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 Single : A 268 HIS :FLIP no HD1:sc= -1.51 F(o=-3.4!,f=-1.5) USER MOD Single : A 269 GLN : amide:sc= -1.39 X(o=-1.4,f=-0.95) USER MOD Single : A 274 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 276 GLN : amide:sc= -0.958 K(o=-0.96,f=-4.9!) USER MOD Single : A 279 ASN :FLIP amide:sc= -1.43! C(o=-5.3!,f=-1.4!) USER MOD Single : A 280 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 281 LYS NZ :NH3+ -156:sc=-0.00138 (180deg=-0.195) USER MOD Single : A 285 SER OG : rot 180:sc= 0 USER MOD Single : A 286 ASN : amide:sc= -0.161 X(o=-0.16,f=0) USER MOD ----------------------------------------------------------------- ATOM 23 N HIS A 268 15.778 -23.345 -15.389 1.00 0.00 N ATOM 24 CA HIS A 268 16.161 -21.983 -15.734 1.00 0.00 C ATOM 25 C HIS A 268 15.431 -20.994 -14.843 1.00 0.00 C ATOM 26 O HIS A 268 15.946 -19.922 -14.529 1.00 0.00 O ATOM 27 CB HIS A 268 15.818 -21.691 -17.195 1.00 0.00 C ATOM 28 CG HIS A 268 16.128 -20.249 -17.500 1.00 0.00 C ATOM 29 ND1 HIS A 268 15.606 -19.073 -17.015 1.00 0.00 N flip ATOM 30 CD2 HIS A 268 17.102 -19.882 -18.416 1.00 0.00 C flip ATOM 31 CE1 HIS A 268 16.246 -17.995 -17.619 1.00 0.00 C flip ATOM 32 NE2 HIS A 268 17.137 -18.538 -18.453 1.00 0.00 N flip ATOM 0 HA HIS A 268 17.236 -21.880 -15.588 1.00 0.00 H new ATOM 0 HB2 HIS A 268 16.390 -22.345 -17.853 1.00 0.00 H new ATOM 0 HB3 HIS A 268 14.764 -21.896 -17.381 1.00 0.00 H new ATOM 0 HD2 HIS A 268 17.720 -20.553 -18.994 1.00 0.00 H new ATOM 0 HE1 HIS A 268 16.062 -16.944 -17.450 1.00 0.00 H new ATOM 0 HE2 HIS A 268 17.768 -17.999 -19.046 1.00 0.00 H new ATOM 41 N GLN A 269 14.217 -21.361 -14.457 1.00 0.00 N ATOM 42 CA GLN A 269 13.397 -20.499 -13.622 1.00 0.00 C ATOM 43 C GLN A 269 14.250 -19.780 -12.572 1.00 0.00 C ATOM 44 O GLN A 269 14.040 -18.599 -12.298 1.00 0.00 O ATOM 45 CB GLN A 269 12.294 -21.337 -12.950 1.00 0.00 C ATOM 46 CG GLN A 269 11.002 -21.265 -13.774 1.00 0.00 C ATOM 47 CD GLN A 269 10.167 -22.521 -13.546 1.00 0.00 C ATOM 48 OE1 GLN A 269 10.640 -23.632 -13.778 1.00 0.00 O ATOM 49 NE2 GLN A 269 8.944 -22.409 -13.103 1.00 0.00 N ATOM 0 H GLN A 269 13.780 -22.248 -14.709 1.00 0.00 H new ATOM 0 HA GLN A 269 12.935 -19.735 -14.248 1.00 0.00 H new ATOM 0 HB2 GLN A 269 12.619 -22.373 -12.858 1.00 0.00 H new ATOM 0 HB3 GLN A 269 12.112 -20.970 -11.940 1.00 0.00 H new ATOM 0 HG2 GLN A 269 10.430 -20.382 -13.491 1.00 0.00 H new ATOM 0 HG3 GLN A 269 11.241 -21.165 -14.833 1.00 0.00 H new ATOM 0 HE21 GLN A 269 8.554 -21.486 -12.911 1.00 0.00 H new ATOM 0 HE22 GLN A 269 8.379 -23.244 -12.949 1.00 0.00 H new ATOM 58 N PRO A 270 15.211 -20.452 -11.992 1.00 0.00 N ATOM 59 CA PRO A 270 16.093 -19.822 -10.978 1.00 0.00 C ATOM 60 C PRO A 270 16.971 -18.720 -11.568 1.00 0.00 C ATOM 61 O PRO A 270 17.353 -17.779 -10.873 1.00 0.00 O ATOM 62 CB PRO A 270 16.934 -20.989 -10.471 1.00 0.00 C ATOM 63 CG PRO A 270 16.079 -22.210 -10.649 1.00 0.00 C ATOM 64 CD PRO A 270 14.966 -21.858 -11.648 1.00 0.00 C ATOM 0 HA PRO A 270 15.526 -19.323 -10.192 1.00 0.00 H new ATOM 0 HB2 PRO A 270 17.863 -21.076 -11.034 1.00 0.00 H new ATOM 0 HB3 PRO A 270 17.207 -20.850 -9.425 1.00 0.00 H new ATOM 0 HG2 PRO A 270 16.675 -23.044 -11.019 1.00 0.00 H new ATOM 0 HG3 PRO A 270 15.653 -22.521 -9.695 1.00 0.00 H new ATOM 0 HD2 PRO A 270 15.009 -22.496 -12.531 1.00 0.00 H new ATOM 0 HD3 PRO A 270 13.979 -21.992 -11.206 1.00 0.00 H new ATOM 72 N GLY A 271 17.283 -18.843 -12.854 1.00 0.00 N ATOM 73 CA GLY A 271 18.113 -17.852 -13.529 1.00 0.00 C ATOM 74 C GLY A 271 19.566 -18.313 -13.608 1.00 0.00 C ATOM 75 O GLY A 271 20.436 -17.770 -12.926 1.00 0.00 O ATOM 0 H GLY A 271 16.976 -19.614 -13.447 1.00 0.00 H new ATOM 0 HA2 GLY A 271 17.729 -17.676 -14.534 1.00 0.00 H new ATOM 0 HA3 GLY A 271 18.058 -16.903 -12.996 1.00 0.00 H new ATOM 79 N GLY A 272 19.822 -19.315 -14.444 1.00 0.00 N ATOM 80 CA GLY A 272 21.176 -19.836 -14.601 1.00 0.00 C ATOM 81 C GLY A 272 21.159 -21.271 -15.115 1.00 0.00 C ATOM 82 O GLY A 272 22.167 -21.976 -15.045 1.00 0.00 O ATOM 0 H GLY A 272 19.118 -19.779 -15.018 1.00 0.00 H new ATOM 0 HA2 GLY A 272 21.733 -19.205 -15.294 1.00 0.00 H new ATOM 0 HA3 GLY A 272 21.697 -19.796 -13.644 1.00 0.00 H new ATOM 86 N GLY A 273 20.013 -21.699 -15.634 1.00 0.00 N ATOM 87 CA GLY A 273 19.882 -23.054 -16.159 1.00 0.00 C ATOM 88 C GLY A 273 19.923 -24.082 -15.033 1.00 0.00 C ATOM 89 O GLY A 273 18.977 -24.848 -14.844 1.00 0.00 O ATOM 0 H GLY A 273 19.167 -21.133 -15.702 1.00 0.00 H new ATOM 0 HA2 GLY A 273 18.944 -23.147 -16.707 1.00 0.00 H new ATOM 0 HA3 GLY A 273 20.686 -23.253 -16.867 1.00 0.00 H new ATOM 93 N LYS A 274 21.022 -24.090 -14.285 1.00 0.00 N ATOM 94 CA LYS A 274 21.175 -25.025 -13.177 1.00 0.00 C ATOM 95 C LYS A 274 20.272 -24.623 -12.016 1.00 0.00 C ATOM 96 O LYS A 274 20.034 -23.438 -11.787 1.00 0.00 O ATOM 97 CB LYS A 274 22.632 -25.051 -12.709 1.00 0.00 C ATOM 98 CG LYS A 274 22.820 -26.179 -11.692 1.00 0.00 C ATOM 99 CD LYS A 274 24.260 -26.164 -11.171 1.00 0.00 C ATOM 100 CE LYS A 274 24.493 -27.387 -10.284 1.00 0.00 C ATOM 101 NZ LYS A 274 25.865 -27.327 -9.703 1.00 0.00 N ATOM 0 H LYS A 274 21.815 -23.464 -14.425 1.00 0.00 H new ATOM 0 HA LYS A 274 20.890 -26.019 -13.521 1.00 0.00 H new ATOM 0 HB2 LYS A 274 23.296 -25.200 -13.560 1.00 0.00 H new ATOM 0 HB3 LYS A 274 22.898 -24.094 -12.260 1.00 0.00 H new ATOM 0 HG2 LYS A 274 22.121 -26.057 -10.864 1.00 0.00 H new ATOM 0 HG3 LYS A 274 22.600 -27.141 -12.155 1.00 0.00 H new ATOM 0 HD2 LYS A 274 24.960 -26.168 -12.006 1.00 0.00 H new ATOM 0 HD3 LYS A 274 24.444 -25.251 -10.605 1.00 0.00 H new ATOM 0 HE2 LYS A 274 23.750 -27.418 -9.487 1.00 0.00 H new ATOM 0 HE3 LYS A 274 24.373 -28.300 -10.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 274 26.023 -28.159 -9.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 274 26.567 -27.317 -10.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 274 25.963 -26.463 -9.133 1.00 0.00 H new ATOM 115 N VAL A 275 19.765 -25.615 -11.291 1.00 0.00 N ATOM 116 CA VAL A 275 18.882 -25.340 -10.167 1.00 0.00 C ATOM 117 C VAL A 275 19.653 -24.696 -9.019 1.00 0.00 C ATOM 118 O VAL A 275 20.693 -25.196 -8.591 1.00 0.00 O ATOM 119 CB VAL A 275 18.230 -26.638 -9.683 1.00 0.00 C ATOM 120 CG1 VAL A 275 19.308 -27.699 -9.447 1.00 0.00 C ATOM 121 CG2 VAL A 275 17.482 -26.373 -8.375 1.00 0.00 C ATOM 0 H VAL A 275 19.948 -26.604 -11.460 1.00 0.00 H new ATOM 0 HA VAL A 275 18.109 -24.648 -10.501 1.00 0.00 H new ATOM 0 HB VAL A 275 17.531 -26.996 -10.439 1.00 0.00 H new ATOM 0 HG11 VAL A 275 18.841 -28.622 -9.103 1.00 0.00 H new ATOM 0 HG12 VAL A 275 19.842 -27.888 -10.378 1.00 0.00 H new ATOM 0 HG13 VAL A 275 20.009 -27.344 -8.692 1.00 0.00 H new ATOM 0 HG21 VAL A 275 17.017 -27.296 -8.028 1.00 0.00 H new ATOM 0 HG22 VAL A 275 18.183 -26.015 -7.621 1.00 0.00 H new ATOM 0 HG23 VAL A 275 16.712 -25.619 -8.542 1.00 0.00 H new ATOM 131 N GLN A 276 19.129 -23.575 -8.532 1.00 0.00 N ATOM 132 CA GLN A 276 19.754 -22.842 -7.435 1.00 0.00 C ATOM 133 C GLN A 276 18.798 -22.736 -6.254 1.00 0.00 C ATOM 134 O GLN A 276 17.590 -22.918 -6.405 1.00 0.00 O ATOM 135 CB GLN A 276 20.146 -21.439 -7.903 1.00 0.00 C ATOM 136 CG GLN A 276 21.198 -21.541 -9.008 1.00 0.00 C ATOM 137 CD GLN A 276 21.557 -20.150 -9.515 1.00 0.00 C ATOM 138 OE1 GLN A 276 20.804 -19.198 -9.307 1.00 0.00 O ATOM 139 NE2 GLN A 276 22.669 -19.972 -10.174 1.00 0.00 N ATOM 0 H GLN A 276 18.269 -23.153 -8.882 1.00 0.00 H new ATOM 0 HA GLN A 276 20.647 -23.383 -7.120 1.00 0.00 H new ATOM 0 HB2 GLN A 276 19.268 -20.909 -8.271 1.00 0.00 H new ATOM 0 HB3 GLN A 276 20.539 -20.862 -7.066 1.00 0.00 H new ATOM 0 HG2 GLN A 276 22.089 -22.040 -8.628 1.00 0.00 H new ATOM 0 HG3 GLN A 276 20.818 -22.149 -9.829 1.00 0.00 H new ATOM 0 HE21 GLN A 276 23.292 -20.761 -10.346 1.00 0.00 H new ATOM 0 HE22 GLN A 276 22.915 -19.044 -10.517 1.00 0.00 H new ATOM 148 N ILE A 277 19.340 -22.434 -5.078 1.00 0.00 N ATOM 149 CA ILE A 277 18.510 -22.301 -3.888 1.00 0.00 C ATOM 150 C ILE A 277 17.388 -21.309 -4.147 1.00 0.00 C ATOM 151 O ILE A 277 16.389 -21.284 -3.429 1.00 0.00 O ATOM 152 CB ILE A 277 19.347 -21.822 -2.703 1.00 0.00 C ATOM 153 CG1 ILE A 277 18.548 -22.002 -1.409 1.00 0.00 C ATOM 154 CG2 ILE A 277 19.696 -20.343 -2.885 1.00 0.00 C ATOM 155 CD1 ILE A 277 19.473 -21.814 -0.206 1.00 0.00 C ATOM 0 H ILE A 277 20.336 -22.279 -4.925 1.00 0.00 H new ATOM 0 HA ILE A 277 18.087 -23.277 -3.652 1.00 0.00 H new ATOM 0 HB ILE A 277 20.266 -22.406 -2.649 1.00 0.00 H new ATOM 0 HG12 ILE A 277 17.732 -21.280 -1.370 1.00 0.00 H new ATOM 0 HG13 ILE A 277 18.097 -22.994 -1.383 1.00 0.00 H new ATOM 0 HG21 ILE A 277 20.293 -20.003 -2.039 1.00 0.00 H new ATOM 0 HG22 ILE A 277 20.265 -20.214 -3.806 1.00 0.00 H new ATOM 0 HG23 ILE A 277 18.779 -19.757 -2.940 1.00 0.00 H new ATOM 0 HD11 ILE A 277 18.903 -21.942 0.714 1.00 0.00 H new ATOM 0 HD12 ILE A 277 20.273 -22.553 -0.243 1.00 0.00 H new ATOM 0 HD13 ILE A 277 19.903 -20.812 -0.230 1.00 0.00 H new ATOM 167 N ILE A 278 17.554 -20.498 -5.185 1.00 0.00 N ATOM 168 CA ILE A 278 16.542 -19.514 -5.529 1.00 0.00 C ATOM 169 C ILE A 278 15.214 -20.215 -5.766 1.00 0.00 C ATOM 170 O ILE A 278 15.167 -21.301 -6.344 1.00 0.00 O ATOM 171 CB ILE A 278 16.955 -18.747 -6.787 1.00 0.00 C ATOM 172 CG1 ILE A 278 18.288 -18.039 -6.534 1.00 0.00 C ATOM 173 CG2 ILE A 278 15.882 -17.711 -7.127 1.00 0.00 C ATOM 174 CD1 ILE A 278 18.793 -17.415 -7.837 1.00 0.00 C ATOM 0 H ILE A 278 18.371 -20.503 -5.795 1.00 0.00 H new ATOM 0 HA ILE A 278 16.439 -18.807 -4.706 1.00 0.00 H new ATOM 0 HB ILE A 278 17.064 -19.442 -7.620 1.00 0.00 H new ATOM 0 HG12 ILE A 278 18.163 -17.268 -5.774 1.00 0.00 H new ATOM 0 HG13 ILE A 278 19.021 -18.749 -6.151 1.00 0.00 H new ATOM 0 HG21 ILE A 278 16.175 -17.164 -8.023 1.00 0.00 H new ATOM 0 HG22 ILE A 278 14.932 -18.216 -7.304 1.00 0.00 H new ATOM 0 HG23 ILE A 278 15.773 -17.014 -6.296 1.00 0.00 H new ATOM 0 HD11 ILE A 278 19.742 -16.911 -7.655 1.00 0.00 H new ATOM 0 HD12 ILE A 278 18.934 -18.196 -8.584 1.00 0.00 H new ATOM 0 HD13 ILE A 278 18.063 -16.692 -8.201 1.00 0.00 H new ATOM 186 N ASN A 279 14.138 -19.601 -5.297 1.00 0.00 N ATOM 187 CA ASN A 279 12.820 -20.193 -5.445 1.00 0.00 C ATOM 188 C ASN A 279 12.426 -20.249 -6.917 1.00 0.00 C ATOM 189 O ASN A 279 12.222 -19.219 -7.561 1.00 0.00 O ATOM 190 CB ASN A 279 11.800 -19.374 -4.653 1.00 0.00 C ATOM 191 CG ASN A 279 12.460 -18.798 -3.403 1.00 0.00 C ATOM 192 OD1 ASN A 279 13.595 -19.294 -2.986 1.00 0.00 O flip ATOM 193 ND2 ASN A 279 11.933 -17.867 -2.795 1.00 0.00 N flip ATOM 0 H ASN A 279 14.152 -18.702 -4.815 1.00 0.00 H new ATOM 0 HA ASN A 279 12.840 -21.211 -5.057 1.00 0.00 H new ATOM 0 HB2 ASN A 279 11.407 -18.568 -5.272 1.00 0.00 H new ATOM 0 HB3 ASN A 279 10.954 -20.002 -4.373 1.00 0.00 H new ATOM 0 HD21 ASN A 279 11.047 -17.481 -3.122 1.00 0.00 H new ATOM 0 HD22 ASN A 279 12.382 -17.481 -1.964 1.00 0.00 H new ATOM 200 N LYS A 280 12.330 -21.468 -7.439 1.00 0.00 N ATOM 201 CA LYS A 280 11.972 -21.677 -8.837 1.00 0.00 C ATOM 202 C LYS A 280 10.621 -21.046 -9.149 1.00 0.00 C ATOM 203 O LYS A 280 10.395 -20.547 -10.251 1.00 0.00 O ATOM 204 CB LYS A 280 11.921 -23.181 -9.123 1.00 0.00 C ATOM 205 CG LYS A 280 13.326 -23.787 -8.965 1.00 0.00 C ATOM 206 CD LYS A 280 13.223 -25.198 -8.377 1.00 0.00 C ATOM 207 CE LYS A 280 13.190 -25.110 -6.849 1.00 0.00 C ATOM 208 NZ LYS A 280 13.143 -26.483 -6.273 1.00 0.00 N ATOM 0 H LYS A 280 12.495 -22.327 -6.914 1.00 0.00 H new ATOM 0 HA LYS A 280 12.724 -21.204 -9.469 1.00 0.00 H new ATOM 0 HB2 LYS A 280 11.226 -23.668 -8.439 1.00 0.00 H new ATOM 0 HB3 LYS A 280 11.550 -23.357 -10.133 1.00 0.00 H new ATOM 0 HG2 LYS A 280 13.827 -23.823 -9.932 1.00 0.00 H new ATOM 0 HG3 LYS A 280 13.932 -23.156 -8.315 1.00 0.00 H new ATOM 0 HD2 LYS A 280 12.323 -25.692 -8.743 1.00 0.00 H new ATOM 0 HD3 LYS A 280 14.072 -25.801 -8.699 1.00 0.00 H new ATOM 0 HE2 LYS A 280 14.071 -24.582 -6.485 1.00 0.00 H new ATOM 0 HE3 LYS A 280 12.320 -24.539 -6.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 280 13.121 -26.423 -5.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 280 12.289 -26.972 -6.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 280 13.986 -27.014 -6.571 1.00 0.00 H new ATOM 222 N LYS A 281 9.730 -21.070 -8.168 1.00 0.00 N ATOM 223 CA LYS A 281 8.402 -20.494 -8.336 1.00 0.00 C ATOM 224 C LYS A 281 8.520 -19.017 -8.711 1.00 0.00 C ATOM 225 O LYS A 281 7.602 -18.435 -9.289 1.00 0.00 O ATOM 226 CB LYS A 281 7.588 -20.653 -7.037 1.00 0.00 C ATOM 227 CG LYS A 281 8.526 -21.018 -5.878 1.00 0.00 C ATOM 228 CD LYS A 281 8.932 -22.508 -5.955 1.00 0.00 C ATOM 229 CE LYS A 281 8.407 -23.265 -4.730 1.00 0.00 C ATOM 230 NZ LYS A 281 9.106 -22.777 -3.507 1.00 0.00 N ATOM 0 H LYS A 281 9.901 -21.481 -7.250 1.00 0.00 H new ATOM 0 HA LYS A 281 7.884 -21.020 -9.138 1.00 0.00 H new ATOM 0 HB2 LYS A 281 7.060 -19.726 -6.812 1.00 0.00 H new ATOM 0 HB3 LYS A 281 6.832 -21.428 -7.163 1.00 0.00 H new ATOM 0 HG2 LYS A 281 9.417 -20.391 -5.912 1.00 0.00 H new ATOM 0 HG3 LYS A 281 8.032 -20.819 -4.927 1.00 0.00 H new ATOM 0 HD2 LYS A 281 8.533 -22.954 -6.866 1.00 0.00 H new ATOM 0 HD3 LYS A 281 10.017 -22.594 -6.007 1.00 0.00 H new ATOM 0 HE2 LYS A 281 7.332 -23.117 -4.631 1.00 0.00 H new ATOM 0 HE3 LYS A 281 8.571 -24.336 -4.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 281 9.077 -23.514 -2.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 281 10.096 -22.557 -3.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 281 8.633 -21.920 -3.156 1.00 0.00 H new ATOM 244 N LEU A 282 9.660 -18.422 -8.374 1.00 0.00 N ATOM 245 CA LEU A 282 9.898 -17.014 -8.671 1.00 0.00 C ATOM 246 C LEU A 282 9.718 -16.749 -10.164 1.00 0.00 C ATOM 247 O LEU A 282 9.203 -15.705 -10.562 1.00 0.00 O ATOM 248 CB LEU A 282 11.320 -16.636 -8.247 1.00 0.00 C ATOM 249 CG LEU A 282 11.518 -15.121 -8.366 1.00 0.00 C ATOM 250 CD1 LEU A 282 10.850 -14.409 -7.184 1.00 0.00 C ATOM 251 CD2 LEU A 282 13.016 -14.807 -8.364 1.00 0.00 C ATOM 0 H LEU A 282 10.430 -18.891 -7.897 1.00 0.00 H new ATOM 0 HA LEU A 282 9.179 -16.409 -8.119 1.00 0.00 H new ATOM 0 HB2 LEU A 282 11.499 -16.955 -7.220 1.00 0.00 H new ATOM 0 HB3 LEU A 282 12.045 -17.156 -8.873 1.00 0.00 H new ATOM 0 HG LEU A 282 11.066 -14.773 -9.295 1.00 0.00 H new ATOM 0 HD11 LEU A 282 10.996 -13.333 -7.278 1.00 0.00 H new ATOM 0 HD12 LEU A 282 9.783 -14.631 -7.181 1.00 0.00 H new ATOM 0 HD13 LEU A 282 11.295 -14.756 -6.252 1.00 0.00 H new ATOM 0 HD21 LEU A 282 13.162 -13.730 -8.449 1.00 0.00 H new ATOM 0 HD22 LEU A 282 13.461 -15.162 -7.434 1.00 0.00 H new ATOM 0 HD23 LEU A 282 13.493 -15.305 -9.208 1.00 0.00 H new ATOM 263 N ASP A 283 10.137 -17.710 -10.983 1.00 0.00 N ATOM 264 CA ASP A 283 10.011 -17.588 -12.434 1.00 0.00 C ATOM 265 C ASP A 283 8.871 -18.464 -12.944 1.00 0.00 C ATOM 266 O ASP A 283 8.401 -19.357 -12.239 1.00 0.00 O ATOM 267 CB ASP A 283 11.324 -17.992 -13.114 1.00 0.00 C ATOM 268 CG ASP A 283 12.286 -16.808 -13.138 1.00 0.00 C ATOM 269 OD1 ASP A 283 11.949 -15.784 -12.566 1.00 0.00 O ATOM 270 OD2 ASP A 283 13.347 -16.942 -13.726 1.00 0.00 O ATOM 0 H ASP A 283 10.566 -18.580 -10.668 1.00 0.00 H new ATOM 0 HA ASP A 283 9.790 -16.548 -12.676 1.00 0.00 H new ATOM 0 HB2 ASP A 283 11.777 -18.828 -12.581 1.00 0.00 H new ATOM 0 HB3 ASP A 283 11.127 -18.331 -14.131 1.00 0.00 H new ATOM 275 N LEU A 284 8.431 -18.205 -14.171 1.00 0.00 N ATOM 276 CA LEU A 284 7.343 -18.980 -14.757 1.00 0.00 C ATOM 277 C LEU A 284 7.888 -20.289 -15.321 1.00 0.00 C ATOM 278 O LEU A 284 9.068 -20.383 -15.654 1.00 0.00 O ATOM 279 CB LEU A 284 6.665 -18.182 -15.872 1.00 0.00 C ATOM 280 CG LEU A 284 6.391 -16.756 -15.390 1.00 0.00 C ATOM 281 CD1 LEU A 284 5.709 -15.959 -16.507 1.00 0.00 C ATOM 282 CD2 LEU A 284 5.475 -16.801 -14.165 1.00 0.00 C ATOM 0 H LEU A 284 8.806 -17.473 -14.774 1.00 0.00 H new ATOM 0 HA LEU A 284 6.609 -19.197 -13.981 1.00 0.00 H new ATOM 0 HB2 LEU A 284 7.301 -18.161 -16.757 1.00 0.00 H new ATOM 0 HB3 LEU A 284 5.731 -18.664 -16.162 1.00 0.00 H new ATOM 0 HG LEU A 284 7.333 -16.275 -15.125 1.00 0.00 H new ATOM 0 HD11 LEU A 284 5.514 -14.943 -16.163 1.00 0.00 H new ATOM 0 HD12 LEU A 284 6.360 -15.927 -17.381 1.00 0.00 H new ATOM 0 HD13 LEU A 284 4.767 -16.439 -16.773 1.00 0.00 H new ATOM 0 HD21 LEU A 284 5.279 -15.786 -13.820 1.00 0.00 H new ATOM 0 HD22 LEU A 284 4.534 -17.282 -14.432 1.00 0.00 H new ATOM 0 HD23 LEU A 284 5.959 -17.367 -13.369 1.00 0.00 H new ATOM 294 N SER A 285 7.028 -21.298 -15.404 1.00 0.00 N ATOM 295 CA SER A 285 7.432 -22.610 -15.909 1.00 0.00 C ATOM 296 C SER A 285 8.035 -22.514 -17.313 1.00 0.00 C ATOM 297 O SER A 285 7.445 -22.989 -18.283 1.00 0.00 O ATOM 298 CB SER A 285 6.219 -23.542 -15.937 1.00 0.00 C ATOM 299 OG SER A 285 6.095 -24.187 -14.675 1.00 0.00 O ATOM 0 H SER A 285 6.048 -21.235 -15.129 1.00 0.00 H new ATOM 0 HA SER A 285 8.196 -23.007 -15.241 1.00 0.00 H new ATOM 0 HB2 SER A 285 5.315 -22.975 -16.159 1.00 0.00 H new ATOM 0 HB3 SER A 285 6.333 -24.283 -16.728 1.00 0.00 H new ATOM 0 HG SER A 285 5.318 -24.784 -14.688 1.00 0.00 H new ATOM 305 N ASN A 286 9.220 -21.917 -17.409 1.00 0.00 N ATOM 306 CA ASN A 286 9.910 -21.781 -18.691 1.00 0.00 C ATOM 307 C ASN A 286 9.076 -21.009 -19.718 1.00 0.00 C ATOM 308 O ASN A 286 9.622 -20.454 -20.672 1.00 0.00 O ATOM 309 CB ASN A 286 10.237 -23.167 -19.248 1.00 0.00 C ATOM 310 CG ASN A 286 10.973 -23.991 -18.197 1.00 0.00 C ATOM 311 OD1 ASN A 286 10.664 -25.166 -17.998 1.00 0.00 O ATOM 312 ND2 ASN A 286 11.934 -23.440 -17.507 1.00 0.00 N ATOM 0 H ASN A 286 9.723 -21.520 -16.616 1.00 0.00 H new ATOM 0 HA ASN A 286 10.825 -21.216 -18.511 1.00 0.00 H new ATOM 0 HB2 ASN A 286 9.319 -23.675 -19.543 1.00 0.00 H new ATOM 0 HB3 ASN A 286 10.851 -23.073 -20.144 1.00 0.00 H new ATOM 0 HD21 ASN A 286 12.431 -23.983 -16.801 1.00 0.00 H new ATOM 0 HD22 ASN A 286 12.188 -22.466 -17.674 1.00 0.00 H new ATOM 319 N VAL A 287 7.762 -20.974 -19.528 1.00 0.00 N ATOM 320 CA VAL A 287 6.886 -20.268 -20.455 1.00 0.00 C ATOM 321 C VAL A 287 7.269 -18.795 -20.551 1.00 0.00 C ATOM 322 O VAL A 287 6.945 -18.129 -21.533 1.00 0.00 O ATOM 323 CB VAL A 287 5.431 -20.397 -20.002 1.00 0.00 C ATOM 324 CG1 VAL A 287 5.234 -19.620 -18.702 1.00 0.00 C ATOM 325 CG2 VAL A 287 4.509 -19.824 -21.082 1.00 0.00 C ATOM 0 H VAL A 287 7.283 -21.422 -18.747 1.00 0.00 H new ATOM 0 HA VAL A 287 6.999 -20.719 -21.441 1.00 0.00 H new ATOM 0 HB VAL A 287 5.192 -21.448 -19.839 1.00 0.00 H new ATOM 0 HG11 VAL A 287 4.197 -19.711 -18.377 1.00 0.00 H new ATOM 0 HG12 VAL A 287 5.892 -20.025 -17.933 1.00 0.00 H new ATOM 0 HG13 VAL A 287 5.472 -18.569 -18.867 1.00 0.00 H new ATOM 0 HG21 VAL A 287 3.471 -19.915 -20.761 1.00 0.00 H new ATOM 0 HG22 VAL A 287 4.748 -18.773 -21.244 1.00 0.00 H new ATOM 0 HG23 VAL A 287 4.651 -20.376 -22.011 1.00 0.00 H new