USER MOD reduce.3.24.130724 H: found=0, std=0, add=437, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 439 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 251 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 267 MET CE :methyl -173:sc= -0.827 (180deg=-1.02) USER MOD Single : A 216 LYS NZ :NH3+ 161:sc= 0 (180deg=-0.334) USER MOD Single : A 223 THR OG1 : rot 180:sc= 0.0562 USER MOD Single : A 229 GLN : amide:sc= -0.151 K(o=-0.15,f=-1.7) USER MOD Single : A 247 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 254 ASN :FLIP amide:sc= -5! C(o=-10!,f=-5!) USER MOD Single : A 258 THR OG1 : rot 108:sc= -2.52! USER MOD Single : A 266 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 269 SER OG : rot -3:sc= 0.307! USER MOD ----------------------------------------------------------------- ATOM 61 N VAL A 204 1.552 17.768 30.097 1.00 0.00 N ATOM 62 CA VAL A 204 0.657 18.387 31.105 1.00 0.00 C ATOM 63 C VAL A 204 0.933 19.875 31.240 1.00 0.00 C ATOM 64 O VAL A 204 0.048 20.644 31.563 1.00 0.00 O ATOM 65 CB VAL A 204 0.918 17.725 32.466 1.00 0.00 C ATOM 66 CG1 VAL A 204 0.430 18.660 33.584 1.00 0.00 C ATOM 67 CG2 VAL A 204 0.148 16.407 32.540 1.00 0.00 C ATOM 0 HA VAL A 204 -0.375 18.245 30.786 1.00 0.00 H new ATOM 0 HB VAL A 204 1.985 17.535 32.585 1.00 0.00 H new ATOM 0 HG11 VAL A 204 0.613 18.195 34.553 1.00 0.00 H new ATOM 0 HG12 VAL A 204 0.969 19.606 33.528 1.00 0.00 H new ATOM 0 HG13 VAL A 204 -0.638 18.843 33.465 1.00 0.00 H new ATOM 0 HG21 VAL A 204 0.330 15.933 33.504 1.00 0.00 H new ATOM 0 HG22 VAL A 204 -0.918 16.602 32.427 1.00 0.00 H new ATOM 0 HG23 VAL A 204 0.483 15.745 31.741 1.00 0.00 H new ATOM 77 N ARG A 205 2.159 20.255 31.001 1.00 0.00 N ATOM 78 CA ARG A 205 2.514 21.690 31.111 1.00 0.00 C ATOM 79 C ARG A 205 1.430 22.561 30.509 1.00 0.00 C ATOM 80 O ARG A 205 1.265 23.701 30.892 1.00 0.00 O ATOM 81 CB ARG A 205 3.828 21.927 30.353 1.00 0.00 C ATOM 82 CG ARG A 205 4.982 21.312 31.147 1.00 0.00 C ATOM 83 CD ARG A 205 5.503 22.341 32.152 1.00 0.00 C ATOM 84 NE ARG A 205 6.223 21.630 33.245 1.00 0.00 N ATOM 85 CZ ARG A 205 7.517 21.492 33.175 1.00 0.00 C ATOM 86 NH1 ARG A 205 8.254 22.549 32.966 1.00 0.00 N ATOM 87 NH2 ARG A 205 8.034 20.301 33.317 1.00 0.00 N ATOM 0 H ARG A 205 2.923 19.634 30.736 1.00 0.00 H new ATOM 0 HA ARG A 205 2.622 21.951 32.164 1.00 0.00 H new ATOM 0 HB2 ARG A 205 3.775 21.481 29.360 1.00 0.00 H new ATOM 0 HB3 ARG A 205 3.994 22.995 30.214 1.00 0.00 H new ATOM 0 HG2 ARG A 205 4.645 20.416 31.667 1.00 0.00 H new ATOM 0 HG3 ARG A 205 5.782 21.007 30.472 1.00 0.00 H new ATOM 0 HD2 ARG A 205 6.171 23.046 31.657 1.00 0.00 H new ATOM 0 HD3 ARG A 205 4.675 22.920 32.561 1.00 0.00 H new ATOM 0 HE ARG A 205 5.708 21.254 34.041 1.00 0.00 H new ATOM 0 HH11 ARG A 205 7.815 23.464 32.860 1.00 0.00 H new ATOM 0 HH12 ARG A 205 9.268 22.460 32.908 1.00 0.00 H new ATOM 0 HH21 ARG A 205 7.427 19.498 33.480 1.00 0.00 H new ATOM 0 HH22 ARG A 205 9.045 20.174 33.265 1.00 0.00 H new ATOM 101 N GLU A 206 0.706 22.014 29.578 1.00 0.00 N ATOM 102 CA GLU A 206 -0.367 22.808 28.952 1.00 0.00 C ATOM 103 C GLU A 206 -1.520 22.966 29.924 1.00 0.00 C ATOM 104 O GLU A 206 -1.834 24.064 30.347 1.00 0.00 O ATOM 105 CB GLU A 206 -0.857 22.073 27.695 1.00 0.00 C ATOM 106 CG GLU A 206 -1.897 22.943 26.980 1.00 0.00 C ATOM 107 CD GLU A 206 -1.249 24.265 26.555 1.00 0.00 C ATOM 108 OE1 GLU A 206 -0.485 24.214 25.605 1.00 0.00 O ATOM 109 OE2 GLU A 206 -1.555 25.251 27.206 1.00 0.00 O ATOM 0 H GLU A 206 0.813 21.061 29.230 1.00 0.00 H new ATOM 0 HA GLU A 206 0.013 23.794 28.685 1.00 0.00 H new ATOM 0 HB2 GLU A 206 -0.019 21.865 27.030 1.00 0.00 H new ATOM 0 HB3 GLU A 206 -1.293 21.112 27.967 1.00 0.00 H new ATOM 0 HG2 GLU A 206 -2.287 22.419 26.107 1.00 0.00 H new ATOM 0 HG3 GLU A 206 -2.742 23.135 27.641 1.00 0.00 H new ATOM 116 N LEU A 207 -2.137 21.869 30.272 1.00 0.00 N ATOM 117 CA LEU A 207 -3.264 21.968 31.218 1.00 0.00 C ATOM 118 C LEU A 207 -2.823 22.754 32.434 1.00 0.00 C ATOM 119 O LEU A 207 -3.571 23.538 32.982 1.00 0.00 O ATOM 120 CB LEU A 207 -3.690 20.557 31.682 1.00 0.00 C ATOM 121 CG LEU A 207 -3.180 19.497 30.704 1.00 0.00 C ATOM 122 CD1 LEU A 207 -3.622 18.113 31.198 1.00 0.00 C ATOM 123 CD2 LEU A 207 -3.776 19.745 29.319 1.00 0.00 C ATOM 0 H LEU A 207 -1.909 20.930 29.945 1.00 0.00 H new ATOM 0 HA LEU A 207 -4.100 22.462 30.723 1.00 0.00 H new ATOM 0 HB2 LEU A 207 -3.296 20.361 32.679 1.00 0.00 H new ATOM 0 HB3 LEU A 207 -4.776 20.503 31.753 1.00 0.00 H new ATOM 0 HG LEU A 207 -2.093 19.547 30.645 1.00 0.00 H new ATOM 0 HD11 LEU A 207 -3.264 17.349 30.508 1.00 0.00 H new ATOM 0 HD12 LEU A 207 -3.206 17.931 32.189 1.00 0.00 H new ATOM 0 HD13 LEU A 207 -4.710 18.075 31.248 1.00 0.00 H new ATOM 0 HD21 LEU A 207 -3.411 18.988 28.625 1.00 0.00 H new ATOM 0 HD22 LEU A 207 -4.863 19.691 29.376 1.00 0.00 H new ATOM 0 HD23 LEU A 207 -3.480 20.733 28.967 1.00 0.00 H new ATOM 135 N ARG A 208 -1.598 22.537 32.833 1.00 0.00 N ATOM 136 CA ARG A 208 -1.090 23.260 34.005 1.00 0.00 C ATOM 137 C ARG A 208 -1.306 24.751 33.842 1.00 0.00 C ATOM 138 O ARG A 208 -1.947 25.382 34.655 1.00 0.00 O ATOM 139 CB ARG A 208 0.418 22.984 34.130 1.00 0.00 C ATOM 140 CG ARG A 208 0.744 22.600 35.576 1.00 0.00 C ATOM 141 CD ARG A 208 2.243 22.796 35.823 1.00 0.00 C ATOM 142 NE ARG A 208 2.437 23.923 36.781 1.00 0.00 N ATOM 143 CZ ARG A 208 3.630 24.164 37.256 1.00 0.00 C ATOM 144 NH1 ARG A 208 4.645 23.494 36.782 1.00 0.00 N ATOM 145 NH2 ARG A 208 3.768 25.064 38.192 1.00 0.00 N ATOM 0 H ARG A 208 -0.941 21.893 32.393 1.00 0.00 H new ATOM 0 HA ARG A 208 -1.621 22.923 34.895 1.00 0.00 H new ATOM 0 HB2 ARG A 208 0.710 22.180 33.454 1.00 0.00 H new ATOM 0 HB3 ARG A 208 0.986 23.867 33.839 1.00 0.00 H new ATOM 0 HG2 ARG A 208 0.166 23.214 36.267 1.00 0.00 H new ATOM 0 HG3 ARG A 208 0.465 21.563 35.761 1.00 0.00 H new ATOM 0 HD2 ARG A 208 2.681 21.882 36.224 1.00 0.00 H new ATOM 0 HD3 ARG A 208 2.754 23.009 34.884 1.00 0.00 H new ATOM 0 HE ARG A 208 1.645 24.501 37.063 1.00 0.00 H new ATOM 0 HH11 ARG A 208 4.499 22.796 36.053 1.00 0.00 H new ATOM 0 HH12 ARG A 208 5.584 23.669 37.141 1.00 0.00 H new ATOM 0 HH21 ARG A 208 2.952 25.566 38.541 1.00 0.00 H new ATOM 0 HH22 ARG A 208 4.692 25.265 38.574 1.00 0.00 H new ATOM 159 N ILE A 209 -0.783 25.284 32.779 1.00 0.00 N ATOM 160 CA ILE A 209 -0.944 26.734 32.539 1.00 0.00 C ATOM 161 C ILE A 209 -2.395 27.173 32.690 1.00 0.00 C ATOM 162 O ILE A 209 -2.682 28.135 33.368 1.00 0.00 O ATOM 163 CB ILE A 209 -0.485 27.041 31.121 1.00 0.00 C ATOM 164 CG1 ILE A 209 1.028 26.918 31.037 1.00 0.00 C ATOM 165 CG2 ILE A 209 -0.878 28.488 30.787 1.00 0.00 C ATOM 166 CD1 ILE A 209 1.430 26.660 29.588 1.00 0.00 C ATOM 0 H ILE A 209 -0.253 24.778 32.069 1.00 0.00 H new ATOM 0 HA ILE A 209 -0.349 27.273 33.276 1.00 0.00 H new ATOM 0 HB ILE A 209 -0.948 26.343 30.423 1.00 0.00 H new ATOM 0 HG12 ILE A 209 1.500 27.831 31.401 1.00 0.00 H new ATOM 0 HG13 ILE A 209 1.375 26.104 31.674 1.00 0.00 H new ATOM 0 HG21 ILE A 209 -0.557 28.727 29.773 1.00 0.00 H new ATOM 0 HG22 ILE A 209 -1.960 28.597 30.860 1.00 0.00 H new ATOM 0 HG23 ILE A 209 -0.396 29.167 31.490 1.00 0.00 H new ATOM 0 HD11 ILE A 209 2.514 26.571 29.522 1.00 0.00 H new ATOM 0 HD12 ILE A 209 0.968 25.736 29.241 1.00 0.00 H new ATOM 0 HD13 ILE A 209 1.095 27.489 28.964 1.00 0.00 H new ATOM 178 N ALA A 210 -3.288 26.457 32.062 1.00 0.00 N ATOM 179 CA ALA A 210 -4.728 26.834 32.166 1.00 0.00 C ATOM 180 C ALA A 210 -5.249 26.695 33.592 1.00 0.00 C ATOM 181 O ALA A 210 -5.884 27.594 34.109 1.00 0.00 O ATOM 182 CB ALA A 210 -5.547 25.919 31.247 1.00 0.00 C ATOM 0 H ALA A 210 -3.088 25.638 31.488 1.00 0.00 H new ATOM 0 HA ALA A 210 -4.827 27.878 31.870 1.00 0.00 H new ATOM 0 HB1 ALA A 210 -6.602 26.185 31.315 1.00 0.00 H new ATOM 0 HB2 ALA A 210 -5.208 26.039 30.218 1.00 0.00 H new ATOM 0 HB3 ALA A 210 -5.414 24.882 31.554 1.00 0.00 H new ATOM 188 N PHE A 211 -4.991 25.578 34.204 1.00 0.00 N ATOM 189 CA PHE A 211 -5.470 25.399 35.573 1.00 0.00 C ATOM 190 C PHE A 211 -4.777 26.381 36.476 1.00 0.00 C ATOM 191 O PHE A 211 -5.399 27.198 37.122 1.00 0.00 O ATOM 192 CB PHE A 211 -5.116 23.977 36.029 1.00 0.00 C ATOM 193 CG PHE A 211 -5.794 23.689 37.366 1.00 0.00 C ATOM 194 CD1 PHE A 211 -5.371 24.328 38.521 1.00 0.00 C ATOM 195 CD2 PHE A 211 -6.856 22.803 37.437 1.00 0.00 C ATOM 196 CE1 PHE A 211 -6.002 24.087 39.719 1.00 0.00 C ATOM 197 CE2 PHE A 211 -7.482 22.565 38.639 1.00 0.00 C ATOM 198 CZ PHE A 211 -7.055 23.207 39.778 1.00 0.00 C ATOM 0 H PHE A 211 -4.472 24.793 33.809 1.00 0.00 H new ATOM 0 HA PHE A 211 -6.547 25.558 35.614 1.00 0.00 H new ATOM 0 HB2 PHE A 211 -5.439 23.253 35.281 1.00 0.00 H new ATOM 0 HB3 PHE A 211 -4.035 23.873 36.127 1.00 0.00 H new ATOM 0 HD1 PHE A 211 -4.542 25.019 38.480 1.00 0.00 H new ATOM 0 HD2 PHE A 211 -7.194 22.297 36.545 1.00 0.00 H new ATOM 0 HE1 PHE A 211 -5.669 24.590 40.615 1.00 0.00 H new ATOM 0 HE2 PHE A 211 -8.310 21.873 38.688 1.00 0.00 H new ATOM 0 HZ PHE A 211 -7.548 23.019 40.720 1.00 0.00 H new ATOM 208 N ARG A 212 -3.491 26.277 36.501 1.00 0.00 N ATOM 209 CA ARG A 212 -2.697 27.180 37.345 1.00 0.00 C ATOM 210 C ARG A 212 -3.006 28.650 37.054 1.00 0.00 C ATOM 211 O ARG A 212 -2.723 29.510 37.864 1.00 0.00 O ATOM 212 CB ARG A 212 -1.230 26.913 37.027 1.00 0.00 C ATOM 213 CG ARG A 212 -0.374 27.267 38.241 1.00 0.00 C ATOM 214 CD ARG A 212 -0.385 26.088 39.216 1.00 0.00 C ATOM 215 NE ARG A 212 0.211 26.523 40.509 1.00 0.00 N ATOM 216 CZ ARG A 212 -0.571 26.963 41.457 1.00 0.00 C ATOM 217 NH1 ARG A 212 -1.647 27.624 41.129 1.00 0.00 N ATOM 218 NH2 ARG A 212 -0.252 26.723 42.699 1.00 0.00 N ATOM 0 H ARG A 212 -2.952 25.596 35.966 1.00 0.00 H new ATOM 0 HA ARG A 212 -2.934 26.996 38.393 1.00 0.00 H new ATOM 0 HB2 ARG A 212 -1.089 25.865 36.762 1.00 0.00 H new ATOM 0 HB3 ARG A 212 -0.920 27.504 36.165 1.00 0.00 H new ATOM 0 HG2 ARG A 212 0.647 27.490 37.930 1.00 0.00 H new ATOM 0 HG3 ARG A 212 -0.762 28.162 38.727 1.00 0.00 H new ATOM 0 HD2 ARG A 212 -1.405 25.737 39.371 1.00 0.00 H new ATOM 0 HD3 ARG A 212 0.180 25.253 38.803 1.00 0.00 H new ATOM 0 HE ARG A 212 1.220 26.478 40.653 1.00 0.00 H new ATOM 0 HH11 ARG A 212 -1.865 27.789 40.146 1.00 0.00 H new ATOM 0 HH12 ARG A 212 -2.271 27.976 41.855 1.00 0.00 H new ATOM 0 HH21 ARG A 212 0.596 26.200 42.916 1.00 0.00 H new ATOM 0 HH22 ARG A 212 -0.851 27.059 43.453 1.00 0.00 H new ATOM 232 N GLU A 213 -3.579 28.919 35.910 1.00 0.00 N ATOM 233 CA GLU A 213 -3.896 30.336 35.582 1.00 0.00 C ATOM 234 C GLU A 213 -5.114 30.822 36.342 1.00 0.00 C ATOM 235 O GLU A 213 -5.066 31.829 37.019 1.00 0.00 O ATOM 236 CB GLU A 213 -4.199 30.439 34.083 1.00 0.00 C ATOM 237 CG GLU A 213 -2.926 30.822 33.343 1.00 0.00 C ATOM 238 CD GLU A 213 -2.767 32.344 33.365 1.00 0.00 C ATOM 239 OE1 GLU A 213 -3.625 32.986 32.781 1.00 0.00 O ATOM 240 OE2 GLU A 213 -1.797 32.778 33.964 1.00 0.00 O ATOM 0 H GLU A 213 -3.836 28.232 35.202 1.00 0.00 H new ATOM 0 HA GLU A 213 -3.039 30.949 35.861 1.00 0.00 H new ATOM 0 HB2 GLU A 213 -4.579 29.488 33.710 1.00 0.00 H new ATOM 0 HB3 GLU A 213 -4.975 31.184 33.907 1.00 0.00 H new ATOM 0 HG2 GLU A 213 -2.063 30.348 33.811 1.00 0.00 H new ATOM 0 HG3 GLU A 213 -2.968 30.464 32.314 1.00 0.00 H new ATOM 247 N PHE A 214 -6.185 30.101 36.216 1.00 0.00 N ATOM 248 CA PHE A 214 -7.418 30.507 36.923 1.00 0.00 C ATOM 249 C PHE A 214 -7.268 30.364 38.439 1.00 0.00 C ATOM 250 O PHE A 214 -8.007 30.967 39.191 1.00 0.00 O ATOM 251 CB PHE A 214 -8.568 29.604 36.441 1.00 0.00 C ATOM 252 CG PHE A 214 -8.471 29.399 34.915 1.00 0.00 C ATOM 253 CD1 PHE A 214 -7.742 30.278 34.121 1.00 0.00 C ATOM 254 CD2 PHE A 214 -9.087 28.309 34.313 1.00 0.00 C ATOM 255 CE1 PHE A 214 -7.631 30.061 32.762 1.00 0.00 C ATOM 256 CE2 PHE A 214 -8.969 28.101 32.954 1.00 0.00 C ATOM 257 CZ PHE A 214 -8.242 28.974 32.182 1.00 0.00 C ATOM 0 H PHE A 214 -6.259 29.252 35.656 1.00 0.00 H new ATOM 0 HA PHE A 214 -7.621 31.555 36.704 1.00 0.00 H new ATOM 0 HB2 PHE A 214 -8.523 28.641 36.950 1.00 0.00 H new ATOM 0 HB3 PHE A 214 -9.527 30.055 36.696 1.00 0.00 H new ATOM 0 HD1 PHE A 214 -7.260 31.134 34.570 1.00 0.00 H new ATOM 0 HD2 PHE A 214 -9.662 27.619 34.913 1.00 0.00 H new ATOM 0 HE1 PHE A 214 -7.062 30.747 32.152 1.00 0.00 H new ATOM 0 HE2 PHE A 214 -9.450 27.249 32.496 1.00 0.00 H new ATOM 0 HZ PHE A 214 -8.150 28.807 31.119 1.00 0.00 H new ATOM 267 N ASP A 215 -6.318 29.572 38.863 1.00 0.00 N ATOM 268 CA ASP A 215 -6.123 29.395 40.328 1.00 0.00 C ATOM 269 C ASP A 215 -5.206 30.482 40.898 1.00 0.00 C ATOM 270 O ASP A 215 -4.001 30.332 40.921 1.00 0.00 O ATOM 271 CB ASP A 215 -5.479 28.023 40.570 1.00 0.00 C ATOM 272 CG ASP A 215 -5.587 27.672 42.055 1.00 0.00 C ATOM 273 OD1 ASP A 215 -6.692 27.791 42.560 1.00 0.00 O ATOM 274 OD2 ASP A 215 -4.559 27.307 42.602 1.00 0.00 O ATOM 0 H ASP A 215 -5.678 29.048 38.266 1.00 0.00 H new ATOM 0 HA ASP A 215 -7.091 29.466 40.824 1.00 0.00 H new ATOM 0 HB2 ASP A 215 -5.976 27.263 39.967 1.00 0.00 H new ATOM 0 HB3 ASP A 215 -4.433 28.039 40.263 1.00 0.00 H new ATOM 279 N LYS A 216 -5.803 31.558 41.347 1.00 0.00 N ATOM 280 CA LYS A 216 -5.023 32.657 41.911 1.00 0.00 C ATOM 281 C LYS A 216 -4.996 32.594 43.431 1.00 0.00 C ATOM 282 O LYS A 216 -5.017 33.609 44.100 1.00 0.00 O ATOM 283 CB LYS A 216 -5.722 33.928 41.500 1.00 0.00 C ATOM 284 CG LYS A 216 -4.735 35.066 41.517 1.00 0.00 C ATOM 285 CD LYS A 216 -3.801 34.957 40.307 1.00 0.00 C ATOM 286 CE LYS A 216 -3.505 36.362 39.775 1.00 0.00 C ATOM 287 NZ LYS A 216 -2.965 37.228 40.861 1.00 0.00 N ATOM 0 H LYS A 216 -6.812 31.706 41.338 1.00 0.00 H new ATOM 0 HA LYS A 216 -3.995 32.605 41.554 1.00 0.00 H new ATOM 0 HB2 LYS A 216 -6.149 33.816 40.503 1.00 0.00 H new ATOM 0 HB3 LYS A 216 -6.549 34.138 42.179 1.00 0.00 H new ATOM 0 HG2 LYS A 216 -5.264 36.019 41.496 1.00 0.00 H new ATOM 0 HG3 LYS A 216 -4.155 35.043 42.440 1.00 0.00 H new ATOM 0 HD2 LYS A 216 -2.874 34.459 40.591 1.00 0.00 H new ATOM 0 HD3 LYS A 216 -4.263 34.350 39.529 1.00 0.00 H new ATOM 0 HE2 LYS A 216 -2.787 36.304 38.957 1.00 0.00 H new ATOM 0 HE3 LYS A 216 -4.415 36.803 39.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 216 -2.477 38.046 40.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 216 -3.747 37.561 41.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 216 -2.294 36.683 41.439 1.00 0.00 H new ATOM 301 N ASP A 217 -4.954 31.415 43.948 1.00 0.00 N ATOM 302 CA ASP A 217 -4.926 31.270 45.419 1.00 0.00 C ATOM 303 C ASP A 217 -4.201 30.001 45.826 1.00 0.00 C ATOM 304 O ASP A 217 -4.319 29.542 46.943 1.00 0.00 O ATOM 305 CB ASP A 217 -6.373 31.215 45.930 1.00 0.00 C ATOM 306 CG ASP A 217 -7.270 30.622 44.841 1.00 0.00 C ATOM 307 OD1 ASP A 217 -6.745 29.828 44.079 1.00 0.00 O ATOM 308 OD2 ASP A 217 -8.431 31.000 44.832 1.00 0.00 O ATOM 0 H ASP A 217 -4.938 30.542 43.420 1.00 0.00 H new ATOM 0 HA ASP A 217 -4.396 32.119 45.851 1.00 0.00 H new ATOM 0 HB2 ASP A 217 -6.429 30.609 46.834 1.00 0.00 H new ATOM 0 HB3 ASP A 217 -6.716 32.215 46.195 1.00 0.00 H new ATOM 313 N ARG A 218 -3.456 29.462 44.913 1.00 0.00 N ATOM 314 CA ARG A 218 -2.707 28.218 45.219 1.00 0.00 C ATOM 315 C ARG A 218 -3.563 27.232 45.994 1.00 0.00 C ATOM 316 O ARG A 218 -3.074 26.499 46.829 1.00 0.00 O ATOM 317 CB ARG A 218 -1.524 28.596 46.085 1.00 0.00 C ATOM 318 CG ARG A 218 -1.167 30.059 45.824 1.00 0.00 C ATOM 319 CD ARG A 218 0.208 30.352 46.425 1.00 0.00 C ATOM 320 NE ARG A 218 1.256 29.811 45.518 1.00 0.00 N ATOM 321 CZ ARG A 218 1.818 30.602 44.647 1.00 0.00 C ATOM 322 NH1 ARG A 218 2.303 31.741 45.054 1.00 0.00 N ATOM 323 NH2 ARG A 218 1.872 30.228 43.398 1.00 0.00 N ATOM 0 H ARG A 218 -3.332 29.826 43.968 1.00 0.00 H new ATOM 0 HA ARG A 218 -2.400 27.750 44.284 1.00 0.00 H new ATOM 0 HB2 ARG A 218 -1.765 28.449 47.138 1.00 0.00 H new ATOM 0 HB3 ARG A 218 -0.672 27.954 45.860 1.00 0.00 H new ATOM 0 HG2 ARG A 218 -1.160 30.259 44.753 1.00 0.00 H new ATOM 0 HG3 ARG A 218 -1.918 30.714 46.266 1.00 0.00 H new ATOM 0 HD2 ARG A 218 0.341 31.426 46.556 1.00 0.00 H new ATOM 0 HD3 ARG A 218 0.293 29.897 47.412 1.00 0.00 H new ATOM 0 HE ARG A 218 1.532 28.831 45.577 1.00 0.00 H new ATOM 0 HH11 ARG A 218 2.239 32.000 46.039 1.00 0.00 H new ATOM 0 HH12 ARG A 218 2.747 32.374 44.388 1.00 0.00 H new ATOM 0 HH21 ARG A 218 1.478 29.330 43.117 1.00 0.00 H new ATOM 0 HH22 ARG A 218 2.308 30.834 42.703 1.00 0.00 H new ATOM 337 N ASP A 219 -4.813 27.231 45.702 1.00 0.00 N ATOM 338 CA ASP A 219 -5.726 26.305 46.406 1.00 0.00 C ATOM 339 C ASP A 219 -5.740 24.966 45.711 1.00 0.00 C ATOM 340 O ASP A 219 -6.116 23.963 46.285 1.00 0.00 O ATOM 341 CB ASP A 219 -7.147 26.884 46.365 1.00 0.00 C ATOM 342 CG ASP A 219 -7.158 28.266 47.015 1.00 0.00 C ATOM 343 OD1 ASP A 219 -6.297 28.479 47.850 1.00 0.00 O ATOM 344 OD2 ASP A 219 -8.032 29.030 46.639 1.00 0.00 O ATOM 0 H ASP A 219 -5.252 27.832 45.004 1.00 0.00 H new ATOM 0 HA ASP A 219 -5.387 26.181 47.435 1.00 0.00 H new ATOM 0 HB2 ASP A 219 -7.492 26.954 45.333 1.00 0.00 H new ATOM 0 HB3 ASP A 219 -7.836 26.220 46.887 1.00 0.00 H new ATOM 349 N GLY A 220 -5.330 24.974 44.480 1.00 0.00 N ATOM 350 CA GLY A 220 -5.309 23.712 43.717 1.00 0.00 C ATOM 351 C GLY A 220 -6.726 23.336 43.290 1.00 0.00 C ATOM 352 O GLY A 220 -6.978 22.223 42.872 1.00 0.00 O ATOM 0 H GLY A 220 -5.010 25.799 43.973 1.00 0.00 H new ATOM 0 HA2 GLY A 220 -4.672 23.819 42.839 1.00 0.00 H new ATOM 0 HA3 GLY A 220 -4.881 22.916 44.326 1.00 0.00 H new ATOM 356 N ARG A 221 -7.622 24.276 43.413 1.00 0.00 N ATOM 357 CA ARG A 221 -9.023 24.008 43.026 1.00 0.00 C ATOM 358 C ARG A 221 -9.654 25.258 42.426 1.00 0.00 C ATOM 359 O ARG A 221 -9.753 26.279 43.078 1.00 0.00 O ATOM 360 CB ARG A 221 -9.802 23.611 44.287 1.00 0.00 C ATOM 361 CG ARG A 221 -9.300 22.250 44.773 1.00 0.00 C ATOM 362 CD ARG A 221 -10.177 21.775 45.931 1.00 0.00 C ATOM 363 NE ARG A 221 -9.567 22.226 47.211 1.00 0.00 N ATOM 364 CZ ARG A 221 -8.828 21.397 47.892 1.00 0.00 C ATOM 365 NH1 ARG A 221 -8.407 20.305 47.312 1.00 0.00 N ATOM 366 NH2 ARG A 221 -8.532 21.685 49.129 1.00 0.00 N ATOM 0 H ARG A 221 -7.439 25.216 43.765 1.00 0.00 H new ATOM 0 HA ARG A 221 -9.051 23.209 42.285 1.00 0.00 H new ATOM 0 HB2 ARG A 221 -9.667 24.362 45.065 1.00 0.00 H new ATOM 0 HB3 ARG A 221 -10.869 23.564 44.071 1.00 0.00 H new ATOM 0 HG2 ARG A 221 -9.329 21.526 43.958 1.00 0.00 H new ATOM 0 HG3 ARG A 221 -8.261 22.326 45.095 1.00 0.00 H new ATOM 0 HD2 ARG A 221 -11.185 22.178 45.831 1.00 0.00 H new ATOM 0 HD3 ARG A 221 -10.265 20.689 45.917 1.00 0.00 H new ATOM 0 HE ARG A 221 -9.726 23.174 47.552 1.00 0.00 H new ATOM 0 HH11 ARG A 221 -8.658 20.113 46.342 1.00 0.00 H new ATOM 0 HH12 ARG A 221 -7.827 19.644 47.829 1.00 0.00 H new ATOM 0 HH21 ARG A 221 -8.878 22.548 49.549 1.00 0.00 H new ATOM 0 HH22 ARG A 221 -7.955 21.047 49.677 1.00 0.00 H new ATOM 380 N ILE A 222 -10.075 25.154 41.193 1.00 0.00 N ATOM 381 CA ILE A 222 -10.700 26.329 40.537 1.00 0.00 C ATOM 382 C ILE A 222 -12.209 26.295 40.707 1.00 0.00 C ATOM 383 O ILE A 222 -12.901 25.567 40.023 1.00 0.00 O ATOM 384 CB ILE A 222 -10.369 26.304 39.035 1.00 0.00 C ATOM 385 CG1 ILE A 222 -8.978 25.718 38.806 1.00 0.00 C ATOM 386 CG2 ILE A 222 -10.378 27.754 38.506 1.00 0.00 C ATOM 387 CD1 ILE A 222 -8.821 25.348 37.331 1.00 0.00 C ATOM 0 H ILE A 222 -10.012 24.313 40.620 1.00 0.00 H new ATOM 0 HA ILE A 222 -10.310 27.236 40.998 1.00 0.00 H new ATOM 0 HB ILE A 222 -11.108 25.692 38.517 1.00 0.00 H new ATOM 0 HG12 ILE A 222 -8.215 26.441 39.095 1.00 0.00 H new ATOM 0 HG13 ILE A 222 -8.835 24.836 39.431 1.00 0.00 H new ATOM 0 HG21 ILE A 222 -10.145 27.754 37.441 1.00 0.00 H new ATOM 0 HG22 ILE A 222 -11.364 28.192 38.662 1.00 0.00 H new ATOM 0 HG23 ILE A 222 -9.632 28.341 39.041 1.00 0.00 H new ATOM 0 HD11 ILE A 222 -7.828 24.929 37.165 1.00 0.00 H new ATOM 0 HD12 ILE A 222 -9.576 24.611 37.058 1.00 0.00 H new ATOM 0 HD13 ILE A 222 -8.946 26.240 36.717 1.00 0.00 H new ATOM 399 N THR A 223 -12.689 27.077 41.623 1.00 0.00 N ATOM 400 CA THR A 223 -14.146 27.111 41.861 1.00 0.00 C ATOM 401 C THR A 223 -14.814 28.056 40.911 1.00 0.00 C ATOM 402 O THR A 223 -14.190 28.965 40.398 1.00 0.00 O ATOM 403 CB THR A 223 -14.393 27.598 43.293 1.00 0.00 C ATOM 404 OG1 THR A 223 -13.508 28.683 43.478 1.00 0.00 O ATOM 405 CG2 THR A 223 -13.936 26.547 44.312 1.00 0.00 C ATOM 0 H THR A 223 -12.134 27.694 42.216 1.00 0.00 H new ATOM 0 HA THR A 223 -14.555 26.112 41.711 1.00 0.00 H new ATOM 0 HB THR A 223 -15.450 27.827 43.428 1.00 0.00 H new ATOM 0 HG1 THR A 223 -13.618 29.044 44.382 1.00 0.00 H new ATOM 0 HG21 THR A 223 -14.121 26.914 45.321 1.00 0.00 H new ATOM 0 HG22 THR A 223 -14.491 25.622 44.155 1.00 0.00 H new ATOM 0 HG23 THR A 223 -12.870 26.356 44.185 1.00 0.00 H new ATOM 413 N VAL A 224 -16.071 27.799 40.669 1.00 0.00 N ATOM 414 CA VAL A 224 -16.841 28.661 39.752 1.00 0.00 C ATOM 415 C VAL A 224 -16.409 30.083 39.935 1.00 0.00 C ATOM 416 O VAL A 224 -16.425 30.879 39.021 1.00 0.00 O ATOM 417 CB VAL A 224 -18.300 28.543 40.159 1.00 0.00 C ATOM 418 CG1 VAL A 224 -18.443 29.047 41.590 1.00 0.00 C ATOM 419 CG2 VAL A 224 -19.171 29.385 39.227 1.00 0.00 C ATOM 0 H VAL A 224 -16.593 27.022 41.074 1.00 0.00 H new ATOM 0 HA VAL A 224 -16.687 28.366 38.714 1.00 0.00 H new ATOM 0 HB VAL A 224 -18.621 27.504 40.092 1.00 0.00 H new ATOM 0 HG11 VAL A 224 -19.485 28.970 41.900 1.00 0.00 H new ATOM 0 HG12 VAL A 224 -17.822 28.444 42.252 1.00 0.00 H new ATOM 0 HG13 VAL A 224 -18.125 30.088 41.643 1.00 0.00 H new ATOM 0 HG21 VAL A 224 -20.216 29.295 39.525 1.00 0.00 H new ATOM 0 HG22 VAL A 224 -18.865 30.429 39.288 1.00 0.00 H new ATOM 0 HG23 VAL A 224 -19.055 29.032 38.202 1.00 0.00 H new ATOM 429 N ALA A 225 -16.012 30.363 41.128 1.00 0.00 N ATOM 430 CA ALA A 225 -15.556 31.737 41.446 1.00 0.00 C ATOM 431 C ALA A 225 -14.275 32.048 40.688 1.00 0.00 C ATOM 432 O ALA A 225 -14.180 33.043 39.989 1.00 0.00 O ATOM 433 CB ALA A 225 -15.269 31.818 42.951 1.00 0.00 C ATOM 0 H ALA A 225 -15.981 29.702 41.904 1.00 0.00 H new ATOM 0 HA ALA A 225 -16.327 32.452 41.160 1.00 0.00 H new ATOM 0 HB1 ALA A 225 -14.932 32.823 43.204 1.00 0.00 H new ATOM 0 HB2 ALA A 225 -16.178 31.590 43.508 1.00 0.00 H new ATOM 0 HB3 ALA A 225 -14.493 31.099 43.213 1.00 0.00 H new ATOM 439 N GLU A 226 -13.310 31.186 40.840 1.00 0.00 N ATOM 440 CA GLU A 226 -12.023 31.399 40.144 1.00 0.00 C ATOM 441 C GLU A 226 -12.227 31.406 38.638 1.00 0.00 C ATOM 442 O GLU A 226 -11.669 32.225 37.939 1.00 0.00 O ATOM 443 CB GLU A 226 -11.075 30.251 40.523 1.00 0.00 C ATOM 444 CG GLU A 226 -10.314 30.630 41.796 1.00 0.00 C ATOM 445 CD GLU A 226 -9.865 29.355 42.511 1.00 0.00 C ATOM 446 OE1 GLU A 226 -8.874 28.803 42.060 1.00 0.00 O ATOM 447 OE2 GLU A 226 -10.538 29.003 43.465 1.00 0.00 O ATOM 0 H GLU A 226 -13.361 30.346 41.416 1.00 0.00 H new ATOM 0 HA GLU A 226 -11.603 32.360 40.440 1.00 0.00 H new ATOM 0 HB2 GLU A 226 -11.641 29.333 40.682 1.00 0.00 H new ATOM 0 HB3 GLU A 226 -10.375 30.057 39.710 1.00 0.00 H new ATOM 0 HG2 GLU A 226 -9.450 31.246 41.548 1.00 0.00 H new ATOM 0 HG3 GLU A 226 -10.951 31.224 42.452 1.00 0.00 H new ATOM 454 N LEU A 227 -13.038 30.498 38.165 1.00 0.00 N ATOM 455 CA LEU A 227 -13.291 30.436 36.707 1.00 0.00 C ATOM 456 C LEU A 227 -14.003 31.696 36.221 1.00 0.00 C ATOM 457 O LEU A 227 -13.919 32.046 35.067 1.00 0.00 O ATOM 458 CB LEU A 227 -14.188 29.222 36.425 1.00 0.00 C ATOM 459 CG LEU A 227 -13.425 28.227 35.547 1.00 0.00 C ATOM 460 CD1 LEU A 227 -14.159 26.887 35.558 1.00 0.00 C ATOM 461 CD2 LEU A 227 -13.368 28.760 34.113 1.00 0.00 C ATOM 0 H LEU A 227 -13.531 29.803 38.726 1.00 0.00 H new ATOM 0 HA LEU A 227 -12.338 30.353 36.184 1.00 0.00 H new ATOM 0 HB2 LEU A 227 -14.484 28.748 37.361 1.00 0.00 H new ATOM 0 HB3 LEU A 227 -15.103 29.539 35.925 1.00 0.00 H new ATOM 0 HG LEU A 227 -12.413 28.097 35.930 1.00 0.00 H new ATOM 0 HD11 LEU A 227 -13.621 26.173 34.935 1.00 0.00 H new ATOM 0 HD12 LEU A 227 -14.212 26.510 36.579 1.00 0.00 H new ATOM 0 HD13 LEU A 227 -15.168 27.022 35.168 1.00 0.00 H new ATOM 0 HD21 LEU A 227 -12.825 28.054 33.484 1.00 0.00 H new ATOM 0 HD22 LEU A 227 -14.381 28.883 33.730 1.00 0.00 H new ATOM 0 HD23 LEU A 227 -12.857 29.723 34.103 1.00 0.00 H new ATOM 473 N ARG A 228 -14.691 32.351 37.117 1.00 0.00 N ATOM 474 CA ARG A 228 -15.417 33.593 36.726 1.00 0.00 C ATOM 475 C ARG A 228 -14.469 34.771 36.554 1.00 0.00 C ATOM 476 O ARG A 228 -14.649 35.590 35.679 1.00 0.00 O ATOM 477 CB ARG A 228 -16.397 33.933 37.841 1.00 0.00 C ATOM 478 CG ARG A 228 -17.484 34.861 37.296 1.00 0.00 C ATOM 479 CD ARG A 228 -18.352 35.348 38.459 1.00 0.00 C ATOM 480 NE ARG A 228 -19.029 36.612 38.060 1.00 0.00 N ATOM 481 CZ ARG A 228 -19.485 37.411 38.984 1.00 0.00 C ATOM 482 NH1 ARG A 228 -20.382 36.964 39.822 1.00 0.00 N ATOM 483 NH2 ARG A 228 -19.028 38.630 39.042 1.00 0.00 N ATOM 0 H ARG A 228 -14.781 32.082 38.097 1.00 0.00 H new ATOM 0 HA ARG A 228 -15.920 33.416 35.775 1.00 0.00 H new ATOM 0 HB2 ARG A 228 -16.846 33.022 38.236 1.00 0.00 H new ATOM 0 HB3 ARG A 228 -15.873 34.414 38.667 1.00 0.00 H new ATOM 0 HG2 ARG A 228 -17.032 35.710 36.782 1.00 0.00 H new ATOM 0 HG3 ARG A 228 -18.096 34.335 36.564 1.00 0.00 H new ATOM 0 HD2 ARG A 228 -19.091 34.591 38.720 1.00 0.00 H new ATOM 0 HD3 ARG A 228 -17.738 35.513 39.344 1.00 0.00 H new ATOM 0 HE ARG A 228 -19.135 36.851 37.074 1.00 0.00 H new ATOM 0 HH11 ARG A 228 -20.715 36.003 39.748 1.00 0.00 H new ATOM 0 HH12 ARG A 228 -20.749 37.576 40.551 1.00 0.00 H new ATOM 0 HH21 ARG A 228 -18.326 38.944 38.372 1.00 0.00 H new ATOM 0 HH22 ARG A 228 -19.372 39.270 39.758 1.00 0.00 H new ATOM 497 N GLN A 229 -13.493 34.851 37.405 1.00 0.00 N ATOM 498 CA GLN A 229 -12.538 35.951 37.312 1.00 0.00 C ATOM 499 C GLN A 229 -11.359 35.550 36.480 1.00 0.00 C ATOM 500 O GLN A 229 -10.470 36.336 36.215 1.00 0.00 O ATOM 501 CB GLN A 229 -12.033 36.228 38.707 1.00 0.00 C ATOM 502 CG GLN A 229 -11.279 37.531 38.686 1.00 0.00 C ATOM 503 CD GLN A 229 -9.816 37.297 39.079 1.00 0.00 C ATOM 504 OE1 GLN A 229 -9.216 36.299 38.726 1.00 0.00 O ATOM 505 NE2 GLN A 229 -9.202 38.194 39.800 1.00 0.00 N ATOM 0 H GLN A 229 -13.324 34.190 38.163 1.00 0.00 H new ATOM 0 HA GLN A 229 -13.022 36.819 36.864 1.00 0.00 H new ATOM 0 HB2 GLN A 229 -12.865 36.282 39.409 1.00 0.00 H new ATOM 0 HB3 GLN A 229 -11.384 35.419 39.044 1.00 0.00 H new ATOM 0 HG2 GLN A 229 -11.330 37.974 37.692 1.00 0.00 H new ATOM 0 HG3 GLN A 229 -11.740 38.239 39.375 1.00 0.00 H new ATOM 0 HE21 GLN A 229 -9.697 39.034 40.100 1.00 0.00 H new ATOM 0 HE22 GLN A 229 -8.226 38.056 40.064 1.00 0.00 H new ATOM 514 N ALA A 230 -11.383 34.340 36.088 1.00 0.00 N ATOM 515 CA ALA A 230 -10.284 33.806 35.266 1.00 0.00 C ATOM 516 C ALA A 230 -10.698 33.624 33.835 1.00 0.00 C ATOM 517 O ALA A 230 -9.897 33.738 32.932 1.00 0.00 O ATOM 518 CB ALA A 230 -9.937 32.440 35.822 1.00 0.00 C ATOM 0 H ALA A 230 -12.127 33.675 36.300 1.00 0.00 H new ATOM 0 HA ALA A 230 -9.447 34.503 35.296 1.00 0.00 H new ATOM 0 HB1 ALA A 230 -9.124 32.006 35.240 1.00 0.00 H new ATOM 0 HB2 ALA A 230 -9.626 32.539 36.862 1.00 0.00 H new ATOM 0 HB3 ALA A 230 -10.811 31.791 35.764 1.00 0.00 H new ATOM 524 N ALA A 231 -11.941 33.347 33.649 1.00 0.00 N ATOM 525 CA ALA A 231 -12.437 33.148 32.290 1.00 0.00 C ATOM 526 C ALA A 231 -12.302 34.405 31.389 1.00 0.00 C ATOM 527 O ALA A 231 -11.939 34.287 30.238 1.00 0.00 O ATOM 528 CB ALA A 231 -13.900 32.724 32.380 1.00 0.00 C ATOM 0 H ALA A 231 -12.637 33.250 34.388 1.00 0.00 H new ATOM 0 HA ALA A 231 -11.825 32.379 31.819 1.00 0.00 H new ATOM 0 HB1 ALA A 231 -14.296 32.568 31.377 1.00 0.00 H new ATOM 0 HB2 ALA A 231 -13.976 31.797 32.948 1.00 0.00 H new ATOM 0 HB3 ALA A 231 -14.475 33.504 32.880 1.00 0.00 H new ATOM 534 N PRO A 232 -12.593 35.598 31.920 1.00 0.00 N ATOM 535 CA PRO A 232 -12.484 36.816 31.117 1.00 0.00 C ATOM 536 C PRO A 232 -11.090 36.961 30.532 1.00 0.00 C ATOM 537 O PRO A 232 -10.842 37.820 29.710 1.00 0.00 O ATOM 538 CB PRO A 232 -12.764 37.970 32.098 1.00 0.00 C ATOM 539 CG PRO A 232 -13.183 37.331 33.455 1.00 0.00 C ATOM 540 CD PRO A 232 -13.024 35.806 33.309 1.00 0.00 C ATOM 0 HA PRO A 232 -13.178 36.803 30.277 1.00 0.00 H new ATOM 0 HB2 PRO A 232 -11.878 38.592 32.223 1.00 0.00 H new ATOM 0 HB3 PRO A 232 -13.555 38.616 31.716 1.00 0.00 H new ATOM 0 HG2 PRO A 232 -12.559 37.707 34.266 1.00 0.00 H new ATOM 0 HG3 PRO A 232 -14.213 37.589 33.700 1.00 0.00 H new ATOM 0 HD2 PRO A 232 -12.288 35.417 34.013 1.00 0.00 H new ATOM 0 HD3 PRO A 232 -13.963 35.290 33.512 1.00 0.00 H new ATOM 702 N LEU A 244 -21.048 29.590 33.316 1.00 0.00 N ATOM 703 CA LEU A 244 -19.841 28.838 33.662 1.00 0.00 C ATOM 704 C LEU A 244 -20.235 27.702 34.581 1.00 0.00 C ATOM 705 O LEU A 244 -19.647 26.641 34.557 1.00 0.00 O ATOM 706 CB LEU A 244 -18.873 29.776 34.410 1.00 0.00 C ATOM 707 CG LEU A 244 -19.657 30.978 34.963 1.00 0.00 C ATOM 708 CD1 LEU A 244 -19.051 31.418 36.282 1.00 0.00 C ATOM 709 CD2 LEU A 244 -19.581 32.130 33.967 1.00 0.00 C ATOM 0 HA LEU A 244 -19.362 28.448 32.764 1.00 0.00 H new ATOM 0 HB2 LEU A 244 -18.385 29.240 35.224 1.00 0.00 H new ATOM 0 HB3 LEU A 244 -18.087 30.118 33.737 1.00 0.00 H new ATOM 0 HG LEU A 244 -20.697 30.692 35.118 1.00 0.00 H new ATOM 0 HD11 LEU A 244 -19.608 32.270 36.672 1.00 0.00 H new ATOM 0 HD12 LEU A 244 -19.098 30.596 36.996 1.00 0.00 H new ATOM 0 HD13 LEU A 244 -18.011 31.705 36.127 1.00 0.00 H new ATOM 0 HD21 LEU A 244 -20.136 32.984 34.356 1.00 0.00 H new ATOM 0 HD22 LEU A 244 -18.539 32.412 33.816 1.00 0.00 H new ATOM 0 HD23 LEU A 244 -20.014 31.818 33.016 1.00 0.00 H new ATOM 721 N ASP A 245 -21.244 27.953 35.389 1.00 0.00 N ATOM 722 CA ASP A 245 -21.705 26.903 36.323 1.00 0.00 C ATOM 723 C ASP A 245 -22.117 25.663 35.548 1.00 0.00 C ATOM 724 O ASP A 245 -21.728 24.565 35.875 1.00 0.00 O ATOM 725 CB ASP A 245 -22.919 27.434 37.104 1.00 0.00 C ATOM 726 CG ASP A 245 -23.222 26.487 38.266 1.00 0.00 C ATOM 727 OD1 ASP A 245 -23.828 25.465 37.988 1.00 0.00 O ATOM 728 OD2 ASP A 245 -22.831 26.839 39.367 1.00 0.00 O ATOM 0 H ASP A 245 -21.755 28.834 35.433 1.00 0.00 H new ATOM 0 HA ASP A 245 -20.897 26.645 37.007 1.00 0.00 H new ATOM 0 HB2 ASP A 245 -22.715 28.437 37.480 1.00 0.00 H new ATOM 0 HB3 ASP A 245 -23.785 27.511 36.446 1.00 0.00 H new ATOM 733 N GLU A 246 -22.916 25.845 34.538 1.00 0.00 N ATOM 734 CA GLU A 246 -23.332 24.661 33.759 1.00 0.00 C ATOM 735 C GLU A 246 -22.096 23.962 33.222 1.00 0.00 C ATOM 736 O GLU A 246 -21.947 22.762 33.355 1.00 0.00 O ATOM 737 CB GLU A 246 -24.207 25.117 32.581 1.00 0.00 C ATOM 738 CG GLU A 246 -25.497 25.734 33.125 1.00 0.00 C ATOM 739 CD GLU A 246 -26.610 24.685 33.097 1.00 0.00 C ATOM 740 OE1 GLU A 246 -26.422 23.677 33.759 1.00 0.00 O ATOM 741 OE2 GLU A 246 -27.585 24.949 32.413 1.00 0.00 O ATOM 0 H GLU A 246 -23.290 26.742 34.226 1.00 0.00 H new ATOM 0 HA GLU A 246 -23.896 23.978 34.394 1.00 0.00 H new ATOM 0 HB2 GLU A 246 -23.669 25.845 31.973 1.00 0.00 H new ATOM 0 HB3 GLU A 246 -24.439 24.270 31.935 1.00 0.00 H new ATOM 0 HG2 GLU A 246 -25.342 26.090 34.144 1.00 0.00 H new ATOM 0 HG3 GLU A 246 -25.781 26.599 32.525 1.00 0.00 H new ATOM 748 N MET A 247 -21.221 24.732 32.626 1.00 0.00 N ATOM 749 CA MET A 247 -19.986 24.133 32.077 1.00 0.00 C ATOM 750 C MET A 247 -19.149 23.569 33.212 1.00 0.00 C ATOM 751 O MET A 247 -18.521 22.540 33.076 1.00 0.00 O ATOM 752 CB MET A 247 -19.181 25.233 31.363 1.00 0.00 C ATOM 753 CG MET A 247 -19.930 25.665 30.101 1.00 0.00 C ATOM 754 SD MET A 247 -20.809 24.383 29.173 1.00 0.00 S ATOM 755 CE MET A 247 -19.453 23.941 28.056 1.00 0.00 C ATOM 0 H MET A 247 -21.314 25.740 32.501 1.00 0.00 H new ATOM 0 HA MET A 247 -20.240 23.335 31.379 1.00 0.00 H new ATOM 0 HB2 MET A 247 -19.040 26.086 32.027 1.00 0.00 H new ATOM 0 HB3 MET A 247 -18.189 24.864 31.103 1.00 0.00 H new ATOM 0 HG2 MET A 247 -20.652 26.431 30.384 1.00 0.00 H new ATOM 0 HG3 MET A 247 -19.213 26.136 29.428 1.00 0.00 H new ATOM 0 HE1 MET A 247 -19.781 23.151 27.381 1.00 0.00 H new ATOM 0 HE2 MET A 247 -19.160 24.816 27.475 1.00 0.00 H new ATOM 0 HE3 MET A 247 -18.601 23.590 28.639 1.00 0.00 H new ATOM 765 N LEU A 248 -19.154 24.265 34.320 1.00 0.00 N ATOM 766 CA LEU A 248 -18.370 23.790 35.479 1.00 0.00 C ATOM 767 C LEU A 248 -18.810 22.384 35.834 1.00 0.00 C ATOM 768 O LEU A 248 -18.000 21.486 35.943 1.00 0.00 O ATOM 769 CB LEU A 248 -18.647 24.729 36.669 1.00 0.00 C ATOM 770 CG LEU A 248 -17.851 24.263 37.875 1.00 0.00 C ATOM 771 CD1 LEU A 248 -16.596 25.123 38.000 1.00 0.00 C ATOM 772 CD2 LEU A 248 -18.704 24.430 39.134 1.00 0.00 C ATOM 0 H LEU A 248 -19.666 25.135 34.464 1.00 0.00 H new ATOM 0 HA LEU A 248 -17.306 23.787 35.243 1.00 0.00 H new ATOM 0 HB2 LEU A 248 -18.372 25.752 36.411 1.00 0.00 H new ATOM 0 HB3 LEU A 248 -19.712 24.734 36.902 1.00 0.00 H new ATOM 0 HG LEU A 248 -17.573 23.216 37.757 1.00 0.00 H new ATOM 0 HD11 LEU A 248 -16.016 24.797 38.863 1.00 0.00 H new ATOM 0 HD12 LEU A 248 -15.993 25.020 37.098 1.00 0.00 H new ATOM 0 HD13 LEU A 248 -16.882 26.167 38.128 1.00 0.00 H new ATOM 0 HD21 LEU A 248 -18.138 24.097 40.004 1.00 0.00 H new ATOM 0 HD22 LEU A 248 -18.972 25.480 39.255 1.00 0.00 H new ATOM 0 HD23 LEU A 248 -19.611 23.833 39.041 1.00 0.00 H new ATOM 784 N ARG A 249 -20.094 22.214 36.008 1.00 0.00 N ATOM 785 CA ARG A 249 -20.596 20.869 36.352 1.00 0.00 C ATOM 786 C ARG A 249 -20.059 19.864 35.348 1.00 0.00 C ATOM 787 O ARG A 249 -19.676 18.766 35.703 1.00 0.00 O ATOM 788 CB ARG A 249 -22.131 20.884 36.273 1.00 0.00 C ATOM 789 CG ARG A 249 -22.703 21.219 37.653 1.00 0.00 C ATOM 790 CD ARG A 249 -24.207 21.467 37.523 1.00 0.00 C ATOM 791 NE ARG A 249 -24.785 20.455 36.593 1.00 0.00 N ATOM 792 CZ ARG A 249 -26.007 20.604 36.160 1.00 0.00 C ATOM 793 NH1 ARG A 249 -26.933 20.970 37.003 1.00 0.00 N ATOM 794 NH2 ARG A 249 -26.262 20.385 34.899 1.00 0.00 N ATOM 0 H ARG A 249 -20.802 22.943 35.926 1.00 0.00 H new ATOM 0 HA ARG A 249 -20.272 20.594 37.356 1.00 0.00 H new ATOM 0 HB2 ARG A 249 -22.462 21.620 35.540 1.00 0.00 H new ATOM 0 HB3 ARG A 249 -22.499 19.914 35.939 1.00 0.00 H new ATOM 0 HG2 ARG A 249 -22.515 20.400 38.347 1.00 0.00 H new ATOM 0 HG3 ARG A 249 -22.210 22.102 38.061 1.00 0.00 H new ATOM 0 HD2 ARG A 249 -24.686 21.398 38.500 1.00 0.00 H new ATOM 0 HD3 ARG A 249 -24.392 22.473 37.147 1.00 0.00 H new ATOM 0 HE ARG A 249 -24.229 19.652 36.297 1.00 0.00 H new ATOM 0 HH11 ARG A 249 -26.696 21.134 37.981 1.00 0.00 H new ATOM 0 HH12 ARG A 249 -27.894 21.092 36.684 1.00 0.00 H new ATOM 0 HH21 ARG A 249 -25.512 20.102 34.269 1.00 0.00 H new ATOM 0 HH22 ARG A 249 -27.212 20.497 34.544 1.00 0.00 H new ATOM 808 N GLU A 250 -20.041 20.264 34.100 1.00 0.00 N ATOM 809 CA GLU A 250 -19.532 19.353 33.049 1.00 0.00 C ATOM 810 C GLU A 250 -18.030 19.175 33.203 1.00 0.00 C ATOM 811 O GLU A 250 -17.499 18.108 32.977 1.00 0.00 O ATOM 812 CB GLU A 250 -19.822 19.980 31.674 1.00 0.00 C ATOM 813 CG GLU A 250 -19.447 18.982 30.576 1.00 0.00 C ATOM 814 CD GLU A 250 -20.282 17.712 30.742 1.00 0.00 C ATOM 815 OE1 GLU A 250 -21.493 17.846 30.667 1.00 0.00 O ATOM 816 OE2 GLU A 250 -19.663 16.679 30.933 1.00 0.00 O ATOM 0 H GLU A 250 -20.356 21.177 33.773 1.00 0.00 H new ATOM 0 HA GLU A 250 -20.020 18.383 33.138 1.00 0.00 H new ATOM 0 HB2 GLU A 250 -20.877 20.244 31.597 1.00 0.00 H new ATOM 0 HB3 GLU A 250 -19.253 20.902 31.554 1.00 0.00 H new ATOM 0 HG2 GLU A 250 -19.623 19.421 29.594 1.00 0.00 H new ATOM 0 HG3 GLU A 250 -18.385 18.743 30.633 1.00 0.00 H new ATOM 823 N MET A 251 -17.369 20.234 33.592 1.00 0.00 N ATOM 824 CA MET A 251 -15.906 20.152 33.769 1.00 0.00 C ATOM 825 C MET A 251 -15.589 19.481 35.096 1.00 0.00 C ATOM 826 O MET A 251 -14.494 19.001 35.312 1.00 0.00 O ATOM 827 CB MET A 251 -15.336 21.580 33.783 1.00 0.00 C ATOM 828 CG MET A 251 -15.330 22.138 32.359 1.00 0.00 C ATOM 829 SD MET A 251 -14.367 23.643 32.065 1.00 0.00 S ATOM 830 CE MET A 251 -12.958 22.855 31.249 1.00 0.00 C ATOM 0 H MET A 251 -17.785 21.144 33.792 1.00 0.00 H new ATOM 0 HA MET A 251 -15.467 19.573 32.957 1.00 0.00 H new ATOM 0 HB2 MET A 251 -15.937 22.217 34.432 1.00 0.00 H new ATOM 0 HB3 MET A 251 -14.324 21.576 34.188 1.00 0.00 H new ATOM 0 HG2 MET A 251 -14.954 21.361 31.693 1.00 0.00 H new ATOM 0 HG3 MET A 251 -16.362 22.335 32.069 1.00 0.00 H new ATOM 0 HE1 MET A 251 -12.225 23.614 30.975 1.00 0.00 H new ATOM 0 HE2 MET A 251 -12.500 22.136 31.928 1.00 0.00 H new ATOM 0 HE3 MET A 251 -13.299 22.340 30.351 1.00 0.00 H new ATOM 840 N ASP A 252 -16.568 19.463 35.964 1.00 0.00 N ATOM 841 CA ASP A 252 -16.368 18.833 37.291 1.00 0.00 C ATOM 842 C ASP A 252 -16.682 17.344 37.229 1.00 0.00 C ATOM 843 O ASP A 252 -17.655 16.939 36.622 1.00 0.00 O ATOM 844 CB ASP A 252 -17.327 19.503 38.286 1.00 0.00 C ATOM 845 CG ASP A 252 -17.030 18.993 39.695 1.00 0.00 C ATOM 846 OD1 ASP A 252 -15.885 18.639 39.912 1.00 0.00 O ATOM 847 OD2 ASP A 252 -17.968 18.988 40.476 1.00 0.00 O ATOM 0 H ASP A 252 -17.495 19.859 35.806 1.00 0.00 H new ATOM 0 HA ASP A 252 -15.330 18.958 37.600 1.00 0.00 H new ATOM 0 HB2 ASP A 252 -17.211 20.586 38.247 1.00 0.00 H new ATOM 0 HB3 ASP A 252 -18.360 19.283 38.017 1.00 0.00 H new ATOM 852 N LEU A 253 -15.853 16.559 37.880 1.00 0.00 N ATOM 853 CA LEU A 253 -16.061 15.088 37.888 1.00 0.00 C ATOM 854 C LEU A 253 -16.295 14.615 39.305 1.00 0.00 C ATOM 855 O LEU A 253 -16.486 13.439 39.549 1.00 0.00 O ATOM 856 CB LEU A 253 -14.783 14.412 37.357 1.00 0.00 C ATOM 857 CG LEU A 253 -14.863 14.274 35.831 1.00 0.00 C ATOM 858 CD1 LEU A 253 -15.294 15.606 35.215 1.00 0.00 C ATOM 859 CD2 LEU A 253 -13.483 13.901 35.285 1.00 0.00 C ATOM 0 H LEU A 253 -15.041 16.883 38.405 1.00 0.00 H new ATOM 0 HA LEU A 253 -16.922 14.836 37.268 1.00 0.00 H new ATOM 0 HB2 LEU A 253 -13.908 15.001 37.633 1.00 0.00 H new ATOM 0 HB3 LEU A 253 -14.663 13.430 37.814 1.00 0.00 H new ATOM 0 HG LEU A 253 -15.588 13.501 35.577 1.00 0.00 H new ATOM 0 HD11 LEU A 253 -15.350 15.505 34.131 1.00 0.00 H new ATOM 0 HD12 LEU A 253 -16.273 15.887 35.604 1.00 0.00 H new ATOM 0 HD13 LEU A 253 -14.567 16.377 35.470 1.00 0.00 H new ATOM 0 HD21 LEU A 253 -13.535 13.802 34.201 1.00 0.00 H new ATOM 0 HD22 LEU A 253 -12.766 14.680 35.544 1.00 0.00 H new ATOM 0 HD23 LEU A 253 -13.163 12.955 35.721 1.00 0.00 H new ATOM 871 N ASN A 254 -16.280 15.553 40.216 1.00 0.00 N ATOM 872 CA ASN A 254 -16.494 15.214 41.633 1.00 0.00 C ATOM 873 C ASN A 254 -17.878 15.647 42.071 1.00 0.00 C ATOM 874 O ASN A 254 -18.225 15.558 43.233 1.00 0.00 O ATOM 875 CB ASN A 254 -15.447 15.976 42.456 1.00 0.00 C ATOM 876 CG ASN A 254 -14.053 15.654 41.917 1.00 0.00 C ATOM 877 OD1 ASN A 254 -13.930 14.759 40.975 1.00 0.00 O flip ATOM 878 ND2 ASN A 254 -13.065 16.217 42.346 1.00 0.00 N flip ATOM 0 H ASN A 254 -16.127 16.543 40.027 1.00 0.00 H new ATOM 0 HA ASN A 254 -16.403 14.138 41.778 1.00 0.00 H new ATOM 0 HB2 ASN A 254 -15.633 17.049 42.400 1.00 0.00 H new ATOM 0 HB3 ASN A 254 -15.518 15.695 43.507 1.00 0.00 H new ATOM 0 HD21 ASN A 254 -13.156 16.917 43.082 1.00 0.00 H new ATOM 0 HD22 ASN A 254 -12.145 15.989 41.970 1.00 0.00 H new ATOM 885 N GLY A 255 -18.649 16.108 41.127 1.00 0.00 N ATOM 886 CA GLY A 255 -20.020 16.557 41.457 1.00 0.00 C ATOM 887 C GLY A 255 -19.999 17.405 42.723 1.00 0.00 C ATOM 888 O GLY A 255 -20.790 17.200 43.625 1.00 0.00 O ATOM 0 H GLY A 255 -18.386 16.191 40.145 1.00 0.00 H new ATOM 0 HA2 GLY A 255 -20.432 17.134 40.629 1.00 0.00 H new ATOM 0 HA3 GLY A 255 -20.670 15.694 41.598 1.00 0.00 H new ATOM 892 N ASP A 256 -19.086 18.343 42.758 1.00 0.00 N ATOM 893 CA ASP A 256 -18.973 19.228 43.942 1.00 0.00 C ATOM 894 C ASP A 256 -18.985 20.676 43.510 1.00 0.00 C ATOM 895 O ASP A 256 -19.271 21.561 44.291 1.00 0.00 O ATOM 896 CB ASP A 256 -17.643 18.934 44.646 1.00 0.00 C ATOM 897 CG ASP A 256 -16.500 19.067 43.636 1.00 0.00 C ATOM 898 OD1 ASP A 256 -16.799 19.500 42.535 1.00 0.00 O ATOM 899 OD2 ASP A 256 -15.394 18.730 44.024 1.00 0.00 O ATOM 0 H ASP A 256 -18.415 18.529 42.012 1.00 0.00 H new ATOM 0 HA ASP A 256 -19.813 19.046 44.613 1.00 0.00 H new ATOM 0 HB2 ASP A 256 -17.495 19.627 45.474 1.00 0.00 H new ATOM 0 HB3 ASP A 256 -17.656 17.930 45.069 1.00 0.00 H new ATOM 904 N GLY A 257 -18.671 20.895 42.266 1.00 0.00 N ATOM 905 CA GLY A 257 -18.657 22.278 41.753 1.00 0.00 C ATOM 906 C GLY A 257 -17.253 22.879 41.858 1.00 0.00 C ATOM 907 O GLY A 257 -17.093 24.053 42.123 1.00 0.00 O ATOM 0 H GLY A 257 -18.425 20.174 41.588 1.00 0.00 H new ATOM 0 HA2 GLY A 257 -18.986 22.289 40.714 1.00 0.00 H new ATOM 0 HA3 GLY A 257 -19.362 22.888 42.317 1.00 0.00 H new ATOM 911 N THR A 258 -16.266 22.057 41.657 1.00 0.00 N ATOM 912 CA THR A 258 -14.887 22.547 41.734 1.00 0.00 C ATOM 913 C THR A 258 -14.016 21.774 40.779 1.00 0.00 C ATOM 914 O THR A 258 -14.285 20.621 40.499 1.00 0.00 O ATOM 915 CB THR A 258 -14.378 22.329 43.156 1.00 0.00 C ATOM 916 OG1 THR A 258 -15.075 21.197 43.629 1.00 0.00 O ATOM 917 CG2 THR A 258 -14.820 23.470 44.088 1.00 0.00 C ATOM 0 H THR A 258 -16.366 21.065 41.442 1.00 0.00 H new ATOM 0 HA THR A 258 -14.856 23.605 41.472 1.00 0.00 H new ATOM 0 HB THR A 258 -13.291 22.249 43.147 1.00 0.00 H new ATOM 0 HG1 THR A 258 -14.463 20.433 43.680 1.00 0.00 H new ATOM 0 HG21 THR A 258 -14.442 23.286 45.094 1.00 0.00 H new ATOM 0 HG22 THR A 258 -14.423 24.416 43.719 1.00 0.00 H new ATOM 0 HG23 THR A 258 -15.909 23.518 44.113 1.00 0.00 H new ATOM 925 N ILE A 259 -12.978 22.414 40.298 1.00 0.00 N ATOM 926 CA ILE A 259 -12.074 21.725 39.350 1.00 0.00 C ATOM 927 C ILE A 259 -10.734 21.400 39.955 1.00 0.00 C ATOM 928 O ILE A 259 -10.003 22.277 40.364 1.00 0.00 O ATOM 929 CB ILE A 259 -11.815 22.643 38.172 1.00 0.00 C ATOM 930 CG1 ILE A 259 -13.114 22.977 37.468 1.00 0.00 C ATOM 931 CG2 ILE A 259 -10.891 21.900 37.196 1.00 0.00 C ATOM 932 CD1 ILE A 259 -13.842 21.686 37.160 1.00 0.00 C ATOM 0 H ILE A 259 -12.726 23.376 40.524 1.00 0.00 H new ATOM 0 HA ILE A 259 -12.563 20.795 39.062 1.00 0.00 H new ATOM 0 HB ILE A 259 -11.359 23.571 38.517 1.00 0.00 H new ATOM 0 HG12 ILE A 259 -13.731 23.619 38.097 1.00 0.00 H new ATOM 0 HG13 ILE A 259 -12.915 23.528 36.549 1.00 0.00 H new ATOM 0 HG21 ILE A 259 -10.685 22.536 36.335 1.00 0.00 H new ATOM 0 HG22 ILE A 259 -9.955 21.653 37.697 1.00 0.00 H new ATOM 0 HG23 ILE A 259 -11.376 20.983 36.862 1.00 0.00 H new ATOM 0 HD11 ILE A 259 -14.780 21.910 36.653 1.00 0.00 H new ATOM 0 HD12 ILE A 259 -13.221 21.063 36.517 1.00 0.00 H new ATOM 0 HD13 ILE A 259 -14.050 21.155 38.089 1.00 0.00 H new ATOM 944 N ASP A 260 -10.439 20.138 39.991 1.00 0.00 N ATOM 945 CA ASP A 260 -9.153 19.695 40.553 1.00 0.00 C ATOM 946 C ASP A 260 -8.262 19.285 39.400 1.00 0.00 C ATOM 947 O ASP A 260 -8.746 18.773 38.411 1.00 0.00 O ATOM 948 CB ASP A 260 -9.402 18.480 41.459 1.00 0.00 C ATOM 949 CG ASP A 260 -9.627 18.957 42.895 1.00 0.00 C ATOM 950 OD1 ASP A 260 -10.580 19.696 43.078 1.00 0.00 O ATOM 951 OD2 ASP A 260 -8.833 18.553 43.729 1.00 0.00 O ATOM 0 H ASP A 260 -11.043 19.390 39.650 1.00 0.00 H new ATOM 0 HA ASP A 260 -8.685 20.491 41.132 1.00 0.00 H new ATOM 0 HB2 ASP A 260 -10.271 17.923 41.109 1.00 0.00 H new ATOM 0 HB3 ASP A 260 -8.550 17.801 41.418 1.00 0.00 H new ATOM 956 N PHE A 261 -6.989 19.523 39.514 1.00 0.00 N ATOM 957 CA PHE A 261 -6.103 19.130 38.395 1.00 0.00 C ATOM 958 C PHE A 261 -6.427 17.723 37.933 1.00 0.00 C ATOM 959 O PHE A 261 -6.038 17.314 36.860 1.00 0.00 O ATOM 960 CB PHE A 261 -4.639 19.200 38.860 1.00 0.00 C ATOM 961 CG PHE A 261 -3.748 19.645 37.683 1.00 0.00 C ATOM 962 CD1 PHE A 261 -4.074 20.763 36.918 1.00 0.00 C ATOM 963 CD2 PHE A 261 -2.605 18.936 37.367 1.00 0.00 C ATOM 964 CE1 PHE A 261 -3.275 21.145 35.868 1.00 0.00 C ATOM 965 CE2 PHE A 261 -1.808 19.331 36.314 1.00 0.00 C ATOM 966 CZ PHE A 261 -2.146 20.436 35.567 1.00 0.00 C ATOM 0 H PHE A 261 -6.534 19.962 40.314 1.00 0.00 H new ATOM 0 HA PHE A 261 -6.258 19.814 37.560 1.00 0.00 H new ATOM 0 HB2 PHE A 261 -4.542 19.901 39.689 1.00 0.00 H new ATOM 0 HB3 PHE A 261 -4.316 18.226 39.227 1.00 0.00 H new ATOM 0 HD1 PHE A 261 -4.961 21.333 37.152 1.00 0.00 H new ATOM 0 HD2 PHE A 261 -2.334 18.067 37.949 1.00 0.00 H new ATOM 0 HE1 PHE A 261 -3.540 22.010 35.278 1.00 0.00 H new ATOM 0 HE2 PHE A 261 -0.916 18.772 36.075 1.00 0.00 H new ATOM 0 HZ PHE A 261 -1.519 20.743 34.743 1.00 0.00 H new ATOM 976 N ASP A 262 -7.149 17.005 38.745 1.00 0.00 N ATOM 977 CA ASP A 262 -7.504 15.628 38.358 1.00 0.00 C ATOM 978 C ASP A 262 -8.642 15.640 37.345 1.00 0.00 C ATOM 979 O ASP A 262 -8.526 15.064 36.290 1.00 0.00 O ATOM 980 CB ASP A 262 -7.958 14.862 39.614 1.00 0.00 C ATOM 981 CG ASP A 262 -6.856 14.928 40.675 1.00 0.00 C ATOM 982 OD1 ASP A 262 -6.017 14.043 40.641 1.00 0.00 O ATOM 983 OD2 ASP A 262 -6.919 15.858 41.462 1.00 0.00 O ATOM 0 H ASP A 262 -7.503 17.315 39.650 1.00 0.00 H new ATOM 0 HA ASP A 262 -6.635 15.146 37.910 1.00 0.00 H new ATOM 0 HB2 ASP A 262 -8.880 15.294 40.004 1.00 0.00 H new ATOM 0 HB3 ASP A 262 -8.174 13.824 39.362 1.00 0.00 H new ATOM 988 N GLU A 263 -9.716 16.317 37.673 1.00 0.00 N ATOM 989 CA GLU A 263 -10.858 16.362 36.720 1.00 0.00 C ATOM 990 C GLU A 263 -10.446 17.137 35.504 1.00 0.00 C ATOM 991 O GLU A 263 -10.569 16.684 34.377 1.00 0.00 O ATOM 992 CB GLU A 263 -12.037 17.101 37.379 1.00 0.00 C ATOM 993 CG GLU A 263 -12.084 16.769 38.865 1.00 0.00 C ATOM 994 CD GLU A 263 -13.228 17.537 39.512 1.00 0.00 C ATOM 995 OE1 GLU A 263 -13.026 18.717 39.729 1.00 0.00 O ATOM 996 OE2 GLU A 263 -14.241 16.901 39.754 1.00 0.00 O ATOM 0 H GLU A 263 -9.847 16.831 38.545 1.00 0.00 H new ATOM 0 HA GLU A 263 -11.148 15.347 36.449 1.00 0.00 H new ATOM 0 HB2 GLU A 263 -11.928 18.177 37.240 1.00 0.00 H new ATOM 0 HB3 GLU A 263 -12.973 16.811 36.902 1.00 0.00 H new ATOM 0 HG2 GLU A 263 -12.223 15.697 39.006 1.00 0.00 H new ATOM 0 HG3 GLU A 263 -11.139 17.033 39.339 1.00 0.00 H new ATOM 1003 N PHE A 264 -9.956 18.302 35.764 1.00 0.00 N ATOM 1004 CA PHE A 264 -9.510 19.172 34.683 1.00 0.00 C ATOM 1005 C PHE A 264 -8.691 18.393 33.675 1.00 0.00 C ATOM 1006 O PHE A 264 -8.939 18.444 32.499 1.00 0.00 O ATOM 1007 CB PHE A 264 -8.604 20.234 35.308 1.00 0.00 C ATOM 1008 CG PHE A 264 -8.283 21.318 34.287 1.00 0.00 C ATOM 1009 CD1 PHE A 264 -9.267 22.176 33.829 1.00 0.00 C ATOM 1010 CD2 PHE A 264 -6.989 21.473 33.828 1.00 0.00 C ATOM 1011 CE1 PHE A 264 -8.954 23.174 32.926 1.00 0.00 C ATOM 1012 CE2 PHE A 264 -6.680 22.466 32.929 1.00 0.00 C ATOM 1013 CZ PHE A 264 -7.657 23.317 32.478 1.00 0.00 C ATOM 0 H PHE A 264 -9.847 18.688 36.702 1.00 0.00 H new ATOM 0 HA PHE A 264 -10.372 19.607 34.178 1.00 0.00 H new ATOM 0 HB2 PHE A 264 -9.094 20.675 36.176 1.00 0.00 H new ATOM 0 HB3 PHE A 264 -7.682 19.773 35.662 1.00 0.00 H new ATOM 0 HD1 PHE A 264 -10.283 22.065 34.178 1.00 0.00 H new ATOM 0 HD2 PHE A 264 -6.213 20.808 34.179 1.00 0.00 H new ATOM 0 HE1 PHE A 264 -9.725 23.842 32.571 1.00 0.00 H new ATOM 0 HE2 PHE A 264 -5.665 22.577 32.577 1.00 0.00 H new ATOM 0 HZ PHE A 264 -7.411 24.098 31.773 1.00 0.00 H new ATOM 1023 N VAL A 265 -7.734 17.668 34.177 1.00 0.00 N ATOM 1024 CA VAL A 265 -6.858 16.864 33.287 1.00 0.00 C ATOM 1025 C VAL A 265 -7.511 15.590 32.781 1.00 0.00 C ATOM 1026 O VAL A 265 -7.344 15.234 31.631 1.00 0.00 O ATOM 1027 CB VAL A 265 -5.624 16.465 34.102 1.00 0.00 C ATOM 1028 CG1 VAL A 265 -4.703 15.616 33.230 1.00 0.00 C ATOM 1029 CG2 VAL A 265 -4.892 17.723 34.541 1.00 0.00 C ATOM 0 H VAL A 265 -7.520 17.598 35.172 1.00 0.00 H new ATOM 0 HA VAL A 265 -6.624 17.474 32.415 1.00 0.00 H new ATOM 0 HB VAL A 265 -5.925 15.892 34.979 1.00 0.00 H new ATOM 0 HG11 VAL A 265 -3.822 15.328 33.804 1.00 0.00 H new ATOM 0 HG12 VAL A 265 -5.233 14.721 32.905 1.00 0.00 H new ATOM 0 HG13 VAL A 265 -4.395 16.192 32.357 1.00 0.00 H new ATOM 0 HG21 VAL A 265 -4.012 17.448 35.122 1.00 0.00 H new ATOM 0 HG22 VAL A 265 -4.584 18.290 33.663 1.00 0.00 H new ATOM 0 HG23 VAL A 265 -5.555 18.334 35.154 1.00 0.00 H new ATOM 1039 N MET A 266 -8.221 14.911 33.640 1.00 0.00 N ATOM 1040 CA MET A 266 -8.883 13.649 33.197 1.00 0.00 C ATOM 1041 C MET A 266 -9.454 13.812 31.803 1.00 0.00 C ATOM 1042 O MET A 266 -9.199 13.014 30.923 1.00 0.00 O ATOM 1043 CB MET A 266 -10.030 13.314 34.167 1.00 0.00 C ATOM 1044 CG MET A 266 -10.496 11.877 33.920 1.00 0.00 C ATOM 1045 SD MET A 266 -10.892 11.411 32.218 1.00 0.00 S ATOM 1046 CE MET A 266 -12.515 10.688 32.548 1.00 0.00 C ATOM 0 H MET A 266 -8.371 15.169 34.615 1.00 0.00 H new ATOM 0 HA MET A 266 -8.144 12.848 33.189 1.00 0.00 H new ATOM 0 HB2 MET A 266 -9.695 13.428 35.198 1.00 0.00 H new ATOM 0 HB3 MET A 266 -10.858 14.007 34.022 1.00 0.00 H new ATOM 0 HG2 MET A 266 -9.718 11.204 34.281 1.00 0.00 H new ATOM 0 HG3 MET A 266 -11.380 11.700 34.532 1.00 0.00 H new ATOM 0 HE1 MET A 266 -12.950 10.328 31.615 1.00 0.00 H new ATOM 0 HE2 MET A 266 -12.408 9.855 33.243 1.00 0.00 H new ATOM 0 HE3 MET A 266 -13.168 11.444 32.985 1.00 0.00 H new ATOM 1056 N MET A 267 -10.197 14.856 31.621 1.00 0.00 N ATOM 1057 CA MET A 267 -10.797 15.094 30.285 1.00 0.00 C ATOM 1058 C MET A 267 -9.723 15.425 29.260 1.00 0.00 C ATOM 1059 O MET A 267 -9.726 14.909 28.160 1.00 0.00 O ATOM 1060 CB MET A 267 -11.741 16.295 30.390 1.00 0.00 C ATOM 1061 CG MET A 267 -12.973 15.906 31.200 1.00 0.00 C ATOM 1062 SD MET A 267 -14.199 17.201 31.524 1.00 0.00 S ATOM 1063 CE MET A 267 -13.112 18.634 31.287 1.00 0.00 C ATOM 0 H MET A 267 -10.416 15.553 32.333 1.00 0.00 H new ATOM 0 HA MET A 267 -11.325 14.194 29.969 1.00 0.00 H new ATOM 0 HB2 MET A 267 -11.230 17.132 30.865 1.00 0.00 H new ATOM 0 HB3 MET A 267 -12.037 16.626 29.395 1.00 0.00 H new ATOM 0 HG2 MET A 267 -13.474 15.090 30.680 1.00 0.00 H new ATOM 0 HG3 MET A 267 -12.636 15.513 32.159 1.00 0.00 H new ATOM 0 HE1 MET A 267 -13.644 19.544 31.563 1.00 0.00 H new ATOM 0 HE2 MET A 267 -12.227 18.527 31.914 1.00 0.00 H new ATOM 0 HE3 MET A 267 -12.811 18.693 30.241 1.00 0.00 H new ATOM 1073 N LEU A 268 -8.818 16.278 29.646 1.00 0.00 N ATOM 1074 CA LEU A 268 -7.732 16.666 28.716 1.00 0.00 C ATOM 1075 C LEU A 268 -6.802 15.511 28.448 1.00 0.00 C ATOM 1076 O LEU A 268 -6.787 14.956 27.367 1.00 0.00 O ATOM 1077 CB LEU A 268 -6.942 17.780 29.375 1.00 0.00 C ATOM 1078 CG LEU A 268 -7.915 18.881 29.753 1.00 0.00 C ATOM 1079 CD1 LEU A 268 -7.251 19.846 30.710 1.00 0.00 C ATOM 1080 CD2 LEU A 268 -8.304 19.622 28.512 1.00 0.00 C ATOM 0 H LEU A 268 -8.786 16.721 30.564 1.00 0.00 H new ATOM 0 HA LEU A 268 -8.167 16.981 27.767 1.00 0.00 H new ATOM 0 HB2 LEU A 268 -6.424 17.409 30.259 1.00 0.00 H new ATOM 0 HB3 LEU A 268 -6.180 18.161 28.695 1.00 0.00 H new ATOM 0 HG LEU A 268 -8.793 18.445 30.230 1.00 0.00 H new ATOM 0 HD11 LEU A 268 -7.954 20.634 30.978 1.00 0.00 H new ATOM 0 HD12 LEU A 268 -6.944 19.313 31.610 1.00 0.00 H new ATOM 0 HD13 LEU A 268 -6.376 20.287 30.233 1.00 0.00 H new ATOM 0 HD21 LEU A 268 -9.004 20.418 28.768 1.00 0.00 H new ATOM 0 HD22 LEU A 268 -7.415 20.054 28.053 1.00 0.00 H new ATOM 0 HD23 LEU A 268 -8.777 18.934 27.811 1.00 0.00 H new ATOM 1092 N SER A 269 -6.042 15.165 29.436 1.00 0.00 N ATOM 1093 CA SER A 269 -5.098 14.040 29.259 1.00 0.00 C ATOM 1094 C SER A 269 -5.839 12.819 28.741 1.00 0.00 C ATOM 1095 O SER A 269 -5.240 11.891 28.237 1.00 0.00 O ATOM 1096 CB SER A 269 -4.475 13.700 30.622 1.00 0.00 C ATOM 1097 OG SER A 269 -3.775 12.484 30.389 1.00 0.00 O ATOM 0 H SER A 269 -6.032 15.609 30.354 1.00 0.00 H new ATOM 0 HA SER A 269 -4.325 14.324 28.545 1.00 0.00 H new ATOM 0 HB2 SER A 269 -3.803 14.488 30.961 1.00 0.00 H new ATOM 0 HB3 SER A 269 -5.238 13.580 31.391 1.00 0.00 H new ATOM 0 HG SER A 269 -3.921 12.195 29.464 1.00 0.00 H new