 HB ILE A 159 15.884 7.415 -0.539 1.00 0.00 H new ATOM 0 HG12 ILE A 159 17.259 6.274 -2.643 1.00 0.00 H new ATOM 0 HG13 ILE A 159 15.527 6.221 -2.380 1.00 0.00 H new ATOM 0 HG21 ILE A 159 15.040 9.217 -1.974 1.00 0.00 H new ATOM 0 HG22 ILE A 159 16.144 9.831 -0.720 1.00 0.00 H new ATOM 0 HG23 ILE A 159 16.711 9.659 -2.398 1.00 0.00 H new ATOM 0 HD11 ILE A 159 16.045 6.893 -4.671 1.00 0.00 H new ATOM 0 HD12 ILE A 159 15.236 8.218 -3.801 1.00 0.00 H new ATOM 0 HD13 ILE A 159 16.994 8.272 -4.068 1.00 0.00 H new ATOM 2374 N LEU A 160 18.370 5.457 -0.365 1.00 0.00 N ATOM 2375 CA LEU A 160 18.541 4.284 0.478 1.00 0.00 C ATOM 2376 C LEU A 160 19.904 4.285 1.159 1.00 0.00 C ATOM 2377 O LEU A 160 20.131 3.543 2.115 1.00 0.00 O ATOM 2378 CB LEU A 160 18.344 3.012 -0.346 1.00 0.00 C ATOM 2379 CG LEU A 160 16.907 2.788 -0.829 1.00 0.00 C ATOM 2380 CD1 LEU A 160 16.586 3.676 -2.022 1.00 0.00 C ATOM 2381 CD2 LEU A 160 16.683 1.327 -1.180 1.00 0.00 C ATOM 0 H LEU A 160 18.427 5.270 -1.366 1.00 0.00 H new ATOM 0 HA LEU A 160 17.784 4.313 1.262 1.00 0.00 H new ATOM 0 HB2 LEU A 160 19.004 3.049 -1.213 1.00 0.00 H new ATOM 0 HB3 LEU A 160 18.651 2.154 0.253 1.00 0.00 H new ATOM 0 HG LEU A 160 16.234 3.058 -0.015 1.00 0.00 H new ATOM 0 HD11 LEU A 160 15.560 3.496 -2.344 1.00 0.00 H new ATOM 0 HD12 LEU A 160 16.699 4.722 -1.738 1.00 0.00 H new ATOM 0 HD13 LEU A 160 17.268 3.447 -2.840 1.00 0.00 H new ATOM 0 HD21 LEU A 160 15.657 1.188 -1.521 1.00 0.00 H new ATOM 0 HD22 LEU A 160 17.372 1.033 -1.972 1.00 0.00 H new ATOM 0 HD23 LEU A 160 16.859 0.710 -0.299 1.00 0.00 H new ATOM 2393 N GLN A 161 20.807 5.130 0.674 1.00 0.00 N ATOM 2394 CA GLN A 161 22.142 5.232 1.251 1.00 0.00 C ATOM 2395 C GLN A 161 22.088 5.950 2.594 1.00 0.00 C ATOM 2396 O GLN A 161 22.437 5.383 3.630 1.00 0.00 O ATOM 2397 CB GLN A 161 23.080 5.973 0.302 1.00 0.00 C ATOM 2398 CG GLN A 161 24.307 5.168 -0.093 1.00 0.00 C ATOM 2399 CD GLN A 161 25.205 4.856 1.087 1.00 0.00 C ATOM 2400 OE1 GLN A 161 24.742 4.392 2.129 1.00 0.00 O ATOM 2401 NE2 GLN A 161 26.500 5.109 0.929 1.00 0.00 N ATOM 0 H GLN A 161 20.639 5.753 -0.116 1.00 0.00 H new ATOM 0 HA GLN A 161 22.525 4.223 1.406 1.00 0.00 H new ATOM 0 HB2 GLN A 161 22.530 6.247 -0.598 1.00 0.00 H new ATOM 0 HB3 GLN A 161 23.401 6.901 0.774 1.00 0.00 H new ATOM 0 HG2 GLN A 161 23.990 4.235 -0.560 1.00 0.00 H new ATOM 0 HG3 GLN A 161 24.875 5.722 -0.840 1.00 0.00 H new ATOM 0 HE21 GLN A 161 26.841 5.494 0.048 1.00 0.00 H new ATOM 0 HE22 GLN A 161 27.153 4.918 1.689 1.00 0.00 H new ATOM 2410 N GLY A 162 21.644 7.203 2.567 1.00 0.00 N ATOM 2411 CA GLY A 162 21.545 7.984 3.786 1.00 0.00 C ATOM 2412 C GLY A 162 20.468 7.465 4.715 1.00 0.00 C ATOM 2413 O GLY A 162 20.707 7.273 5.908 1.00 0.00 O ATOM 0 H GLY A 162 21.351 7.692 1.721 1.00 0.00 H new ATOM 0 HA2 GLY A 162 22.505 7.970 4.303 1.00 0.00 H new ATOM 0 HA3 GLY A 162 21.334 9.023 3.533 1.00 0.00 H new ATOM 2417 N HIS A 163 19.278 7.232 4.168 1.00 0.00 N ATOM 2418 CA HIS A 163 18.161 6.726 4.957 1.00 0.00 C ATOM 2419 C HIS A 163 18.558 5.451 5.694 1.00 0.00 C ATOM 2420 O HIS A 163 17.912 5.055 6.665 1.00 0.00 O ATOM 2421 CB HIS A 163 16.952 6.457 4.057 1.00 0.00 C ATOM 2422 CG HIS A 163 16.219 7.698 3.652 1.00 0.00 C ATOM 2423 ND1 HIS A 163 16.024 8.736 4.530 1.00 0.00 N ATOM 2424 CD2 HIS A 163 15.656 8.016 2.460 1.00 0.00 C ATOM 2425 CE1 HIS A 163 15.352 9.655 3.861 1.00 0.00 C ATOM 2426 NE2 HIS A 163 15.105 9.264 2.602 1.00 0.00 N ATOM 0 H HIS A 163 19.063 7.386 3.183 1.00 0.00 H new ATOM 0 HA HIS A 163 17.891 7.483 5.693 1.00 0.00 H new ATOM 0 HB2 HIS A 163 17.286 5.933 3.161 1.00 0.00 H new ATOM 0 HB3 HIS A 163 16.263 5.791 4.577 1.00 0.00 H new ATOM 0 HD2 HIS A 163 15.644 7.404 1.570 1.00 0.00 H new ATOM 0 HE1 HIS A 163 15.040 10.602 4.276 1.00 0.00 H new ATOM 0 HE2 HIS A 163 14.604 9.793 1.888 1.00 0.00 H new ATOM 2434 N MET A 164 19.628 4.813 5.226 1.00 0.00 N ATOM 2435 CA MET A 164 20.116 3.584 5.840 1.00 0.00 C ATOM 2436 C MET A 164 21.216 3.885 6.852 1.00 0.00 C ATOM 2437 O MET A 164 22.138 4.653 6.574 1.00 0.00 O ATOM 2438 CB MET A 164 20.645 2.631 4.766 1.00 0.00 C ATOM 2439 CG MET A 164 19.561 1.791 4.110 1.00 0.00 C ATOM 2440 SD MET A 164 19.445 0.135 4.814 1.00 0.00 S ATOM 2441 CE MET A 164 21.085 -0.495 4.466 1.00 0.00 C ATOM 0 H MET A 164 20.173 5.128 4.423 1.00 0.00 H new ATOM 0 HA MET A 164 19.284 3.110 6.361 1.00 0.00 H new ATOM 0 HB2 MET A 164 21.158 3.211 3.999 1.00 0.00 H new ATOM 0 HB3 MET A 164 21.386 1.968 5.213 1.00 0.00 H new ATOM 0 HG2 MET A 164 18.601 2.295 4.218 1.00 0.00 H new ATOM 0 HG3 MET A 164 19.763 1.714 3.042 1.00 0.00 H new ATOM 0 HE1 MET A 164 21.016 -1.538 4.157 1.00 0.00 H new ATOM 0 HE2 MET A 164 21.538 0.091 3.667 1.00 0.00 H new ATOM 0 HE3 MET A 164 21.700 -0.422 5.363 1.00 0.00 H new