USER MOD reduce.3.24.130724 H: found=0, std=0, add=161, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 162 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 269 GLN :FLIP amide:sc= 0.958 F(o=-1.3!,f=1.8) USER MOD Set 1.2: A 285 SER OG : rot 180:sc= 0.87 USER MOD Single : A 268 HIS : no HD1:sc= -0.365 X(o=-0.36,f=-0.37) USER MOD Single : A 274 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 276 GLN : amide:sc= -0.814 K(o=-0.81,f=-2.7!) USER MOD Single : A 279 ASN :FLIP amide:sc= -0.964 F(o=-5.3!,f=-0.96) USER MOD Single : A 280 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 281 LYS NZ :NH3+ -154:sc= 0 (180deg=-0.0152) USER MOD Single : A 286 ASN : amide:sc= -0.398 X(o=-0.4,f=-0.4) USER MOD ----------------------------------------------------------------- ATOM 23 N HIS A 268 -15.312 0.984 0.394 1.00 0.00 N ATOM 24 CA HIS A 268 -16.710 0.836 0.006 1.00 0.00 C ATOM 25 C HIS A 268 -17.137 1.979 -0.909 1.00 0.00 C ATOM 26 O HIS A 268 -16.670 3.109 -0.768 1.00 0.00 O ATOM 27 CB HIS A 268 -17.599 0.819 1.252 1.00 0.00 C ATOM 28 CG HIS A 268 -19.018 0.527 0.852 1.00 0.00 C ATOM 29 ND1 HIS A 268 -19.400 -0.694 0.317 1.00 0.00 N ATOM 30 CD2 HIS A 268 -20.161 1.287 0.902 1.00 0.00 C ATOM 31 CE1 HIS A 268 -20.721 -0.634 0.069 1.00 0.00 C ATOM 32 NE2 HIS A 268 -21.234 0.552 0.408 1.00 0.00 N ATOM 0 HA HIS A 268 -16.820 -0.105 -0.532 1.00 0.00 H new ATOM 0 HB2 HIS A 268 -17.245 0.064 1.954 1.00 0.00 H new ATOM 0 HB3 HIS A 268 -17.545 1.780 1.764 1.00 0.00 H new ATOM 0 HD2 HIS A 268 -20.218 2.301 1.269 1.00 0.00 H new ATOM 0 HE1 HIS A 268 -21.296 -1.445 -0.352 1.00 0.00 H new ATOM 0 HE2 HIS A 268 -22.205 0.854 0.323 1.00 0.00 H new ATOM 41 N GLN A 269 -18.027 1.677 -1.848 1.00 0.00 N ATOM 42 CA GLN A 269 -18.508 2.690 -2.781 1.00 0.00 C ATOM 43 C GLN A 269 -19.162 3.840 -2.013 1.00 0.00 C ATOM 44 O GLN A 269 -19.773 3.630 -0.965 1.00 0.00 O ATOM 45 CB GLN A 269 -19.512 2.066 -3.763 1.00 0.00 C ATOM 46 CG GLN A 269 -20.081 0.775 -3.167 1.00 0.00 C ATOM 47 CD GLN A 269 -21.271 0.297 -3.993 1.00 0.00 C ATOM 48 OE1 GLN A 269 -22.059 1.171 -4.556 1.00 0.00 O flip ATOM 49 NE2 GLN A 269 -21.488 -0.908 -4.130 1.00 0.00 N flip ATOM 0 H GLN A 269 -18.427 0.748 -1.983 1.00 0.00 H new ATOM 0 HA GLN A 269 -17.663 3.082 -3.347 1.00 0.00 H new ATOM 0 HB2 GLN A 269 -20.319 2.769 -3.970 1.00 0.00 H new ATOM 0 HB3 GLN A 269 -19.022 1.854 -4.714 1.00 0.00 H new ATOM 0 HG2 GLN A 269 -19.310 0.005 -3.145 1.00 0.00 H new ATOM 0 HG3 GLN A 269 -20.389 0.946 -2.136 1.00 0.00 H new ATOM 0 HE21 GLN A 269 -20.871 -1.591 -3.689 1.00 0.00 H new ATOM 0 HE22 GLN A 269 -22.284 -1.223 -4.684 1.00 0.00 H new ATOM 58 N PRO A 270 -19.036 5.043 -2.510 1.00 0.00 N ATOM 59 CA PRO A 270 -19.622 6.244 -1.844 1.00 0.00 C ATOM 60 C PRO A 270 -21.130 6.119 -1.645 1.00 0.00 C ATOM 61 O PRO A 270 -21.694 6.705 -0.720 1.00 0.00 O ATOM 62 CB PRO A 270 -19.290 7.387 -2.805 1.00 0.00 C ATOM 63 CG PRO A 270 -19.161 6.751 -4.148 1.00 0.00 C ATOM 64 CD PRO A 270 -18.677 5.320 -3.912 1.00 0.00 C ATOM 0 HA PRO A 270 -19.220 6.392 -0.842 1.00 0.00 H new ATOM 0 HB2 PRO A 270 -20.075 8.143 -2.802 1.00 0.00 H new ATOM 0 HB3 PRO A 270 -18.365 7.887 -2.517 1.00 0.00 H new ATOM 0 HG2 PRO A 270 -20.117 6.755 -4.671 1.00 0.00 H new ATOM 0 HG3 PRO A 270 -18.455 7.301 -4.770 1.00 0.00 H new ATOM 0 HD2 PRO A 270 -19.160 4.619 -4.593 1.00 0.00 H new ATOM 0 HD3 PRO A 270 -17.603 5.231 -4.073 1.00 0.00 H new ATOM 72 N GLY A 271 -21.778 5.357 -2.517 1.00 0.00 N ATOM 73 CA GLY A 271 -23.220 5.167 -2.426 1.00 0.00 C ATOM 74 C GLY A 271 -23.955 6.271 -3.177 1.00 0.00 C ATOM 75 O GLY A 271 -25.184 6.274 -3.252 1.00 0.00 O ATOM 0 H GLY A 271 -21.332 4.864 -3.290 1.00 0.00 H new ATOM 0 HA2 GLY A 271 -23.491 4.196 -2.840 1.00 0.00 H new ATOM 0 HA3 GLY A 271 -23.527 5.165 -1.380 1.00 0.00 H new ATOM 79 N GLY A 272 -23.191 7.206 -3.732 1.00 0.00 N ATOM 80 CA GLY A 272 -23.774 8.314 -4.479 1.00 0.00 C ATOM 81 C GLY A 272 -24.010 9.522 -3.578 1.00 0.00 C ATOM 82 O GLY A 272 -24.508 10.553 -4.029 1.00 0.00 O ATOM 0 H GLY A 272 -22.172 7.219 -3.679 1.00 0.00 H new ATOM 0 HA2 GLY A 272 -23.112 8.592 -5.299 1.00 0.00 H new ATOM 0 HA3 GLY A 272 -24.718 7.999 -4.925 1.00 0.00 H new ATOM 86 N GLY A 273 -23.654 9.389 -2.302 1.00 0.00 N ATOM 87 CA GLY A 273 -23.840 10.484 -1.355 1.00 0.00 C ATOM 88 C GLY A 273 -22.607 11.379 -1.294 1.00 0.00 C ATOM 89 O GLY A 273 -22.552 12.421 -1.947 1.00 0.00 O ATOM 0 H GLY A 273 -23.241 8.545 -1.905 1.00 0.00 H new ATOM 0 HA2 GLY A 273 -24.708 11.076 -1.646 1.00 0.00 H new ATOM 0 HA3 GLY A 273 -24.048 10.080 -0.364 1.00 0.00 H new ATOM 93 N LYS A 274 -21.616 10.965 -0.508 1.00 0.00 N ATOM 94 CA LYS A 274 -20.388 11.740 -0.373 1.00 0.00 C ATOM 95 C LYS A 274 -19.684 11.849 -1.724 1.00 0.00 C ATOM 96 O LYS A 274 -19.051 12.860 -2.030 1.00 0.00 O ATOM 97 CB LYS A 274 -19.458 11.079 0.646 1.00 0.00 C ATOM 98 CG LYS A 274 -18.374 12.073 1.064 1.00 0.00 C ATOM 99 CD LYS A 274 -17.403 11.392 2.031 1.00 0.00 C ATOM 100 CE LYS A 274 -16.383 12.413 2.538 1.00 0.00 C ATOM 101 NZ LYS A 274 -15.314 11.712 3.305 1.00 0.00 N ATOM 0 H LYS A 274 -21.639 10.105 0.040 1.00 0.00 H new ATOM 0 HA LYS A 274 -20.642 12.741 -0.024 1.00 0.00 H new ATOM 0 HB2 LYS A 274 -20.027 10.756 1.518 1.00 0.00 H new ATOM 0 HB3 LYS A 274 -19.003 10.188 0.215 1.00 0.00 H new ATOM 0 HG2 LYS A 274 -17.837 12.433 0.186 1.00 0.00 H new ATOM 0 HG3 LYS A 274 -18.827 12.943 1.539 1.00 0.00 H new ATOM 0 HD2 LYS A 274 -17.951 10.963 2.870 1.00 0.00 H new ATOM 0 HD3 LYS A 274 -16.892 10.570 1.530 1.00 0.00 H new ATOM 0 HE2 LYS A 274 -15.947 12.954 1.698 1.00 0.00 H new ATOM 0 HE3 LYS A 274 -16.876 13.151 3.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 274 -14.621 12.407 3.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 274 -15.737 11.215 4.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 274 -14.837 11.025 2.687 1.00 0.00 H new ATOM 115 N VAL A 275 -19.812 10.799 -2.529 1.00 0.00 N ATOM 116 CA VAL A 275 -19.199 10.769 -3.855 1.00 0.00 C ATOM 117 C VAL A 275 -17.711 11.113 -3.793 1.00 0.00 C ATOM 118 O VAL A 275 -17.112 11.474 -4.805 1.00 0.00 O ATOM 119 CB VAL A 275 -19.917 11.759 -4.779 1.00 0.00 C ATOM 120 CG1 VAL A 275 -19.371 11.632 -6.207 1.00 0.00 C ATOM 121 CG2 VAL A 275 -21.420 11.456 -4.776 1.00 0.00 C ATOM 0 H VAL A 275 -20.334 9.957 -2.287 1.00 0.00 H new ATOM 0 HA VAL A 275 -19.296 9.757 -4.247 1.00 0.00 H new ATOM 0 HB VAL A 275 -19.746 12.774 -4.422 1.00 0.00 H new ATOM 0 HG11 VAL A 275 -19.886 12.339 -6.858 1.00 0.00 H new ATOM 0 HG12 VAL A 275 -18.303 11.849 -6.209 1.00 0.00 H new ATOM 0 HG13 VAL A 275 -19.536 10.618 -6.571 1.00 0.00 H new ATOM 0 HG21 VAL A 275 -21.934 12.158 -5.432 1.00 0.00 H new ATOM 0 HG22 VAL A 275 -21.587 10.439 -5.131 1.00 0.00 H new ATOM 0 HG23 VAL A 275 -21.809 11.555 -3.763 1.00 0.00 H new ATOM 131 N GLN A 276 -17.112 10.996 -2.612 1.00 0.00 N ATOM 132 CA GLN A 276 -15.689 11.295 -2.470 1.00 0.00 C ATOM 133 C GLN A 276 -14.876 10.473 -3.464 1.00 0.00 C ATOM 134 O GLN A 276 -13.907 10.960 -4.046 1.00 0.00 O ATOM 135 CB GLN A 276 -15.217 10.975 -1.050 1.00 0.00 C ATOM 136 CG GLN A 276 -13.797 11.507 -0.855 1.00 0.00 C ATOM 137 CD GLN A 276 -13.829 13.024 -0.708 1.00 0.00 C ATOM 138 OE1 GLN A 276 -14.176 13.538 0.355 1.00 0.00 O ATOM 139 NE2 GLN A 276 -13.496 13.774 -1.721 1.00 0.00 N ATOM 0 H GLN A 276 -17.578 10.702 -1.754 1.00 0.00 H new ATOM 0 HA GLN A 276 -15.542 12.356 -2.669 1.00 0.00 H new ATOM 0 HB2 GLN A 276 -15.890 11.427 -0.321 1.00 0.00 H new ATOM 0 HB3 GLN A 276 -15.240 9.898 -0.881 1.00 0.00 H new ATOM 0 HG2 GLN A 276 -13.348 11.056 0.030 1.00 0.00 H new ATOM 0 HG3 GLN A 276 -13.174 11.228 -1.705 1.00 0.00 H new ATOM 0 HE21 GLN A 276 -13.209 13.345 -2.601 1.00 0.00 H new ATOM 0 HE22 GLN A 276 -13.523 14.790 -1.634 1.00 0.00 H new ATOM 148 N ILE A 277 -15.284 9.222 -3.649 1.00 0.00 N ATOM 149 CA ILE A 277 -14.599 8.326 -4.573 1.00 0.00 C ATOM 150 C ILE A 277 -14.775 8.796 -6.013 1.00 0.00 C ATOM 151 O ILE A 277 -14.010 8.409 -6.895 1.00 0.00 O ATOM 152 CB ILE A 277 -15.156 6.907 -4.433 1.00 0.00 C ATOM 153 CG1 ILE A 277 -15.089 6.465 -2.966 1.00 0.00 C ATOM 154 CG2 ILE A 277 -14.328 5.949 -5.289 1.00 0.00 C ATOM 155 CD1 ILE A 277 -13.673 6.673 -2.424 1.00 0.00 C ATOM 0 H ILE A 277 -16.084 8.806 -3.172 1.00 0.00 H new ATOM 0 HA ILE A 277 -13.537 8.331 -4.328 1.00 0.00 H new ATOM 0 HB ILE A 277 -16.194 6.894 -4.766 1.00 0.00 H new ATOM 0 HG12 ILE A 277 -15.803 7.036 -2.372 1.00 0.00 H new ATOM 0 HG13 ILE A 277 -15.370 5.415 -2.880 1.00 0.00 H new ATOM 0 HG21 ILE A 277 -14.724 4.938 -5.190 1.00 0.00 H new ATOM 0 HG22 ILE A 277 -14.378 6.258 -6.333 1.00 0.00 H new ATOM 0 HG23 ILE A 277 -13.291 5.967 -4.955 1.00 0.00 H new ATOM 0 HD11 ILE A 277 -13.632 6.357 -1.382 1.00 0.00 H new ATOM 0 HD12 ILE A 277 -12.969 6.082 -3.010 1.00 0.00 H new ATOM 0 HD13 ILE A 277 -13.408 7.728 -2.494 1.00 0.00 H new ATOM 167 N ILE A 278 -15.803 9.611 -6.243 1.00 0.00 N ATOM 168 CA ILE A 278 -16.099 10.114 -7.584 1.00 0.00 C ATOM 169 C ILE A 278 -16.487 8.956 -8.497 1.00 0.00 C ATOM 170 O ILE A 278 -17.627 8.870 -8.953 1.00 0.00 O ATOM 171 CB ILE A 278 -14.890 10.858 -8.165 1.00 0.00 C ATOM 172 CG1 ILE A 278 -14.472 11.976 -7.207 1.00 0.00 C ATOM 173 CG2 ILE A 278 -15.270 11.471 -9.515 1.00 0.00 C ATOM 174 CD1 ILE A 278 -13.197 12.643 -7.725 1.00 0.00 C ATOM 0 H ILE A 278 -16.444 9.937 -5.520 1.00 0.00 H new ATOM 0 HA ILE A 278 -16.932 10.814 -7.515 1.00 0.00 H new ATOM 0 HB ILE A 278 -14.064 10.159 -8.298 1.00 0.00 H new ATOM 0 HG12 ILE A 278 -15.271 12.713 -7.120 1.00 0.00 H new ATOM 0 HG13 ILE A 278 -14.303 11.570 -6.210 1.00 0.00 H new ATOM 0 HG21 ILE A 278 -14.412 12.000 -9.929 1.00 0.00 H new ATOM 0 HG22 ILE A 278 -15.574 10.680 -10.201 1.00 0.00 H new ATOM 0 HG23 ILE A 278 -16.095 12.170 -9.378 1.00 0.00 H new ATOM 0 HD11 ILE A 278 -12.900 13.439 -7.042 1.00 0.00 H new ATOM 0 HD12 ILE A 278 -12.399 11.903 -7.789 1.00 0.00 H new ATOM 0 HD13 ILE A 278 -13.382 13.063 -8.714 1.00 0.00 H new ATOM 186 N ASN A 279 -15.539 8.059 -8.749 1.00 0.00 N ATOM 187 CA ASN A 279 -15.806 6.900 -9.593 1.00 0.00 C ATOM 188 C ASN A 279 -16.173 5.703 -8.720 1.00 0.00 C ATOM 189 O ASN A 279 -15.298 5.001 -8.214 1.00 0.00 O ATOM 190 CB ASN A 279 -14.569 6.567 -10.431 1.00 0.00 C ATOM 191 CG ASN A 279 -14.250 7.722 -11.372 1.00 0.00 C ATOM 192 OD1 ASN A 279 -14.978 8.802 -11.330 1.00 0.00 O flip ATOM 193 ND2 ASN A 279 -13.312 7.638 -12.164 1.00 0.00 N flip ATOM 0 H ASN A 279 -14.588 8.111 -8.385 1.00 0.00 H new ATOM 0 HA ASN A 279 -16.637 7.129 -10.261 1.00 0.00 H new ATOM 0 HB2 ASN A 279 -13.718 6.374 -9.778 1.00 0.00 H new ATOM 0 HB3 ASN A 279 -14.743 5.657 -11.005 1.00 0.00 H new ATOM 0 HD21 ASN A 279 -12.744 6.791 -12.194 1.00 0.00 H new ATOM 0 HD22 ASN A 279 -13.102 8.415 -12.790 1.00 0.00 H new ATOM 200 N LYS A 280 -17.471 5.484 -8.538 1.00 0.00 N ATOM 201 CA LYS A 280 -17.940 4.378 -7.711 1.00 0.00 C ATOM 202 C LYS A 280 -17.486 3.038 -8.281 1.00 0.00 C ATOM 203 O LYS A 280 -17.054 2.154 -7.541 1.00 0.00 O ATOM 204 CB LYS A 280 -19.465 4.408 -7.630 1.00 0.00 C ATOM 205 CG LYS A 280 -20.054 4.038 -8.992 1.00 0.00 C ATOM 206 CD LYS A 280 -21.537 4.415 -9.025 1.00 0.00 C ATOM 207 CE LYS A 280 -21.684 5.885 -9.432 1.00 0.00 C ATOM 208 NZ LYS A 280 -21.901 5.973 -10.904 1.00 0.00 N ATOM 0 H LYS A 280 -18.212 6.053 -8.948 1.00 0.00 H new ATOM 0 HA LYS A 280 -17.514 4.491 -6.714 1.00 0.00 H new ATOM 0 HB2 LYS A 280 -19.813 3.710 -6.869 1.00 0.00 H new ATOM 0 HB3 LYS A 280 -19.805 5.400 -7.332 1.00 0.00 H new ATOM 0 HG2 LYS A 280 -19.518 4.558 -9.786 1.00 0.00 H new ATOM 0 HG3 LYS A 280 -19.935 2.970 -9.174 1.00 0.00 H new ATOM 0 HD2 LYS A 280 -22.069 3.777 -9.730 1.00 0.00 H new ATOM 0 HD3 LYS A 280 -21.986 4.252 -8.045 1.00 0.00 H new ATOM 0 HE2 LYS A 280 -22.522 6.338 -8.902 1.00 0.00 H new ATOM 0 HE3 LYS A 280 -20.790 6.442 -9.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 280 -22.001 6.970 -11.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 280 -21.088 5.555 -11.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 280 -22.766 5.455 -11.159 1.00 0.00 H new ATOM 222 N LYS A 281 -17.585 2.894 -9.598 1.00 0.00 N ATOM 223 CA LYS A 281 -17.177 1.657 -10.248 1.00 0.00 C ATOM 224 C LYS A 281 -15.701 1.375 -9.986 1.00 0.00 C ATOM 225 O LYS A 281 -15.278 0.220 -9.938 1.00 0.00 O ATOM 226 CB LYS A 281 -17.437 1.735 -11.759 1.00 0.00 C ATOM 227 CG LYS A 281 -16.599 2.854 -12.396 1.00 0.00 C ATOM 228 CD LYS A 281 -17.135 4.226 -11.971 1.00 0.00 C ATOM 229 CE LYS A 281 -16.747 5.270 -13.020 1.00 0.00 C ATOM 230 NZ LYS A 281 -17.698 5.199 -14.166 1.00 0.00 N ATOM 0 H LYS A 281 -17.941 3.611 -10.230 1.00 0.00 H new ATOM 0 HA LYS A 281 -17.767 0.841 -9.831 1.00 0.00 H new ATOM 0 HB2 LYS A 281 -17.193 0.780 -12.225 1.00 0.00 H new ATOM 0 HB3 LYS A 281 -18.496 1.917 -11.942 1.00 0.00 H new ATOM 0 HG2 LYS A 281 -15.556 2.754 -12.094 1.00 0.00 H new ATOM 0 HG3 LYS A 281 -16.627 2.765 -13.482 1.00 0.00 H new ATOM 0 HD2 LYS A 281 -18.219 4.188 -11.863 1.00 0.00 H new ATOM 0 HD3 LYS A 281 -16.728 4.503 -10.999 1.00 0.00 H new ATOM 0 HE2 LYS A 281 -16.764 6.267 -12.580 1.00 0.00 H new ATOM 0 HE3 LYS A 281 -15.729 5.092 -13.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 281 -17.230 5.547 -15.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 281 -17.997 4.213 -14.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 281 -18.531 5.788 -13.963 1.00 0.00 H new ATOM 244 N LEU A 282 -14.922 2.440 -9.819 1.00 0.00 N ATOM 245 CA LEU A 282 -13.492 2.296 -9.564 1.00 0.00 C ATOM 246 C LEU A 282 -13.255 1.522 -8.270 1.00 0.00 C ATOM 247 O LEU A 282 -12.311 0.737 -8.170 1.00 0.00 O ATOM 248 CB LEU A 282 -12.842 3.679 -9.458 1.00 0.00 C ATOM 249 CG LEU A 282 -11.318 3.537 -9.397 1.00 0.00 C ATOM 250 CD1 LEU A 282 -10.754 3.441 -10.816 1.00 0.00 C ATOM 251 CD2 LEU A 282 -10.722 4.760 -8.696 1.00 0.00 C ATOM 0 H LEU A 282 -15.253 3.404 -9.855 1.00 0.00 H new ATOM 0 HA LEU A 282 -13.046 1.745 -10.392 1.00 0.00 H new ATOM 0 HB2 LEU A 282 -13.125 4.290 -10.315 1.00 0.00 H new ATOM 0 HB3 LEU A 282 -13.204 4.193 -8.567 1.00 0.00 H new ATOM 0 HG LEU A 282 -11.060 2.635 -8.843 1.00 0.00 H new ATOM 0 HD11 LEU A 282 -9.670 3.340 -10.770 1.00 0.00 H new ATOM 0 HD12 LEU A 282 -11.179 2.572 -11.318 1.00 0.00 H new ATOM 0 HD13 LEU A 282 -11.011 4.343 -11.372 1.00 0.00 H new ATOM 0 HD21 LEU A 282 -9.637 4.661 -8.651 1.00 0.00 H new ATOM 0 HD22 LEU A 282 -10.982 5.661 -9.252 1.00 0.00 H new ATOM 0 HD23 LEU A 282 -11.122 4.830 -7.684 1.00 0.00 H new ATOM 263 N ASP A 283 -14.116 1.751 -7.284 1.00 0.00 N ATOM 264 CA ASP A 283 -13.992 1.073 -5.996 1.00 0.00 C ATOM 265 C ASP A 283 -14.979 -0.084 -5.898 1.00 0.00 C ATOM 266 O ASP A 283 -16.121 0.020 -6.347 1.00 0.00 O ATOM 267 CB ASP A 283 -14.252 2.063 -4.860 1.00 0.00 C ATOM 268 CG ASP A 283 -13.967 1.402 -3.516 1.00 0.00 C ATOM 269 OD1 ASP A 283 -13.494 0.277 -3.520 1.00 0.00 O ATOM 270 OD2 ASP A 283 -14.226 2.029 -2.502 1.00 0.00 O ATOM 0 H ASP A 283 -14.903 2.397 -7.350 1.00 0.00 H new ATOM 0 HA ASP A 283 -12.980 0.678 -5.912 1.00 0.00 H new ATOM 0 HB2 ASP A 283 -13.621 2.943 -4.982 1.00 0.00 H new ATOM 0 HB3 ASP A 283 -15.286 2.405 -4.894 1.00 0.00 H new ATOM 275 N LEU A 284 -14.536 -1.184 -5.295 1.00 0.00 N ATOM 276 CA LEU A 284 -15.385 -2.350 -5.127 1.00 0.00 C ATOM 277 C LEU A 284 -15.889 -2.422 -3.704 1.00 0.00 C ATOM 278 O LEU A 284 -15.179 -2.057 -2.768 1.00 0.00 O ATOM 279 CB LEU A 284 -14.600 -3.626 -5.419 1.00 0.00 C ATOM 280 CG LEU A 284 -14.055 -3.595 -6.842 1.00 0.00 C ATOM 281 CD1 LEU A 284 -13.314 -4.905 -7.120 1.00 0.00 C ATOM 282 CD2 LEU A 284 -15.220 -3.446 -7.822 1.00 0.00 C ATOM 0 H LEU A 284 -13.595 -1.288 -4.917 1.00 0.00 H new ATOM 0 HA LEU A 284 -16.221 -2.262 -5.820 1.00 0.00 H new ATOM 0 HB2 LEU A 284 -13.779 -3.727 -4.709 1.00 0.00 H new ATOM 0 HB3 LEU A 284 -15.244 -4.496 -5.287 1.00 0.00 H new ATOM 0 HG LEU A 284 -13.370 -2.755 -6.962 1.00 0.00 H new ATOM 0 HD11 LEU A 284 -12.920 -4.892 -8.136 1.00 0.00 H new ATOM 0 HD12 LEU A 284 -12.491 -5.015 -6.414 1.00 0.00 H new ATOM 0 HD13 LEU A 284 -14.002 -5.743 -7.008 1.00 0.00 H new ATOM 0 HD21 LEU A 284 -14.837 -3.423 -8.842 1.00 0.00 H new ATOM 0 HD22 LEU A 284 -15.901 -4.290 -7.709 1.00 0.00 H new ATOM 0 HD23 LEU A 284 -15.754 -2.519 -7.614 1.00 0.00 H new ATOM 294 N SER A 285 -17.095 -2.927 -3.533 1.00 0.00 N ATOM 295 CA SER A 285 -17.630 -3.072 -2.200 1.00 0.00 C ATOM 296 C SER A 285 -16.643 -3.904 -1.397 1.00 0.00 C ATOM 297 O SER A 285 -15.517 -4.134 -1.838 1.00 0.00 O ATOM 298 CB SER A 285 -18.992 -3.766 -2.243 1.00 0.00 C ATOM 299 OG SER A 285 -19.874 -3.017 -3.069 1.00 0.00 O ATOM 0 H SER A 285 -17.710 -3.237 -4.285 1.00 0.00 H new ATOM 0 HA SER A 285 -17.770 -2.094 -1.740 1.00 0.00 H new ATOM 0 HB2 SER A 285 -18.885 -4.779 -2.630 1.00 0.00 H new ATOM 0 HB3 SER A 285 -19.402 -3.851 -1.237 1.00 0.00 H new ATOM 0 HG SER A 285 -20.748 -3.460 -3.100 1.00 0.00 H new ATOM 305 N ASN A 286 -17.056 -4.362 -0.237 1.00 0.00 N ATOM 306 CA ASN A 286 -16.179 -5.176 0.594 1.00 0.00 C ATOM 307 C ASN A 286 -15.565 -6.315 -0.223 1.00 0.00 C ATOM 308 O ASN A 286 -14.753 -7.085 0.288 1.00 0.00 O ATOM 309 CB ASN A 286 -16.958 -5.754 1.775 1.00 0.00 C ATOM 310 CG ASN A 286 -16.006 -6.501 2.705 1.00 0.00 C ATOM 311 OD1 ASN A 286 -16.092 -7.722 2.831 1.00 0.00 O ATOM 312 ND2 ASN A 286 -15.094 -5.835 3.358 1.00 0.00 N ATOM 0 H ASN A 286 -17.982 -4.191 0.155 1.00 0.00 H new ATOM 0 HA ASN A 286 -15.377 -4.540 0.968 1.00 0.00 H new ATOM 0 HB2 ASN A 286 -17.459 -4.953 2.319 1.00 0.00 H new ATOM 0 HB3 ASN A 286 -17.734 -6.429 1.415 1.00 0.00 H new ATOM 0 HD21 ASN A 286 -14.448 -6.326 3.976 1.00 0.00 H new ATOM 0 HD22 ASN A 286 -15.027 -4.823 3.250 1.00 0.00 H new ATOM 319 N VAL A 287 -15.965 -6.423 -1.491 1.00 0.00 N ATOM 320 CA VAL A 287 -15.451 -7.480 -2.356 1.00 0.00 C ATOM 321 C VAL A 287 -13.931 -7.419 -2.457 1.00 0.00 C ATOM 322 O VAL A 287 -13.264 -8.453 -2.506 1.00 0.00 O ATOM 323 CB VAL A 287 -16.060 -7.351 -3.753 1.00 0.00 C ATOM 324 CG1 VAL A 287 -15.375 -8.336 -4.701 1.00 0.00 C ATOM 325 CG2 VAL A 287 -17.557 -7.666 -3.686 1.00 0.00 C ATOM 0 H VAL A 287 -16.636 -5.797 -1.936 1.00 0.00 H new ATOM 0 HA VAL A 287 -15.730 -8.439 -1.919 1.00 0.00 H new ATOM 0 HB VAL A 287 -15.917 -6.335 -4.120 1.00 0.00 H new ATOM 0 HG11 VAL A 287 -15.809 -8.244 -5.697 1.00 0.00 H new ATOM 0 HG12 VAL A 287 -14.309 -8.114 -4.748 1.00 0.00 H new ATOM 0 HG13 VAL A 287 -15.518 -9.353 -4.335 1.00 0.00 H new ATOM 0 HG21 VAL A 287 -17.993 -7.575 -4.681 1.00 0.00 H new ATOM 0 HG22 VAL A 287 -17.699 -8.683 -3.320 1.00 0.00 H new ATOM 0 HG23 VAL A 287 -18.046 -6.965 -3.010 1.00 0.00 H new