USER MOD reduce.3.24.130724 H: found=0, std=0, add=544, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 545 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 296 ASN : amide:sc= -0.424 K(o=0.82,f=-1.3!) USER MOD Set 1.2: A 300 THR OG1 : rot 70:sc= 1.24 USER MOD Set 2.1: A 279 THR OG1 : rot -69:sc= -0.489 USER MOD Set 2.2: A 284 ASN : amide:sc= -1.2 K(o=-1.7,f=-4.9!) USER MOD Set 3.1: A 251 GLN : amide:sc= -0.592 K(o=-0.046,f=-4.9) USER MOD Set 3.2: A 254 SER OG : rot -140:sc= 0.545 USER MOD Single : A 249 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 252 CYS SG : rot -174:sc= -3.73 USER MOD Single : A 260 GLN : amide:sc= -0.688 X(o=-0.69,f=-0.83) USER MOD Single : A 263 THR OG1 : rot 85:sc= 0.338 USER MOD Single : A 267 GLN : amide:sc= -2.22 X(o=-2.2,f=-2.4!) USER MOD Single : A 275 SER OG : rot 24:sc= -3.32! USER MOD Single : A 276 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.185) USER MOD Single : A 278 THR OG1 : rot 105:sc= 0.848 USER MOD Single : A 280 ASN : amide:sc= 0.252 X(o=0.25,f=-0.24) USER MOD Single : A 281 ASN : amide:sc= -0.878 K(o=-0.88,f=-2.3!) USER MOD Single : A 292 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 294 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0494) USER MOD Single : A 299 SER OG : rot 180:sc= 0 USER MOD Single : A 302 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 305 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 306 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 309 HIS :FLIP no HE2:sc= -11.7! C(o=-12!,f=-12!) USER MOD Single : A 310 THR OG1 : rot 60:sc= -0.504 USER MOD Single : A 311 ASN : amide:sc= -0.263 X(o=-0.26,f=-0.045) USER MOD Single : A 312 CYS SG : rot -34:sc= -2.48! USER MOD ----------------------------------------------------------------- ATOM 75 N ARG A 247 -6.084 -15.046 3.122 1.00 0.00 N ATOM 76 CA ARG A 247 -5.428 -14.287 2.055 1.00 0.00 C ATOM 77 C ARG A 247 -5.833 -12.833 2.061 1.00 0.00 C ATOM 78 O ARG A 247 -6.667 -12.398 2.855 1.00 0.00 O ATOM 79 CB ARG A 247 -5.698 -14.912 0.681 1.00 0.00 C ATOM 80 CG ARG A 247 -7.168 -15.167 0.394 1.00 0.00 C ATOM 81 CD ARG A 247 -7.382 -15.640 -1.034 1.00 0.00 C ATOM 82 NE ARG A 247 -8.646 -16.355 -1.191 1.00 0.00 N ATOM 83 CZ ARG A 247 -8.868 -17.579 -0.719 1.00 0.00 C ATOM 84 NH1 ARG A 247 -7.915 -18.226 -0.058 1.00 0.00 N ATOM 85 NH2 ARG A 247 -10.046 -18.159 -0.907 1.00 0.00 N ATOM 0 HA ARG A 247 -4.357 -14.332 2.251 1.00 0.00 H new ATOM 0 HB2 ARG A 247 -5.297 -14.255 -0.090 1.00 0.00 H new ATOM 0 HB3 ARG A 247 -5.156 -15.855 0.610 1.00 0.00 H new ATOM 0 HG2 ARG A 247 -7.551 -15.916 1.088 1.00 0.00 H new ATOM 0 HG3 ARG A 247 -7.737 -14.253 0.565 1.00 0.00 H new ATOM 0 HD2 ARG A 247 -7.365 -14.782 -1.706 1.00 0.00 H new ATOM 0 HD3 ARG A 247 -6.559 -16.291 -1.327 1.00 0.00 H new ATOM 0 HE ARG A 247 -9.403 -15.889 -1.692 1.00 0.00 H new ATOM 0 HH11 ARG A 247 -7.007 -17.785 0.090 1.00 0.00 H new ATOM 0 HH12 ARG A 247 -8.091 -19.164 0.302 1.00 0.00 H new ATOM 0 HH21 ARG A 247 -10.782 -17.667 -1.414 1.00 0.00 H new ATOM 0 HH22 ARG A 247 -10.216 -19.097 -0.545 1.00 0.00 H new ATOM 99 N TRP A 248 -5.185 -12.073 1.200 1.00 0.00 N ATOM 100 CA TRP A 248 -5.427 -10.650 1.137 1.00 0.00 C ATOM 101 C TRP A 248 -5.311 -10.067 -0.258 1.00 0.00 C ATOM 102 O TRP A 248 -4.980 -10.741 -1.230 1.00 0.00 O ATOM 103 CB TRP A 248 -4.413 -9.947 2.018 1.00 0.00 C ATOM 104 CG TRP A 248 -4.788 -9.859 3.451 1.00 0.00 C ATOM 105 CD1 TRP A 248 -4.277 -10.595 4.472 1.00 0.00 C ATOM 106 CD2 TRP A 248 -5.741 -8.969 4.019 1.00 0.00 C ATOM 107 NE1 TRP A 248 -4.821 -10.174 5.667 1.00 0.00 N ATOM 108 CE2 TRP A 248 -5.735 -9.176 5.405 1.00 0.00 C ATOM 109 CE3 TRP A 248 -6.591 -8.005 3.480 1.00 0.00 C ATOM 110 CZ2 TRP A 248 -6.552 -8.435 6.262 1.00 0.00 C ATOM 111 CZ3 TRP A 248 -7.404 -7.285 4.326 1.00 0.00 C ATOM 112 CH2 TRP A 248 -7.376 -7.498 5.704 1.00 0.00 C ATOM 0 H TRP A 248 -4.490 -12.418 0.538 1.00 0.00 H new ATOM 0 HA TRP A 248 -6.454 -10.496 1.469 1.00 0.00 H new ATOM 0 HB2 TRP A 248 -3.459 -10.469 1.938 1.00 0.00 H new ATOM 0 HB3 TRP A 248 -4.257 -8.938 1.635 1.00 0.00 H new ATOM 0 HD1 TRP A 248 -3.554 -11.390 4.364 1.00 0.00 H new ATOM 0 HE1 TRP A 248 -4.586 -10.540 6.590 1.00 0.00 H new ATOM 0 HE3 TRP A 248 -6.612 -7.826 2.415 1.00 0.00 H new ATOM 0 HZ2 TRP A 248 -6.533 -8.597 7.330 1.00 0.00 H new ATOM 0 HZ3 TRP A 248 -8.074 -6.544 3.916 1.00 0.00 H new ATOM 0 HH2 TRP A 248 -8.018 -6.911 6.343 1.00 0.00 H new ATOM 123 N MET A 249 -5.564 -8.771 -0.281 1.00 0.00 N ATOM 124 CA MET A 249 -5.493 -7.924 -1.461 1.00 0.00 C ATOM 125 C MET A 249 -5.427 -6.496 -0.949 1.00 0.00 C ATOM 126 O MET A 249 -6.368 -5.713 -1.086 1.00 0.00 O ATOM 127 CB MET A 249 -6.719 -8.083 -2.335 1.00 0.00 C ATOM 128 CG MET A 249 -6.645 -9.238 -3.319 1.00 0.00 C ATOM 129 SD MET A 249 -6.350 -8.690 -5.011 1.00 0.00 S ATOM 130 CE MET A 249 -7.822 -9.303 -5.826 1.00 0.00 C ATOM 0 H MET A 249 -5.836 -8.257 0.557 1.00 0.00 H new ATOM 0 HA MET A 249 -4.628 -8.192 -2.067 1.00 0.00 H new ATOM 0 HB2 MET A 249 -7.590 -8.223 -1.695 1.00 0.00 H new ATOM 0 HB3 MET A 249 -6.876 -7.158 -2.890 1.00 0.00 H new ATOM 0 HG2 MET A 249 -5.848 -9.917 -3.017 1.00 0.00 H new ATOM 0 HG3 MET A 249 -7.576 -9.803 -3.281 1.00 0.00 H new ATOM 0 HE1 MET A 249 -7.788 -9.042 -6.884 1.00 0.00 H new ATOM 0 HE2 MET A 249 -7.871 -10.387 -5.721 1.00 0.00 H new ATOM 0 HE3 MET A 249 -8.704 -8.854 -5.370 1.00 0.00 H new ATOM 140 N VAL A 250 -4.333 -6.214 -0.287 1.00 0.00 N ATOM 141 CA VAL A 250 -4.110 -4.926 0.364 1.00 0.00 C ATOM 142 C VAL A 250 -4.347 -3.747 -0.559 1.00 0.00 C ATOM 143 O VAL A 250 -4.183 -3.848 -1.775 1.00 0.00 O ATOM 144 CB VAL A 250 -2.695 -4.826 0.962 1.00 0.00 C ATOM 145 CG1 VAL A 250 -1.654 -5.298 -0.033 1.00 0.00 C ATOM 146 CG2 VAL A 250 -2.413 -3.400 1.412 1.00 0.00 C ATOM 0 H VAL A 250 -3.560 -6.870 -0.178 1.00 0.00 H new ATOM 0 HA VAL A 250 -4.845 -4.879 1.167 1.00 0.00 H new ATOM 0 HB VAL A 250 -2.640 -5.478 1.834 1.00 0.00 H new ATOM 0 HG11 VAL A 250 -0.662 -5.218 0.412 1.00 0.00 H new ATOM 0 HG12 VAL A 250 -1.850 -6.337 -0.299 1.00 0.00 H new ATOM 0 HG13 VAL A 250 -1.700 -4.679 -0.929 1.00 0.00 H new ATOM 0 HG21 VAL A 250 -1.409 -3.343 1.833 1.00 0.00 H new ATOM 0 HG22 VAL A 250 -2.487 -2.727 0.557 1.00 0.00 H new ATOM 0 HG23 VAL A 250 -3.141 -3.107 2.168 1.00 0.00 H new ATOM 156 N GLN A 251 -4.721 -2.614 0.038 1.00 0.00 N ATOM 157 CA GLN A 251 -4.961 -1.412 -0.723 1.00 0.00 C ATOM 158 C GLN A 251 -4.579 -0.202 0.093 1.00 0.00 C ATOM 159 O GLN A 251 -5.390 0.684 0.360 1.00 0.00 O ATOM 160 CB GLN A 251 -6.416 -1.343 -1.152 1.00 0.00 C ATOM 161 CG GLN A 251 -6.762 -0.097 -1.952 1.00 0.00 C ATOM 162 CD GLN A 251 -7.927 0.673 -1.362 1.00 0.00 C ATOM 163 OE1 GLN A 251 -7.745 1.546 -0.513 1.00 0.00 O ATOM 164 NE2 GLN A 251 -9.136 0.352 -1.811 1.00 0.00 N ATOM 0 H GLN A 251 -4.861 -2.515 1.044 1.00 0.00 H new ATOM 0 HA GLN A 251 -4.345 -1.428 -1.622 1.00 0.00 H new ATOM 0 HB2 GLN A 251 -6.651 -2.224 -1.750 1.00 0.00 H new ATOM 0 HB3 GLN A 251 -7.049 -1.381 -0.265 1.00 0.00 H new ATOM 0 HG2 GLN A 251 -5.889 0.553 -1.999 1.00 0.00 H new ATOM 0 HG3 GLN A 251 -7.002 -0.383 -2.976 1.00 0.00 H new ATOM 0 HE21 GLN A 251 -9.241 -0.378 -2.515 1.00 0.00 H new ATOM 0 HE22 GLN A 251 -9.959 0.836 -1.451 1.00 0.00 H new ATOM 173 N CYS A 252 -3.317 -0.180 0.467 1.00 0.00 N ATOM 174 CA CYS A 252 -2.767 0.912 1.242 1.00 0.00 C ATOM 175 C CYS A 252 -2.071 1.879 0.309 1.00 0.00 C ATOM 176 O CYS A 252 -0.847 1.902 0.215 1.00 0.00 O ATOM 177 CB CYS A 252 -1.784 0.397 2.294 1.00 0.00 C ATOM 178 SG CYS A 252 -2.439 -0.910 3.357 1.00 0.00 S ATOM 0 H CYS A 252 -2.646 -0.915 0.244 1.00 0.00 H new ATOM 0 HA CYS A 252 -3.579 1.420 1.763 1.00 0.00 H new ATOM 0 HB2 CYS A 252 -0.893 0.024 1.789 1.00 0.00 H new ATOM 0 HB3 CYS A 252 -1.470 1.233 2.919 1.00 0.00 H new ATOM 0 HG CYS A 252 -1.575 -1.186 4.288 1.00 0.00 H new ATOM 184 N GLY A 253 -2.861 2.656 -0.406 1.00 0.00 N ATOM 185 CA GLY A 253 -2.297 3.589 -1.345 1.00 0.00 C ATOM 186 C GLY A 253 -3.147 4.808 -1.551 1.00 0.00 C ATOM 187 O GLY A 253 -2.629 5.914 -1.678 1.00 0.00 O ATOM 0 H GLY A 253 -3.880 2.657 -0.353 1.00 0.00 H new ATOM 0 HA2 GLY A 253 -1.312 3.896 -0.995 1.00 0.00 H new ATOM 0 HA3 GLY A 253 -2.153 3.088 -2.303 1.00 0.00 H new ATOM 191 N SER A 254 -4.449 4.592 -1.628 1.00 0.00 N ATOM 192 CA SER A 254 -5.404 5.661 -1.868 1.00 0.00 C ATOM 193 C SER A 254 -5.169 6.884 -0.986 1.00 0.00 C ATOM 194 O SER A 254 -5.938 7.150 -0.063 1.00 0.00 O ATOM 195 CB SER A 254 -6.829 5.137 -1.666 1.00 0.00 C ATOM 196 OG SER A 254 -6.829 3.929 -0.926 1.00 0.00 O ATOM 0 H SER A 254 -4.874 3.670 -1.526 1.00 0.00 H new ATOM 0 HA SER A 254 -5.263 5.986 -2.899 1.00 0.00 H new ATOM 0 HB2 SER A 254 -7.425 5.886 -1.145 1.00 0.00 H new ATOM 0 HB3 SER A 254 -7.300 4.973 -2.635 1.00 0.00 H new ATOM 0 HG SER A 254 -7.491 3.314 -1.304 1.00 0.00 H new ATOM 202 N PHE A 255 -4.125 7.650 -1.296 1.00 0.00 N ATOM 203 CA PHE A 255 -3.841 8.864 -0.539 1.00 0.00 C ATOM 204 C PHE A 255 -3.800 10.080 -1.454 1.00 0.00 C ATOM 205 O PHE A 255 -3.087 10.089 -2.457 1.00 0.00 O ATOM 206 CB PHE A 255 -2.517 8.792 0.249 1.00 0.00 C ATOM 207 CG PHE A 255 -1.860 7.439 0.322 1.00 0.00 C ATOM 208 CD1 PHE A 255 -2.464 6.395 1.006 1.00 0.00 C ATOM 209 CD2 PHE A 255 -0.619 7.218 -0.271 1.00 0.00 C ATOM 210 CE1 PHE A 255 -1.847 5.161 1.099 1.00 0.00 C ATOM 211 CE2 PHE A 255 -0.006 5.988 -0.183 1.00 0.00 C ATOM 212 CZ PHE A 255 -0.616 4.959 0.503 1.00 0.00 C ATOM 0 H PHE A 255 -3.471 7.455 -2.054 1.00 0.00 H new ATOM 0 HA PHE A 255 -4.655 8.959 0.179 1.00 0.00 H new ATOM 0 HB2 PHE A 255 -1.812 9.491 -0.201 1.00 0.00 H new ATOM 0 HB3 PHE A 255 -2.704 9.137 1.266 1.00 0.00 H new ATOM 0 HD1 PHE A 255 -3.427 6.547 1.471 1.00 0.00 H new ATOM 0 HD2 PHE A 255 -0.132 8.020 -0.806 1.00 0.00 H new ATOM 0 HE1 PHE A 255 -2.326 4.356 1.637 1.00 0.00 H new ATOM 0 HE2 PHE A 255 0.954 5.829 -0.652 1.00 0.00 H new ATOM 0 HZ PHE A 255 -0.132 3.996 0.575 1.00 0.00 H new ATOM 222 N ARG A 256 -4.547 11.122 -1.083 1.00 0.00 N ATOM 223 CA ARG A 256 -4.574 12.361 -1.857 1.00 0.00 C ATOM 224 C ARG A 256 -3.158 12.803 -2.211 1.00 0.00 C ATOM 225 O ARG A 256 -2.941 13.505 -3.198 1.00 0.00 O ATOM 226 CB ARG A 256 -5.288 13.465 -1.076 1.00 0.00 C ATOM 227 CG ARG A 256 -6.115 14.391 -1.953 1.00 0.00 C ATOM 228 CD ARG A 256 -6.638 15.583 -1.169 1.00 0.00 C ATOM 229 NE ARG A 256 -6.541 16.825 -1.934 1.00 0.00 N ATOM 230 CZ ARG A 256 -7.306 17.108 -2.986 1.00 0.00 C ATOM 231 NH1 ARG A 256 -8.227 16.247 -3.399 1.00 0.00 N ATOM 232 NH2 ARG A 256 -7.149 18.259 -3.627 1.00 0.00 N ATOM 0 H ARG A 256 -5.140 11.131 -0.253 1.00 0.00 H new ATOM 0 HA ARG A 256 -5.122 12.174 -2.780 1.00 0.00 H new ATOM 0 HB2 ARG A 256 -5.938 13.009 -0.329 1.00 0.00 H new ATOM 0 HB3 ARG A 256 -4.547 14.055 -0.536 1.00 0.00 H new ATOM 0 HG2 ARG A 256 -5.508 14.742 -2.787 1.00 0.00 H new ATOM 0 HG3 ARG A 256 -6.953 13.838 -2.378 1.00 0.00 H new ATOM 0 HD2 ARG A 256 -7.678 15.407 -0.892 1.00 0.00 H new ATOM 0 HD3 ARG A 256 -6.074 15.683 -0.242 1.00 0.00 H new ATOM 0 HE ARG A 256 -5.847 17.514 -1.645 1.00 0.00 H new ATOM 0 HH11 ARG A 256 -8.353 15.361 -2.910 1.00 0.00 H new ATOM 0 HH12 ARG A 256 -8.809 16.471 -4.206 1.00 0.00 H new ATOM 0 HH21 ARG A 256 -6.443 18.925 -3.313 1.00 0.00 H new ATOM 0 HH22 ARG A 256 -7.734 18.478 -4.433 1.00 0.00 H new ATOM 246 N GLY A 257 -2.198 12.363 -1.405 1.00 0.00 N ATOM 247 CA GLY A 257 -0.811 12.686 -1.639 1.00 0.00 C ATOM 248 C GLY A 257 -0.259 11.957 -2.846 1.00 0.00 C ATOM 249 O GLY A 257 0.701 11.207 -2.732 1.00 0.00 O ATOM 0 H GLY A 257 -2.364 11.781 -0.584 1.00 0.00 H new ATOM 0 HA2 GLY A 257 -0.708 13.761 -1.785 1.00 0.00 H new ATOM 0 HA3 GLY A 257 -0.224 12.427 -0.758 1.00 0.00 H new ATOM 253 N ALA A 258 -0.885 12.171 -4.002 1.00 0.00 N ATOM 254 CA ALA A 258 -0.470 11.527 -5.249 1.00 0.00 C ATOM 255 C ALA A 258 1.048 11.463 -5.365 1.00 0.00 C ATOM 256 O ALA A 258 1.604 10.472 -5.839 1.00 0.00 O ATOM 257 CB ALA A 258 -1.061 12.261 -6.443 1.00 0.00 C ATOM 0 H ALA A 258 -1.689 12.791 -4.102 1.00 0.00 H new ATOM 0 HA ALA A 258 -0.846 10.504 -5.238 1.00 0.00 H new ATOM 0 HB1 ALA A 258 -0.744 11.772 -7.364 1.00 0.00 H new ATOM 0 HB2 ALA A 258 -2.149 12.244 -6.378 1.00 0.00 H new ATOM 0 HB3 ALA A 258 -0.714 13.294 -6.443 1.00 0.00 H new ATOM 263 N GLU A 259 1.712 12.519 -4.915 1.00 0.00 N ATOM 264 CA GLU A 259 3.169 12.567 -4.955 1.00 0.00 C ATOM 265 C GLU A 259 3.743 11.624 -3.907 1.00 0.00 C ATOM 266 O GLU A 259 4.692 10.884 -4.172 1.00 0.00 O ATOM 267 CB GLU A 259 3.682 13.992 -4.728 1.00 0.00 C ATOM 268 CG GLU A 259 2.944 14.748 -3.632 1.00 0.00 C ATOM 269 CD GLU A 259 3.884 15.416 -2.648 1.00 0.00 C ATOM 270 OE1 GLU A 259 4.674 16.284 -3.078 1.00 0.00 O ATOM 271 OE2 GLU A 259 3.833 15.071 -1.449 1.00 0.00 O ATOM 0 H GLU A 259 1.270 13.349 -4.520 1.00 0.00 H new ATOM 0 HA GLU A 259 3.498 12.249 -5.944 1.00 0.00 H new ATOM 0 HB2 GLU A 259 4.742 13.950 -4.476 1.00 0.00 H new ATOM 0 HB3 GLU A 259 3.598 14.550 -5.660 1.00 0.00 H new ATOM 0 HG2 GLU A 259 2.303 15.504 -4.086 1.00 0.00 H new ATOM 0 HG3 GLU A 259 2.293 14.058 -3.095 1.00 0.00 H new ATOM 278 N GLN A 260 3.137 11.631 -2.726 1.00 0.00 N ATOM 279 CA GLN A 260 3.559 10.754 -1.647 1.00 0.00 C ATOM 280 C GLN A 260 3.190 9.317 -1.991 1.00 0.00 C ATOM 281 O GLN A 260 3.892 8.380 -1.625 1.00 0.00 O ATOM 282 CB GLN A 260 2.896 11.166 -0.332 1.00 0.00 C ATOM 283 CG GLN A 260 3.700 12.184 0.462 1.00 0.00 C ATOM 284 CD GLN A 260 4.093 11.677 1.835 1.00 0.00 C ATOM 285 OE1 GLN A 260 5.195 11.162 2.029 1.00 0.00 O ATOM 286 NE2 GLN A 260 3.190 11.820 2.800 1.00 0.00 N ATOM 0 H GLN A 260 2.350 12.237 -2.493 1.00 0.00 H new ATOM 0 HA GLN A 260 4.639 10.833 -1.526 1.00 0.00 H new ATOM 0 HB2 GLN A 260 1.911 11.580 -0.546 1.00 0.00 H new ATOM 0 HB3 GLN A 260 2.742 10.278 0.282 1.00 0.00 H new ATOM 0 HG2 GLN A 260 4.600 12.445 -0.096 1.00 0.00 H new ATOM 0 HG3 GLN A 260 3.116 13.098 0.570 1.00 0.00 H new ATOM 0 HE21 GLN A 260 2.289 12.252 2.595 1.00 0.00 H new ATOM 0 HE22 GLN A 260 3.398 11.497 3.745 1.00 0.00 H new ATOM 295 N ALA A 261 2.084 9.163 -2.713 1.00 0.00 N ATOM 296 CA ALA A 261 1.605 7.855 -3.136 1.00 0.00 C ATOM 297 C ALA A 261 2.593 7.203 -4.092 1.00 0.00 C ATOM 298 O ALA A 261 2.992 6.054 -3.897 1.00 0.00 O ATOM 299 CB ALA A 261 0.252 7.991 -3.788 1.00 0.00 C ATOM 0 H ALA A 261 1.498 9.940 -3.019 1.00 0.00 H new ATOM 0 HA ALA A 261 1.512 7.216 -2.258 1.00 0.00 H new ATOM 0 HB1 ALA A 261 -0.101 7.009 -4.102 1.00 0.00 H new ATOM 0 HB2 ALA A 261 -0.454 8.419 -3.076 1.00 0.00 H new ATOM 0 HB3 ALA A 261 0.331 8.643 -4.658 1.00 0.00 H new ATOM 305 N GLU A 262 2.998 7.946 -5.120 1.00 0.00 N ATOM 306 CA GLU A 262 3.955 7.432 -6.091 1.00 0.00 C ATOM 307 C GLU A 262 5.251 7.068 -5.384 1.00 0.00 C ATOM 308 O GLU A 262 5.839 6.016 -5.635 1.00 0.00 O ATOM 309 CB GLU A 262 4.220 8.467 -7.187 1.00 0.00 C ATOM 310 CG GLU A 262 3.425 8.223 -8.460 1.00 0.00 C ATOM 311 CD GLU A 262 4.020 7.122 -9.316 1.00 0.00 C ATOM 312 OE1 GLU A 262 4.314 6.038 -8.770 1.00 0.00 O ATOM 313 OE2 GLU A 262 4.192 7.345 -10.533 1.00 0.00 O ATOM 0 H GLU A 262 2.680 8.898 -5.299 1.00 0.00 H new ATOM 0 HA GLU A 262 3.539 6.540 -6.560 1.00 0.00 H new ATOM 0 HB2 GLU A 262 3.981 9.459 -6.804 1.00 0.00 H new ATOM 0 HB3 GLU A 262 5.283 8.466 -7.427 1.00 0.00 H new ATOM 0 HG2 GLU A 262 2.399 7.962 -8.199 1.00 0.00 H new ATOM 0 HG3 GLU A 262 3.381 9.145 -9.039 1.00 0.00 H new ATOM 320 N THR A 263 5.674 7.939 -4.475 1.00 0.00 N ATOM 321 CA THR A 263 6.880 7.703 -3.700 1.00 0.00 C ATOM 322 C THR A 263 6.615 6.628 -2.655 1.00 0.00 C ATOM 323 O THR A 263 7.517 5.886 -2.268 1.00 0.00 O ATOM 324 CB THR A 263 7.343 8.995 -3.023 1.00 0.00 C ATOM 325 OG1 THR A 263 7.575 10.009 -3.984 1.00 0.00 O ATOM 326 CG2 THR A 263 8.613 8.827 -2.217 1.00 0.00 C ATOM 0 H THR A 263 5.197 8.814 -4.259 1.00 0.00 H new ATOM 0 HA THR A 263 7.670 7.365 -4.370 1.00 0.00 H new ATOM 0 HB THR A 263 6.536 9.271 -2.345 1.00 0.00 H new ATOM 0 HG1 THR A 263 6.731 10.460 -4.194 1.00 0.00 H new ATOM 0 HG21 THR A 263 8.885 9.780 -1.764 1.00 0.00 H new ATOM 0 HG22 THR A 263 8.452 8.086 -1.434 1.00 0.00 H new ATOM 0 HG23 THR A 263 9.418 8.493 -2.872 1.00 0.00 H new ATOM 334 N VAL A 264 5.361 6.539 -2.214 1.00 0.00 N ATOM 335 CA VAL A 264 4.969 5.546 -1.230 1.00 0.00 C ATOM 336 C VAL A 264 5.082 4.150 -1.837 1.00 0.00 C ATOM 337 O VAL A 264 5.528 3.211 -1.181 1.00 0.00 O ATOM 338 CB VAL A 264 3.525 5.784 -0.698 1.00 0.00 C ATOM 339 CG1 VAL A 264 2.885 4.478 -0.247 1.00 0.00 C ATOM 340 CG2 VAL A 264 3.546 6.778 0.451 1.00 0.00 C ATOM 0 H VAL A 264 4.603 7.146 -2.526 1.00 0.00 H new ATOM 0 HA VAL A 264 5.645 5.636 -0.380 1.00 0.00 H new ATOM 0 HB VAL A 264 2.928 6.193 -1.513 1.00 0.00 H new ATOM 0 HG11 VAL A 264 1.877 4.674 0.120 1.00 0.00 H new ATOM 0 HG12 VAL A 264 2.837 3.787 -1.088 1.00 0.00 H new ATOM 0 HG13 VAL A 264 3.482 4.037 0.551 1.00 0.00 H new ATOM 0 HG21 VAL A 264 2.530 6.936 0.814 1.00 0.00 H new ATOM 0 HG22 VAL A 264 4.164 6.387 1.259 1.00 0.00 H new ATOM 0 HG23 VAL A 264 3.959 7.726 0.105 1.00 0.00 H new ATOM 350 N ARG A 265 4.685 4.029 -3.100 1.00 0.00 N ATOM 351 CA ARG A 265 4.748 2.753 -3.802 1.00 0.00 C ATOM 352 C ARG A 265 6.181 2.231 -3.847 1.00 0.00 C ATOM 353 O ARG A 265 6.451 1.098 -3.447 1.00 0.00 O ATOM 354 CB ARG A 265 4.200 2.899 -5.223 1.00 0.00 C ATOM 355 CG ARG A 265 3.370 1.708 -5.674 1.00 0.00 C ATOM 356 CD ARG A 265 4.121 0.850 -6.680 1.00 0.00 C ATOM 357 NE ARG A 265 5.289 0.201 -6.089 1.00 0.00 N ATOM 358 CZ ARG A 265 6.215 -0.441 -6.797 1.00 0.00 C ATOM 359 NH1 ARG A 265 6.111 -0.524 -8.118 1.00 0.00 N ATOM 360 NH2 ARG A 265 7.247 -1.002 -6.182 1.00 0.00 N ATOM 0 H ARG A 265 4.316 4.799 -3.658 1.00 0.00 H new ATOM 0 HA ARG A 265 4.134 2.035 -3.258 1.00 0.00 H new ATOM 0 HB2 ARG A 265 3.589 3.800 -5.278 1.00 0.00 H new ATOM 0 HB3 ARG A 265 5.032 3.035 -5.914 1.00 0.00 H new ATOM 0 HG2 ARG A 265 3.101 1.103 -4.808 1.00 0.00 H new ATOM 0 HG3 ARG A 265 2.439 2.060 -6.119 1.00 0.00 H new ATOM 0 HD2 ARG A 265 3.449 0.091 -7.080 1.00 0.00 H new ATOM 0 HD3 ARG A 265 4.438 1.470 -7.519 1.00 0.00 H new ATOM 0 HE ARG A 265 5.401 0.242 -5.076 1.00 0.00 H new ATOM 0 HH11 ARG A 265 5.318 -0.094 -8.595 1.00 0.00 H new ATOM 0 HH12 ARG A 265 6.824 -1.017 -8.656 1.00 0.00 H new ATOM 0 HH21 ARG A 265 7.331 -0.941 -5.167 1.00 0.00 H new ATOM 0 HH22 ARG A 265 7.957 -1.494 -6.724 1.00 0.00 H new ATOM 374 N ALA A 266 7.096 3.064 -4.333 1.00 0.00 N ATOM 375 CA ALA A 266 8.500 2.684 -4.426 1.00 0.00 C ATOM 376 C ALA A 266 9.069 2.374 -3.048 1.00 0.00 C ATOM 377 O ALA A 266 9.858 1.442 -2.886 1.00 0.00 O ATOM 378 CB ALA A 266 9.303 3.788 -5.097 1.00 0.00 C ATOM 0 H ALA A 266 6.890 4.005 -4.668 1.00 0.00 H new ATOM 0 HA ALA A 266 8.571 1.782 -5.034 1.00 0.00 H new ATOM 0 HB1 ALA A 266 10.350 3.490 -5.159 1.00 0.00 H new ATOM 0 HB2 ALA A 266 8.915 3.962 -6.101 1.00 0.00 H new ATOM 0 HB3 ALA A 266 9.221 4.704 -4.512 1.00 0.00 H new ATOM 384 N GLN A 267 8.660 3.156 -2.053 1.00 0.00 N ATOM 385 CA GLN A 267 9.126 2.958 -0.686 1.00 0.00 C ATOM 386 C GLN A 267 8.728 1.574 -0.184 1.00 0.00 C ATOM 387 O GLN A 267 9.514 0.890 0.467 1.00 0.00 O ATOM 388 CB GLN A 267 8.551 4.034 0.235 1.00 0.00 C ATOM 389 CG GLN A 267 9.383 5.304 0.284 1.00 0.00 C ATOM 390 CD GLN A 267 10.066 5.503 1.623 1.00 0.00 C ATOM 391 OE1 GLN A 267 11.015 4.795 1.960 1.00 0.00 O ATOM 392 NE2 GLN A 267 9.586 6.471 2.396 1.00 0.00 N ATOM 0 H GLN A 267 8.008 3.932 -2.168 1.00 0.00 H new ATOM 0 HA GLN A 267 10.213 3.035 -0.679 1.00 0.00 H new ATOM 0 HB2 GLN A 267 7.543 4.283 -0.097 1.00 0.00 H new ATOM 0 HB3 GLN A 267 8.464 3.628 1.243 1.00 0.00 H new ATOM 0 HG2 GLN A 267 10.137 5.271 -0.503 1.00 0.00 H new ATOM 0 HG3 GLN A 267 8.743 6.161 0.076 1.00 0.00 H new ATOM 0 HE21 GLN A 267 8.798 7.034 2.077 1.00 0.00 H new ATOM 0 HE22 GLN A 267 10.006 6.651 3.308 1.00 0.00 H new ATOM 401 N LEU A 268 7.504 1.165 -0.505 1.00 0.00 N ATOM 402 CA LEU A 268 7.000 -0.144 -0.102 1.00 0.00 C ATOM 403 C LEU A 268 7.932 -1.241 -0.594 1.00 0.00 C ATOM 404 O LEU A 268 8.312 -2.129 0.163 1.00 0.00 O ATOM 405 CB LEU A 268 5.579 -0.356 -0.654 1.00 0.00 C ATOM 406 CG LEU A 268 4.430 0.085 0.268 1.00 0.00 C ATOM 407 CD1 LEU A 268 3.824 1.387 -0.224 1.00 0.00 C ATOM 408 CD2 LEU A 268 3.355 -0.996 0.361 1.00 0.00 C ATOM 0 H LEU A 268 6.842 1.723 -1.044 1.00 0.00 H new ATOM 0 HA LEU A 268 6.961 -0.187 0.986 1.00 0.00 H new ATOM 0 HB2 LEU A 268 5.491 0.185 -1.596 1.00 0.00 H new ATOM 0 HB3 LEU A 268 5.452 -1.415 -0.881 1.00 0.00 H new ATOM 0 HG LEU A 268 4.841 0.243 1.265 1.00 0.00 H new ATOM 0 HD11 LEU A 268 3.012 1.684 0.440 1.00 0.00 H new ATOM 0 HD12 LEU A 268 4.589 2.164 -0.233 1.00 0.00 H new ATOM 0 HD13 LEU A 268 3.435 1.249 -1.233 1.00 0.00 H new ATOM 0 HD21 LEU A 268 2.555 -0.658 1.019 1.00 0.00 H new ATOM 0 HD22 LEU A 268 2.950 -1.192 -0.632 1.00 0.00 H new ATOM 0 HD23 LEU A 268 3.792 -1.910 0.762 1.00 0.00 H new ATOM 420 N ALA A 269 8.309 -1.163 -1.861 1.00 0.00 N ATOM 421 CA ALA A 269 9.209 -2.147 -2.449 1.00 0.00 C ATOM 422 C ALA A 269 10.640 -1.943 -1.964 1.00 0.00 C ATOM 423 O ALA A 269 11.437 -2.880 -1.942 1.00 0.00 O ATOM 424 CB ALA A 269 9.148 -2.079 -3.967 1.00 0.00 C ATOM 0 H ALA A 269 8.007 -0.430 -2.502 1.00 0.00 H new ATOM 0 HA ALA A 269 8.883 -3.137 -2.128 1.00 0.00 H new ATOM 0 HB1 ALA A 269 9.825 -2.820 -4.392 1.00 0.00 H new ATOM 0 HB2 ALA A 269 8.131 -2.285 -4.300 1.00 0.00 H new ATOM 0 HB3 ALA A 269 9.444 -1.084 -4.299 1.00 0.00 H new ATOM 430 N PHE A 270 10.962 -0.714 -1.574 1.00 0.00 N ATOM 431 CA PHE A 270 12.299 -0.396 -1.090 1.00 0.00 C ATOM 432 C PHE A 270 12.450 -0.769 0.382 1.00 0.00 C ATOM 433 O PHE A 270 13.544 -1.099 0.838 1.00 0.00 O ATOM 434 CB PHE A 270 12.597 1.093 -1.285 1.00 0.00 C ATOM 435 CG PHE A 270 13.999 1.373 -1.751 1.00 0.00 C ATOM 436 CD1 PHE A 270 15.046 0.542 -1.383 1.00 0.00 C ATOM 437 CD2 PHE A 270 14.269 2.467 -2.557 1.00 0.00 C ATOM 438 CE1 PHE A 270 16.336 0.797 -1.810 1.00 0.00 C ATOM 439 CE2 PHE A 270 15.557 2.728 -2.987 1.00 0.00 C ATOM 440 CZ PHE A 270 16.591 1.891 -2.612 1.00 0.00 C ATOM 0 H PHE A 270 10.317 0.076 -1.584 1.00 0.00 H new ATOM 0 HA PHE A 270 13.014 -0.980 -1.669 1.00 0.00 H new ATOM 0 HB2 PHE A 270 11.894 1.503 -2.010 1.00 0.00 H new ATOM 0 HB3 PHE A 270 12.425 1.615 -0.344 1.00 0.00 H new ATOM 0 HD1 PHE A 270 14.852 -0.315 -0.755 1.00 0.00 H new ATOM 0 HD2 PHE A 270 13.464 3.124 -2.853 1.00 0.00 H new ATOM 0 HE1 PHE A 270 17.143 0.141 -1.517 1.00 0.00 H new ATOM 0 HE2 PHE A 270 15.755 3.584 -3.615 1.00 0.00 H new ATOM 0 HZ PHE A 270 17.598 2.093 -2.946 1.00 0.00 H new ATOM 450 N GLU A 271 11.347 -0.716 1.122 1.00 0.00 N ATOM 451 CA GLU A 271 11.368 -1.051 2.540 1.00 0.00 C ATOM 452 C GLU A 271 11.311 -2.564 2.747 1.00 0.00 C ATOM 453 O GLU A 271 11.597 -3.058 3.839 1.00 0.00 O ATOM 454 CB GLU A 271 10.198 -0.377 3.260 1.00 0.00 C ATOM 455 CG GLU A 271 10.624 0.741 4.197 1.00 0.00 C ATOM 456 CD GLU A 271 11.080 1.981 3.454 1.00 0.00 C ATOM 457 OE1 GLU A 271 10.329 2.458 2.578 1.00 0.00 O ATOM 458 OE2 GLU A 271 12.189 2.475 3.749 1.00 0.00 O ATOM 0 H GLU A 271 10.431 -0.445 0.764 1.00 0.00 H new ATOM 0 HA GLU A 271 12.304 -0.684 2.961 1.00 0.00 H new ATOM 0 HB2 GLU A 271 9.508 0.025 2.518 1.00 0.00 H new ATOM 0 HB3 GLU A 271 9.651 -1.128 3.829 1.00 0.00 H new ATOM 0 HG2 GLU A 271 9.791 0.999 4.851 1.00 0.00 H new ATOM 0 HG3 GLU A 271 11.433 0.386 4.836 1.00 0.00 H new ATOM 465 N GLY A 272 10.945 -3.296 1.698 1.00 0.00 N ATOM 466 CA GLY A 272 10.865 -4.741 1.798 1.00 0.00 C ATOM 467 C GLY A 272 9.457 -5.269 1.602 1.00 0.00 C ATOM 468 O GLY A 272 9.160 -6.407 1.963 1.00 0.00 O ATOM 0 H GLY A 272 10.703 -2.915 0.783 1.00 0.00 H new ATOM 0 HA2 GLY A 272 11.523 -5.189 1.053 1.00 0.00 H new ATOM 0 HA3 GLY A 272 11.232 -5.053 2.776 1.00 0.00 H new ATOM 472 N PHE A 273 8.586 -4.446 1.022 1.00 0.00 N ATOM 473 CA PHE A 273 7.209 -4.853 0.778 1.00 0.00 C ATOM 474 C PHE A 273 6.639 -4.158 -0.451 1.00 0.00 C ATOM 475 O PHE A 273 5.994 -3.122 -0.348 1.00 0.00 O ATOM 476 CB PHE A 273 6.336 -4.597 2.010 1.00 0.00 C ATOM 477 CG PHE A 273 6.125 -3.149 2.404 1.00 0.00 C ATOM 478 CD1 PHE A 273 7.187 -2.278 2.657 1.00 0.00 C ATOM 479 CD2 PHE A 273 4.837 -2.681 2.594 1.00 0.00 C ATOM 480 CE1 PHE A 273 6.951 -0.979 3.092 1.00 0.00 C ATOM 481 CE2 PHE A 273 4.608 -1.387 3.014 1.00 0.00 C ATOM 482 CZ PHE A 273 5.663 -0.543 3.267 1.00 0.00 C ATOM 0 H PHE A 273 8.810 -3.499 0.715 1.00 0.00 H new ATOM 0 HA PHE A 273 7.208 -5.925 0.582 1.00 0.00 H new ATOM 0 HB2 PHE A 273 5.359 -5.048 1.835 1.00 0.00 H new ATOM 0 HB3 PHE A 273 6.781 -5.119 2.857 1.00 0.00 H new ATOM 0 HD1 PHE A 273 8.202 -2.617 2.513 1.00 0.00 H new ATOM 0 HD2 PHE A 273 3.999 -3.338 2.411 1.00 0.00 H new ATOM 0 HE1 PHE A 273 7.779 -0.315 3.291 1.00 0.00 H new ATOM 0 HE2 PHE A 273 3.595 -1.036 3.145 1.00 0.00 H new ATOM 0 HZ PHE A 273 5.477 0.466 3.604 1.00 0.00 H new ATOM 492 N ASP A 274 6.904 -4.743 -1.618 1.00 0.00 N ATOM 493 CA ASP A 274 6.446 -4.190 -2.890 1.00 0.00 C ATOM 494 C ASP A 274 4.928 -4.267 -3.052 1.00 0.00 C ATOM 495 O ASP A 274 4.351 -5.349 -3.147 1.00 0.00 O ATOM 496 CB ASP A 274 7.122 -4.922 -4.053 1.00 0.00 C ATOM 497 CG ASP A 274 8.625 -5.029 -3.878 1.00 0.00 C ATOM 498 OD1 ASP A 274 9.068 -5.468 -2.796 1.00 0.00 O ATOM 499 OD2 ASP A 274 9.359 -4.676 -4.824 1.00 0.00 O ATOM 0 H ASP A 274 7.438 -5.607 -1.708 1.00 0.00 H new ATOM 0 HA ASP A 274 6.723 -3.136 -2.896 1.00 0.00 H new ATOM 0 HB2 ASP A 274 6.698 -5.922 -4.144 1.00 0.00 H new ATOM 0 HB3 ASP A 274 6.904 -4.398 -4.984 1.00 0.00 H new ATOM 504 N SER A 275 4.302 -3.097 -3.117 1.00 0.00 N ATOM 505 CA SER A 275 2.856 -2.977 -3.305 1.00 0.00 C ATOM 506 C SER A 275 2.579 -2.436 -4.711 1.00 0.00 C ATOM 507 O SER A 275 3.161 -1.425 -5.107 1.00 0.00 O ATOM 508 CB SER A 275 2.280 -1.991 -2.295 1.00 0.00 C ATOM 509 OG SER A 275 2.849 -0.702 -2.457 1.00 0.00 O ATOM 0 H SER A 275 4.783 -2.201 -3.041 1.00 0.00 H new ATOM 0 HA SER A 275 2.398 -3.957 -3.170 1.00 0.00 H new ATOM 0 HB2 SER A 275 1.198 -1.932 -2.416 1.00 0.00 H new ATOM 0 HB3 SER A 275 2.468 -2.350 -1.283 1.00 0.00 H new ATOM 0 HG SER A 275 3.175 -0.602 -3.376 1.00 0.00 H new ATOM 515 N LYS A 276 1.690 -3.074 -5.458 1.00 0.00 N ATOM 516 CA LYS A 276 1.355 -2.603 -6.800 1.00 0.00 C ATOM 517 C LYS A 276 0.763 -1.196 -6.733 1.00 0.00 C ATOM 518 O LYS A 276 0.189 -0.805 -5.717 1.00 0.00 O ATOM 519 CB LYS A 276 0.368 -3.558 -7.477 1.00 0.00 C ATOM 520 CG LYS A 276 1.038 -4.600 -8.358 1.00 0.00 C ATOM 521 CD LYS A 276 0.983 -5.984 -7.731 1.00 0.00 C ATOM 522 CE LYS A 276 2.253 -6.295 -6.954 1.00 0.00 C ATOM 523 NZ LYS A 276 2.103 -7.509 -6.104 1.00 0.00 N ATOM 0 H LYS A 276 1.190 -3.913 -5.164 1.00 0.00 H new ATOM 0 HA LYS A 276 2.269 -2.574 -7.393 1.00 0.00 H new ATOM 0 HB2 LYS A 276 -0.218 -4.065 -6.711 1.00 0.00 H new ATOM 0 HB3 LYS A 276 -0.330 -2.978 -8.081 1.00 0.00 H new ATOM 0 HG2 LYS A 276 0.549 -4.622 -9.332 1.00 0.00 H new ATOM 0 HG3 LYS A 276 2.077 -4.319 -8.529 1.00 0.00 H new ATOM 0 HD2 LYS A 276 0.123 -6.049 -7.065 1.00 0.00 H new ATOM 0 HD3 LYS A 276 0.840 -6.732 -8.511 1.00 0.00 H new ATOM 0 HE2 LYS A 276 3.078 -6.440 -7.651 1.00 0.00 H new ATOM 0 HE3 LYS A 276 2.512 -5.442 -6.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 276 3.043 -7.863 -5.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 276 1.566 -7.268 -5.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 276 1.594 -8.244 -6.635 1.00 0.00 H new ATOM 537 N ILE A 277 0.918 -0.432 -7.811 1.00 0.00 N ATOM 538 CA ILE A 277 0.407 0.938 -7.854 1.00 0.00 C ATOM 539 C ILE A 277 -0.919 1.029 -8.608 1.00 0.00 C ATOM 540 O ILE A 277 -1.160 0.290 -9.562 1.00 0.00 O ATOM 541 CB ILE A 277 1.423 1.898 -8.513 1.00 0.00 C ATOM 542 CG1 ILE A 277 0.982 3.356 -8.331 1.00 0.00 C ATOM 543 CG2 ILE A 277 1.593 1.569 -9.990 1.00 0.00 C ATOM 544 CD1 ILE A 277 1.997 4.211 -7.603 1.00 0.00 C ATOM 0 H ILE A 277 1.390 -0.735 -8.663 1.00 0.00 H new ATOM 0 HA ILE A 277 0.245 1.236 -6.818 1.00 0.00 H new ATOM 0 HB ILE A 277 2.387 1.767 -8.021 1.00 0.00 H new ATOM 0 HG12 ILE A 277 0.788 3.793 -9.311 1.00 0.00 H new ATOM 0 HG13 ILE A 277 0.041 3.376 -7.781 1.00 0.00 H new ATOM 0 HG21 ILE A 277 2.312 2.256 -10.435 1.00 0.00 H new ATOM 0 HG22 ILE A 277 1.955 0.546 -10.096 1.00 0.00 H new ATOM 0 HG23 ILE A 277 0.634 1.669 -10.498 1.00 0.00 H new ATOM 0 HD11 ILE A 277 1.617 5.228 -7.511 1.00 0.00 H new ATOM 0 HD12 ILE A 277 2.174 3.799 -6.610 1.00 0.00 H new ATOM 0 HD13 ILE A 277 2.932 4.222 -8.163 1.00 0.00 H new ATOM 556 N THR A 278 -1.768 1.952 -8.168 1.00 0.00 N ATOM 557 CA THR A 278 -3.070 2.169 -8.786 1.00 0.00 C ATOM 558 C THR A 278 -3.489 3.625 -8.641 1.00 0.00 C ATOM 559 O THR A 278 -2.926 4.368 -7.840 1.00 0.00 O ATOM 560 CB THR A 278 -4.123 1.261 -8.150 1.00 0.00 C ATOM 561 OG1 THR A 278 -3.520 0.107 -7.591 1.00 0.00 O ATOM 562 CG2 THR A 278 -5.183 0.799 -9.125 1.00 0.00 C ATOM 0 H THR A 278 -1.574 2.567 -7.378 1.00 0.00 H new ATOM 0 HA THR A 278 -2.990 1.927 -9.846 1.00 0.00 H new ATOM 0 HB THR A 278 -4.600 1.868 -7.381 1.00 0.00 H new ATOM 0 HG1 THR A 278 -3.501 0.188 -6.615 1.00 0.00 H new ATOM 0 HG21 THR A 278 -5.898 0.159 -8.609 1.00 0.00 H new ATOM 0 HG22 THR A 278 -5.702 1.665 -9.536 1.00 0.00 H new ATOM 0 HG23 THR A 278 -4.714 0.240 -9.934 1.00 0.00 H new ATOM 570 N THR A 279 -4.482 4.019 -9.422 1.00 0.00 N ATOM 571 CA THR A 279 -4.997 5.387 -9.392 1.00 0.00 C ATOM 572 C THR A 279 -6.357 5.449 -10.088 1.00 0.00 C ATOM 573 O THR A 279 -6.519 4.903 -11.180 1.00 0.00 O ATOM 574 CB THR A 279 -4.019 6.341 -10.081 1.00 0.00 C ATOM 575 OG1 THR A 279 -2.711 5.798 -10.092 1.00 0.00 O ATOM 576 CG2 THR A 279 -3.944 7.701 -9.421 1.00 0.00 C ATOM 0 H THR A 279 -4.953 3.409 -10.090 1.00 0.00 H new ATOM 0 HA THR A 279 -5.112 5.692 -8.352 1.00 0.00 H new ATOM 0 HB THR A 279 -4.404 6.466 -11.093 1.00 0.00 H new ATOM 0 HG1 THR A 279 -2.353 5.789 -9.180 1.00 0.00 H new ATOM 0 HG21 THR A 279 -3.233 8.328 -9.959 1.00 0.00 H new ATOM 0 HG22 THR A 279 -4.928 8.170 -9.440 1.00 0.00 H new ATOM 0 HG23 THR A 279 -3.617 7.586 -8.388 1.00 0.00 H new ATOM 584 N ASN A 280 -7.340 6.105 -9.467 1.00 0.00 N ATOM 585 CA ASN A 280 -8.672 6.204 -10.070 1.00 0.00 C ATOM 586 C ASN A 280 -9.653 6.930 -9.154 1.00 0.00 C ATOM 587 O ASN A 280 -10.524 7.664 -9.621 1.00 0.00 O ATOM 588 CB ASN A 280 -9.209 4.809 -10.401 1.00 0.00 C ATOM 589 CG ASN A 280 -9.568 4.660 -11.868 1.00 0.00 C ATOM 590 OD1 ASN A 280 -10.635 4.150 -12.209 1.00 0.00 O ATOM 591 ND2 ASN A 280 -8.675 5.105 -12.743 1.00 0.00 N ATOM 0 H ASN A 280 -7.243 6.568 -8.563 1.00 0.00 H new ATOM 0 HA ASN A 280 -8.574 6.784 -10.988 1.00 0.00 H new ATOM 0 HB2 ASN A 280 -8.461 4.062 -10.135 1.00 0.00 H new ATOM 0 HB3 ASN A 280 -10.090 4.608 -9.792 1.00 0.00 H new ATOM 0 HD21 ASN A 280 -8.860 5.031 -13.743 1.00 0.00 H new ATOM 0 HD22 ASN A 280 -7.803 5.521 -12.415 1.00 0.00 H new ATOM 598 N ASN A 281 -9.510 6.720 -7.851 1.00 0.00 N ATOM 599 CA ASN A 281 -10.386 7.355 -6.868 1.00 0.00 C ATOM 600 C ASN A 281 -9.979 8.805 -6.614 1.00 0.00 C ATOM 601 O ASN A 281 -10.422 9.423 -5.647 1.00 0.00 O ATOM 602 CB ASN A 281 -10.332 6.581 -5.555 1.00 0.00 C ATOM 603 CG ASN A 281 -11.482 6.925 -4.628 1.00 0.00 C ATOM 604 OD1 ASN A 281 -12.246 7.857 -4.886 1.00 0.00 O ATOM 605 ND2 ASN A 281 -11.611 6.173 -3.540 1.00 0.00 N ATOM 0 H ASN A 281 -8.795 6.114 -7.448 1.00 0.00 H new ATOM 0 HA ASN A 281 -11.400 7.347 -7.267 1.00 0.00 H new ATOM 0 HB2 ASN A 281 -10.348 5.512 -5.767 1.00 0.00 H new ATOM 0 HB3 ASN A 281 -9.389 6.792 -5.052 1.00 0.00 H new ATOM 0 HD21 ASN A 281 -12.366 6.358 -2.879 1.00 0.00 H new ATOM 0 HD22 ASN A 281 -10.955 5.411 -3.366 1.00 0.00 H new ATOM 612 N GLY A 282 -9.113 9.331 -7.469 1.00 0.00 N ATOM 613 CA GLY A 282 -8.636 10.688 -7.304 1.00 0.00 C ATOM 614 C GLY A 282 -7.205 10.694 -6.818 1.00 0.00 C ATOM 615 O GLY A 282 -6.449 11.632 -7.073 1.00 0.00 O ATOM 0 H GLY A 282 -8.731 8.839 -8.277 1.00 0.00 H new ATOM 0 HA2 GLY A 282 -8.706 11.221 -8.252 1.00 0.00 H new ATOM 0 HA3 GLY A 282 -9.269 11.218 -6.593 1.00 0.00 H new ATOM 619 N TRP A 283 -6.838 9.624 -6.119 1.00 0.00 N ATOM 620 CA TRP A 283 -5.505 9.464 -5.590 1.00 0.00 C ATOM 621 C TRP A 283 -4.968 8.084 -5.920 1.00 0.00 C ATOM 622 O TRP A 283 -5.707 7.196 -6.345 1.00 0.00 O ATOM 623 CB TRP A 283 -5.513 9.693 -4.084 1.00 0.00 C ATOM 624 CG TRP A 283 -6.631 9.013 -3.355 1.00 0.00 C ATOM 625 CD1 TRP A 283 -7.030 7.718 -3.486 1.00 0.00 C ATOM 626 CD2 TRP A 283 -7.483 9.596 -2.363 1.00 0.00 C ATOM 627 NE1 TRP A 283 -8.094 7.464 -2.655 1.00 0.00 N ATOM 628 CE2 TRP A 283 -8.388 8.600 -1.951 1.00 0.00 C ATOM 629 CE3 TRP A 283 -7.573 10.866 -1.787 1.00 0.00 C ATOM 630 CZ2 TRP A 283 -9.366 8.834 -0.989 1.00 0.00 C ATOM 631 CZ3 TRP A 283 -8.542 11.097 -0.832 1.00 0.00 C ATOM 632 CH2 TRP A 283 -9.427 10.085 -0.439 1.00 0.00 C ATOM 0 H TRP A 283 -7.464 8.847 -5.908 1.00 0.00 H new ATOM 0 HA TRP A 283 -4.850 10.203 -6.051 1.00 0.00 H new ATOM 0 HB2 TRP A 283 -4.565 9.347 -3.672 1.00 0.00 H new ATOM 0 HB3 TRP A 283 -5.571 10.765 -3.893 1.00 0.00 H new ATOM 0 HD1 TRP A 283 -6.576 6.995 -4.147 1.00 0.00 H new ATOM 0 HE1 TRP A 283 -8.585 6.573 -2.576 1.00 0.00 H new ATOM 0 HE3 TRP A 283 -6.896 11.653 -2.084 1.00 0.00 H new ATOM 0 HZ2 TRP A 283 -10.052 8.056 -0.688 1.00 0.00 H new ATOM 0 HZ3 TRP A 283 -8.619 12.075 -0.380 1.00 0.00 H new ATOM 0 HH2 TRP A 283 -10.172 10.297 0.313 1.00 0.00 H new ATOM 643 N ASN A 284 -3.675 7.918 -5.727 1.00 0.00 N ATOM 644 CA ASN A 284 -3.010 6.652 -6.005 1.00 0.00 C ATOM 645 C ASN A 284 -3.523 5.573 -5.062 1.00 0.00 C ATOM 646 O ASN A 284 -3.386 5.698 -3.855 1.00 0.00 O ATOM 647 CB ASN A 284 -1.497 6.831 -5.840 1.00 0.00 C ATOM 648 CG ASN A 284 -0.757 6.796 -7.162 1.00 0.00 C ATOM 649 OD1 ASN A 284 -0.600 5.740 -7.774 1.00 0.00 O ATOM 650 ND2 ASN A 284 -0.296 7.960 -7.608 1.00 0.00 N ATOM 0 H ASN A 284 -3.056 8.648 -5.376 1.00 0.00 H new ATOM 0 HA ASN A 284 -3.226 6.343 -7.028 1.00 0.00 H new ATOM 0 HB2 ASN A 284 -1.300 7.781 -5.343 1.00 0.00 H new ATOM 0 HB3 ASN A 284 -1.111 6.045 -5.191 1.00 0.00 H new ATOM 0 HD21 ASN A 284 0.212 8.003 -8.492 1.00 0.00 H new ATOM 0 HD22 ASN A 284 -0.450 8.811 -7.067 1.00 0.00 H new ATOM 657 N ARG A 285 -4.133 4.527 -5.611 1.00 0.00 N ATOM 658 CA ARG A 285 -4.681 3.453 -4.787 1.00 0.00 C ATOM 659 C ARG A 285 -3.792 2.208 -4.780 1.00 0.00 C ATOM 660 O ARG A 285 -4.157 1.158 -5.309 1.00 0.00 O ATOM 661 CB ARG A 285 -6.090 3.091 -5.259 1.00 0.00 C ATOM 662 CG ARG A 285 -6.762 2.024 -4.409 1.00 0.00 C ATOM 663 CD ARG A 285 -6.955 0.728 -5.180 1.00 0.00 C ATOM 664 NE ARG A 285 -8.301 0.187 -5.008 1.00 0.00 N ATOM 665 CZ ARG A 285 -8.851 -0.704 -5.829 1.00 0.00 C ATOM 666 NH1 ARG A 285 -8.175 -1.159 -6.877 1.00 0.00 N ATOM 667 NH2 ARG A 285 -10.083 -1.142 -5.602 1.00 0.00 N ATOM 0 H ARG A 285 -4.260 4.400 -6.615 1.00 0.00 H new ATOM 0 HA ARG A 285 -4.722 3.825 -3.763 1.00 0.00 H new ATOM 0 HB2 ARG A 285 -6.707 3.989 -5.255 1.00 0.00 H new ATOM 0 HB3 ARG A 285 -6.040 2.743 -6.291 1.00 0.00 H new ATOM 0 HG2 ARG A 285 -6.159 1.833 -3.522 1.00 0.00 H new ATOM 0 HG3 ARG A 285 -7.729 2.390 -4.064 1.00 0.00 H new ATOM 0 HD2 ARG A 285 -6.767 0.904 -6.239 1.00 0.00 H new ATOM 0 HD3 ARG A 285 -6.223 -0.007 -4.844 1.00 0.00 H new ATOM 0 HE ARG A 285 -8.851 0.511 -4.212 1.00 0.00 H new ATOM 0 HH11 ARG A 285 -7.228 -0.826 -7.057 1.00 0.00 H new ATOM 0 HH12 ARG A 285 -8.603 -1.842 -7.502 1.00 0.00 H new ATOM 0 HH21 ARG A 285 -10.608 -0.796 -4.799 1.00 0.00 H new ATOM 0 HH22 ARG A 285 -10.505 -1.825 -6.231 1.00 0.00 H new ATOM 681 N VAL A 286 -2.635 2.340 -4.147 1.00 0.00 N ATOM 682 CA VAL A 286 -1.669 1.239 -4.012 1.00 0.00 C ATOM 683 C VAL A 286 -2.369 -0.071 -3.643 1.00 0.00 C ATOM 684 O VAL A 286 -3.483 -0.072 -3.122 1.00 0.00 O ATOM 685 CB VAL A 286 -0.616 1.547 -2.915 1.00 0.00 C ATOM 686 CG1 VAL A 286 0.391 0.419 -2.742 1.00 0.00 C ATOM 687 CG2 VAL A 286 0.098 2.861 -3.197 1.00 0.00 C ATOM 0 H VAL A 286 -2.332 3.210 -3.710 1.00 0.00 H new ATOM 0 HA VAL A 286 -1.177 1.136 -4.979 1.00 0.00 H new ATOM 0 HB VAL A 286 -1.161 1.639 -1.976 1.00 0.00 H new ATOM 0 HG11 VAL A 286 1.105 0.685 -1.963 1.00 0.00 H new ATOM 0 HG12 VAL A 286 -0.131 -0.495 -2.459 1.00 0.00 H new ATOM 0 HG13 VAL A 286 0.921 0.258 -3.680 1.00 0.00 H new ATOM 0 HG21 VAL A 286 0.830 3.053 -2.413 1.00 0.00 H new ATOM 0 HG22 VAL A 286 0.605 2.800 -4.160 1.00 0.00 H new ATOM 0 HG23 VAL A 286 -0.629 3.673 -3.220 1.00 0.00 H new ATOM 697 N VAL A 287 -1.678 -1.170 -3.901 1.00 0.00 N ATOM 698 CA VAL A 287 -2.166 -2.515 -3.599 1.00 0.00 C ATOM 699 C VAL A 287 -1.013 -3.493 -3.747 1.00 0.00 C ATOM 700 O VAL A 287 -0.207 -3.341 -4.652 1.00 0.00 O ATOM 701 CB VAL A 287 -3.296 -2.960 -4.552 1.00 0.00 C ATOM 702 CG1 VAL A 287 -4.600 -2.241 -4.244 1.00 0.00 C ATOM 703 CG2 VAL A 287 -2.890 -2.738 -6.001 1.00 0.00 C ATOM 0 H VAL A 287 -0.753 -1.158 -4.330 1.00 0.00 H new ATOM 0 HA VAL A 287 -2.563 -2.501 -2.584 1.00 0.00 H new ATOM 0 HB VAL A 287 -3.462 -4.026 -4.396 1.00 0.00 H new ATOM 0 HG11 VAL A 287 -5.373 -2.579 -4.934 1.00 0.00 H new ATOM 0 HG12 VAL A 287 -4.905 -2.462 -3.221 1.00 0.00 H new ATOM 0 HG13 VAL A 287 -4.458 -1.166 -4.356 1.00 0.00 H new ATOM 0 HG21 VAL A 287 -3.699 -3.057 -6.658 1.00 0.00 H new ATOM 0 HG22 VAL A 287 -2.686 -1.680 -6.164 1.00 0.00 H new ATOM 0 HG23 VAL A 287 -1.993 -3.318 -6.221 1.00 0.00 H new ATOM 713 N ILE A 288 -0.933 -4.508 -2.895 1.00 0.00 N ATOM 714 CA ILE A 288 0.150 -5.485 -3.017 1.00 0.00 C ATOM 715 C ILE A 288 -0.408 -6.812 -3.473 1.00 0.00 C ATOM 716 O ILE A 288 -0.400 -7.794 -2.731 1.00 0.00 O ATOM 717 CB ILE A 288 0.941 -5.703 -1.707 1.00 0.00 C ATOM 718 CG1 ILE A 288 1.281 -4.385 -1.017 1.00 0.00 C ATOM 719 CG2 ILE A 288 2.208 -6.493 -1.987 1.00 0.00 C ATOM 720 CD1 ILE A 288 1.103 -4.414 0.483 1.00 0.00 C ATOM 0 H ILE A 288 -1.585 -4.677 -2.129 1.00 0.00 H new ATOM 0 HA ILE A 288 0.846 -5.075 -3.749 1.00 0.00 H new ATOM 0 HB ILE A 288 0.303 -6.270 -1.029 1.00 0.00 H new ATOM 0 HG12 ILE A 288 2.314 -4.123 -1.245 1.00 0.00 H new ATOM 0 HG13 ILE A 288 0.653 -3.597 -1.432 1.00 0.00 H new ATOM 0 HG21 ILE A 288 2.758 -6.641 -1.057 1.00 0.00 H new ATOM 0 HG22 ILE A 288 1.946 -7.462 -2.412 1.00 0.00 H new ATOM 0 HG23 ILE A 288 2.831 -5.944 -2.693 1.00 0.00 H new ATOM 0 HD11 ILE A 288 1.364 -3.441 0.899 1.00 0.00 H new ATOM 0 HD12 ILE A 288 0.065 -4.644 0.722 1.00 0.00 H new ATOM 0 HD13 ILE A 288 1.751 -5.178 0.912 1.00 0.00 H new ATOM 732 N GLY A 289 -0.907 -6.819 -4.703 1.00 0.00 N ATOM 733 CA GLY A 289 -1.498 -8.022 -5.263 1.00 0.00 C ATOM 734 C GLY A 289 -2.288 -8.781 -4.218 1.00 0.00 C ATOM 735 O GLY A 289 -2.748 -8.186 -3.243 1.00 0.00 O ATOM 0 H GLY A 289 -0.913 -6.011 -5.325 1.00 0.00 H new ATOM 0 HA2 GLY A 289 -2.151 -7.757 -6.095 1.00 0.00 H new ATOM 0 HA3 GLY A 289 -0.713 -8.662 -5.666 1.00 0.00 H new ATOM 739 N PRO A 290 -2.450 -10.097 -4.365 1.00 0.00 N ATOM 740 CA PRO A 290 -3.167 -10.891 -3.390 1.00 0.00 C ATOM 741 C PRO A 290 -2.228 -11.370 -2.286 1.00 0.00 C ATOM 742 O PRO A 290 -1.511 -12.357 -2.450 1.00 0.00 O ATOM 743 CB PRO A 290 -3.677 -12.061 -4.225 1.00 0.00 C ATOM 744 CG PRO A 290 -2.634 -12.253 -5.282 1.00 0.00 C ATOM 745 CD PRO A 290 -1.937 -10.923 -5.470 1.00 0.00 C ATOM 0 HA PRO A 290 -3.962 -10.346 -2.880 1.00 0.00 H new ATOM 0 HB2 PRO A 290 -3.797 -12.959 -3.618 1.00 0.00 H new ATOM 0 HB3 PRO A 290 -4.650 -11.841 -4.664 1.00 0.00 H new ATOM 0 HG2 PRO A 290 -1.921 -13.022 -4.984 1.00 0.00 H new ATOM 0 HG3 PRO A 290 -3.089 -12.584 -6.216 1.00 0.00 H new ATOM 0 HD2 PRO A 290 -0.853 -11.029 -5.420 1.00 0.00 H new ATOM 0 HD3 PRO A 290 -2.170 -10.483 -6.440 1.00 0.00 H new ATOM 753 N VAL A 291 -2.221 -10.649 -1.173 1.00 0.00 N ATOM 754 CA VAL A 291 -1.349 -10.981 -0.045 1.00 0.00 C ATOM 755 C VAL A 291 -1.894 -12.169 0.742 1.00 0.00 C ATOM 756 O VAL A 291 -2.875 -12.792 0.341 1.00 0.00 O ATOM 757 CB VAL A 291 -1.125 -9.779 0.916 1.00 0.00 C ATOM 758 CG1 VAL A 291 0.302 -9.262 0.802 1.00 0.00 C ATOM 759 CG2 VAL A 291 -2.114 -8.649 0.654 1.00 0.00 C ATOM 0 H VAL A 291 -2.809 -9.829 -1.023 1.00 0.00 H new ATOM 0 HA VAL A 291 -0.384 -11.245 -0.478 1.00 0.00 H new ATOM 0 HB VAL A 291 -1.295 -10.140 1.930 1.00 0.00 H new ATOM 0 HG11 VAL A 291 0.440 -8.421 1.482 1.00 0.00 H new ATOM 0 HG12 VAL A 291 0.999 -10.058 1.063 1.00 0.00 H new ATOM 0 HG13 VAL A 291 0.490 -8.936 -0.221 1.00 0.00 H new ATOM 0 HG21 VAL A 291 -1.922 -7.830 1.347 1.00 0.00 H new ATOM 0 HG22 VAL A 291 -1.997 -8.293 -0.370 1.00 0.00 H new ATOM 0 HG23 VAL A 291 -3.131 -9.015 0.797 1.00 0.00 H new ATOM 769 N LYS A 292 -1.241 -12.490 1.857 1.00 0.00 N ATOM 770 CA LYS A 292 -1.659 -13.616 2.686 1.00 0.00 C ATOM 771 C LYS A 292 -1.992 -13.174 4.106 1.00 0.00 C ATOM 772 O LYS A 292 -1.233 -12.437 4.735 1.00 0.00 O ATOM 773 CB LYS A 292 -0.565 -14.685 2.717 1.00 0.00 C ATOM 774 CG LYS A 292 -1.003 -15.984 3.375 1.00 0.00 C ATOM 775 CD LYS A 292 -1.041 -17.132 2.379 1.00 0.00 C ATOM 776 CE LYS A 292 -2.270 -17.055 1.489 1.00 0.00 C ATOM 777 NZ LYS A 292 -3.439 -17.754 2.092 1.00 0.00 N ATOM 0 H LYS A 292 -0.424 -11.988 2.205 1.00 0.00 H new ATOM 0 HA LYS A 292 -2.563 -14.035 2.243 1.00 0.00 H new ATOM 0 HB2 LYS A 292 -0.244 -14.894 1.697 1.00 0.00 H new ATOM 0 HB3 LYS A 292 0.301 -14.292 3.249 1.00 0.00 H new ATOM 0 HG2 LYS A 292 -0.319 -16.229 4.188 1.00 0.00 H new ATOM 0 HG3 LYS A 292 -1.990 -15.853 3.818 1.00 0.00 H new ATOM 0 HD2 LYS A 292 -0.142 -17.111 1.763 1.00 0.00 H new ATOM 0 HD3 LYS A 292 -1.037 -18.081 2.915 1.00 0.00 H new ATOM 0 HE2 LYS A 292 -2.524 -16.010 1.311 1.00 0.00 H new ATOM 0 HE3 LYS A 292 -2.044 -17.497 0.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 292 -4.256 -17.678 1.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 292 -3.206 -18.757 2.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 292 -3.672 -17.316 3.006 1.00 0.00 H new ATOM 791 N GLY A 293 -3.136 -13.636 4.606 1.00 0.00 N ATOM 792 CA GLY A 293 -3.556 -13.289 5.950 1.00 0.00 C ATOM 793 C GLY A 293 -2.770 -14.038 7.003 1.00 0.00 C ATOM 794 O GLY A 293 -3.005 -15.224 7.233 1.00 0.00 O ATOM 0 H GLY A 293 -3.780 -14.246 4.101 1.00 0.00 H new ATOM 0 HA2 GLY A 293 -3.434 -12.217 6.102 1.00 0.00 H new ATOM 0 HA3 GLY A 293 -4.617 -13.509 6.066 1.00 0.00 H new ATOM 798 N LYS A 294 -1.833 -13.346 7.636 1.00 0.00 N ATOM 799 CA LYS A 294 -1.001 -13.959 8.668 1.00 0.00 C ATOM 800 C LYS A 294 -0.288 -12.896 9.498 1.00 0.00 C ATOM 801 O LYS A 294 -0.432 -12.851 10.721 1.00 0.00 O ATOM 802 CB LYS A 294 0.032 -14.895 8.032 1.00 0.00 C ATOM 803 CG LYS A 294 -0.392 -16.356 8.004 1.00 0.00 C ATOM 804 CD LYS A 294 -0.793 -16.852 9.384 1.00 0.00 C ATOM 805 CE LYS A 294 -0.569 -18.349 9.527 1.00 0.00 C ATOM 806 NZ LYS A 294 -1.318 -19.125 8.500 1.00 0.00 N ATOM 0 H LYS A 294 -1.628 -12.363 7.456 1.00 0.00 H new ATOM 0 HA LYS A 294 -1.652 -14.535 9.326 1.00 0.00 H new ATOM 0 HB2 LYS A 294 0.227 -14.564 7.012 1.00 0.00 H new ATOM 0 HB3 LYS A 294 0.970 -14.810 8.580 1.00 0.00 H new ATOM 0 HG2 LYS A 294 -1.228 -16.479 7.316 1.00 0.00 H new ATOM 0 HG3 LYS A 294 0.427 -16.965 7.622 1.00 0.00 H new ATOM 0 HD2 LYS A 294 -0.217 -16.323 10.143 1.00 0.00 H new ATOM 0 HD3 LYS A 294 -1.843 -16.622 9.563 1.00 0.00 H new ATOM 0 HE2 LYS A 294 0.496 -18.566 9.441 1.00 0.00 H new ATOM 0 HE3 LYS A 294 -0.880 -18.669 10.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 294 -1.263 -20.139 8.723 1.00 0.00 H new ATOM 0 HZ2 LYS A 294 -2.314 -18.825 8.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 294 -0.901 -18.953 7.563 1.00 0.00 H new ATOM 820 N GLU A 295 0.485 -12.048 8.829 1.00 0.00 N ATOM 821 CA GLU A 295 1.227 -10.994 9.511 1.00 0.00 C ATOM 822 C GLU A 295 1.908 -10.049 8.522 1.00 0.00 C ATOM 823 O GLU A 295 2.154 -8.887 8.838 1.00 0.00 O ATOM 824 CB GLU A 295 2.271 -11.608 10.443 1.00 0.00 C ATOM 825 CG GLU A 295 3.019 -10.582 11.280 1.00 0.00 C ATOM 826 CD GLU A 295 2.837 -10.798 12.770 1.00 0.00 C ATOM 827 OE1 GLU A 295 3.627 -11.566 13.360 1.00 0.00 O ATOM 828 OE2 GLU A 295 1.905 -10.201 13.348 1.00 0.00 O ATOM 0 H GLU A 295 0.614 -12.069 7.817 1.00 0.00 H new ATOM 0 HA GLU A 295 0.513 -10.411 10.093 1.00 0.00 H new ATOM 0 HB2 GLU A 295 1.779 -12.318 11.108 1.00 0.00 H new ATOM 0 HB3 GLU A 295 2.989 -12.173 9.849 1.00 0.00 H new ATOM 0 HG2 GLU A 295 4.081 -10.626 11.038 1.00 0.00 H new ATOM 0 HG3 GLU A 295 2.673 -9.582 11.017 1.00 0.00 H new ATOM 835 N ASN A 296 2.222 -10.549 7.328 1.00 0.00 N ATOM 836 CA ASN A 296 2.881 -9.734 6.313 1.00 0.00 C ATOM 837 C ASN A 296 2.051 -8.502 5.980 1.00 0.00 C ATOM 838 O ASN A 296 2.505 -7.373 6.157 1.00 0.00 O ATOM 839 CB ASN A 296 3.131 -10.556 5.046 1.00 0.00 C ATOM 840 CG ASN A 296 3.915 -9.785 4.003 1.00 0.00 C ATOM 841 OD1 ASN A 296 3.463 -8.753 3.507 1.00 0.00 O ATOM 842 ND2 ASN A 296 5.098 -10.285 3.663 1.00 0.00 N ATOM 0 H ASN A 296 2.031 -11.509 7.042 1.00 0.00 H new ATOM 0 HA ASN A 296 3.839 -9.405 6.716 1.00 0.00 H new ATOM 0 HB2 ASN A 296 3.674 -11.464 5.307 1.00 0.00 H new ATOM 0 HB3 ASN A 296 2.176 -10.866 4.623 1.00 0.00 H new ATOM 0 HD21 ASN A 296 5.671 -9.810 2.965 1.00 0.00 H new ATOM 0 HD22 ASN A 296 5.434 -11.143 4.100 1.00 0.00 H new ATOM 849 N ALA A 297 0.829 -8.722 5.508 1.00 0.00 N ATOM 850 CA ALA A 297 -0.064 -7.619 5.169 1.00 0.00 C ATOM 851 C ALA A 297 -0.224 -6.687 6.369 1.00 0.00 C ATOM 852 O ALA A 297 -0.349 -5.472 6.218 1.00 0.00 O ATOM 853 CB ALA A 297 -1.418 -8.154 4.724 1.00 0.00 C ATOM 0 H ALA A 297 0.435 -9.650 5.352 1.00 0.00 H new ATOM 0 HA ALA A 297 0.370 -7.054 4.344 1.00 0.00 H new ATOM 0 HB1 ALA A 297 -2.074 -7.320 4.474 1.00 0.00 H new ATOM 0 HB2 ALA A 297 -1.288 -8.789 3.848 1.00 0.00 H new ATOM 0 HB3 ALA A 297 -1.862 -8.736 5.531 1.00 0.00 H new ATOM 859 N ASP A 298 -0.203 -7.271 7.567 1.00 0.00 N ATOM 860 CA ASP A 298 -0.328 -6.501 8.802 1.00 0.00 C ATOM 861 C ASP A 298 0.923 -5.663 9.024 1.00 0.00 C ATOM 862 O ASP A 298 0.850 -4.440 9.122 1.00 0.00 O ATOM 863 CB ASP A 298 -0.555 -7.435 9.993 1.00 0.00 C ATOM 864 CG ASP A 298 -1.435 -6.811 11.060 1.00 0.00 C ATOM 865 OD1 ASP A 298 -1.412 -5.570 11.198 1.00 0.00 O ATOM 866 OD2 ASP A 298 -2.148 -7.564 11.756 1.00 0.00 O ATOM 0 H ASP A 298 -0.100 -8.276 7.707 1.00 0.00 H new ATOM 0 HA ASP A 298 -1.188 -5.837 8.713 1.00 0.00 H new ATOM 0 HB2 ASP A 298 -1.014 -8.360 9.643 1.00 0.00 H new ATOM 0 HB3 ASP A 298 0.407 -7.702 10.430 1.00 0.00 H new ATOM 871 N SER A 299 2.079 -6.322 9.071 1.00 0.00 N ATOM 872 CA SER A 299 3.338 -5.613 9.245 1.00 0.00 C ATOM 873 C SER A 299 3.518 -4.633 8.093 1.00 0.00 C ATOM 874 O SER A 299 4.119 -3.570 8.244 1.00 0.00 O ATOM 875 CB SER A 299 4.510 -6.597 9.294 1.00 0.00 C ATOM 876 OG SER A 299 5.123 -6.596 10.572 1.00 0.00 O ATOM 0 H SER A 299 2.167 -7.335 8.992 1.00 0.00 H new ATOM 0 HA SER A 299 3.317 -5.069 10.189 1.00 0.00 H new ATOM 0 HB2 SER A 299 4.157 -7.601 9.057 1.00 0.00 H new ATOM 0 HB3 SER A 299 5.245 -6.330 8.534 1.00 0.00 H new ATOM 0 HG SER A 299 5.867 -7.234 10.578 1.00 0.00 H new ATOM 882 N THR A 300 2.956 -5.005 6.945 1.00 0.00 N ATOM 883 CA THR A 300 3.005 -4.182 5.751 1.00 0.00 C ATOM 884 C THR A 300 2.288 -2.860 6.004 1.00 0.00 C ATOM 885 O THR A 300 2.724 -1.806 5.543 1.00 0.00 O ATOM 886 CB THR A 300 2.356 -4.940 4.591 1.00 0.00 C ATOM 887 OG1 THR A 300 3.200 -5.986 4.147 1.00 0.00 O ATOM 888 CG2 THR A 300 2.041 -4.077 3.396 1.00 0.00 C ATOM 0 H THR A 300 2.456 -5.885 6.822 1.00 0.00 H new ATOM 0 HA THR A 300 4.041 -3.963 5.493 1.00 0.00 H new ATOM 0 HB THR A 300 1.417 -5.320 4.994 1.00 0.00 H new ATOM 0 HG1 THR A 300 3.235 -6.690 4.828 1.00 0.00 H new ATOM 0 HG21 THR A 300 1.584 -4.687 2.617 1.00 0.00 H new ATOM 0 HG22 THR A 300 1.351 -3.286 3.690 1.00 0.00 H new ATOM 0 HG23 THR A 300 2.961 -3.633 3.016 1.00 0.00 H new ATOM 896 N LEU A 301 1.194 -2.926 6.758 1.00 0.00 N ATOM 897 CA LEU A 301 0.425 -1.736 7.096 1.00 0.00 C ATOM 898 C LEU A 301 1.315 -0.744 7.830 1.00 0.00 C ATOM 899 O LEU A 301 1.466 0.404 7.412 1.00 0.00 O ATOM 900 CB LEU A 301 -0.780 -2.113 7.959 1.00 0.00 C ATOM 901 CG LEU A 301 -1.555 -0.941 8.562 1.00 0.00 C ATOM 902 CD1 LEU A 301 -2.578 -0.411 7.567 1.00 0.00 C ATOM 903 CD2 LEU A 301 -2.235 -1.368 9.855 1.00 0.00 C ATOM 0 H LEU A 301 0.821 -3.793 7.146 1.00 0.00 H new ATOM 0 HA LEU A 301 0.059 -1.273 6.179 1.00 0.00 H new ATOM 0 HB2 LEU A 301 -1.466 -2.706 7.354 1.00 0.00 H new ATOM 0 HB3 LEU A 301 -0.436 -2.754 8.771 1.00 0.00 H new ATOM 0 HG LEU A 301 -0.853 -0.139 8.790 1.00 0.00 H new ATOM 0 HD11 LEU A 301 -3.121 0.423 8.012 1.00 0.00 H new ATOM 0 HD12 LEU A 301 -2.067 -0.072 6.666 1.00 0.00 H new ATOM 0 HD13 LEU A 301 -3.280 -1.204 7.309 1.00 0.00 H new ATOM 0 HD21 LEU A 301 -2.783 -0.524 10.274 1.00 0.00 H new ATOM 0 HD22 LEU A 301 -2.927 -2.184 9.650 1.00 0.00 H new ATOM 0 HD23 LEU A 301 -1.482 -1.702 10.569 1.00 0.00 H new ATOM 915 N ASN A 302 1.928 -1.208 8.913 1.00 0.00 N ATOM 916 CA ASN A 302 2.832 -0.375 9.688 1.00 0.00 C ATOM 917 C ASN A 302 4.036 0.000 8.834 1.00 0.00 C ATOM 918 O ASN A 302 4.640 1.057 9.016 1.00 0.00 O ATOM 919 CB ASN A 302 3.289 -1.108 10.951 1.00 0.00 C ATOM 920 CG ASN A 302 2.470 -0.731 12.170 1.00 0.00 C ATOM 921 OD1 ASN A 302 1.299 -1.093 12.283 1.00 0.00 O ATOM 922 ND2 ASN A 302 3.085 0.000 13.092 1.00 0.00 N ATOM 0 H ASN A 302 1.814 -2.156 9.272 1.00 0.00 H new ATOM 0 HA ASN A 302 2.307 0.531 9.990 1.00 0.00 H new ATOM 0 HB2 ASN A 302 3.219 -2.184 10.788 1.00 0.00 H new ATOM 0 HB3 ASN A 302 4.339 -0.882 11.139 1.00 0.00 H new ATOM 0 HD21 ASN A 302 2.585 0.284 13.935 1.00 0.00 H new ATOM 0 HD22 ASN A 302 4.057 0.278 12.957 1.00 0.00 H new ATOM 929 N ARG A 303 4.369 -0.879 7.891 1.00 0.00 N ATOM 930 CA ARG A 303 5.487 -0.648 6.992 1.00 0.00 C ATOM 931 C ARG A 303 5.149 0.467 6.004 1.00 0.00 C ATOM 932 O ARG A 303 5.986 1.319 5.712 1.00 0.00 O ATOM 933 CB ARG A 303 5.851 -1.940 6.255 1.00 0.00 C ATOM 934 CG ARG A 303 7.227 -2.478 6.612 1.00 0.00 C ATOM 935 CD ARG A 303 7.140 -3.607 7.626 1.00 0.00 C ATOM 936 NE ARG A 303 8.352 -4.422 7.645 1.00 0.00 N ATOM 937 CZ ARG A 303 8.631 -5.359 6.740 1.00 0.00 C ATOM 938 NH1 ARG A 303 7.789 -5.599 5.742 1.00 0.00 N ATOM 939 NH2 ARG A 303 9.754 -6.056 6.835 1.00 0.00 N ATOM 0 H ARG A 303 3.877 -1.758 7.733 1.00 0.00 H new ATOM 0 HA ARG A 303 6.352 -0.335 7.577 1.00 0.00 H new ATOM 0 HB2 ARG A 303 5.103 -2.700 6.481 1.00 0.00 H new ATOM 0 HB3 ARG A 303 5.808 -1.760 5.181 1.00 0.00 H new ATOM 0 HG2 ARG A 303 7.724 -2.836 5.710 1.00 0.00 H new ATOM 0 HG3 ARG A 303 7.840 -1.672 7.015 1.00 0.00 H new ATOM 0 HD2 ARG A 303 6.968 -3.190 8.618 1.00 0.00 H new ATOM 0 HD3 ARG A 303 6.283 -4.238 7.393 1.00 0.00 H new ATOM 0 HE ARG A 303 9.025 -4.264 8.396 1.00 0.00 H new ATOM 0 HH11 ARG A 303 6.923 -5.065 5.665 1.00 0.00 H new ATOM 0 HH12 ARG A 303 8.008 -6.318 5.052 1.00 0.00 H new ATOM 0 HH21 ARG A 303 10.403 -5.875 7.600 1.00 0.00 H new ATOM 0 HH22 ARG A 303 9.969 -6.774 6.143 1.00 0.00 H new ATOM 953 N LEU A 304 3.908 0.476 5.513 1.00 0.00 N ATOM 954 CA LEU A 304 3.459 1.514 4.584 1.00 0.00 C ATOM 955 C LEU A 304 3.670 2.885 5.209 1.00 0.00 C ATOM 956 O LEU A 304 3.941 3.860 4.511 1.00 0.00 O ATOM 957 CB LEU A 304 2.006 1.271 4.170 1.00 0.00 C ATOM 958 CG LEU A 304 1.859 0.643 2.780 1.00 0.00 C ATOM 959 CD1 LEU A 304 1.096 -0.670 2.855 1.00 0.00 C ATOM 960 CD2 LEU A 304 1.183 1.604 1.811 1.00 0.00 C ATOM 0 H LEU A 304 3.199 -0.221 5.742 1.00 0.00 H new ATOM 0 HA LEU A 304 4.053 1.475 3.671 1.00 0.00 H new ATOM 0 HB2 LEU A 304 1.532 0.621 4.905 1.00 0.00 H new ATOM 0 HB3 LEU A 304 1.468 2.219 4.190 1.00 0.00 H new ATOM 0 HG LEU A 304 2.860 0.434 2.403 1.00 0.00 H new ATOM 0 HD11 LEU A 304 1.005 -1.096 1.856 1.00 0.00 H new ATOM 0 HD12 LEU A 304 1.633 -1.367 3.499 1.00 0.00 H new ATOM 0 HD13 LEU A 304 0.102 -0.490 3.265 1.00 0.00 H new ATOM 0 HD21 LEU A 304 1.092 1.131 0.833 1.00 0.00 H new ATOM 0 HD22 LEU A 304 0.191 1.859 2.184 1.00 0.00 H new ATOM 0 HD23 LEU A 304 1.781 2.511 1.721 1.00 0.00 H new ATOM 972 N LYS A 305 3.620 2.942 6.538 1.00 0.00 N ATOM 973 CA LYS A 305 3.880 4.189 7.241 1.00 0.00 C ATOM 974 C LYS A 305 5.292 4.660 6.898 1.00 0.00 C ATOM 975 O LYS A 305 5.582 5.857 6.883 1.00 0.00 O ATOM 976 CB LYS A 305 3.735 3.998 8.752 1.00 0.00 C ATOM 977 CG LYS A 305 3.112 5.190 9.461 1.00 0.00 C ATOM 978 CD LYS A 305 4.175 6.125 10.018 1.00 0.00 C ATOM 979 CE LYS A 305 3.830 6.588 11.424 1.00 0.00 C ATOM 980 NZ LYS A 305 4.397 5.683 12.462 1.00 0.00 N ATOM 0 H LYS A 305 3.404 2.148 7.141 1.00 0.00 H new ATOM 0 HA LYS A 305 3.154 4.940 6.929 1.00 0.00 H new ATOM 0 HB2 LYS A 305 3.125 3.115 8.941 1.00 0.00 H new ATOM 0 HB3 LYS A 305 4.718 3.804 9.181 1.00 0.00 H new ATOM 0 HG2 LYS A 305 2.474 5.736 8.766 1.00 0.00 H new ATOM 0 HG3 LYS A 305 2.473 4.839 10.272 1.00 0.00 H new ATOM 0 HD2 LYS A 305 5.139 5.616 10.028 1.00 0.00 H new ATOM 0 HD3 LYS A 305 4.278 6.991 9.364 1.00 0.00 H new ATOM 0 HE2 LYS A 305 4.210 7.598 11.577 1.00 0.00 H new ATOM 0 HE3 LYS A 305 2.747 6.634 11.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 305 4.139 6.034 13.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 305 4.016 4.724 12.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 305 5.433 5.658 12.373 1.00 0.00 H new ATOM 994 N MET A 306 6.158 3.689 6.593 1.00 0.00 N ATOM 995 CA MET A 306 7.540 3.961 6.212 1.00 0.00 C ATOM 996 C MET A 306 7.587 4.625 4.842 1.00 0.00 C ATOM 997 O MET A 306 8.540 5.330 4.509 1.00 0.00 O ATOM 998 CB MET A 306 8.344 2.652 6.173 1.00 0.00 C ATOM 999 CG MET A 306 8.208 1.820 7.438 1.00 0.00 C ATOM 1000 SD MET A 306 9.774 1.613 8.310 1.00 0.00 S ATOM 1001 CE MET A 306 9.520 2.691 9.719 1.00 0.00 C ATOM 0 H MET A 306 5.919 2.698 6.604 1.00 0.00 H new ATOM 0 HA MET A 306 7.978 4.632 6.951 1.00 0.00 H new ATOM 0 HB2 MET A 306 8.016 2.058 5.320 1.00 0.00 H new ATOM 0 HB3 MET A 306 9.396 2.886 6.013 1.00 0.00 H new ATOM 0 HG2 MET A 306 7.487 2.294 8.104 1.00 0.00 H new ATOM 0 HG3 MET A 306 7.808 0.839 7.181 1.00 0.00 H new ATOM 0 HE1 MET A 306 10.404 2.672 10.356 1.00 0.00 H new ATOM 0 HE2 MET A 306 9.346 3.709 9.371 1.00 0.00 H new ATOM 0 HE3 MET A 306 8.655 2.349 10.288 1.00 0.00 H new ATOM 1011 N ALA A 307 6.552 4.377 4.048 1.00 0.00 N ATOM 1012 CA ALA A 307 6.459 4.924 2.706 1.00 0.00 C ATOM 1013 C ALA A 307 5.940 6.366 2.710 1.00 0.00 C ATOM 1014 O ALA A 307 6.122 7.098 1.737 1.00 0.00 O ATOM 1015 CB ALA A 307 5.573 4.026 1.855 1.00 0.00 C ATOM 0 H ALA A 307 5.759 3.794 4.317 1.00 0.00 H new ATOM 0 HA ALA A 307 7.460 4.954 2.277 1.00 0.00 H new ATOM 0 HB1 ALA A 307 5.502 4.435 0.847 1.00 0.00 H new ATOM 0 HB2 ALA A 307 6.004 3.026 1.811 1.00 0.00 H new ATOM 0 HB3 ALA A 307 4.578 3.973 2.296 1.00 0.00 H new ATOM 1021 N GLY A 308 5.301 6.772 3.807 1.00 0.00 N ATOM 1022 CA GLY A 308 4.779 8.127 3.903 1.00 0.00 C ATOM 1023 C GLY A 308 3.476 8.304 3.147 1.00 0.00 C ATOM 1024 O GLY A 308 3.446 8.913 2.077 1.00 0.00 O ATOM 0 H GLY A 308 5.136 6.189 4.628 1.00 0.00 H new ATOM 0 HA2 GLY A 308 4.624 8.379 4.952 1.00 0.00 H new ATOM 0 HA3 GLY A 308 5.519 8.826 3.513 1.00 0.00 H new ATOM 1028 N HIS A 309 2.401 7.760 3.702 1.00 0.00 N ATOM 1029 CA HIS A 309 1.085 7.838 3.074 1.00 0.00 C ATOM 1030 C HIS A 309 0.046 8.433 4.023 1.00 0.00 C ATOM 1031 O HIS A 309 0.326 8.659 5.201 1.00 0.00 O ATOM 1032 CB HIS A 309 0.637 6.442 2.671 1.00 0.00 C ATOM 1033 CG HIS A 309 0.611 5.494 3.836 1.00 0.00 C ATOM 1034 ND1 HIS A 309 1.339 4.376 4.114 1.00 0.00 N flip ATOM 1035 CD2 HIS A 309 -0.222 5.681 4.920 1.00 0.00 C flip ATOM 1036 CE1 HIS A 309 0.928 3.931 5.350 1.00 0.00 C flip ATOM 1037 NE2 HIS A 309 -0.009 4.732 5.811 1.00 0.00 N flip ATOM 0 H HIS A 309 2.413 7.258 4.590 1.00 0.00 H new ATOM 0 HA HIS A 309 1.167 8.485 2.200 1.00 0.00 H new ATOM 0 HB2 HIS A 309 -0.357 6.496 2.227 1.00 0.00 H new ATOM 0 HB3 HIS A 309 1.308 6.054 1.905 1.00 0.00 H new ATOM 0 HD1 HIS A 309 2.051 3.951 3.520 1.00 0.00 H new ATOM 0 HD2 HIS A 309 -0.939 6.482 5.023 1.00 0.00 H new ATOM 0 HE1 HIS A 309 1.314 3.061 5.861 1.00 0.00 H new ATOM 1046 N THR A 310 -1.161 8.674 3.506 1.00 0.00 N ATOM 1047 CA THR A 310 -2.241 9.229 4.320 1.00 0.00 C ATOM 1048 C THR A 310 -3.556 8.456 4.138 1.00 0.00 C ATOM 1049 O THR A 310 -4.558 9.023 3.699 1.00 0.00 O ATOM 1050 CB THR A 310 -2.456 10.704 3.975 1.00 0.00 C ATOM 1051 OG1 THR A 310 -2.942 10.845 2.652 1.00 0.00 O ATOM 1052 CG2 THR A 310 -1.199 11.537 4.094 1.00 0.00 C ATOM 0 H THR A 310 -1.413 8.495 2.534 1.00 0.00 H new ATOM 0 HA THR A 310 -1.942 9.135 5.364 1.00 0.00 H new ATOM 0 HB THR A 310 -3.182 11.067 4.703 1.00 0.00 H new ATOM 0 HG1 THR A 310 -3.795 10.371 2.565 1.00 0.00 H new ATOM 0 HG21 THR A 310 -1.423 12.572 3.835 1.00 0.00 H new ATOM 0 HG22 THR A 310 -0.828 11.491 5.118 1.00 0.00 H new ATOM 0 HG23 THR A 310 -0.440 11.149 3.415 1.00 0.00 H new ATOM 1060 N ASN A 311 -3.558 7.166 4.495 1.00 0.00 N ATOM 1061 CA ASN A 311 -4.766 6.337 4.383 1.00 0.00 C ATOM 1062 C ASN A 311 -4.495 4.878 4.774 1.00 0.00 C ATOM 1063 O ASN A 311 -4.788 4.472 5.896 1.00 0.00 O ATOM 1064 CB ASN A 311 -5.350 6.409 2.967 1.00 0.00 C ATOM 1065 CG ASN A 311 -6.862 6.528 2.972 1.00 0.00 C ATOM 1066 OD1 ASN A 311 -7.555 5.741 3.616 1.00 0.00 O ATOM 1067 ND2 ASN A 311 -7.380 7.516 2.252 1.00 0.00 N ATOM 0 H ASN A 311 -2.743 6.675 4.862 1.00 0.00 H new ATOM 0 HA ASN A 311 -5.497 6.739 5.084 1.00 0.00 H new ATOM 0 HB2 ASN A 311 -4.922 7.264 2.443 1.00 0.00 H new ATOM 0 HB3 ASN A 311 -5.060 5.517 2.411 1.00 0.00 H new ATOM 0 HD21 ASN A 311 -8.391 7.646 2.217 1.00 0.00 H new ATOM 0 HD22 ASN A 311 -6.767 8.145 1.734 1.00 0.00 H new ATOM 1074 N CYS A 312 -3.940 4.106 3.838 1.00 0.00 N ATOM 1075 CA CYS A 312 -3.619 2.688 4.053 1.00 0.00 C ATOM 1076 C CYS A 312 -4.830 1.874 4.531 1.00 0.00 C ATOM 1077 O CYS A 312 -5.467 2.221 5.524 1.00 0.00 O ATOM 1078 CB CYS A 312 -2.447 2.539 5.037 1.00 0.00 C ATOM 1079 SG CYS A 312 -2.890 2.644 6.790 1.00 0.00 S ATOM 0 H CYS A 312 -3.699 4.444 2.906 1.00 0.00 H new ATOM 0 HA CYS A 312 -3.325 2.282 3.085 1.00 0.00 H new ATOM 0 HB2 CYS A 312 -1.964 1.578 4.858 1.00 0.00 H new ATOM 0 HB3 CYS A 312 -1.710 3.312 4.818 1.00 0.00 H new ATOM 0 HG CYS A 312 -3.868 3.487 6.941 1.00 0.00 H new ATOM 1085 N ILE A 313 -5.135 0.773 3.826 1.00 0.00 N ATOM 1086 CA ILE A 313 -6.251 -0.086 4.196 1.00 0.00 C ATOM 1087 C ILE A 313 -6.132 -1.432 3.498 1.00 0.00 C ATOM 1088 O ILE A 313 -6.201 -1.512 2.271 1.00 0.00 O ATOM 1089 CB ILE A 313 -7.616 0.540 3.841 1.00 0.00 C ATOM 1090 CG1 ILE A 313 -7.590 1.144 2.429 1.00 0.00 C ATOM 1091 CG2 ILE A 313 -8.015 1.585 4.874 1.00 0.00 C ATOM 1092 CD1 ILE A 313 -6.772 2.414 2.311 1.00 0.00 C ATOM 0 H ILE A 313 -4.621 0.465 3.001 1.00 0.00 H new ATOM 0 HA ILE A 313 -6.205 -0.213 5.278 1.00 0.00 H new ATOM 0 HB ILE A 313 -8.366 -0.251 3.854 1.00 0.00 H new ATOM 0 HG12 ILE A 313 -7.191 0.403 1.736 1.00 0.00 H new ATOM 0 HG13 ILE A 313 -8.613 1.354 2.117 1.00 0.00 H new ATOM 0 HG21 ILE A 313 -8.980 2.013 4.604 1.00 0.00 H new ATOM 0 HG22 ILE A 313 -8.087 1.117 5.856 1.00 0.00 H new ATOM 0 HG23 ILE A 313 -7.263 2.374 4.903 1.00 0.00 H new ATOM 0 HD11 ILE A 313 -6.806 2.775 1.283 1.00 0.00 H new ATOM 0 HD12 ILE A 313 -7.182 3.174 2.976 1.00 0.00 H new ATOM 0 HD13 ILE A 313 -5.738 2.208 2.589 1.00 0.00 H new ATOM 1104 N ARG A 314 -5.943 -2.489 4.278 1.00 0.00 N ATOM 1105 CA ARG A 314 -5.806 -3.823 3.710 1.00 0.00 C ATOM 1106 C ARG A 314 -7.149 -4.347 3.224 1.00 0.00 C ATOM 1107 O ARG A 314 -8.101 -4.467 3.995 1.00 0.00 O ATOM 1108 CB ARG A 314 -5.180 -4.796 4.721 1.00 0.00 C ATOM 1109 CG ARG A 314 -3.843 -5.354 4.248 1.00 0.00 C ATOM 1110 CD ARG A 314 -2.677 -4.436 4.613 1.00 0.00 C ATOM 1111 NE ARG A 314 -2.855 -3.831 5.932 1.00 0.00 N ATOM 1112 CZ ARG A 314 -2.975 -4.530 7.062 1.00 0.00 C ATOM 1113 NH1 ARG A 314 -2.851 -5.851 7.054 1.00 0.00 N ATOM 1114 NH2 ARG A 314 -3.201 -3.902 8.208 1.00 0.00 N ATOM 0 H ARG A 314 -5.882 -2.449 5.295 1.00 0.00 H new ATOM 0 HA ARG A 314 -5.136 -3.750 2.853 1.00 0.00 H new ATOM 0 HB2 ARG A 314 -5.039 -4.284 5.673 1.00 0.00 H new ATOM 0 HB3 ARG A 314 -5.870 -5.620 4.901 1.00 0.00 H new ATOM 0 HG2 ARG A 314 -3.683 -6.337 4.692 1.00 0.00 H new ATOM 0 HG3 ARG A 314 -3.870 -5.493 3.167 1.00 0.00 H new ATOM 0 HD2 ARG A 314 -1.747 -5.005 4.596 1.00 0.00 H new ATOM 0 HD3 ARG A 314 -2.584 -3.651 3.863 1.00 0.00 H new ATOM 0 HE ARG A 314 -2.890 -2.813 5.992 1.00 0.00 H new ATOM 0 HH11 ARG A 314 -2.662 -6.340 6.179 1.00 0.00 H new ATOM 0 HH12 ARG A 314 -2.944 -6.377 7.923 1.00 0.00 H new ATOM 0 HH21 ARG A 314 -3.283 -2.885 8.225 1.00 0.00 H new ATOM 0 HH22 ARG A 314 -3.293 -4.436 9.072 1.00 0.00 H new ATOM 1128 N LEU A 315 -7.210 -4.659 1.936 1.00 0.00 N ATOM 1129 CA LEU A 315 -8.421 -5.181 1.326 1.00 0.00 C ATOM 1130 C LEU A 315 -8.334 -6.696 1.224 1.00 0.00 C ATOM 1131 O LEU A 315 -7.476 -7.232 0.527 1.00 0.00 O ATOM 1132 CB LEU A 315 -8.633 -4.586 -0.063 1.00 0.00 C ATOM 1133 CG LEU A 315 -9.887 -3.724 -0.218 1.00 0.00 C ATOM 1134 CD1 LEU A 315 -9.841 -2.954 -1.528 1.00 0.00 C ATOM 1135 CD2 LEU A 315 -11.136 -4.589 -0.150 1.00 0.00 C ATOM 0 H LEU A 315 -6.427 -4.558 1.291 1.00 0.00 H new ATOM 0 HA LEU A 315 -9.268 -4.903 1.954 1.00 0.00 H new ATOM 0 HB2 LEU A 315 -7.762 -3.982 -0.319 1.00 0.00 H new ATOM 0 HB3 LEU A 315 -8.680 -5.400 -0.786 1.00 0.00 H new ATOM 0 HG LEU A 315 -9.920 -3.007 0.602 1.00 0.00 H new ATOM 0 HD11 LEU A 315 -10.740 -2.345 -1.624 1.00 0.00 H new ATOM 0 HD12 LEU A 315 -8.963 -2.309 -1.540 1.00 0.00 H new ATOM 0 HD13 LEU A 315 -9.787 -3.655 -2.361 1.00 0.00 H new ATOM 0 HD21 LEU A 315 -12.020 -3.961 -0.262 1.00 0.00 H new ATOM 0 HD22 LEU A 315 -11.111 -5.327 -0.952 1.00 0.00 H new ATOM 0 HD23 LEU A 315 -11.173 -5.100 0.812 1.00 0.00 H new ATOM 1147 N ALA A 316 -9.208 -7.386 1.932 1.00 0.00 N ATOM 1148 CA ALA A 316 -9.200 -8.842 1.924 1.00 0.00 C ATOM 1149 C ALA A 316 -10.034 -9.409 0.784 1.00 0.00 C ATOM 1150 O ALA A 316 -11.151 -8.959 0.525 1.00 0.00 O ATOM 1151 CB ALA A 316 -9.679 -9.376 3.262 1.00 0.00 C ATOM 0 H ALA A 316 -9.930 -6.967 2.518 1.00 0.00 H new ATOM 0 HA ALA A 316 -8.173 -9.168 1.761 1.00 0.00 H new ATOM 0 HB1 ALA A 316 -9.669 -10.466 3.244 1.00 0.00 H new ATOM 0 HB2 ALA A 316 -9.019 -9.020 4.053 1.00 0.00 H new ATOM 0 HB3 ALA A 316 -10.694 -9.026 3.451 1.00 0.00 H new ATOM 1157 N ALA A 317 -9.474 -10.404 0.103 1.00 0.00 N ATOM 1158 CA ALA A 317 -10.144 -11.050 -1.017 1.00 0.00 C ATOM 1159 C ALA A 317 -11.343 -11.872 -0.549 1.00 0.00 C ATOM 1160 O ALA A 317 -12.275 -12.118 -1.316 1.00 0.00 O ATOM 1161 CB ALA A 317 -9.157 -11.932 -1.770 1.00 0.00 C ATOM 0 H ALA A 317 -8.550 -10.782 0.311 1.00 0.00 H new ATOM 0 HA ALA A 317 -10.516 -10.274 -1.686 1.00 0.00 H new ATOM 0 HB1 ALA A 317 -9.664 -12.413 -2.607 1.00 0.00 H new ATOM 0 HB2 ALA A 317 -8.336 -11.321 -2.145 1.00 0.00 H new ATOM 0 HB3 ALA A 317 -8.764 -12.694 -1.097 1.00 0.00 H new